0 B14R0.337 C#CC(=O)CCCCCCCCCC=C 1458a_100000211873_100009814027 [0,0,0,0,0,0|1,0,3]=4 1 B14R0.337 C#CC(=O)CCCCCCCCCCC 1458a_100000211873_100011215454 [0,0,0,0,0,0|1,0,1]=2 2 B14R0.337 C#CC(=O)CCCCCCCCCCO 1458a_100000211873_100009813290 [0,0,0,0,0,0|2,0,1]=3 3 B14R0.337 C#CCCCCCCCNCC(=O)NC 2230a_100000693194_100153394163 [0,0,0,0,0,0|2,0,2]=4 4 B14R0.337 C#CCCCCCCCOCC(=O)CC 34a_100000725409_100153394163 [0,0,0,0,0,0|2,0,2]=4 5 B14R0.337 C#CCCCCCCCOCC(=O)CC 7a_100000054614_100000747405 [0,0,0,0,0,0|2,0,2]=4 6 B14R0.337 C#CCCCCCCCOCC(=O)NC 34a_100000054614_100000183359 [0,0,0,0,0,0|2,0,2]=4 7 B14R0.337 C#CCCCCCCCOCC(=O)NC 34a_100000750040_100153394163 [0,0,0,0,0,0|2,0,2]=4 8 B14R0.337 C#CCCCCCCCOCC(=O)NC 7a_100000054614_100000183359 [0,0,0,0,0,0|2,0,2]=4 9 B14R0.337 C#CCCCCCCCOCC(=O)OC 34a_100000054614_100000747449 [0,0,0,0,0,0|1,0,2]=3 10 B14R0.337 C#CCCCCCCCOCC(=O)OC 7a_100000054614_100000747449 [0,0,0,0,0,0|1,0,2]=3 11 B14R0.337 C#CCCCCCCCSCC(=O)CC 62a_100000747405_100153394163 [0,0,0,0,0,0|2,0,2]=4 12 B14R0.337 C#CCCCCCCCSCC(=O)CC 62a_100153394163_100000747405 [0,0,0,0,0,0|2,0,2]=4 13 B14R0.337 C#CCCCCCCCSCC(=O)NC 62a_100000183359_100153394163 [0,0,0,0,0,0|2,0,2]=4 14 B14R0.337 C#CCCCCCCCSCC(=O)NC 62a_100153394163_100000183359 [0,0,0,0,0,0|2,0,2]=4 15 B14R0.337 C#CCCCCCCCSCC(=O)OC 62a_100000747449_100153394163 [0,0,0,0,0,0|1,0,2]=3 16 B14R0.337 C#CCCCCCCCSCC(=O)OC 62a_100153394163_100000747449 [0,0,0,0,0,0|1,0,2]=3 17 B14R0.337 C#CCCCCCCNCCC(=O)NC 2230a_100000738227_100012276617 [0,0,0,0,0,0|2,0,2]=4 18 B14R0.337 C#CCCCCCCNCCC(=O)NC 34a_100000738227_100012276617 [0,0,0,0,0,0|2,0,2]=4 19 B14R0.337 C#CCCCCCCOCCC(=O)NC 34a_100000754576_100012276617 [0,0,0,0,0,0|2,0,2]=4 20 B14R0.337 C#CCCCCCCOCCC(=O)NC 34a_100011217361_100012179268 [0,0,0,0,0,0|2,0,2]=4 21 B14R0.337 C#CCCCCCCOCCC(=O)NC 7a_100011217361_100000737683 [0,0,0,0,0,0|2,0,2]=4 22 B14R0.337 C#CCCCCCCOCCC(=O)OC 34a_100011217361_100000742370 [0,0,0,0,0,0|1,0,2]=3 23 B14R0.337 C#CCCCCCCOCCC(=O)OC 7a_100011217361_100000204255 [0,0,0,0,0,0|1,0,2]=3 24 B14R0.337 C#CCCCCCCSCCC(=O)NC 62a_100000737683_100012276617 [0,0,0,0,0,0|2,0,2]=4 25 B14R0.337 C#CCCCCCCSCCC(=O)NC 62a_100012276617_100000737683 [0,0,0,0,0,0|2,0,2]=4 26 B14R0.337 C#CCCCCCCSCCC(=O)OC 62a_100000204255_100012276617 [0,0,0,0,0,0|1,0,2]=3 27 B14R0.337 C#CCCCCCCSCCC(=O)OC 62a_100012276617_100000204255 [0,0,0,0,0,0|1,0,2]=3 28 B14R0.337 C#CCCCCCCSCOC(=O)OC 62a_100012276617_100000139417 [0,0,0,0,0,0|2,0,2]=4 29 B14R0.337 C#CCCCCCNCCCC(=O)NC 2230a_100000740002_100012094781 [0,0,0,0,0,0|2,0,2]=4 30 B14R0.337 C#CCCCCCNCCCC(=O)NC 34a_100000740002_100012094781 [0,0,0,0,0,0|2,0,2]=4 31 B14R0.337 C#CCCCCCOCCCC(=O)NC 34a_100000766912_100000741757 [0,0,0,0,0,0|2,0,2]=4 32 B14R0.337 C#CCCCCCOCCCC(=O)NC 7a_100000766912_100000741757 [0,0,0,0,0,0|2,0,2]=4 33 B14R0.337 C#CCCCCCOCCCC(=O)OC 34a_100000766912_100000742333 [0,0,0,0,0,0|1,0,2]=3 34 B14R0.337 C#CCCCCCOCCCC(=O)OC 7a_100000766912_100011218270 [0,0,0,0,0,0|1,0,2]=3 35 B14R0.337 C#CCCCCCOCCNC(=O)OC 34a_100000757965_100012094781 [0,0,0,0,0,0|2,0,2]=4 36 B14R0.337 C#CCCCCCOCCOC(=O)OC 34a_100010262106_100012094781 [0,0,0,0,0,0|2,0,2]=4 37 B14R0.337 C#CCCCCCSCCCC(=O)NC 62a_100000741757_100012094781 [0,0,0,0,0,0|2,0,2]=4 38 B14R0.337 C#CCCCCCSCCCC(=O)NC 62a_100012094781_100000741757 [0,0,0,0,0,0|2,0,2]=4 39 B14R0.337 C#CCCCCCSCCCC(=O)OC 62a_100011218270_100012094781 [0,0,0,0,0,0|1,0,2]=3 40 B14R0.337 C#CCCCCCSCCCC(=O)OC 62a_100012094781_100011218270 [0,0,0,0,0,0|1,0,2]=3 41 B14R0.337 C#CCCCCNCCCCC(=O)OC 2230a_100000706060_100000204269 [0,0,0,0,0,0|1,0,2]=3 42 B14R0.337 C#CCCCCNCCCCC(=O)OC 34a_100000706060_100000204269 [0,0,0,0,0,0|1,0,2]=3 43 B14R0.337 C#CCCCCNCCOCC(=O)OC 2230a_100000706060_100000090808 [0,0,0,0,0,0|2,0,2]=4 44 B14R0.337 C#CCCCCNCCOCC(=O)OC 34a_100000706060_100000090808 [0,0,0,0,0,0|2,0,2]=4 45 B14R0.337 C#CCCCCOCCCCC(=O)OC 34a_100000059025_100010269958 [0,0,0,0,0,0|1,0,2]=3 46 B14R0.337 C#CCCCCOCCCCC(=O)OC 34a_100000766709_100000204269 [0,0,0,0,0,0|1,0,2]=3 47 B14R0.337 C#CCCCCOCCCCC(=O)OC 7a_100000059025_100010269958 [0,0,0,0,0,0|1,0,2]=3 48 B14R0.337 C#CCCCCOCCCCC(=O)OC 7a_100000766709_100000204269 [0,0,0,0,0,0|1,0,2]=3 49 B14R0.337 C#CCCCCOCCOCC(=O)OC 34a_100000766709_100000090808 [0,0,0,0,0,0|2,0,2]=4 50 B14R0.337 C#CCCCCOCCOCC(=O)OC 7a_100000766709_100000090808 [0,0,0,0,0,0|2,0,2]=4 51 B14R0.337 C#CCCCCSCCCCC(=O)OC 62a_100000204269_100010269958 [0,0,0,0,0,0|1,0,2]=3 52 B14R0.337 C#CCCCCSCCCCC(=O)OC 62a_100010269958_100000204269 [0,0,0,0,0,0|1,0,2]=3 53 B14R0.337 C#CCCCCSCCOCC(=O)OC 62a_100000090808_100010269958 [0,0,0,0,0,0|2,0,2]=4 54 B14R0.337 C#CCCCCSCCOCC(=O)OC 62a_100010269958_100000090808 [0,0,0,0,0,0|2,0,2]=4 55 B14R0.337 C#CCCCNCCCCCC(=O)OC 34a_100000718082_100009816466 [0,0,0,0,0,0|1,0,2]=3 56 B14R0.337 C#CCCCOCCCCCC(=O)OC 34a_100000074720_100000695029 [0,0,0,0,0,0|1,0,2]=3 57 B14R0.337 C#CCCCOCCCCCC(=O)OC 34a_100000215630_100009816466 [0,0,0,0,0,0|1,0,2]=3 58 B14R0.337 C#CCCCOCCCCCC(=O)OC 7a_100000074720_100011215417 [0,0,0,0,0,0|1,0,2]=3 59 B14R0.337 C#CCCCOCCCCCC(=O)OC 7a_100000215630_100009816466 [0,0,0,0,0,0|1,0,2]=3 60 B14R0.337 C#CCCCSCCCCCC(=O)OC 62a_100009816466_100011215417 [0,0,0,0,0,0|1,0,2]=3 61 B14R0.337 C#CCCCSCCCCCC(=O)OC 62a_100011215417_100009816466 [0,0,0,0,0,0|1,0,2]=3 62 B14R0.337 C#CCCNCCCCCCC(=O)OC 34a_100000755551_100009815986 [0,0,0,0,0,0|1,0,2]=3 63 B14R0.337 C#CCCOCCCCCCC(=O)OC 34a_100009863599_100000688953 [0,0,0,0,0,0|1,0,2]=3 64 B14R0.337 C#CCCOCCCCCCC(=O)OC 34a_100011215631_100009815986 [0,0,0,0,0,0|1,0,2]=3 65 B14R0.337 C#CCCOCCCCCCC(=O)OC 7a_100009863599_100000688953 [0,0,0,0,0,0|1,0,2]=3 66 B14R0.337 C#CCCSCCCCCCC(=O)OC 62a_100000688953_100009815986 [0,0,0,0,0,0|1,0,2]=3 67 B14R0.337 C#CCCSCCCCCCC(=O)OC 62a_100009815986_100000688953 [0,0,0,0,0,0|1,0,2]=3 68 B14R0.337 C#CCNCCCCCCCC(=O)OC 34a_100000212058_100010004213 [0,0,0,0,0,0|1,0,2]=3 69 B14R0.337 C#CCOCCCCCCCC(=O)OC 34a_100000210247_100010004213 [0,0,0,0,0,0|1,0,2]=3 70 B14R0.337 C#CCOCCCCCCCC(=O)OC 34a_100011022521_100000184674 [0,0,0,0,0,0|1,0,2]=3 71 B14R0.337 C#CCOCCCCCCCC(=O)OC 7a_100011022521_100000038162 [0,0,0,0,0,0|1,0,2]=3 72 B14R0.337 C#CCOCCNCCCCC(=O)OC 2230a_100000700922_100000204269 [0,0,0,0,0,0|2,0,2]=4 73 B14R0.337 C#CCOCCNCCCCC(=O)OC 34a_100000700922_100000204269 [0,0,0,0,0,0|2,0,2]=4 74 B14R0.337 C#CCOCCOCCCCC(=O)OC 34a_100000054580_100000204269 [0,0,0,0,0,0|2,0,2]=4 75 B14R0.337 C#CCOCCOCCCCC(=O)OC 34a_100000059025_100010402529 [0,0,0,0,0,0|2,0,2]=4 76 B14R0.337 C#CCOCCOCCCCC(=O)OC 7a_100000054580_100000204269 [0,0,0,0,0,0|2,0,2]=4 77 B14R0.337 C#CCOCCOCCCCC(=O)OC 7a_100000059025_100010402529 [0,0,0,0,0,0|2,0,2]=4 78 B14R0.337 C#CCOCCSCCCCC(=O)OC 62a_100000204269_100010402529 [0,0,0,0,0,0|2,0,2]=4 79 B14R0.337 C#CCOCCSCCCCC(=O)OC 62a_100010402529_100000204269 [0,0,0,0,0,0|2,0,2]=4 80 B14R0.337 C#CCSCCCCCCCC(=O)OC 62a_100000038162_100010004213 [0,0,0,0,0,0|1,0,2]=3 81 B14R0.337 C/C=C/CCOCCCCCC(=O)OC 34a_100016278192_100009816466 [0,0,0,0,0,0|1,0,2]=3 82 B14R0.337 C/C=C/COCCCCCCC(=O)OC 34a_100009863599_100102629194 [0,0,0,0,0,0|1,0,2]=3 83 B14R0.337 C/C=C/COCCCCCCC(=O)OC 34a_100016270725_100009815986 [0,0,0,0,0,0|1,0,2]=3 84 B14R0.337 C/C=C/COCCCCCCC(=O)OC 7a_100009863599_100102629194 [0,0,0,0,0,0|1,0,2]=3 85 B14R0.337 C/C=C/CSCCCCCCC(=O)OC 62a_100009815986_100102629194 [0,0,0,0,0,0|1,0,2]=3 86 B14R0.337 C/C=C/CSCCCCCCC(=O)OC 62a_100102629194_100009815986 [0,0,0,0,0,0|1,0,2]=3 87 B14R0.337 C=C(C#N)CNCCCCCCCCC 2230a_100000212291_100000694840 [0,0,0,0,0,0|4,0,0]=4 88 B14R0.337 C=C(C#N)CNCCCCCCCCC 34a_100000212291_100000694840 [0,0,0,0,0,0|4,0,0]=4 89 B14R0.337 C=C(C#N)COCCCCCCCCC 34a_100000210712_100000694840 [0,0,0,0,0,0|4,0,0]=4 90 B14R0.337 C=CC(=O)CCCCCCCCCCC 1458a_100000185746_100011215454 [0,0,0,0,0,0|1,0,1]=2 91 B14R0.337 C=CC(=O)CCCCCCCCCCO 1458a_100000185746_100009813290 [0,0,0,0,0,0|2,0,1]=3 92 B14R0.337 C=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000185746 [0,0,0,0,0,0|2,0,1]=3 93 B14R0.337 C=CC(=O)NCCCCCCCCCC 240690a_100000684558_200121576911 [0,0,0,0,0,0|2,0,1]=3 94 B14R0.337 C=CC(=O)NCCCCCCCCCO 240690a_100000078944_200121576911 [0,0,0,0,0,0|3,0,1]=4 95 B14R0.337 C=CC(=O)NCCCCOCCCCC 34a_100014118770_100000718602 [0,0,0,0,0,0|3,0,1]=4 96 B14R0.337 C=CC(=O)NCCNCCCCCCC 2230a_114873766552_100000210681 [0,0,0,0,0,0|3,0,1]=4 97 B14R0.337 C=CC(=O)NCCOCCCCCCC 34a_100011304386_100000210614 [0,0,0,0,0,0|3,0,1]=4 98 B14R0.337 C=CC(=O)OCCCCCCOCCC 34a_100000210258_100009894100 [0,0,0,0,0,0|3,0,1]=4 99 B14R0.337 C=CC(=O)OCCCCCCSCCC 62a_100000210303_100009894100 [0,0,0,0,0,0|3,0,1]=4 100 B14R0.337 C=CC(=O)OCCCCCCSCCC 62a_100009894100_100000210303 [0,0,0,0,0,0|3,0,1]=4 101 B14R0.337 C=CC(=O)OCCCCCOCCCC 7a_200011023508_100000210211 [0,0,0,0,0,0|3,0,1]=4 102 B14R0.337 C=CC(=O)OCCNCCCCCCC 2230a_100000229938_100009813456 [0,0,0,0,0,0|3,0,1]=4 103 B14R0.337 C=CC(=O)OCCOCCCCCCC 34a_100000210272_100009813456 [0,0,0,0,0,0|3,0,1]=4 104 B14R0.337 C=CC(=O)OCCOCCCCCCC 7a_100000210272_100009813456 [0,0,0,0,0,0|3,0,1]=4 105 B14R0.337 C=CC(=O)OCCSCCCCCCC 62a_100000210614_100009813456 [0,0,0,0,0,0|3,0,1]=4 106 B14R0.337 C=CC(=O)OCCSCCCCCCC 62a_100009813456_100000210316 [0,0,0,0,0,0|3,0,1]=4 107 B14R0.337 C=CCCCCCCCCCC(=O)C=C 1458a_100000185746_100009814027 [0,0,0,0,0,0|1,0,3]=4 108 B14R0.337 C=CCCCCCCCCCC(=O)CC 1458a_100000210414_100009814027 [0,0,0,0,0,0|1,0,2]=3 109 B14R0.337 C=CCCCCCCCCCC(=O)CO 1458a_100000210174_100009814027 [0,0,0,0,0,0|2,0,2]=4 110 B14R0.337 C=CCCCCCCCNCC(=O)NC 2230a_100000693194_100012355270 [0,0,0,0,0,0|2,0,2]=4 111 B14R0.337 C=CCCCCCCCOCC(=O)CC 34a_100000725409_100012355270 [0,0,0,0,0,0|2,0,2]=4 112 B14R0.337 C=CCCCCCCCOCC(=O)CC 7a_100000730831_100000747405 [0,0,0,0,0,0|2,0,2]=4 113 B14R0.337 C=CCCCCCCCOCC(=O)NC 34a_100000730831_100000183359 [0,0,0,0,0,0|2,0,2]=4 114 B14R0.337 C=CCCCCCCCOCC(=O)NC 34a_100000750040_100012355270 [0,0,0,0,0,0|2,0,2]=4 115 B14R0.337 C=CCCCCCCCOCC(=O)NC 7a_100000730831_100000183359 [0,0,0,0,0,0|2,0,2]=4 116 B14R0.337 C=CCCCCCCCOCC(=O)OC 34a_100000730831_100000747449 [0,0,0,0,0,0|1,0,2]=3 117 B14R0.337 C=CCCCCCCCOCC(=O)OC 7a_100000730831_100000747449 [0,0,0,0,0,0|1,0,2]=3 118 B14R0.337 C=CCCCCCCCSCC(=O)CC 62a_100000747405_100012355270 [0,0,0,0,0,0|2,0,2]=4 119 B14R0.337 C=CCCCCCCCSCC(=O)CC 62a_100012355270_100000747405 [0,0,0,0,0,0|2,0,2]=4 120 B14R0.337 C=CCCCCCCCSCC(=O)NC 62a_100000183359_100012355270 [0,0,0,0,0,0|2,0,2]=4 121 B14R0.337 C=CCCCCCCCSCC(=O)NC 62a_100012355270_100000183359 [0,0,0,0,0,0|2,0,2]=4 122 B14R0.337 C=CCCCCCCCSCC(=O)OC 62a_100000747449_100012355270 [0,0,0,0,0,0|1,0,2]=3 123 B14R0.337 C=CCCCCCCCSCC(=O)OC 62a_100012355270_100000747449 [0,0,0,0,0,0|1,0,2]=3 124 B14R0.337 C=CCCCCCCNCCC(=O)NC 2230a_100000738227_100011215473 [0,0,0,0,0,0|2,0,2]=4 125 B14R0.337 C=CCCCCCCNCCC(=O)NC 34a_100000738227_100011215473 [0,0,0,0,0,0|2,0,2]=4 126 B14R0.337 C=CCCCCCCOCCC(=O)NC 34a_100000754576_100011215473 [0,0,0,0,0,0|2,0,2]=4 127 B14R0.337 C=CCCCCCCOCCC(=O)NC 34a_200011216477_100012179268 [0,0,0,0,0,0|2,0,2]=4 128 B14R0.337 C=CCCCCCCOCCC(=O)NC 7a_200011216477_100000737683 [0,0,0,0,0,0|2,0,2]=4 129 B14R0.337 C=CCCCCCCOCCC(=O)OC 34a_200011216477_100000742370 [0,0,0,0,0,0|1,0,2]=3 130 B14R0.337 C=CCCCCCCOCCC(=O)OC 7a_200011216477_100000204255 [0,0,0,0,0,0|1,0,2]=3 131 B14R0.337 C=CCCCCCCSCCC(=O)NC 62a_100000737683_100011215473 [0,0,0,0,0,0|2,0,2]=4 132 B14R0.337 C=CCCCCCCSCCC(=O)NC 62a_100011215473_100000737683 [0,0,0,0,0,0|2,0,2]=4 133 B14R0.337 C=CCCCCCCSCCC(=O)OC 62a_100000204255_100011215473 [0,0,0,0,0,0|1,0,2]=3 134 B14R0.337 C=CCCCCCCSCCC(=O)OC 62a_100011215473_100000204255 [0,0,0,0,0,0|1,0,2]=3 135 B14R0.337 C=CCCCCCCSCOC(=O)OC 62a_100011215473_100000139417 [0,0,0,0,0,0|2,0,2]=4 136 B14R0.337 C=CCCCCCNCCCC(=O)NC 2230a_100000740002_100000700193 [0,0,0,0,0,0|2,0,2]=4 137 B14R0.337 C=CCCCCCNCCCC(=O)NC 34a_100000740002_100000700193 [0,0,0,0,0,0|2,0,2]=4 138 B14R0.337 C=CCCCCCOCCCC(=O)NC 34a_100011216702_100000741757 [0,0,0,0,0,0|2,0,2]=4 139 B14R0.337 C=CCCCCCOCCCC(=O)NC 7a_100011216702_100000741757 [0,0,0,0,0,0|2,0,2]=4 140 B14R0.337 C=CCCCCCOCCCC(=O)OC 34a_100011216702_100000742333 [0,0,0,0,0,0|1,0,2]=3 141 B14R0.337 C=CCCCCCOCCCC(=O)OC 7a_100011216702_100011218270 [0,0,0,0,0,0|1,0,2]=3 142 B14R0.337 C=CCCCCCOCCNC(=O)OC 34a_100000757965_100000700193 [0,0,0,0,0,0|2,0,2]=4 143 B14R0.337 C=CCCCCCOCCOC(=O)OC 34a_100010262106_100000700193 [0,0,0,0,0,0|2,0,2]=4 144 B14R0.337 C=CCCCCCSCCCC(=O)NC 62a_100000700193_100000741757 [0,0,0,0,0,0|2,0,2]=4 145 B14R0.337 C=CCCCCCSCCCC(=O)NC 62a_100000741757_100000700193 [0,0,0,0,0,0|2,0,2]=4 146 B14R0.337 C=CCCCCCSCCCC(=O)OC 62a_100000700193_100011218270 [0,0,0,0,0,0|1,0,2]=3 147 B14R0.337 C=CCCCCCSCCCC(=O)OC 62a_100011218270_100000700193 [0,0,0,0,0,0|1,0,2]=3 148 B14R0.337 C=CCCCCNCCCCC(=O)OC 2230a_100000703577_100000204269 [0,0,0,0,0,0|1,0,2]=3 149 B14R0.337 C=CCCCCNCCCCC(=O)OC 34a_100000703577_100000204269 [0,0,0,0,0,0|1,0,2]=3 150 B14R0.337 C=CCCCCNCCOCC(=O)OC 2230a_100000703577_100000090808 [0,0,0,0,0,0|2,0,2]=4 151 B14R0.337 C=CCCCCNCCOCC(=O)OC 34a_100000703577_100000090808 [0,0,0,0,0,0|2,0,2]=4 152 B14R0.337 C=CCCCCOCCCCC(=O)OC 34a_100000059025_100011215482 [0,0,0,0,0,0|1,0,2]=3 153 B14R0.337 C=CCCCCOCCCCC(=O)OC 34a_100000766645_100000204269 [0,0,0,0,0,0|1,0,2]=3 154 B14R0.337 C=CCCCCOCCCCC(=O)OC 7a_100000059025_100011215482 [0,0,0,0,0,0|1,0,2]=3 155 B14R0.337 C=CCCCCOCCCCC(=O)OC 7a_100000766645_100000204269 [0,0,0,0,0,0|1,0,2]=3 156 B14R0.337 C=CCCCCOCCOCC(=O)OC 34a_100000766645_100000090808 [0,0,0,0,0,0|2,0,2]=4 157 B14R0.337 C=CCCCCOCCOCC(=O)OC 7a_100000766645_100000090808 [0,0,0,0,0,0|2,0,2]=4 158 B14R0.337 C=CCCCCSCCCCC(=O)OC 62a_100000204269_100011215482 [0,0,0,0,0,0|1,0,2]=3 159 B14R0.337 C=CCCCCSCCCCC(=O)OC 62a_100011215482_100000204269 [0,0,0,0,0,0|1,0,2]=3 160 B14R0.337 C=CCCCCSCCOCC(=O)OC 62a_100000090808_100011215482 [0,0,0,0,0,0|2,0,2]=4 161 B14R0.337 C=CCCCCSCCOCC(=O)OC 62a_100011215482_100000090808 [0,0,0,0,0,0|2,0,2]=4 162 B14R0.337 C=CCCCNCCCCCC(=O)OC 2230a_100000700776_100009816466 [0,0,0,0,0,0|1,0,2]=3 163 B14R0.337 C=CCCCNCCCCCC(=O)OC 34a_100000700776_100009816466 [0,0,0,0,0,0|1,0,2]=3 164 B14R0.337 C=CCCCOCCCCCC(=O)OC 34a_100000074720_100000757094 [0,0,0,0,0,0|1,0,2]=3 165 B14R0.337 C=CCCCOCCCCCC(=O)OC 34a_100000758997_100009816466 [0,0,0,0,0,0|1,0,2]=3 166 B14R0.337 C=CCCCOCCCCCC(=O)OC 7a_100000074720_100000757094 [0,0,0,0,0,0|1,0,2]=3 167 B14R0.337 C=CCCCOCCCCCC(=O)OC 7a_100000758997_100009816466 [0,0,0,0,0,0|1,0,2]=3 168 B14R0.337 C=CCCCSCCCCCC(=O)OC 62a_100009816466_100000757094 [0,0,0,0,0,0|1,0,2]=3 169 B14R0.337 C=CCCCSCCCCCC(=O)OC 62a_100011713584_100009816466 [0,0,0,0,0,0|1,0,2]=3 170 B14R0.337 C=CCCNCCCCCCC(=O)OC 2230a_100015191253_100009815986 [0,0,0,0,0,0|1,0,2]=3 171 B14R0.337 C=CCCOCCCCCCC(=O)OC 34a_100009863599_100000754431 [0,0,0,0,0,0|1,0,2]=3 172 B14R0.337 C=CCCOCCCCCCC(=O)OC 34a_100011205117_100009815986 [0,0,0,0,0,0|1,0,2]=3 173 B14R0.337 C=CCCOCCCCCCC(=O)OC 7a_100009863599_100000754431 [0,0,0,0,0,0|1,0,2]=3 174 B14R0.337 C=CCCSCCCCCCC(=O)OC 62a_100000754431_100009815986 [0,0,0,0,0,0|1,0,2]=3 175 B14R0.337 C=CCCSCCCCCCC(=O)OC 62a_100009815986_100000754431 [0,0,0,0,0,0|1,0,2]=3 176 B14R0.337 C=CCNCCCCCCCC(=O)OC 2230a_100020586998_100010004213 [0,0,0,0,0,0|1,0,2]=3 177 B14R0.337 C=CCOCCCCCCCC(=O)OC 34a_100011022521_100015514636 [0,0,0,0,0,0|1,0,2]=3 178 B14R0.337 C=CCOCCCCCCCC(=O)OC 34a_200000210373_100010004213 [0,0,0,0,0,0|1,0,2]=3 179 B14R0.337 C=CCOCCCCCCCC(=O)OC 7a_100011022521_100015514636 [0,0,0,0,0,0|1,0,2]=3 180 B14R0.337 C=CCOCCOCCCCC(=O)OC 34a_100000037705_100000204269 [0,0,0,0,0,0|2,0,2]=4 181 B14R0.337 C=CCOCCOCCCCC(=O)OC 7a_100000037705_100000204269 [0,0,0,0,0,0|2,0,2]=4 182 B14R0.337 C=CCSCCCCCCCC(=O)OC 62a_100000210623_100010004213 [0,0,0,0,0,0|1,0,2]=3 183 B14R0.337 C=CCSCCCCCCCC(=O)OC 62a_100010004213_100000210623 [0,0,0,0,0,0|1,0,2]=3 184 B14R0.337 C=COCCCCOCCCC(=O)OC 34a_100000031558_100000742333 [0,0,0,0,0,0|2,0,2]=4 185 B14R0.337 C=COCCCCOCCCC(=O)OC 7a_100000031558_100011218270 [0,0,0,0,0,0|2,0,2]=4 186 B14R0.337 C=COCCCNCCCCC(=O)OC 2230a_100000210767_100000204269 [0,0,0,0,0,0|2,0,2]=4 187 B14R0.337 C=COCCCNCCCCC(=O)OC 34a_100000210767_100000204269 [0,0,0,0,0,0|2,0,2]=4 188 B14R0.337 C=COCCOCCCCCC(=O)OC 34a_100000033082_100009816466 [0,0,0,0,0,0|2,0,2]=4 189 B14R0.337 C=COCCOCCCCCC(=O)OC 34a_100000074720_100000039644 [0,0,0,0,0,0|2,0,2]=4 190 B14R0.337 C=COCCOCCCCCC(=O)OC 7a_100000074720_100000039644 [0,0,0,0,0,0|2,0,2]=4 191 B14R0.337 C=COCCSCCCCCC(=O)OC 62a_100000039644_100009816466 [0,0,0,0,0,0|2,0,2]=4 192 B14R0.337 C=COCCSCCCCCC(=O)OC 62a_100009816466_100000039644 [0,0,0,0,0,0|2,0,2]=4 193 B14R0.337 CC#CCCOCCCCCC(=O)OC 34a_100000750427_100009816466 [0,0,0,0,0,0|1,0,2]=3 194 B14R0.337 CC#CCNCCCCCCC(=O)OC 2230a_100000685387_100009815986 [0,0,0,0,0,0|1,0,2]=3 195 B14R0.337 CC#CCNCCCCCCC(=O)OC 34a_100000685387_100009815986 [0,0,0,0,0,0|1,0,2]=3 196 B14R0.337 CC#CCOCCCCCCC(=O)OC 34a_100000761923_100009815986 [0,0,0,0,0,0|1,0,2]=3 197 B14R0.337 CC#CCOCCCCCCC(=O)OC 34a_100009863599_100000748600 [0,0,0,0,0,0|1,0,2]=3 198 B14R0.337 CC#CCOCCCCCCC(=O)OC 7a_100009863599_100000748600 [0,0,0,0,0,0|1,0,2]=3 199 B14R0.337 CC#CCSCCCCCCC(=O)OC 62a_100000748600_100009815986 [0,0,0,0,0,0|1,0,2]=3 200 B14R0.337 CC#CCSCCCCCCC(=O)OC 62a_100009815986_100000748600 [0,0,0,0,0,0|1,0,2]=3 201 B14R0.337 CC/C=C/CCCOCCCC(=O)NC 34a_100016287902_100000741757 [0,0,0,0,0,0|2,0,2]=4 202 B14R0.337 CC/C=C/CCCOCCCC(=O)NC 7a_100016287902_100000741757 [0,0,0,0,0,0|2,0,2]=4 203 B14R0.337 CC/C=C/CCCOCCCC(=O)OC 34a_100016287902_100000742333 [0,0,0,0,0,0|1,0,2]=3 204 B14R0.337 CC/C=C/CCCOCCCC(=O)OC 7a_100016287902_100011218270 [0,0,0,0,0,0|1,0,2]=3 205 B14R0.337 CC/C=C\CCCCCNCC(=O)NC 269862a_100000693194_100016288537 [0,0,0,0,0,0|2,0,2]=4 206 B14R0.337 CC/C=C\CCCCCOCC(=O)CC 7a_100016268722_100000747405 [0,0,0,0,0,0|2,0,2]=4 207 B14R0.337 CC/C=C\CCCCCOCC(=O)NC 34a_100016268722_100000183359 [0,0,0,0,0,0|2,0,2]=4 208 B14R0.337 CC/C=C\CCCCCOCC(=O)NC 7a_100016268722_100000183359 [0,0,0,0,0,0|2,0,2]=4 209 B14R0.337 CC/C=C\CCCCCOCC(=O)OC 34a_100016268722_100000747449 [0,0,0,0,0,0|1,0,2]=3 210 B14R0.337 CC/C=C\CCCCCOCC(=O)OC 7a_100016268722_100000747449 [0,0,0,0,0,0|1,0,2]=3 211 B14R0.337 CC/C=C\CCCCOCCC(=O)NC 34a_100016287862_100012179268 [0,0,0,0,0,0|2,0,2]=4 212 B14R0.337 CC/C=C\CCCCOCCC(=O)NC 7a_100016287862_100000737683 [0,0,0,0,0,0|2,0,2]=4 213 B14R0.337 CC/C=C\CCCCOCCC(=O)OC 34a_100016287862_100000742370 [0,0,0,0,0,0|1,0,2]=3 214 B14R0.337 CC/C=C\CCCCOCCC(=O)OC 7a_100016287862_100000204255 [0,0,0,0,0,0|1,0,2]=3 215 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 34a_100000059025_100015370543 [0,0,0,0,0,0|1,0,2]=3 216 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 34a_100016288707_100000204269 [0,0,0,0,0,0|1,0,2]=3 217 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 7a_100000059025_100015370543 [0,0,0,0,0,0|1,0,2]=3 218 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 7a_100016288707_100000204269 [0,0,0,0,0,0|1,0,2]=3 219 B14R0.337 CC/C=C\CCOCCOCC(=O)OC 34a_100016288707_100000090808 [0,0,0,0,0,0|2,0,2]=4 220 B14R0.337 CC/C=C\CCOCCOCC(=O)OC 7a_100016288707_100000090808 [0,0,0,0,0,0|2,0,2]=4 221 B14R0.337 CC/C=C\CCSCCCCC(=O)OC 62a_100000204269_100015370543 [0,0,0,0,0,0|1,0,2]=3 222 B14R0.337 CC/C=C\CCSCCCCC(=O)OC 62a_100015370543_100000204269 [0,0,0,0,0,0|1,0,2]=3 223 B14R0.337 CC/C=C\CCSCCOCC(=O)OC 62a_100000090808_100015370543 [0,0,0,0,0,0|2,0,2]=4 224 B14R0.337 CC/C=C\CCSCCOCC(=O)OC 62a_100015370543_100000090808 [0,0,0,0,0,0|2,0,2]=4 225 B14R0.337 CC/C=C\COCCCCCC(=O)OC 34a_100000074720_100103147603 [0,0,0,0,0,0|1,0,2]=3 226 B14R0.337 CC/C=C\COCCCCCC(=O)OC 34a_100016268518_100009816466 [0,0,0,0,0,0|1,0,2]=3 227 B14R0.337 CC/C=C\COCCCCCC(=O)OC 7a_100000074720_100103147603 [0,0,0,0,0,0|1,0,2]=3 228 B14R0.337 CC/C=C\CSCCCCCC(=O)OC 62a_100009816466_100103147603 [0,0,0,0,0,0|1,0,2]=3 229 B14R0.337 CC/C=C\CSCCCCCC(=O)OC 62a_100103147603_100009816466 [0,0,0,0,0,0|1,0,2]=3 230 B14R0.337 CC=C=CCCOCCCCC(=O)OC 34a_100011020354_100000204269 [0,0,0,0,0,0|1,0,3]=4 231 B14R0.337 CC=CCCCOCCCCC(=O)OC 34a_100020645299_100000204269 [0,0,0,0,0,0|1,0,2]=3 232 B14R0.337 CC=CCCCOCCOCC(=O)OC 34a_100020645299_100000090808 [0,0,0,0,0,0|2,0,2]=4 233 B14R0.337 CC=CCOCCCCCCC(=O)OC 34a_100009863599_100000070051 [0,0,0,0,0,0|1,0,2]=3 234 B14R0.337 CC=CCOCCCCCCC(=O)OC 7a_100009863599_100000070051 [0,0,0,0,0,0|1,0,2]=3 235 B14R0.337 CC=CCSCCCCCCC(=O)OC 62a_100000070051_100009815986 [0,0,0,0,0,0|1,0,2]=3 236 B14R0.337 CC=CCSCCCCCCC(=O)OC 62a_100009815986_100000070051 [0,0,0,0,0,0|1,0,2]=3 237 B14R0.337 CCC#CCCOCCCCC(=O)OC 34a_100000036655_100000204269 [0,0,0,0,0,0|1,0,2]=3 238 B14R0.337 CCC#CCCOCCCCC(=O)OC 7a_100000036655_100000204269 [0,0,0,0,0,0|1,0,2]=3 239 B14R0.337 CCC#CCCOCCOCC(=O)OC 34a_100000036655_100000090808 [0,0,0,0,0,0|2,0,2]=4 240 B14R0.337 CCC#CCCOCCOCC(=O)OC 7a_100000036655_100000090808 [0,0,0,0,0,0|2,0,2]=4 241 B14R0.337 CCC#CCOCCCCCC(=O)OC 34a_100000032950_100009816466 [0,0,0,0,0,0|1,0,2]=3 242 B14R0.337 CCC#CCOCCCCCC(=O)OC 34a_100000074720_100009813939 [0,0,0,0,0,0|1,0,2]=3 243 B14R0.337 CCC#CCOCCCCCC(=O)OC 7a_100000074720_100009813939 [0,0,0,0,0,0|1,0,2]=3 244 B14R0.337 CCC#CCSCCCCCC(=O)OC 62a_100009813939_100009816466 [0,0,0,0,0,0|1,0,2]=3 245 B14R0.337 CCC#CCSCCCCCC(=O)OC 62a_100009816466_100009813939 [0,0,0,0,0,0|1,0,2]=3 246 B14R0.337 CCC(=O)CCCCCCCCCCO 1458a_100000210414_100009813290 [0,0,0,0,0,0|2,0,0]=2 247 B14R0.337 CCC(=O)COCCCCCCCCBr 7a_100009813846_100000747405 [0,0,0,0,0,0|3,0,0]=3 248 B14R0.337 CCC(=O)COCCCCCCCCCl 7a_100000033203_100000747405 [0,0,0,0,0,0|3,0,0]=3 249 B14R0.337 CCC(=O)COCCCCCCCCO 34a_100000725409_100000033203 [0,0,0,0,0,0|3,0,0]=3 250 B14R0.337 CCC(=O)COCCCOCCCOC 7a_200011215475_100000747405 [0,0,0,0,0,0|4,0,0]=4 251 B14R0.337 CCC(=O)CSCCCCCCCCO 62a_100000033203_100000747405 [0,0,0,0,0,0|3,0,0]=3 252 B14R0.337 CCC(=O)CSCCCCCCCCO 62a_100000747405_100000033203 [0,0,0,0,0,0|3,0,0]=3 253 B14R0.337 CCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210414 [0,0,0,0,0,0|3,0,0]=3 254 B14R0.337 CCC(=O)NCCNCCCCCCF 34a_100132302217_100015922095 [0,0,0,0,0,0|4,0,0]=4 255 B14R0.337 CCC(=O)NCCNCCCCCCO 34a_100132302217_100000766143 [0,0,0,0,0,0|4,0,0]=4 256 B14R0.337 CCC(=O)NCCOCCCCCCF 34a_200000158885_100015922095 [0,0,0,0,0,0|4,0,0]=4 257 B14R0.337 CCC(=O)NCCOCCCCCCF 7a_200000158885_100015922095 [0,0,0,0,0,0|4,0,0]=4 258 B14R0.337 CCC(=O)NCCOCCCCCCO 34a_200000158885_100000766143 [0,0,0,0,0,0|4,0,0]=4 259 B14R0.337 CCC(=O)NCCOCCCCCCO 7a_200000158885_100000766143 [0,0,0,0,0,0|4,0,0]=4 260 B14R0.337 CCC(=O)OCCOCCCCCCF 7a_200000031056_100015922095 [0,0,0,0,0,0|4,0,0]=4 261 B14R0.337 CCC(=O)OCCOCCCCCCO 7a_200000031056_100000766143 [0,0,0,0,0,0|4,0,0]=4 262 B14R0.337 CCC/C=C/COCCCCC(=O)OC 34a_100016278788_100000204269 [0,0,0,0,0,0|1,0,2]=3 263 B14R0.337 CCC/C=C/COCCCCC(=O)OC 7a_100016278788_100000204269 [0,0,0,0,0,0|1,0,2]=3 264 B14R0.337 CCC/C=C/COCCOCC(=O)OC 34a_100016278788_100000090808 [0,0,0,0,0,0|2,0,2]=4 265 B14R0.337 CCC/C=C/COCCOCC(=O)OC 7a_100016278788_100000090808 [0,0,0,0,0,0|2,0,2]=4 266 B14R0.337 CCCC#CCCOCCCC(=O)NC 34a_100000042726_100000741757 [0,0,0,0,0,0|2,0,2]=4 267 B14R0.337 CCCC#CCCOCCCC(=O)NC 7a_100000042726_100000741757 [0,0,0,0,0,0|2,0,2]=4 268 B14R0.337 CCCC#CCCOCCCC(=O)OC 34a_100000042726_100000742333 [0,0,0,0,0,0|1,0,2]=3 269 B14R0.337 CCCC#CCCOCCCC(=O)OC 7a_100000042726_100011218270 [0,0,0,0,0,0|1,0,2]=3 270 B14R0.337 CCCC#CCOCCCCC(=O)OC 34a_100000034806_100000204269 [0,0,0,0,0,0|1,0,2]=3 271 B14R0.337 CCCC#CCOCCCCC(=O)OC 7a_100000034806_100000204269 [0,0,0,0,0,0|1,0,2]=3 272 B14R0.337 CCCC#CCOCCOCC(=O)OC 34a_100000034806_100000090808 [0,0,0,0,0,0|2,0,2]=4 273 B14R0.337 CCCC#CCOCCOCC(=O)OC 7a_100000034806_100000090808 [0,0,0,0,0,0|2,0,2]=4 274 B14R0.337 CCCC/C=C/COCCCC(=O)NC 34a_200016272032_100000741757 [0,0,0,0,0,0|2,0,2]=4 275 B14R0.337 CCCC/C=C/COCCCC(=O)NC 7a_200016272032_100000741757 [0,0,0,0,0,0|2,0,2]=4 276 B14R0.337 CCCC/C=C/COCCCC(=O)OC 34a_200016272032_100000742333 [0,0,0,0,0,0|1,0,2]=3 277 B14R0.337 CCCC/C=C/COCCCC(=O)OC 7a_200016272032_100011218270 [0,0,0,0,0,0|1,0,2]=3 278 B14R0.337 CCCC/C=C\CCOCCC(=O)NC 34a_200016286491_100012179268 [0,0,0,0,0,0|2,0,2]=4 279 B14R0.337 CCCC/C=C\CCOCCC(=O)NC 7a_200016286491_100000737683 [0,0,0,0,0,0|2,0,2]=4 280 B14R0.337 CCCC/C=C\CCOCCC(=O)OC 34a_200016286491_100000742370 [0,0,0,0,0,0|1,0,2]=3 281 B14R0.337 CCCC/C=C\CCOCCC(=O)OC 7a_200016286491_100000204255 [0,0,0,0,0,0|1,0,2]=3 282 B14R0.337 CCCCC#CCCCNCC(=O)NC 2230a_100000693194_200000047210 [0,0,0,0,0,0|2,0,2]=4 283 B14R0.337 CCCCC#CCCCOCC(=O)CC 34a_100000725409_200000047210 [0,0,0,0,0,0|2,0,2]=4 284 B14R0.337 CCCCC#CCCCOCC(=O)NC 34a_100000750040_200000047210 [0,0,0,0,0,0|2,0,2]=4 285 B14R0.337 CCCCC#CCCCSCC(=O)CC 62a_100000747405_200000047210 [0,0,0,0,0,0|2,0,2]=4 286 B14R0.337 CCCCC#CCCCSCC(=O)CC 62a_200000047210_100000747405 [0,0,0,0,0,0|2,0,2]=4 287 B14R0.337 CCCCC#CCCCSCC(=O)NC 62a_100000183359_200000047210 [0,0,0,0,0,0|2,0,2]=4 288 B14R0.337 CCCCC#CCCCSCC(=O)NC 62a_200000047210_100000183359 [0,0,0,0,0,0|2,0,2]=4 289 B14R0.337 CCCCC#CCCCSCC(=O)OC 62a_100000747449_200000047210 [0,0,0,0,0,0|1,0,2]=3 290 B14R0.337 CCCCC#CCCCSCC(=O)OC 62a_200000047210_100000747449 [0,0,0,0,0,0|1,0,2]=3 291 B14R0.337 CCCCC#CCCOCCC(=O)NC 34a_100000037610_100012179268 [0,0,0,0,0,0|2,0,2]=4 292 B14R0.337 CCCCC#CCCOCCC(=O)NC 7a_100000037610_100000737683 [0,0,0,0,0,0|2,0,2]=4 293 B14R0.337 CCCCC#CCCOCCC(=O)OC 34a_100000037610_100000742370 [0,0,0,0,0,0|1,0,2]=3 294 B14R0.337 CCCCC#CCCOCCC(=O)OC 7a_100000037610_100000204255 [0,0,0,0,0,0|1,0,2]=3 295 B14R0.337 CCCCC#CCOCCCC(=O)NC 34a_200000034558_100000741757 [0,0,0,0,0,0|2,0,2]=4 296 B14R0.337 CCCCC#CCOCCCC(=O)NC 7a_200000034558_100000741757 [0,0,0,0,0,0|2,0,2]=4 297 B14R0.337 CCCCC#CCOCCCC(=O)OC 34a_200000034558_100000742333 [0,0,0,0,0,0|1,0,2]=3 298 B14R0.337 CCCCC#CCOCCCC(=O)OC 7a_200000034558_100011218270 [0,0,0,0,0,0|1,0,2]=3 299 B14R0.337 CCCCC/C=C/COCCC(=O)NC 34a_100016258190_100012179268 [0,0,0,0,0,0|2,0,2]=4 300 B14R0.337 CCCCC/C=C/COCCC(=O)NC 7a_100016258190_100000737683 [0,0,0,0,0,0|2,0,2]=4 301 B14R0.337 CCCCC/C=C/COCCC(=O)OC 34a_100016258190_100000742370 [0,0,0,0,0,0|1,0,2]=3 302 B14R0.337 CCCCC/C=C/COCCC(=O)OC 7a_100016258190_100000204255 [0,0,0,0,0,0|1,0,2]=3 303 B14R0.337 CCCCC/C=C\CCOCC(=O)CC 7a_100016277358_100000747405 [0,0,0,0,0,0|2,0,2]=4 304 B14R0.337 CCCCC/C=C\CCOCC(=O)NC 34a_100016277358_100000183359 [0,0,0,0,0,0|2,0,2]=4 305 B14R0.337 CCCCC/C=C\CCOCC(=O)NC 7a_100016277358_100000183359 [0,0,0,0,0,0|2,0,2]=4 306 B14R0.337 CCCCC/C=C\CCOCC(=O)OC 34a_100016277358_100000747449 [0,0,0,0,0,0|1,0,2]=3 307 B14R0.337 CCCCC/C=C\CCOCC(=O)OC 7a_100016277358_100000747449 [0,0,0,0,0,0|1,0,2]=3 308 B14R0.337 CCCCCC#CCCOCC(=O)CC 7a_200000042877_100000747405 [0,0,0,0,0,0|2,0,2]=4 309 B14R0.337 CCCCCC#CCCOCC(=O)NC 34a_200000042877_100000183359 [0,0,0,0,0,0|2,0,2]=4 310 B14R0.337 CCCCCC#CCCOCC(=O)NC 7a_200000042877_100000183359 [0,0,0,0,0,0|2,0,2]=4 311 B14R0.337 CCCCCC#CCCOCC(=O)OC 34a_200000042877_100000747449 [0,0,0,0,0,0|1,0,2]=3 312 B14R0.337 CCCCCC#CCCOCC(=O)OC 7a_200000042877_100000747449 [0,0,0,0,0,0|1,0,2]=3 313 B14R0.337 CCCCCC#CCNCCC(=O)NC 2230a_100000738227_100009816472 [0,0,0,0,0,0|2,0,2]=4 314 B14R0.337 CCCCCC#CCNCCC(=O)NC 34a_100000738227_100009816472 [0,0,0,0,0,0|2,0,2]=4 315 B14R0.337 CCCCCC#CCOCCC(=O)NC 34a_100000754576_100009816472 [0,0,0,0,0,0|2,0,2]=4 316 B14R0.337 CCCCCC#CCOCCC(=O)NC 34a_200000033628_100012179268 [0,0,0,0,0,0|2,0,2]=4 317 B14R0.337 CCCCCC#CCOCCC(=O)NC 7a_200000033628_100000737683 [0,0,0,0,0,0|2,0,2]=4 318 B14R0.337 CCCCCC#CCOCCC(=O)OC 34a_200000033628_100000742370 [0,0,0,0,0,0|1,0,2]=3 319 B14R0.337 CCCCCC#CCOCCC(=O)OC 7a_200000033628_100000204255 [0,0,0,0,0,0|1,0,2]=3 320 B14R0.337 CCCCCC#CCSCCC(=O)NC 62a_100000737683_100009816472 [0,0,0,0,0,0|2,0,2]=4 321 B14R0.337 CCCCCC#CCSCCC(=O)NC 62a_100009816472_100000737683 [0,0,0,0,0,0|2,0,2]=4 322 B14R0.337 CCCCCC#CCSCCC(=O)OC 62a_100000204255_100009816472 [0,0,0,0,0,0|1,0,2]=3 323 B14R0.337 CCCCCC#CCSCCC(=O)OC 62a_100009816472_100000204255 [0,0,0,0,0,0|1,0,2]=3 324 B14R0.337 CCCCCC#CCSCOC(=O)OC 62a_100009816472_100000139417 [0,0,0,0,0,0|2,0,2]=4 325 B14R0.337 CCCCCC/C=C/COCC(=O)CC 7a_200016276170_100000747405 [0,0,0,0,0,0|2,0,2]=4 326 B14R0.337 CCCCCC/C=C/COCC(=O)NC 34a_200016276170_100000183359 [0,0,0,0,0,0|2,0,2]=4 327 B14R0.337 CCCCCC/C=C/COCC(=O)NC 7a_200016276170_100000183359 [0,0,0,0,0,0|2,0,2]=4 328 B14R0.337 CCCCCC/C=C/COCC(=O)OC 34a_200016276170_100000747449 [0,0,0,0,0,0|1,0,2]=3 329 B14R0.337 CCCCCC/C=C/COCC(=O)OC 7a_200016276170_100000747449 [0,0,0,0,0,0|1,0,2]=3 330 B14R0.337 CCCCCCC#CCOCC(=O)CC 7a_200000037284_100000747405 [0,0,0,0,0,0|2,0,2]=4 331 B14R0.337 CCCCCCC#CCOCC(=O)NC 34a_200000037284_100000183359 [0,0,0,0,0,0|2,0,2]=4 332 B14R0.337 CCCCCCC#CCOCC(=O)NC 7a_200000037284_100000183359 [0,0,0,0,0,0|2,0,2]=4 333 B14R0.337 CCCCCCC#CCOCC(=O)OC 34a_200000037284_100000747449 [0,0,0,0,0,0|1,0,2]=3 334 B14R0.337 CCCCCCC#CCOCC(=O)OC 7a_200000037284_100000747449 [0,0,0,0,0,0|1,0,2]=3 335 B14R0.337 CCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218696 [0,0,0,0,0,0|3,0,1]=4 336 B14R0.337 CCCCCCCCCC=CC(=O)CC 1458a_200015352897_100000210202 [0,0,0,0,0,0|1,0,2]=3 337 B14R0.337 CCCCCCCCCC=CC(=O)CF 1458a_200015352897_100015361967 [0,0,0,0,0,0|2,0,2]=4 338 B14R0.337 CCCCCCCCCC=CC(=O)NC 11a_106832991635_200015352897 [0,0,0,0,0,0|1,0,2]=3 339 B14R0.337 CCCCCCCCCC=CC(=O)NC 1626a_100102657272_200015352897 [0,0,0,0,0,0|1,0,2]=3 340 B14R0.337 CCCCCCCCCC=CC(=O)NC 240690a_100102657272_200015352897 [0,0,0,0,0,0|1,0,2]=3 341 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011215454 [0,0,0,0,0,0|1,0,0]=1 342 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210736_100000210202 [0,0,0,0,0,0|1,0,0]=1 343 B14R0.337 CCCCCCCCCCCC(=O)CF 1458a_100000210736_100015361967 [0,0,0,0,0,0|2,0,0]=2 344 B14R0.337 CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215454 [0,0,0,0,0,0|2,0,0]=2 345 B14R0.337 CCCCCCCCCCCC(=O)NC 11a_106832991635_100000210736 [0,0,0,0,0,0|1,0,0]=1 346 B14R0.337 CCCCCCCCCCCC(=O)NC 1626a_100102657272_100000210736 [0,0,0,0,0,0|1,0,0]=1 347 B14R0.337 CCCCCCCCCCCC(=O)NC 240690a_100102657272_100000210736 [0,0,0,0,0,0|1,0,0]=1 348 B14R0.337 CCCCCCCCCCCC(C)NC 270004a_106832991635_100011216755 [0,0,0,0,0,0|2,0,1]=3 349 B14R0.337 CCCCCCCCCCCC(C)OC 34a_100011217895_200000210301 [0,0,0,0,0,0|1,0,1]=2 350 B14R0.337 CCCCCCCCCCCC(C)OC 7a_100011217895_200000210301 [0,0,0,0,0,0|1,0,1]=2 351 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 34a_100011217895_200025704644 [0,0,0,0,0,0|1,0,1]=2 352 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 7a_100011217895_200025704644 [0,0,0,0,0,0|1,0,1]=2 353 B14R0.337 CCCCCCCCCCCN(C)CC 2230a_100000225621_100011215454 [0,0,0,0,0,0|3,0,0]=3 354 B14R0.337 CCCCCCCCCCCN(C)CC 269982a_100000225621_100011215454 [0,0,0,0,0,0|3,0,0]=3 355 B14R0.337 CCCCCCCCCCNC(=O)CC 11a_100000684558_100000210414 [0,0,0,0,0,0|2,0,0]=2 356 B14R0.337 CCCCCCCCCCNC(=O)CC 1626a_100000684558_100000210414 [0,0,0,0,0,0|2,0,0]=2 357 B14R0.337 CCCCCCCCCCNC(=O)CC 240690a_100000684558_100000210414 [0,0,0,0,0,0|2,0,0]=2 358 B14R0.337 CCCCCCCCCCNC(=O)CC 527a_100000684558_100000210414 [0,0,0,0,0,0|2,0,0]=2 359 B14R0.337 CCCCCCCCCCNC(=O)CO 240690a_100000684558_100000210174 [0,0,0,0,0,0|3,0,0]=3 360 B14R0.337 CCCCCCCCCCNC(=O)CO 527a_100000684558_100000210174 [0,0,0,0,0,0|3,0,0]=3 361 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100000684558_106832991635 [0,0,0,0,0,0|2,0,0]=2 362 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100102657272_100000684558 [0,0,0,0,0,0|2,0,0]=2 363 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100000684558_100102657272 [0,0,0,0,0,0|2,0,0]=2 364 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100102657272_100000684558 [0,0,0,0,0,0|2,0,0]=2 365 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_100000684558_100102657272 [0,0,0,0,0,0|2,0,0]=2 366 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_106832991638_100000684558 [0,0,0,0,0,0|2,0,0]=2 367 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000209981_100000210320 [0,0,0,0,0,0|3,0,1]=4 368 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000684558_100000758301 [0,0,0,0,0,0|3,0,1]=4 369 B14R0.337 CCCCCCCCCCNC(C)CC 34a_100000684558_100011215416 [0,0,0,0,0,0|3,0,1]=4 370 B14R0.337 CCCCCCCCCCOC(C)CC 34a_100000210711_100011215416 [0,0,0,0,0,0|3,0,1]=4 371 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210228_100000210320 [0,0,0,0,0,0|3,0,1]=4 372 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210711_100000758301 [0,0,0,0,0,0|3,0,1]=4 373 B14R0.337 CCCCCCCCCCSC(C)CC 62a_100000758301_100000210320 [0,0,0,0,0,0|3,0,1]=4 374 B14R0.337 CCCCCCCCCCSC(C)OC 62a_100009879195_100000210320 [0,0,0,0,0,0|2,0,1]=3 375 B14R0.337 CCCCCCCCCNCC(=O)NC 2230a_100000212291_100000183359 [0,0,0,0,0,0|2,0,0]=2 376 B14R0.337 CCCCCCCCCNCC(=O)NC 2230a_100000693194_100011214924 [0,0,0,0,0,0|2,0,0]=2 377 B14R0.337 CCCCCCCCCNCC(=O)NC 34a_100000212291_100000183359 [0,0,0,0,0,0|2,0,0]=2 378 B14R0.337 CCCCCCCCCNCC(=O)OC 2230a_100000212291_100000747449 [0,0,0,0,0,0|1,0,0]=1 379 B14R0.337 CCCCCCCCCNCC(=O)OC 34a_100000212291_100000747449 [0,0,0,0,0,0|1,0,0]=1 380 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100000212291_100000748023 [0,0,0,0,0,0|3,0,1]=4 381 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100020588543_100011214924 [0,0,0,0,0,0|3,0,1]=4 382 B14R0.337 CCCCCCCCCNCC(C)CC 270004a_100000212291_100000243153 [0,0,0,0,0,0|3,0,1]=4 383 B14R0.337 CCCCCCCCCNCC(C)CC 34a_100000212291_100000748023 [0,0,0,0,0,0|3,0,1]=4 384 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100000212291_100011218378 [0,0,0,0,0,0|2,0,2]=4 385 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100011218483_100011214924 [0,0,0,0,0,0|2,0,2]=4 386 B14R0.337 CCCCCCCCCNCC(O)CC 34a_100000212291_100011218378 [0,0,0,0,0,0|2,0,2]=4 387 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 2230a_100000212291_100009816398 [0,0,0,0,0,0|3,0,1]=4 388 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 34a_100000212291_100009816398 [0,0,0,0,0,0|3,0,1]=4 389 B14R0.337 CCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011214924 [0,0,0,0,0,0|2,0,1]=3 390 B14R0.337 CCCCCCCCCOCC(=O)CC 34a_100000725409_100011214924 [0,0,0,0,0,0|2,0,0]=2 391 B14R0.337 CCCCCCCCCOCC(=O)CC 7a_100000210712_100000747405 [0,0,0,0,0,0|2,0,0]=2 392 B14R0.337 CCCCCCCCCOCC(=O)NC 34a_100000210712_100000183359 [0,0,0,0,0,0|2,0,0]=2 393 B14R0.337 CCCCCCCCCOCC(=O)NC 34a_100000750040_100011214924 [0,0,0,0,0,0|2,0,0]=2 394 B14R0.337 CCCCCCCCCOCC(=O)NC 7a_100000210712_100000183359 [0,0,0,0,0,0|2,0,0]=2 395 B14R0.337 CCCCCCCCCOCC(=O)OC 34a_100000210712_100000747449 [0,0,0,0,0,0|1,0,0]=1 396 B14R0.337 CCCCCCCCCOCC(=O)OC 7a_100000210712_100000747449 [0,0,0,0,0,0|1,0,0]=1 397 B14R0.337 CCCCCCCCCOCC(C)CC 34a_100000210712_100000748023 [0,0,0,0,0,0|3,0,1]=4 398 B14R0.337 CCCCCCCCCOCC(C)CC 7a_100000210712_100000748023 [0,0,0,0,0,0|3,0,1]=4 399 B14R0.337 CCCCCCCCCOCC(C)OC 34a_100000690652_100011214924 [0,0,0,0,0,0|2,0,1]=3 400 B14R0.337 CCCCCCCCCOCC(O)CC 34a_100000210712_100011218378 [0,0,0,0,0,0|2,0,2]=4 401 B14R0.337 CCCCCCCCCOCC(O)CC 7a_100000210712_100011218378 [0,0,0,0,0,0|2,0,2]=4 402 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 34a_100000210712_100009816398 [0,0,0,0,0,0|3,0,1]=4 403 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100000210712_100009816398 [0,0,0,0,0,0|3,0,1]=4 404 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210328 [0,0,0,0,0,0|3,0,1]=4 405 B14R0.337 CCCCCCCCCSCC(=O)CC 62a_100000747405_100000210670 [0,0,0,0,0,0|2,0,0]=2 406 B14R0.337 CCCCCCCCCSCC(=O)NC 62a_100000183359_100000210670 [0,0,0,0,0,0|2,0,0]=2 407 B14R0.337 CCCCCCCCCSCC(=O)OC 62a_100000747449_100000210670 [0,0,0,0,0,0|1,0,0]=1 408 B14R0.337 CCCCCCCCCSCC(C)CC 62a_100000748023_100000210670 [0,0,0,0,0,0|3,0,1]=4 409 B14R0.337 CCCCCCCCCSCC(O)CC 62a_100011218378_100000210670 [0,0,0,0,0,0|2,0,2]=4 410 B14R0.337 CCCCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210670 [0,0,0,0,0,0|3,0,1]=4 411 B14R0.337 CCCCCCCCNCCC(=O)NC 2230a_100000229939_100000737683 [0,0,0,0,0,0|2,0,0]=2 412 B14R0.337 CCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210759 [0,0,0,0,0,0|2,0,0]=2 413 B14R0.337 CCCCCCCCNCCC(=O)NC 34a_100000229939_100012179268 [0,0,0,0,0,0|2,0,0]=2 414 B14R0.337 CCCCCCCCNCCC(=O)NC 34a_100000738227_100000210759 [0,0,0,0,0,0|2,0,0]=2 415 B14R0.337 CCCCCCCCNCCC(=O)OC 2230a_100000229939_100000204255 [0,0,0,0,0,0|1,0,0]=1 416 B14R0.337 CCCCCCCCNCCC(=O)OC 34a_100000229939_100000742370 [0,0,0,0,0,0|1,0,0]=1 417 B14R0.337 CCCCCCCCNCCC(C)CC 2230a_100020591266_100000210759 [0,0,0,0,0,0|3,0,1]=4 418 B14R0.337 CCCCCCCCOCCC(=NO)N 34a_100000749954_100000210759 [0,0,0,0,0,0|4,0,0]=4 419 B14R0.337 CCCCCCCCOCCC(=O)NC 34a_100000210232_100012179268 [0,0,0,0,0,0|2,0,0]=2 420 B14R0.337 CCCCCCCCOCCC(=O)NC 34a_100000754576_100000210759 [0,0,0,0,0,0|2,0,0]=2 421 B14R0.337 CCCCCCCCOCCC(=O)NC 7a_100000210232_100000737683 [0,0,0,0,0,0|2,0,0]=2 422 B14R0.337 CCCCCCCCOCCC(=O)OC 34a_100000210232_100000742370 [0,0,0,0,0,0|1,0,0]=1 423 B14R0.337 CCCCCCCCOCCC(=O)OC 7a_100000210232_100000204255 [0,0,0,0,0,0|1,0,0]=1 424 B14R0.337 CCCCCCCCOCCC(C)CC 7a_100011215188_100000210759 [0,0,0,0,0,0|3,0,1]=4 425 B14R0.337 CCCCCCCCOCCC(C)OC 7a_100000764861_100000210759 [0,0,0,0,0,0|2,0,1]=3 426 B14R0.337 CCCCCCCCSCCC(=O)NC 62a_100000210759_100000737683 [0,0,0,0,0,0|2,0,0]=2 427 B14R0.337 CCCCCCCCSCCC(=O)NC 62a_100000737683_100000210317 [0,0,0,0,0,0|2,0,0]=2 428 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000204255_100000210317 [0,0,0,0,0,0|1,0,0]=1 429 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000210759_100000204255 [0,0,0,0,0,0|1,0,0]=1 430 B14R0.337 CCCCCCCCSCOC(=O)OC 62a_100000210759_100000139417 [0,0,0,0,0,0|2,0,0]=2 431 B14R0.337 CCCCCCCNC/C=C/C(=O)OC 2230a_100000229938_100000742655 [0,0,0,0,0,0|1,0,2]=3 432 B14R0.337 CCCCCCCNCCCC(=O)NC 2230a_100000229938_100000741757 [0,0,0,0,0,0|2,0,0]=2 433 B14R0.337 CCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210681 [0,0,0,0,0,0|2,0,0]=2 434 B14R0.337 CCCCCCCNCCCC(=O)NC 34a_100000740002_100000210614 [0,0,0,0,0,0|2,0,0]=2 435 B14R0.337 CCCCCCCNCCCC(=O)OC 2230a_100000229938_100011218270 [0,0,0,0,0,0|1,0,0]=1 436 B14R0.337 CCCCCCCNCCCN(C)CC 2230a_100000229938_100015186262 [0,0,0,0,0,0|4,0,0]=4 437 B14R0.337 CCCCCCCNCCNC(=O)CC 34a_100132302217_100000210614 [0,0,0,0,0,0|3,0,0]=3 438 B14R0.337 CCCCCCCNCCNC(=O)NC 34a_100015205895_100000210614 [0,0,0,0,0,0|3,0,0]=3 439 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 34a_100000210272_100000742655 [0,0,0,0,0,0|1,0,2]=3 440 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 7a_100000210272_100000742655 [0,0,0,0,0,0|1,0,2]=3 441 B14R0.337 CCCCCCCOCCCC(=O)NC 34a_100000210272_100000741757 [0,0,0,0,0,0|2,0,0]=2 442 B14R0.337 CCCCCCCOCCCC(=O)NC 7a_100000210272_100000741757 [0,0,0,0,0,0|2,0,0]=2 443 B14R0.337 CCCCCCCOCCCC(=O)NN 34a_100000211488_100000210614 [0,0,0,0,0,0|3,0,0]=3 444 B14R0.337 CCCCCCCOCCCC(=O)OC 34a_100000210272_100000742333 [0,0,0,0,0,0|1,0,0]=1 445 B14R0.337 CCCCCCCOCCCC(=O)OC 7a_100000210272_100011218270 [0,0,0,0,0,0|1,0,0]=1 446 B14R0.337 CCCCCCCOCCCC(C)CC 7a_100011216074_100000210614 [0,0,0,0,0,0|3,0,1]=4 447 B14R0.337 CCCCCCCOCCCN(C)CC 7a_100000210272_100015186262 [0,0,0,0,0,0|4,0,0]=4 448 B14R0.337 CCCCCCCOCCNC(=O)CC 34a_200000158885_100000210614 [0,0,0,0,0,0|3,0,0]=3 449 B14R0.337 CCCCCCCOCCNC(=O)CC 7a_200000158885_100000210614 [0,0,0,0,0,0|3,0,0]=3 450 B14R0.337 CCCCCCCOCCNC(=O)OC 34a_100000757965_100000210614 [0,0,0,0,0,0|2,0,0]=2 451 B14R0.337 CCCCCCCOCCOC(=O)CC 7a_200000031056_100000210614 [0,0,0,0,0,0|3,0,0]=3 452 B14R0.337 CCCCCCCOCCOC(=O)NC 34a_100000210272_200011997002 [0,0,0,0,0,0|3,0,0]=3 453 B14R0.337 CCCCCCCOCCOC(=O)NC 7a_100000210272_200011997002 [0,0,0,0,0,0|3,0,0]=3 454 B14R0.337 CCCCCCCOCCOC(=O)OC 34a_100010262106_100000210614 [0,0,0,0,0,0|2,0,0]=2 455 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000210614_100000742655 [0,0,0,0,0,0|1,0,2]=3 456 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210316 [0,0,0,0,0,0|1,0,2]=3 457 B14R0.337 CCCCCCCSCCCC(=O)NC 62a_100000210614_100000741757 [0,0,0,0,0,0|2,0,0]=2 458 B14R0.337 CCCCCCCSCCCC(=O)NC 62a_100000741757_100000210316 [0,0,0,0,0,0|2,0,0]=2 459 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100000210614_100011218270 [0,0,0,0,0,0|1,0,0]=1 460 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100011218270_100000210316 [0,0,0,0,0,0|1,0,0]=1 461 B14R0.337 CCCCCCCSCCCN(C)CC 62a_100000210614_100015186262 [0,0,0,0,0,0|4,0,0]=4 462 B14R0.337 CCCCCCCSCCOC(=O)NC 62a_100000210614_200011997002 [0,0,0,0,0,0|3,0,0]=3 463 B14R0.337 CCCCCCCSCCOC(=O)NC 62a_200011997002_100000210316 [0,0,0,0,0,0|3,0,0]=3 464 B14R0.337 CCCCCCNCCCCC(=O)OC 2230a_100000210581_100000204269 [0,0,0,0,0,0|1,0,0]=1 465 B14R0.337 CCCCCCNCCOCC(=O)OC 2230a_100000210581_100000090808 [0,0,0,0,0,0|2,0,0]=2 466 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000059025_100000210314 [0,0,0,0,0,0|1,0,0]=1 467 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000210259_100000204269 [0,0,0,0,0,0|1,0,0]=1 468 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000059025_100000210314 [0,0,0,0,0,0|1,0,0]=1 469 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000210259_100000204269 [0,0,0,0,0,0|1,0,0]=1 470 B14R0.337 CCCCCCOCCOCC(=O)CC 7a_100000691444_100000747405 [0,0,0,0,0,0|3,0,0]=3 471 B14R0.337 CCCCCCOCCOCC(=O)NC 34a_100000691444_100000183359 [0,0,0,0,0,0|3,0,0]=3 472 B14R0.337 CCCCCCOCCOCC(=O)NC 7a_100000691444_100000183359 [0,0,0,0,0,0|3,0,0]=3 473 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000210259_100000090808 [0,0,0,0,0,0|2,0,0]=2 474 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000691444_100000747449 [0,0,0,0,0,0|2,0,0]=2 475 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000210259_100000090808 [0,0,0,0,0,0|2,0,0]=2 476 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000691444_100000747449 [0,0,0,0,0,0|2,0,0]=2 477 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000204269_100000210757 [0,0,0,0,0,0|1,0,0]=1 478 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000210314_100000204269 [0,0,0,0,0,0|1,0,0]=1 479 B14R0.337 CCCCCCSCCOCC(=O)OC 62a_100000090808_100000210757 [0,0,0,0,0,0|2,0,0]=2 480 B14R0.337 CCCCCCSCCOCC(=O)OC 62a_100000210314_100000090808 [0,0,0,0,0,0|2,0,0]=2 481 B14R0.337 CCCCCNCCCCCC(=O)OC 2230a_100000209983_100009816466 [0,0,0,0,0,0|1,0,0]=1 482 B14R0.337 CCCCCNCCOCCC(=O)NC 34a_100000224656_100012179268 [0,0,0,0,0,0|3,0,0]=3 483 B14R0.337 CCCCCNCCOCCC(=O)OC 34a_100000224656_100000742370 [0,0,0,0,0,0|2,0,0]=2 484 B14R0.337 CCCCCNN=CCCCC(=O)OC 4a_100000694160_100000094087 [0,0,0,0,0,0|2,0,1]=3 485 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000074720_100000718602 [0,0,0,0,0,0|1,0,0]=1 486 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000210253_100009816466 [0,0,0,0,0,0|1,0,0]=1 487 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000074720_100000210326 [0,0,0,0,0,0|1,0,0]=1 488 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000210253_100009816466 [0,0,0,0,0,0|1,0,0]=1 489 B14R0.337 CCCCCOCCCCCC(C)CC 7a_200000035636_100000210326 [0,0,0,0,0,0|3,0,1]=4 490 B14R0.337 CCCCCOCCOCCC(=O)NC 34a_100011215259_100012179268 [0,0,0,0,0,0|3,0,0]=3 491 B14R0.337 CCCCCOCCOCCC(=O)NC 7a_100011215259_100000737683 [0,0,0,0,0,0|3,0,0]=3 492 B14R0.337 CCCCCOCCOCCC(=O)OC 34a_100011215259_100000742370 [0,0,0,0,0,0|2,0,0]=2 493 B14R0.337 CCCCCOCCOCCC(=O)OC 7a_100011215259_100000204255 [0,0,0,0,0,0|2,0,0]=2 494 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100000210326_100009816466 [0,0,0,0,0,0|1,0,0]=1 495 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100009816466_100000210326 [0,0,0,0,0,0|1,0,0]=1 496 B14R0.337 CCCCNCCCCCCC(=O)OC 2230a_100000102301_100009815986 [0,0,0,0,0,0|1,0,0]=1 497 B14R0.337 CCCCNCCCCCCC(=O)OC 7a_106832991798_100009815986 [0,0,0,0,0,0|1,0,0]=1 498 B14R0.337 CCCCNCCCCOCC(=O)NC 34a_200011216965_100000183359 [0,0,0,0,0,0|3,0,0]=3 499 B14R0.337 CCCCNCCCCOCC(=O)OC 34a_200011216965_100000747449 [0,0,0,0,0,0|2,0,0]=2 500 B14R0.337 CCCCNN=CCCCCC(=O)OC 4a_100025702795_100000052768 [0,0,0,0,0,0|2,0,1]=3 501 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100000210227_100009815986 [0,0,0,0,0,0|1,0,0]=1 502 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100009863599_100000210210 [0,0,0,0,0,0|1,0,0]=1 503 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100000210227_100009815986 [0,0,0,0,0,0|1,0,0]=1 504 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100009863599_100000210211 [0,0,0,0,0,0|1,0,0]=1 505 B14R0.337 CCCCOCCCCOCC(=O)CC 7a_200000760531_100000747405 [0,0,0,0,0,0|3,0,0]=3 506 B14R0.337 CCCCOCCCCOCC(=O)NC 34a_200000760531_100000183359 [0,0,0,0,0,0|3,0,0]=3 507 B14R0.337 CCCCOCCCCOCC(=O)NC 7a_200000760531_100000183359 [0,0,0,0,0,0|3,0,0]=3 508 B14R0.337 CCCCOCCCCOCC(=O)OC 34a_200000760531_100000747449 [0,0,0,0,0,0|2,0,0]=2 509 B14R0.337 CCCCOCCCCOCC(=O)OC 7a_200000760531_100000747449 [0,0,0,0,0,0|2,0,0]=2 510 B14R0.337 CCCCOCCCNCCC(=O)NC 2230a_200000211371_100000737683 [0,0,0,0,0,0|3,0,0]=3 511 B14R0.337 CCCCOCCCNCCC(=O)NC 34a_200000211371_100012179268 [0,0,0,0,0,0|3,0,0]=3 512 B14R0.337 CCCCOCCCNCCC(=O)OC 2230a_200000211371_100000204255 [0,0,0,0,0,0|2,0,0]=2 513 B14R0.337 CCCCOCCCNCCC(=O)OC 34a_200000211371_100000742370 [0,0,0,0,0,0|2,0,0]=2 514 B14R0.337 CCCCOCCCOCCC(=O)NC 34a_200011215613_100012179268 [0,0,0,0,0,0|3,0,0]=3 515 B14R0.337 CCCCOCCCOCCC(=O)NC 7a_200011215613_100000737683 [0,0,0,0,0,0|3,0,0]=3 516 B14R0.337 CCCCOCCCOCCC(=O)OC 34a_200011215613_100000742370 [0,0,0,0,0,0|2,0,0]=2 517 B14R0.337 CCCCOCCCOCCC(=O)OC 7a_200011215613_100000204255 [0,0,0,0,0,0|2,0,0]=2 518 B14R0.337 CCCCOCCNCCCC(=O)NC 2230a_100000740002_100000743108 [0,0,0,0,0,0|3,0,0]=3 519 B14R0.337 CCCCOCCNCCCC(=O)NC 34a_100000740002_100000743108 [0,0,0,0,0,0|3,0,0]=3 520 B14R0.337 CCCCOCCNCCNC(=O)CC 34a_100132302217_100000743108 [0,0,0,0,0,0|4,0,0]=4 521 B14R0.337 CCCCOCCNCCNC(=O)NC 34a_100015205895_100000743108 [0,0,0,0,0,0|4,0,0]=4 522 B14R0.337 CCCCOCCOC/C=C/C(=O)OC 34a_100000210238_100000742655 [0,0,0,0,0,0|2,0,2]=4 523 B14R0.337 CCCCOCCOC/C=C/C(=O)OC 7a_100000210238_100000742655 [0,0,0,0,0,0|2,0,2]=4 524 B14R0.337 CCCCOCCOCCCC(=O)NC 34a_100000210238_100000741757 [0,0,0,0,0,0|3,0,0]=3 525 B14R0.337 CCCCOCCOCCCC(=O)NC 7a_100000210238_100000741757 [0,0,0,0,0,0|3,0,0]=3 526 B14R0.337 CCCCOCCOCCCC(=O)NN 34a_100000211488_100000743108 [0,0,0,0,0,0|4,0,0]=4 527 B14R0.337 CCCCOCCOCCCC(=O)OC 34a_100000210238_100000742333 [0,0,0,0,0,0|2,0,0]=2 528 B14R0.337 CCCCOCCOCCCC(=O)OC 7a_100000210238_100011218270 [0,0,0,0,0,0|2,0,0]=2 529 B14R0.337 CCCCOCCOCCNC(=O)CC 34a_200000158885_100000743108 [0,0,0,0,0,0|4,0,0]=4 530 B14R0.337 CCCCOCCOCCNC(=O)CC 7a_200000158885_100000743108 [0,0,0,0,0,0|4,0,0]=4 531 B14R0.337 CCCCOCCOCCNC(=O)OC 34a_100000757965_100000743108 [0,0,0,0,0,0|3,0,0]=3 532 B14R0.337 CCCCOCCOCCOC(=O)CC 7a_200000031056_100000743108 [0,0,0,0,0,0|4,0,0]=4 533 B14R0.337 CCCCOCCOCCOC(=O)NC 34a_100000210238_200011997002 [0,0,0,0,0,0|4,0,0]=4 534 B14R0.337 CCCCOCCOCCOC(=O)NC 7a_100000210238_200011997002 [0,0,0,0,0,0|4,0,0]=4 535 B14R0.337 CCCCOCCOCCOC(=O)OC 34a_100010262106_100000743108 [0,0,0,0,0,0|3,0,0]=3 536 B14R0.337 CCCCOCCSC/C=C/C(=O)OC 62a_100000742655_100000743108 [0,0,0,0,0,0|2,0,2]=4 537 B14R0.337 CCCCOCCSC/C=C/C(=O)OC 62a_100000743108_100000742655 [0,0,0,0,0,0|2,0,2]=4 538 B14R0.337 CCCCOCCSCCCC(=O)NC 62a_100000741757_100000743108 [0,0,0,0,0,0|3,0,0]=3 539 B14R0.337 CCCCOCCSCCCC(=O)NC 62a_100000743108_100000741757 [0,0,0,0,0,0|3,0,0]=3 540 B14R0.337 CCCCOCCSCCCC(=O)OC 62a_100000743108_100011218270 [0,0,0,0,0,0|2,0,0]=2 541 B14R0.337 CCCCOCCSCCCC(=O)OC 62a_100011218270_100000743108 [0,0,0,0,0,0|2,0,0]=2 542 B14R0.337 CCCCOCCSCCOC(=O)NC 62a_100000743108_200011997002 [0,0,0,0,0,0|4,0,0]=4 543 B14R0.337 CCCCOCCSCCOC(=O)NC 62a_200011997002_100000743108 [0,0,0,0,0,0|4,0,0]=4 544 B14R0.337 CCCCOCOCCCCC(=O)OC 34a_100000059025_100011995733 [0,0,0,0,0,0|2,0,0]=2 545 B14R0.337 CCCCOCSCCCCC(=O)OC 62a_100000204269_100011995733 [0,0,0,0,0,0|2,0,0]=2 546 B14R0.337 CCCCOCSCCCCC(=O)OC 62a_100011995733_100000204269 [0,0,0,0,0,0|2,0,0]=2 547 B14R0.337 CCCCOCSCCOCC(=O)OC 62a_100000090808_100011995733 [0,0,0,0,0,0|3,0,0]=3 548 B14R0.337 CCCCOCSCCOCC(=O)OC 62a_100011995733_100000090808 [0,0,0,0,0,0|3,0,0]=3 549 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100000210211_100009815986 [0,0,0,0,0,0|1,0,0]=1 550 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100009815986_100000210210 [0,0,0,0,0,0|1,0,0]=1 551 B14R0.337 CCCCSCCNC/C=C/C(=O)OC 2230a_100025743550_100000742655 [0,0,0,0,0,0|2,0,2]=4 552 B14R0.337 CCCCSCCNCCCC(=O)NC 2230a_100025743550_100000741757 [0,0,0,0,0,0|3,0,0]=3 553 B14R0.337 CCCCSCCNCCCC(=O)OC 2230a_100025743550_100011218270 [0,0,0,0,0,0|2,0,0]=2 554 B14R0.337 CCCCSCCOC/C=C/C(=O)OC 34a_200000230436_100000742655 [0,0,0,0,0,0|2,0,2]=4 555 B14R0.337 CCCCSCCOC/C=C/C(=O)OC 7a_200000230436_100000742655 [0,0,0,0,0,0|2,0,2]=4 556 B14R0.337 CCCCSCCOCCCC(=O)NC 34a_200000230436_100000741757 [0,0,0,0,0,0|3,0,0]=3 557 B14R0.337 CCCCSCCOCCCC(=O)NC 7a_200000230436_100000741757 [0,0,0,0,0,0|3,0,0]=3 558 B14R0.337 CCCCSCCOCCCC(=O)OC 34a_200000230436_100000742333 [0,0,0,0,0,0|2,0,0]=2 559 B14R0.337 CCCCSCCOCCCC(=O)OC 7a_200000230436_100011218270 [0,0,0,0,0,0|2,0,0]=2 560 B14R0.337 CCCCSCCOCCOC(=O)NC 34a_200000230436_200011997002 [0,0,0,0,0,0|4,0,0]=4 561 B14R0.337 CCCCSCCOCCOC(=O)NC 7a_200000230436_200011997002 [0,0,0,0,0,0|4,0,0]=4 562 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100000210258_100010004213 [0,0,0,0,0,0|1,0,0]=1 563 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100011022521_100000210303 [0,0,0,0,0,0|1,0,0]=1 564 B14R0.337 CCCOCCCCCCCC(=O)OC 7a_100011022521_100000210303 [0,0,0,0,0,0|1,0,0]=1 565 B14R0.337 CCCOCCCNC/C=C/C(=O)OC 2230a_100011217757_100000742655 [0,0,0,0,0,0|2,0,2]=4 566 B14R0.337 CCCOCCCNC/C=C/C(=O)OC 34a_100011217757_100000742655 [0,0,0,0,0,0|2,0,2]=4 567 B14R0.337 CCCOCCCNCCCC(=O)NC 2230a_100011217757_100000741757 [0,0,0,0,0,0|3,0,0]=3 568 B14R0.337 CCCOCCCNCCCC(=O)NC 34a_100011217757_100000741757 [0,0,0,0,0,0|3,0,0]=3 569 B14R0.337 CCCOCCCNCCCC(=O)OC 2230a_100011217757_100011218270 [0,0,0,0,0,0|2,0,0]=2 570 B14R0.337 CCCOCCCNCCCC(=O)OC 34a_100011217757_100000742333 [0,0,0,0,0,0|2,0,0]=2 571 B14R0.337 CCCOCCCNCCOC(=O)NC 34a_100011217757_200011997002 [0,0,0,0,0,0|4,0,0]=4 572 B14R0.337 CCCOCCNCCCCC(=O)OC 2230a_100161115042_100000204269 [0,0,0,0,0,0|2,0,0]=2 573 B14R0.337 CCCOCCNCCCCC(=O)OC 34a_100161115042_100000204269 [0,0,0,0,0,0|2,0,0]=2 574 B14R0.337 CCCOCCNCCOCC(=O)OC 2230a_100161115042_100000090808 [0,0,0,0,0,0|3,0,0]=3 575 B14R0.337 CCCOCCNCCOCC(=O)OC 34a_100161115042_100000090808 [0,0,0,0,0,0|3,0,0]=3 576 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000059025_100011215938 [0,0,0,0,0,0|2,0,0]=2 577 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000752267_100000204269 [0,0,0,0,0,0|2,0,0]=2 578 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000059025_100011215938 [0,0,0,0,0,0|2,0,0]=2 579 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000752267_100000204269 [0,0,0,0,0,0|2,0,0]=2 580 B14R0.337 CCCOCCOCCNCC(=O)NC 2230a_200011904461_100000183359 [0,0,0,0,0,0|4,0,0]=4 581 B14R0.337 CCCOCCOCCNCC(=O)NC 34a_200011904461_100000183359 [0,0,0,0,0,0|4,0,0]=4 582 B14R0.337 CCCOCCOCCNCC(=O)OC 2230a_200011904461_100000747449 [0,0,0,0,0,0|3,0,0]=3 583 B14R0.337 CCCOCCOCCNCC(=O)OC 34a_200011904461_100000747449 [0,0,0,0,0,0|3,0,0]=3 584 B14R0.337 CCCOCCOCCOCC(=O)OC 34a_100000752267_100000090808 [0,0,0,0,0,0|3,0,0]=3 585 B14R0.337 CCCOCCOCCOCC(=O)OC 34a_100011023656_100000210303 [0,0,0,0,0,0|3,0,0]=3 586 B14R0.337 CCCOCCOCCOCC(=O)OC 7a_100000752267_100000090808 [0,0,0,0,0,0|3,0,0]=3 587 B14R0.337 CCCOCCOCCOCC(=O)OC 7a_100011023656_100000210303 [0,0,0,0,0,0|3,0,0]=3 588 B14R0.337 CCCOCCSCCCCC(=O)OC 62a_100000204269_100011215938 [0,0,0,0,0,0|2,0,0]=2 589 B14R0.337 CCCOCCSCCCCC(=O)OC 62a_100011215938_100000204269 [0,0,0,0,0,0|2,0,0]=2 590 B14R0.337 CCCOCCSCCOCC(=O)OC 62a_100000090808_100011215938 [0,0,0,0,0,0|3,0,0]=3 591 B14R0.337 CCCOCCSCCOCC(=O)OC 62a_100011215938_100000090808 [0,0,0,0,0,0|3,0,0]=3 592 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100000210303_100010004213 [0,0,0,0,0,0|1,0,0]=1 593 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100010004213_100000210303 [0,0,0,0,0,0|1,0,0]=1 594 B14R0.337 CCCSCCNCCCCC(=O)OC 2230a_100020603323_100000204269 [0,0,0,0,0,0|2,0,0]=2 595 B14R0.337 CCCSCCNCCOCC(=O)OC 2230a_100020603323_100000090808 [0,0,0,0,0,0|3,0,0]=3 596 B14R0.337 CCCSCCOCCCCC(=O)OC 34a_200000230433_100000204269 [0,0,0,0,0,0|2,0,0]=2 597 B14R0.337 CCCSCCOCCCCC(=O)OC 7a_200000230433_100000204269 [0,0,0,0,0,0|2,0,0]=2 598 B14R0.337 CCCSCCOCCOCC(=O)OC 34a_200000230433_100000090808 [0,0,0,0,0,0|3,0,0]=3 599 B14R0.337 CCCSCCOCCOCC(=O)OC 7a_200000230433_100000090808 [0,0,0,0,0,0|3,0,0]=3 600 B14R0.337 CCN(C)CCCCCCCCCCO 2230a_100000225621_100009813290 [0,0,0,0,0,0|4,0,0]=4 601 B14R0.337 CCN(C)CCCCCCCCCCO 269982a_100000225621_100009813290 [0,0,0,0,0,0|4,0,0]=4 602 B14R0.337 CCNCCCCCCCCC(=O)OC 2230a_100015525214_100010282707 [0,0,0,0,0,0|1,0,0]=1 603 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100000035544_100000210202 [0,0,0,0,0,0|1,0,0]=1 604 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100121572206_100010282707 [0,0,0,0,0,0|1,0,0]=1 605 B14R0.337 CCOCCCCCCCCC(=O)OC 7a_100000035544_100000210202 [0,0,0,0,0,0|1,0,0]=1 606 B14R0.337 CCOCCCNCCCCC(=O)OC 2230a_100000210961_100000204269 [0,0,0,0,0,0|2,0,0]=2 607 B14R0.337 CCOCCCNCCCCC(=O)OC 34a_100000210961_100000204269 [0,0,0,0,0,0|2,0,0]=2 608 B14R0.337 CCOCCCNCCOCC(=O)OC 2230a_100000210961_100000090808 [0,0,0,0,0,0|3,0,0]=3 609 B14R0.337 CCOCCCNCCOCC(=O)OC 34a_100000210961_100000090808 [0,0,0,0,0,0|3,0,0]=3 610 B14R0.337 CCOCCCOCCCCC(=O)OC 34a_100000059025_100012232248 [0,0,0,0,0,0|2,0,0]=2 611 B14R0.337 CCOCCCOCCCCC(=O)OC 34a_100000757476_100000204269 [0,0,0,0,0,0|2,0,0]=2 612 B14R0.337 CCOCCCOCCCCC(=O)OC 7a_100000059025_100012232248 [0,0,0,0,0,0|2,0,0]=2 613 B14R0.337 CCOCCCOCCCCC(=O)OC 7a_100000757476_100000204269 [0,0,0,0,0,0|2,0,0]=2 614 B14R0.337 CCOCCCOCCOCC(=O)OC 34a_100000757476_100000090808 [0,0,0,0,0,0|3,0,0]=3 615 B14R0.337 CCOCCCOCCOCC(=O)OC 7a_100000757476_100000090808 [0,0,0,0,0,0|3,0,0]=3 616 B14R0.337 CCOCCCSCCCCC(=O)OC 62a_100000204269_100012232248 [0,0,0,0,0,0|2,0,0]=2 617 B14R0.337 CCOCCCSCCCCC(=O)OC 62a_100012232248_100000204269 [0,0,0,0,0,0|2,0,0]=2 618 B14R0.337 CCOCCCSCCOCC(=O)OC 62a_100000090808_100012232248 [0,0,0,0,0,0|3,0,0]=3 619 B14R0.337 CCOCCCSCCOCC(=O)OC 62a_100012232248_100000090808 [0,0,0,0,0,0|3,0,0]=3 620 B14R0.337 CCOCCNCCCCCC(=O)OC 2230a_102516460346_100009816466 [0,0,0,0,0,0|2,0,0]=2 621 B14R0.337 CCOCCNCCCCCC(=O)OC 34a_102516460346_100009816466 [0,0,0,0,0,0|2,0,0]=2 622 B14R0.337 CCOCCNN=CCCCC(=O)OC 4a_100000732670_100000094087 [0,0,0,0,0,0|3,0,1]=4 623 B14R0.337 CCOCCOCCCCCC(=O)OC 34a_100000074720_100000210147 [0,0,0,0,0,0|2,0,0]=2 624 B14R0.337 CCOCCOCCCCCC(=O)OC 34a_100000210136_100009816466 [0,0,0,0,0,0|2,0,0]=2 625 B14R0.337 CCOCCOCCCCCC(=O)OC 7a_100000074720_100011215890 [0,0,0,0,0,0|2,0,0]=2 626 B14R0.337 CCOCCOCCCCCC(=O)OC 7a_100000210136_100009816466 [0,0,0,0,0,0|2,0,0]=2 627 B14R0.337 CCOCCOCCNCCC(=O)NC 2230a_100000738227_100011211534 [0,0,0,0,0,0|4,0,0]=4 628 B14R0.337 CCOCCOCCNCCC(=O)NC 2230a_100102712874_100000737683 [0,0,0,0,0,0|4,0,0]=4 629 B14R0.337 CCOCCOCCNCCC(=O)NC 34a_100000738227_100011211534 [0,0,0,0,0,0|4,0,0]=4 630 B14R0.337 CCOCCOCCNCCC(=O)NC 34a_100102712874_100012179268 [0,0,0,0,0,0|4,0,0]=4 631 B14R0.337 CCOCCOCCNCCC(=O)OC 2230a_100102712874_100000204255 [0,0,0,0,0,0|3,0,0]=3 632 B14R0.337 CCOCCOCCNCCC(=O)OC 34a_100102712874_100000742370 [0,0,0,0,0,0|3,0,0]=3 633 B14R0.337 CCOCCOCCOCCC(=O)NC 34a_100000210240_100012179268 [0,0,0,0,0,0|4,0,0]=4 634 B14R0.337 CCOCCOCCOCCC(=O)NC 34a_100000754576_100011211534 [0,0,0,0,0,0|4,0,0]=4 635 B14R0.337 CCOCCOCCOCCC(=O)NC 7a_100000210240_100000737683 [0,0,0,0,0,0|4,0,0]=4 636 B14R0.337 CCOCCOCCOCCC(=O)OC 34a_100000210240_100000742370 [0,0,0,0,0,0|3,0,0]=3 637 B14R0.337 CCOCCOCCOCCC(=O)OC 34a_100010982084_100000210202 [0,0,0,0,0,0|3,0,0]=3 638 B14R0.337 CCOCCOCCOCCC(=O)OC 7a_100000210240_100000204255 [0,0,0,0,0,0|3,0,0]=3 639 B14R0.337 CCOCCOCCOCCC(=O)OC 7a_100010982084_100000210202 [0,0,0,0,0,0|3,0,0]=3 640 B14R0.337 CCOCCOCCSCCC(=O)NC 62a_100000737683_100011211534 [0,0,0,0,0,0|4,0,0]=4 641 B14R0.337 CCOCCOCCSCCC(=O)NC 62a_100011211534_100000737683 [0,0,0,0,0,0|4,0,0]=4 642 B14R0.337 CCOCCOCCSCCC(=O)OC 62a_100000204255_100011211534 [0,0,0,0,0,0|3,0,0]=3 643 B14R0.337 CCOCCOCCSCCC(=O)OC 62a_100011211534_100000204255 [0,0,0,0,0,0|3,0,0]=3 644 B14R0.337 CCOCCOCCSCOC(=O)OC 62a_100011211534_100000139417 [0,0,0,0,0,0|4,0,0]=4 645 B14R0.337 CCOCCSCCCCCC(=O)OC 62a_100000210147_100009816466 [0,0,0,0,0,0|2,0,0]=2 646 B14R0.337 CCOCCSCCCCCC(=O)OC 62a_100009816466_100011215890 [0,0,0,0,0,0|2,0,0]=2 647 B14R0.337 CCOCSCCCCCCC(=O)OC 62a_100000739092_100009815986 [0,0,0,0,0,0|2,0,0]=2 648 B14R0.337 CCOCSCCCCCCC(=O)OC 62a_100009815986_100000739092 [0,0,0,0,0,0|2,0,0]=2 649 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100000210202_100010282707 [0,0,0,0,0,0|1,0,0]=1 650 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100010282707_100000210202 [0,0,0,0,0,0|1,0,0]=1 651 B14R0.337 CCSCCCOCCCCC(=O)OC 34a_100011216438_100000204269 [0,0,0,0,0,0|2,0,0]=2 652 B14R0.337 CCSCCCOCCCCC(=O)OC 7a_100011216438_100000204269 [0,0,0,0,0,0|2,0,0]=2 653 B14R0.337 CCSCCCOCCOCC(=O)OC 34a_100011216438_100000090808 [0,0,0,0,0,0|3,0,0]=3 654 B14R0.337 CCSCCCOCCOCC(=O)OC 7a_100011216438_100000090808 [0,0,0,0,0,0|3,0,0]=3 655 B14R0.337 CCSCCNCCCCCC(=O)OC 2230a_100000106463_100009816466 [0,0,0,0,0,0|2,0,0]=2 656 B14R0.337 CCSCCOCCCCCC(=O)OC 34a_100000074720_100000757381 [0,0,0,0,0,0|2,0,0]=2 657 B14R0.337 CCSCCOCCCCCC(=O)OC 34a_100000212035_100009816466 [0,0,0,0,0,0|2,0,0]=2 658 B14R0.337 CCSCCOCCCCCC(=O)OC 7a_100000074720_100000757381 [0,0,0,0,0,0|2,0,0]=2 659 B14R0.337 CCSCCOCCCCCC(=O)OC 7a_100000212035_100009816466 [0,0,0,0,0,0|2,0,0]=2 660 B14R0.337 CCSCCSCCCCCC(=O)OC 62a_100000757381_100009816466 [0,0,0,0,0,0|2,0,0]=2 661 B14R0.337 CCSCCSCCCCCC(=O)OC 62a_100009816466_100000757381 [0,0,0,0,0,0|2,0,0]=2 662 B14R0.337 CNC(=O)CCCCCCCCCCO 240690a_100102657272_200000016029 [0,0,0,0,0,0|2,0,0]=2 663 B14R0.337 CNC(=O)CCCNCCCCCC#N 2230a_100000740002_100009813376 [0,0,0,0,0,0|3,0,1]=4 664 B14R0.337 CNC(=O)CCCNCCCCCC=O 2230a_100000740002_100000139337 [0,0,0,0,0,0|3,0,1]=4 665 B14R0.337 CNC(=O)CCCNCCCCCCF 2230a_100000740002_100015922095 [0,0,0,0,0,0|3,0,0]=3 666 B14R0.337 CNC(=O)CCCNCCCCCCF 34a_100000740002_100015922095 [0,0,0,0,0,0|3,0,0]=3 667 B14R0.337 CNC(=O)CCCNCCCCCCO 2230a_100000686447_100000741757 [0,0,0,0,0,0|3,0,0]=3 668 B14R0.337 CNC(=O)CCCNCCCCCCO 2230a_100000740002_100000766143 [0,0,0,0,0,0|3,0,0]=3 669 B14R0.337 CNC(=O)CCCNCCCCCCO 34a_100000686447_100000741757 [0,0,0,0,0,0|3,0,0]=3 670 B14R0.337 CNC(=O)CCCNCCCCCCO 34a_100000740002_100000766143 [0,0,0,0,0,0|3,0,0]=3 671 B14R0.337 CNC(=O)CCCNCCCCCOC 2230a_100000747528_100000741757 [0,0,0,0,0,0|3,0,0]=3 672 B14R0.337 CNC(=O)CCCNCCCCCOC 34a_100000747528_100000741757 [0,0,0,0,0,0|3,0,0]=3 673 B14R0.337 CNC(=O)CCCNCCOCCOC 2230a_100000740002_100000695917 [0,0,0,0,0,0|4,0,0]=4 674 B14R0.337 CNC(=O)CCCNCCOCCOC 2230a_100000745349_100000741757 [0,0,0,0,0,0|4,0,0]=4 675 B14R0.337 CNC(=O)CCCNCCOCCOC 34a_100000740002_100000695917 [0,0,0,0,0,0|4,0,0]=4 676 B14R0.337 CNC(=O)CCCNCCOCCOC 34a_100000745349_100000741757 [0,0,0,0,0,0|4,0,0]=4 677 B14R0.337 CNC(=O)CCCOCCCCCCBr 34a_100011215345_100000741757 [0,0,0,0,0,0|3,0,0]=3 678 B14R0.337 CNC(=O)CCCOCCCCCCBr 7a_100011215345_100000741757 [0,0,0,0,0,0|3,0,0]=3 679 B14R0.337 CNC(=O)CCCOCCCCCCCl 34a_100000766143_100000741757 [0,0,0,0,0,0|3,0,0]=3 680 B14R0.337 CNC(=O)CCCOCCCCCCCl 7a_100000766143_100000741757 [0,0,0,0,0,0|3,0,0]=3 681 B14R0.337 CNC(=O)CCCOCCCCCCF 34a_100000732779_100000741757 [0,0,0,0,0,0|3,0,0]=3 682 B14R0.337 CNC(=O)CCCOCCCCCCF 7a_100000732779_100000741757 [0,0,0,0,0,0|3,0,0]=3 683 B14R0.337 CNC(=O)CCCOCCCCCCN 34a_100000686447_100000741757 [0,0,0,0,0,0|3,0,0]=3 684 B14R0.337 CNC(=O)CCCOCCOCCOC 34a_100011215163_100000741757 [0,0,0,0,0,0|4,0,0]=4 685 B14R0.337 CNC(=O)CCCOCCOCCOC 7a_100011215163_100000741757 [0,0,0,0,0,0|4,0,0]=4 686 B14R0.337 CNC(=O)CCCSCCCCCC#N 62a_100000741757_100009813376 [0,0,0,0,0,0|3,0,1]=4 687 B14R0.337 CNC(=O)CCCSCCCCCC#N 62a_100009813376_100000741757 [0,0,0,0,0,0|3,0,1]=4 688 B14R0.337 CNC(=O)CCCSCCCCCC=O 62a_100000139337_100000741757 [0,0,0,0,0,0|3,0,1]=4 689 B14R0.337 CNC(=O)CCCSCCCCCC=O 62a_100000741757_100000139337 [0,0,0,0,0,0|3,0,1]=4 690 B14R0.337 CNC(=O)CCCSCCCCCCF 62a_100000741757_100015922095 [0,0,0,0,0,0|3,0,0]=3 691 B14R0.337 CNC(=O)CCCSCCCCCCF 62a_100015922095_100000741757 [0,0,0,0,0,0|3,0,0]=3 692 B14R0.337 CNC(=O)CCCSCCCCCCO 62a_100000741757_100000766143 [0,0,0,0,0,0|3,0,0]=3 693 B14R0.337 CNC(=O)CCCSCCCCCCO 62a_100000766143_100000741757 [0,0,0,0,0,0|3,0,0]=3 694 B14R0.337 CNC(=O)CCCSCCOCCOC 62a_100000695917_100000741757 [0,0,0,0,0,0|4,0,0]=4 695 B14R0.337 CNC(=O)CCCSCCOCCOC 62a_100000741757_100000695917 [0,0,0,0,0,0|4,0,0]=4 696 B14R0.337 CNC(=O)CCNCCCCCCC#N 2230a_100000738227_100009813337 [0,0,0,0,0,0|3,0,1]=4 697 B14R0.337 CNC(=O)CCNCCCCCCCO 2230a_100000738227_100000760002 [0,0,0,0,0,0|3,0,0]=3 698 B14R0.337 CNC(=O)CCNCCCCCCCO 2230a_100011996573_100000737683 [0,0,0,0,0,0|3,0,0]=3 699 B14R0.337 CNC(=O)CCNCCCCCCCO 34a_100000738227_100000760002 [0,0,0,0,0,0|3,0,0]=3 700 B14R0.337 CNC(=O)CCNCCCCCCCO 34a_100011996573_100012179268 [0,0,0,0,0,0|3,0,0]=3 701 B14R0.337 CNC(=O)CCNCCCCCCOC 2230a_100000738227_100011998445 [0,0,0,0,0,0|3,0,0]=3 702 B14R0.337 CNC(=O)CCNCCCCCCOC 34a_100000738227_100011998445 [0,0,0,0,0,0|3,0,0]=3 703 B14R0.337 CNC(=O)CCNCCCOCCCO 2230a_100011310245_100000737683 [0,0,0,0,0,0|4,0,0]=4 704 B14R0.337 CNC(=O)CCNCCCOCCCO 34a_100011310245_100012179268 [0,0,0,0,0,0|4,0,0]=4 705 B14R0.337 CNC(=O)CCNCCCOCCOC 2230a_100000206027_100000737683 [0,0,0,0,0,0|4,0,0]=4 706 B14R0.337 CNC(=O)CCNCCCOCCOC 2230a_100000738227_100011216529 [0,0,0,0,0,0|4,0,0]=4 707 B14R0.337 CNC(=O)CCNCCCOCCOC 34a_100000206027_100012179268 [0,0,0,0,0,0|4,0,0]=4 708 B14R0.337 CNC(=O)CCNCCCOCCOC 34a_100000738227_100011216529 [0,0,0,0,0,0|4,0,0]=4 709 B14R0.337 CNC(=O)CCOCCCCCCCBr 34a_100000760002_100012179268 [0,0,0,0,0,0|3,0,0]=3 710 B14R0.337 CNC(=O)CCOCCCCCCCBr 7a_100000760002_100000737683 [0,0,0,0,0,0|3,0,0]=3 711 B14R0.337 CNC(=O)CCOCCCCCCCN 34a_100011996573_100012179268 [0,0,0,0,0,0|3,0,0]=3 712 B14R0.337 CNC(=O)CCOCCCCCCCO 34a_100000754576_100000760002 [0,0,0,0,0,0|3,0,0]=3 713 B14R0.337 CNC(=O)CCOCCCCCCOC 34a_100000754576_100011998445 [0,0,0,0,0,0|3,0,0]=3 714 B14R0.337 CNC(=O)CCOCCCCCCOC 34a_200012092642_100012179268 [0,0,0,0,0,0|3,0,0]=3 715 B14R0.337 CNC(=O)CCOCCCCCCOC 7a_200012092642_100000737683 [0,0,0,0,0,0|3,0,0]=3 716 B14R0.337 CNC(=O)CCOCCCOCCCN 34a_100011310245_100012179268 [0,0,0,0,0,0|4,0,0]=4 717 B14R0.337 CNC(=O)CCOCCCOCCOC 34a_100000754576_100011216529 [0,0,0,0,0,0|4,0,0]=4 718 B14R0.337 CNC(=O)CCSCCCCCCC#N 62a_100000737683_100009813337 [0,0,0,0,0,0|3,0,1]=4 719 B14R0.337 CNC(=O)CCSCCCCCCC#N 62a_100009813337_100000737683 [0,0,0,0,0,0|3,0,1]=4 720 B14R0.337 CNC(=O)CCSCCCCCCCO 62a_100000737683_100000760002 [0,0,0,0,0,0|3,0,0]=3 721 B14R0.337 CNC(=O)CCSCCCCCCCO 62a_100000760002_100000737683 [0,0,0,0,0,0|3,0,0]=3 722 B14R0.337 CNC(=O)CCSCCCCCCOC 62a_100000737683_100011998445 [0,0,0,0,0,0|3,0,0]=3 723 B14R0.337 CNC(=O)CCSCCCCCCOC 62a_100011998445_100000737683 [0,0,0,0,0,0|3,0,0]=3 724 B14R0.337 CNC(=O)CCSCCCOCCOC 62a_100000737683_100011216529 [0,0,0,0,0,0|4,0,0]=4 725 B14R0.337 CNC(=O)CCSCCCOCCOC 62a_100011216529_100000737683 [0,0,0,0,0,0|4,0,0]=4 726 B14R0.337 CNC(=O)CNCCCCCCCCO 2230a_100000693194_100000033203 [0,0,0,0,0,0|3,0,0]=3 727 B14R0.337 CNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183359 [0,0,0,0,0,0|3,0,0]=3 728 B14R0.337 CNC(=O)CNCCCCCCCCO 34a_102515433106_100000183359 [0,0,0,0,0,0|3,0,0]=3 729 B14R0.337 CNC(=O)COCCCCCCCCBr 34a_100009813846_100000183359 [0,0,0,0,0,0|3,0,0]=3 730 B14R0.337 CNC(=O)COCCCCCCCCBr 7a_100009813846_100000183359 [0,0,0,0,0,0|3,0,0]=3 731 B14R0.337 CNC(=O)COCCCCCCCCCl 34a_100000033203_100000183359 [0,0,0,0,0,0|3,0,0]=3 732 B14R0.337 CNC(=O)COCCCCCCCCCl 7a_100000033203_100000183359 [0,0,0,0,0,0|3,0,0]=3 733 B14R0.337 CNC(=O)COCCCCCCCCN 34a_102515433106_100000183359 [0,0,0,0,0,0|3,0,0]=3 734 B14R0.337 CNC(=O)COCCCCCCCCO 34a_100000750040_100000033203 [0,0,0,0,0,0|3,0,0]=3 735 B14R0.337 CNC(=O)COCCCCCNCCN 34a_103619048469_100000183359 [0,0,0,0,0,0|4,0,0]=4 736 B14R0.337 CNC(=O)COCCCOCCCOC 34a_200011215475_100000183359 [0,0,0,0,0,0|4,0,0]=4 737 B14R0.337 CNC(=O)COCCCOCCCOC 7a_200011215475_100000183359 [0,0,0,0,0,0|4,0,0]=4 738 B14R0.337 CNC(=O)CSCCCCCCCCO 62a_100000033203_100000183359 [0,0,0,0,0,0|3,0,0]=3 739 B14R0.337 CNC(=O)CSCCCCCCCCO 62a_100000183359_100000033203 [0,0,0,0,0,0|3,0,0]=3 740 B14R0.337 CNC(=O)NCCCCCCCCCO 2708a_100000078944_106832991635 [0,0,0,0,0,0|3,0,0]=3 741 B14R0.337 CNC(=O)NCCCCCCCCCO 2708a_100102657272_100000078944 [0,0,0,0,0,0|3,0,0]=3 742 B14R0.337 CNC(=O)NCCCCCCCCCO 273464a_100000078944_100102657272 [0,0,0,0,0,0|3,0,0]=3 743 B14R0.337 CNC(=O)NCCCCCCCCCO 273464a_100102657272_100000078944 [0,0,0,0,0,0|3,0,0]=3 744 B14R0.337 CNC(=O)NCCCCCCCCCO 512a_100000078944_100102657272 [0,0,0,0,0,0|3,0,0]=3 745 B14R0.337 CNC(=O)NCCCCCCCCCO 512a_106832991638_100000078944 [0,0,0,0,0,0|3,0,0]=3 746 B14R0.337 CNC(=O)NCCNCCCCCCF 34a_100015205895_100015922095 [0,0,0,0,0,0|4,0,0]=4 747 B14R0.337 CNC(=O)NCCNCCCCCCO 34a_100015205895_100000766143 [0,0,0,0,0,0|4,0,0]=4 748 B14R0.337 CNC(=O)OCCNCCCCCCO 34a_100000686447_200011997002 [0,0,0,0,0,0|4,0,0]=4 749 B14R0.337 CNC(=O)OCCNCCCCCOC 34a_100000747528_200011997002 [0,0,0,0,0,0|4,0,0]=4 750 B14R0.337 CNC(=O)OCCOCCCCCCBr 34a_100011215345_200011997002 [0,0,0,0,0,0|4,0,0]=4 751 B14R0.337 CNC(=O)OCCOCCCCCCBr 7a_100011215345_200011997002 [0,0,0,0,0,0|4,0,0]=4 752 B14R0.337 CNC(=O)OCCOCCCCCCCl 34a_100000766143_200011997002 [0,0,0,0,0,0|4,0,0]=4 753 B14R0.337 CNC(=O)OCCOCCCCCCCl 7a_100000766143_200011997002 [0,0,0,0,0,0|4,0,0]=4 754 B14R0.337 CNC(=O)OCCOCCCCCCF 34a_100000732779_200011997002 [0,0,0,0,0,0|4,0,0]=4 755 B14R0.337 CNC(=O)OCCOCCCCCCF 7a_100000732779_200011997002 [0,0,0,0,0,0|4,0,0]=4 756 B14R0.337 CNC(=O)OCCOCCCCCCN 34a_100000686447_200011997002 [0,0,0,0,0,0|4,0,0]=4 757 B14R0.337 CNC(=O)OCCSCCCCCCF 62a_100015922095_200011997002 [0,0,0,0,0,0|4,0,0]=4 758 B14R0.337 CNC(=O)OCCSCCCCCCF 62a_200011997002_100015922095 [0,0,0,0,0,0|4,0,0]=4 759 B14R0.337 CNC(=O)OCCSCCCCCCO 62a_100000766143_200011997002 [0,0,0,0,0,0|4,0,0]=4 760 B14R0.337 CNC(=O)OCCSCCCCCCO 62a_200011997002_100000766143 [0,0,0,0,0,0|4,0,0]=4 761 B14R0.337 CNCCCCCCCCCC(=O)OC 2230a_106832991635_100009813843 [0,0,0,0,0,0|1,0,0]=1 762 B14R0.337 CNCCCCCCCCCC(=O)OC 34a_100102657272_100009813843 [0,0,0,0,0,0|1,0,0]=1 763 B14R0.337 CNCCCCCCCCCC(=O)OC 7a_106832991635_100009813843 [0,0,0,0,0,0|1,0,0]=1 764 B14R0.337 CNCCCCCOC/C=C/C(=O)OC 34a_100000722520_100000742655 [0,0,0,0,0,0|2,0,2]=4 765 B14R0.337 CNCCCCCOCCCC(=O)NC 34a_100000722520_100000741757 [0,0,0,0,0,0|3,0,0]=3 766 B14R0.337 CNCCCCCOCCCC(=O)OC 34a_100000722520_100000742333 [0,0,0,0,0,0|2,0,0]=2 767 B14R0.337 CNCCCCCOCCOC(=O)NC 34a_100000722520_200011997002 [0,0,0,0,0,0|4,0,0]=4 768 B14R0.337 CNCCCOCCCCCC(=O)OC 34a_100000213112_100009816466 [0,0,0,0,0,0|2,0,0]=2 769 B14R0.337 CNCCOCCOCCCC(=O)NC 34a_100000228057_100000741757 [0,0,0,0,0,0|4,0,0]=4 770 B14R0.337 CNCCOCCOCCCC(=O)OC 34a_100000228057_100000742333 [0,0,0,0,0,0|3,0,0]=3 771 B14R0.337 COC(=O)/C=C/CNCCCCCCO 2230a_100000686447_100000742655 [0,0,0,0,0,0|2,0,2]=4 772 B14R0.337 COC(=O)/C=C/CNCCCCCCO 34a_100000686447_100000742655 [0,0,0,0,0,0|2,0,2]=4 773 B14R0.337 COC(=O)/C=C/COCCCCCCBr 34a_100011215345_100000742655 [0,0,0,0,0,0|2,0,2]=4 774 B14R0.337 COC(=O)/C=C/COCCCCCCBr 7a_100011215345_100000742655 [0,0,0,0,0,0|2,0,2]=4 775 B14R0.337 COC(=O)/C=C/COCCCCCCCl 34a_100000766143_100000742655 [0,0,0,0,0,0|2,0,2]=4 776 B14R0.337 COC(=O)/C=C/COCCCCCCCl 7a_100000766143_100000742655 [0,0,0,0,0,0|2,0,2]=4 777 B14R0.337 COC(=O)/C=C/COCCCCCCF 34a_100000732779_100000742655 [0,0,0,0,0,0|2,0,2]=4 778 B14R0.337 COC(=O)/C=C/COCCCCCCF 7a_100000732779_100000742655 [0,0,0,0,0,0|2,0,2]=4 779 B14R0.337 COC(=O)/C=C/COCCCCCCN 34a_100000686447_100000742655 [0,0,0,0,0,0|2,0,2]=4 780 B14R0.337 COC(=O)/C=C/CSCCCCCCF 62a_100000742655_100015922095 [0,0,0,0,0,0|2,0,2]=4 781 B14R0.337 COC(=O)/C=C/CSCCCCCCF 62a_100015922095_100000742655 [0,0,0,0,0,0|2,0,2]=4 782 B14R0.337 COC(=O)/C=C/CSCCCCCCO 62a_100000742655_100000766143 [0,0,0,0,0,0|2,0,2]=4 783 B14R0.337 COC(=O)/C=C/CSCCCCCCO 62a_100000766143_100000742655 [0,0,0,0,0,0|2,0,2]=4 784 B14R0.337 COC(=O)CCCCCCCCCSC 62a_200000210301_100009813843 [0,0,0,0,0,0|1,0,0]=1 785 B14R0.337 COC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009813843 [0,0,0,0,0,0|1,0,0]=1 786 B14R0.337 COC(=O)CCCCCCCCOCF 34a_100000035544_100015361967 [0,0,0,0,0,0|2,0,0]=2 787 B14R0.337 COC(=O)CCCCCCCCOCF 7a_100000035544_100015361967 [0,0,0,0,0,0|2,0,0]=2 788 B14R0.337 COC(=O)CCCCCCCCSCF 62a_100010282707_100015361967 [0,0,0,0,0,0|2,0,0]=2 789 B14R0.337 COC(=O)CCCCCCCCSCF 62a_100015361967_100010282707 [0,0,0,0,0,0|2,0,0]=2 790 B14R0.337 COC(=O)CCCCCCCNCCF 34a_100000724931_100010004213 [0,0,0,0,0,0|2,0,0]=2 791 B14R0.337 COC(=O)CCCCCCCNCCO 2230a_100016997473_100010004213 [0,0,0,0,0,0|2,0,0]=2 792 B14R0.337 COC(=O)CCCCCCCNCCO 34a_100016990907_100010004213 [0,0,0,0,0,0|2,0,0]=2 793 B14R0.337 COC(=O)CCCCCCCOCC#N 7a_100011022521_100011215382 [0,0,0,0,0,0|2,0,1]=3 794 B14R0.337 COC(=O)CCCCCCCOCC=O 34a_100011022521_200009817547 [0,0,0,0,0,0|2,0,1]=3 795 B14R0.337 COC(=O)CCCCCCCOCC=O 7a_100011022521_200015260668 [0,0,0,0,0,0|2,0,1]=3 796 B14R0.337 COC(=O)CCCCCCCOCCBr 34a_100000211926_100010004213 [0,0,0,0,0,0|2,0,0]=2 797 B14R0.337 COC(=O)CCCCCCCOCCF 34a_100011022521_100011217306 [0,0,0,0,0,0|2,0,0]=2 798 B14R0.337 COC(=O)CCCCCCCOCCF 7a_100011022521_100011217306 [0,0,0,0,0,0|2,0,0]=2 799 B14R0.337 COC(=O)CCCCCCCOCCN 34a_100000210304_100010004213 [0,0,0,0,0,0|2,0,0]=2 800 B14R0.337 COC(=O)CCCCCCCOCCO 34a_100011022521_100000211926 [0,0,0,0,0,0|2,0,0]=2 801 B14R0.337 COC(=O)CCCCCCCOCCO 7a_100011022521_100000211926 [0,0,0,0,0,0|2,0,0]=2 802 B14R0.337 COC(=O)CCCCCCCOCSC 34a_100011022521_100011218213 [0,0,0,0,0,0|2,0,0]=2 803 B14R0.337 COC(=O)CCCCCCCSCC#N 62a_100010004213_100011215382 [0,0,0,0,0,0|2,0,1]=3 804 B14R0.337 COC(=O)CCCCCCCSCC#N 62a_100011215382_100010004213 [0,0,0,0,0,0|2,0,1]=3 805 B14R0.337 COC(=O)CCCCCCCSCC=O 62a_100010004213_200015260668 [0,0,0,0,0,0|2,0,1]=3 806 B14R0.337 COC(=O)CCCCCCCSCC=O 62a_200015260668_100010004213 [0,0,0,0,0,0|2,0,1]=3 807 B14R0.337 COC(=O)CCCCCCCSCCF 62a_100010004213_100011217306 [0,0,0,0,0,0|2,0,0]=2 808 B14R0.337 COC(=O)CCCCCCCSCCF 62a_100011217306_100010004213 [0,0,0,0,0,0|2,0,0]=2 809 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100000211926_100010004213 [0,0,0,0,0,0|2,0,0]=2 810 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100010004213_100000211926 [0,0,0,0,0,0|2,0,0]=2 811 B14R0.337 COC(=O)CCCCCCCSCSC 62a_100010004213_100011218213 [0,0,0,0,0,0|2,0,0]=2 812 B14R0.337 COC(=O)CCCCCCCSCSC 62a_100011218213_100010004213 [0,0,0,0,0,0|2,0,0]=2 813 B14R0.337 COC(=O)CCCCCCNCCCF 2230a_100015189416_100009815986 [0,0,0,0,0,0|2,0,0]=2 814 B14R0.337 COC(=O)CCCCCCNCCCF 34a_100015189416_100009815986 [0,0,0,0,0,0|2,0,0]=2 815 B14R0.337 COC(=O)CCCCCCNCCSC 2230a_100020590264_100009815986 [0,0,0,0,0,0|2,0,0]=2 816 B14R0.337 COC(=O)CCCCCCOCCC#N 7a_100009863599_100000184422 [0,0,0,0,0,0|2,0,1]=3 817 B14R0.337 COC(=O)CCCCCCOCCCBr 34a_100011217188_100009815986 [0,0,0,0,0,0|2,0,0]=2 818 B14R0.337 COC(=O)CCCCCCOCCCCl 34a_100000230001_100009815986 [0,0,0,0,0,0|2,0,0]=2 819 B14R0.337 COC(=O)CCCCCCOCCCF 34a_100000759539_100009815986 [0,0,0,0,0,0|2,0,0]=2 820 B14R0.337 COC(=O)CCCCCCOCCCF 34a_100009863599_100011934791 [0,0,0,0,0,0|2,0,0]=2 821 B14R0.337 COC(=O)CCCCCCOCCCF 7a_100009863599_100011934791 [0,0,0,0,0,0|2,0,0]=2 822 B14R0.337 COC(=O)CCCCCCOCCCN 34a_100000182051_100009815986 [0,0,0,0,0,0|2,0,0]=2 823 B14R0.337 COC(=O)CCCCCCOCCCO 34a_100009863599_100000230001 [0,0,0,0,0,0|2,0,0]=2 824 B14R0.337 COC(=O)CCCCCCOCCCO 7a_100009863599_100011215043 [0,0,0,0,0,0|2,0,0]=2 825 B14R0.337 COC(=O)CCCCCCOCCON 34a_100000700252_100009815986 [0,0,0,0,0,0|3,0,0]=3 826 B14R0.337 COC(=O)CCCCCCOCCSC 34a_100000230434_100009815986 [0,0,0,0,0,0|2,0,0]=2 827 B14R0.337 COC(=O)CCCCCCOCCSC 34a_100009863599_100000212216 [0,0,0,0,0,0|2,0,0]=2 828 B14R0.337 COC(=O)CCCCCCOCCSC 7a_100000230434_100009815986 [0,0,0,0,0,0|2,0,0]=2 829 B14R0.337 COC(=O)CCCCCCOCCSC 7a_100009863599_100000212216 [0,0,0,0,0,0|2,0,0]=2 830 B14R0.337 COC(=O)CCCCCCSCCC#N 62a_100009815986_100011215226 [0,0,0,0,0,0|2,0,1]=3 831 B14R0.337 COC(=O)CCCCCCSCCC#N 62a_100011215226_100009815986 [0,0,0,0,0,0|2,0,1]=3 832 B14R0.337 COC(=O)CCCCCCSCCCF 62a_100009815986_100011934791 [0,0,0,0,0,0|2,0,0]=2 833 B14R0.337 COC(=O)CCCCCCSCCCF 62a_100011934791_100009815986 [0,0,0,0,0,0|2,0,0]=2 834 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100009815986_100011215043 [0,0,0,0,0,0|2,0,0]=2 835 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100011215043_100009815986 [0,0,0,0,0,0|2,0,0]=2 836 B14R0.337 COC(=O)CCCCCCSCCSC 62a_100000212216_100009815986 [0,0,0,0,0,0|2,0,0]=2 837 B14R0.337 COC(=O)CCCCCCSCCSC 62a_100009815986_100000751147 [0,0,0,0,0,0|2,0,0]=2 838 B14R0.337 COC(=O)CCCCCCSCSC#N 62a_100000211825_100009815986 [0,0,0,0,0,0|3,0,1]=4 839 B14R0.337 COC(=O)CCCCCCSCSC#N 62a_100009815986_100000211825 [0,0,0,0,0,0|3,0,1]=4 840 B14R0.337 COC(=O)CCCCCNCCCCO 2230a_100000750430_100009816466 [0,0,0,0,0,0|2,0,0]=2 841 B14R0.337 COC(=O)CCCCCNCCCCO 34a_100000750430_100009816466 [0,0,0,0,0,0|2,0,0]=2 842 B14R0.337 COC(=O)CCCCCNCCCSC 2230a_100000749238_100009816466 [0,0,0,0,0,0|2,0,0]=2 843 B14R0.337 COC(=O)CCCCCOCC#CCCl 34a_200000047223_100009816466 [0,0,0,0,0,0|2,0,2]=4 844 B14R0.337 COC(=O)CCCCCOCC#CCO 34a_100000074720_200000047223 [0,0,0,0,0,0|2,0,2]=4 845 B14R0.337 COC(=O)CCCCCOCC#CCO 7a_100000074720_200000047223 [0,0,0,0,0,0|2,0,2]=4 846 B14R0.337 COC(=O)CCCCCOCCCC#N 7a_100000074720_100000687738 [0,0,0,0,0,0|2,0,1]=3 847 B14R0.337 COC(=O)CCCCCOCCCC=O 7a_100000074720_200011292268 [0,0,0,0,0,0|2,0,1]=3 848 B14R0.337 COC(=O)CCCCCOCCCCBr 34a_100011216708_100009816466 [0,0,0,0,0,0|2,0,0]=2 849 B14R0.337 COC(=O)CCCCCOCCCCCl 34a_100000210776_100009816466 [0,0,0,0,0,0|2,0,0]=2 850 B14R0.337 COC(=O)CCCCCOCCCCCl 7a_100000210776_100009816466 [0,0,0,0,0,0|2,0,0]=2 851 B14R0.337 COC(=O)CCCCCOCCCCF 34a_100000074720_100000729493 [0,0,0,0,0,0|2,0,0]=2 852 B14R0.337 COC(=O)CCCCCOCCCCF 34a_100011995726_100009816466 [0,0,0,0,0,0|2,0,0]=2 853 B14R0.337 COC(=O)CCCCCOCCCCF 7a_100000074720_100000729493 [0,0,0,0,0,0|2,0,0]=2 854 B14R0.337 COC(=O)CCCCCOCCCCF 7a_100011995726_100009816466 [0,0,0,0,0,0|2,0,0]=2 855 B14R0.337 COC(=O)CCCCCOCCCCI 34a_200012148704_100009816466 [0,0,0,0,0,0|2,0,0]=2 856 B14R0.337 COC(=O)CCCCCOCCCCN 34a_100000750430_100009816466 [0,0,0,0,0,0|2,0,0]=2 857 B14R0.337 COC(=O)CCCCCOCCCCO 34a_100000074720_100011216708 [0,0,0,0,0,0|2,0,0]=2 858 B14R0.337 COC(=O)CCCCCOCCCCO 7a_100000074720_100000210776 [0,0,0,0,0,0|2,0,0]=2 859 B14R0.337 COC(=O)CCCCCOCCCSC 34a_100000690336_100009816466 [0,0,0,0,0,0|2,0,0]=2 860 B14R0.337 COC(=O)CCCCCOCCCSC 7a_100000690336_100009816466 [0,0,0,0,0,0|2,0,0]=2 861 B14R0.337 COC(=O)CCCCCSCC#CCO 62a_100009816466_200000047223 [0,0,0,0,0,0|2,0,2]=4 862 B14R0.337 COC(=O)CCCCCSCC#CCO 62a_200000047223_100009816466 [0,0,0,0,0,0|2,0,2]=4 863 B14R0.337 COC(=O)CCCCCSCCCC#N 62a_100000687738_100009816466 [0,0,0,0,0,0|2,0,1]=3 864 B14R0.337 COC(=O)CCCCCSCCCC#N 62a_100009816466_100000687738 [0,0,0,0,0,0|2,0,1]=3 865 B14R0.337 COC(=O)CCCCCSCCCC=O 62a_100009816466_200011292268 [0,0,0,0,0,0|2,0,1]=3 866 B14R0.337 COC(=O)CCCCCSCCCC=O 62a_200011292268_100009816466 [0,0,0,0,0,0|2,0,1]=3 867 B14R0.337 COC(=O)CCCCCSCCCCF 62a_100000729493_100009816466 [0,0,0,0,0,0|2,0,0]=2 868 B14R0.337 COC(=O)CCCCCSCCCCF 62a_100009816466_100000729493 [0,0,0,0,0,0|2,0,0]=2 869 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100000210776_100009816466 [0,0,0,0,0,0|2,0,0]=2 870 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100009816466_100000210776 [0,0,0,0,0,0|2,0,0]=2 871 B14R0.337 COC(=O)CCCCCSCCSC#N 62a_100000034367_100009816466 [0,0,0,0,0,0|3,0,1]=4 872 B14R0.337 COC(=O)CCCCCSCCSC#N 62a_100009816466_100000034367 [0,0,0,0,0,0|3,0,1]=4 873 B14R0.337 COC(=O)CCCCNCCCCCO 2230a_100000762737_100000204269 [0,0,0,0,0,0|2,0,0]=2 874 B14R0.337 COC(=O)CCCCNCCCCCO 34a_100000762737_100000204269 [0,0,0,0,0,0|2,0,0]=2 875 B14R0.337 COC(=O)CCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000204269 [0,0,0,0,0,0|4,0,0]=4 876 B14R0.337 COC(=O)CCCCNCCOCCO 2230a_100000211614_100000204269 [0,0,0,0,0,0|3,0,0]=3 877 B14R0.337 COC(=O)CCCCNCCOCCO 34a_100000211614_100000204269 [0,0,0,0,0,0|3,0,0]=3 878 B14R0.337 COC(=O)CCCCNCCSCCO 2230a_100011219999_100000204269 [0,0,0,0,0,0|3,0,0]=3 879 B14R0.337 COC(=O)CCCCOCCCCC#N 7a_100000059025_100000211819 [0,0,0,0,0,0|2,0,1]=3 880 B14R0.337 COC(=O)CCCCOCCCCC=O 7a_100000059025_100000139335 [0,0,0,0,0,0|2,0,1]=3 881 B14R0.337 COC(=O)CCCCOCCCCCBr 34a_100000746331_100000204269 [0,0,0,0,0,0|2,0,0]=2 882 B14R0.337 COC(=O)CCCCOCCCCCBr 7a_100000746331_100000204269 [0,0,0,0,0,0|2,0,0]=2 883 B14R0.337 COC(=O)CCCCOCCCCCCl 34a_100000746330_100000204269 [0,0,0,0,0,0|2,0,0]=2 884 B14R0.337 COC(=O)CCCCOCCCCCCl 7a_100000746330_100000204269 [0,0,0,0,0,0|2,0,0]=2 885 B14R0.337 COC(=O)CCCCOCCCCCF 34a_100000059025_100000729378 [0,0,0,0,0,0|2,0,0]=2 886 B14R0.337 COC(=O)CCCCOCCCCCF 7a_100000059025_100000729378 [0,0,0,0,0,0|2,0,0]=2 887 B14R0.337 COC(=O)CCCCOCCCCCI 34a_200012148887_100000204269 [0,0,0,0,0,0|2,0,0]=2 888 B14R0.337 COC(=O)CCCCOCCCCCI 7a_200012148887_100000204269 [0,0,0,0,0,0|2,0,0]=2 889 B14R0.337 COC(=O)CCCCOCCCCCN 34a_100000762737_100000204269 [0,0,0,0,0,0|2,0,0]=2 890 B14R0.337 COC(=O)CCCCOCCCCCO 34a_100000059025_100000746330 [0,0,0,0,0,0|2,0,0]=2 891 B14R0.337 COC(=O)CCCCOCCCCCO 7a_100000059025_100000746330 [0,0,0,0,0,0|2,0,0]=2 892 B14R0.337 COC(=O)CCCCOCCCCSC 34a_100011217163_100000204269 [0,0,0,0,0,0|2,0,0]=2 893 B14R0.337 COC(=O)CCCCOCCCCSC 7a_100011217163_100000204269 [0,0,0,0,0,0|2,0,0]=2 894 B14R0.337 COC(=O)CCCCOCCOCC#N 7a_100000059025_200000047693 [0,0,0,0,0,0|3,0,1]=4 895 B14R0.337 COC(=O)CCCCOCCOCCBr 34a_100000692535_100000204269 [0,0,0,0,0,0|3,0,0]=3 896 B14R0.337 COC(=O)CCCCOCCOCCBr 7a_100000692535_100000204269 [0,0,0,0,0,0|3,0,0]=3 897 B14R0.337 COC(=O)CCCCOCCOCCCl 34a_100011215305_100000204269 [0,0,0,0,0,0|3,0,0]=3 898 B14R0.337 COC(=O)CCCCOCCOCCCl 7a_100011215305_100000204269 [0,0,0,0,0,0|3,0,0]=3 899 B14R0.337 COC(=O)CCCCOCCOCCF 34a_200015357709_100000204269 [0,0,0,0,0,0|3,0,0]=3 900 B14R0.337 COC(=O)CCCCOCCOCCF 7a_200015357709_100000204269 [0,0,0,0,0,0|3,0,0]=3 901 B14R0.337 COC(=O)CCCCOCCOCCI 34a_100012149058_100000204269 [0,0,0,0,0,0|3,0,0]=3 902 B14R0.337 COC(=O)CCCCOCCOCCI 7a_100012149058_100000204269 [0,0,0,0,0,0|3,0,0]=3 903 B14R0.337 COC(=O)CCCCOCCOCCN 34a_100000211614_100000204269 [0,0,0,0,0,0|3,0,0]=3 904 B14R0.337 COC(=O)CCCCOCCOCCO 34a_100000059025_100000692535 [0,0,0,0,0,0|3,0,0]=3 905 B14R0.337 COC(=O)CCCCOCCOCCO 7a_100000059025_100011215305 [0,0,0,0,0,0|3,0,0]=3 906 B14R0.337 COC(=O)CCCCSCCCCC#N 62a_100000204269_100000211819 [0,0,0,0,0,0|2,0,1]=3 907 B14R0.337 COC(=O)CCCCSCCCCC#N 62a_100011219923_100000204269 [0,0,0,0,0,0|2,0,1]=3 908 B14R0.337 COC(=O)CCCCSCCCCC=O 62a_100000139335_100000204269 [0,0,0,0,0,0|2,0,1]=3 909 B14R0.337 COC(=O)CCCCSCCCCC=O 62a_100000204269_100000139335 [0,0,0,0,0,0|2,0,1]=3 910 B14R0.337 COC(=O)CCCCSCCCCCF 62a_100000204269_100000729378 [0,0,0,0,0,0|2,0,0]=2 911 B14R0.337 COC(=O)CCCCSCCCCCF 62a_100000729378_100000204269 [0,0,0,0,0,0|2,0,0]=2 912 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000204269_100000746330 [0,0,0,0,0,0|2,0,0]=2 913 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000746330_100000204269 [0,0,0,0,0,0|2,0,0]=2 914 B14R0.337 COC(=O)CCCCSCCOCC#N 62a_100000204269_200000047693 [0,0,0,0,0,0|3,0,1]=4 915 B14R0.337 COC(=O)CCCCSCCOCC#N 62a_200000047693_100000204269 [0,0,0,0,0,0|3,0,1]=4 916 B14R0.337 COC(=O)CCCCSCCOCCO 62a_100000204269_100011215305 [0,0,0,0,0,0|3,0,0]=3 917 B14R0.337 COC(=O)CCCCSCCOCCO 62a_100011215305_100000204269 [0,0,0,0,0,0|3,0,0]=3 918 B14R0.337 COC(=O)CCCNCCCCCCO 2230a_100000686447_100011218270 [0,0,0,0,0,0|2,0,0]=2 919 B14R0.337 COC(=O)CCCNCCCCCCO 34a_100000686447_100000742333 [0,0,0,0,0,0|2,0,0]=2 920 B14R0.337 COC(=O)CCCNCCCCN=[N+]=[N-] 2230a_100000101370_100011218270 [0,0,0,0,0,0|4,0,0]=4 921 B14R0.337 COC(=O)CCCOCCCCCCBr 34a_100011215345_100000742333 [0,0,0,0,0,0|2,0,0]=2 922 B14R0.337 COC(=O)CCCOCCCCCCBr 7a_100011215345_100011218270 [0,0,0,0,0,0|2,0,0]=2 923 B14R0.337 COC(=O)CCCOCCCCCCCl 34a_100000766143_100000742333 [0,0,0,0,0,0|2,0,0]=2 924 B14R0.337 COC(=O)CCCOCCCCCCCl 7a_100000766143_100011218270 [0,0,0,0,0,0|2,0,0]=2 925 B14R0.337 COC(=O)CCCOCCCCCCF 34a_100000732779_100000742333 [0,0,0,0,0,0|2,0,0]=2 926 B14R0.337 COC(=O)CCCOCCCCCCF 7a_100000732779_100011218270 [0,0,0,0,0,0|2,0,0]=2 927 B14R0.337 COC(=O)CCCOCCCCCCN 34a_100000686447_100000742333 [0,0,0,0,0,0|2,0,0]=2 928 B14R0.337 COC(=O)CCCSCCCCCC#N 62a_100009813376_100011218270 [0,0,0,0,0,0|2,0,1]=3 929 B14R0.337 COC(=O)CCCSCCCCCC#N 62a_100011218270_100009813376 [0,0,0,0,0,0|2,0,1]=3 930 B14R0.337 COC(=O)CCCSCCCCCC=O 62a_100000139337_100011218270 [0,0,0,0,0,0|2,0,1]=3 931 B14R0.337 COC(=O)CCCSCCCCCC=O 62a_100011218270_100000139337 [0,0,0,0,0,0|2,0,1]=3 932 B14R0.337 COC(=O)CCCSCCCCCCF 62a_100011218270_100015922095 [0,0,0,0,0,0|2,0,0]=2 933 B14R0.337 COC(=O)CCCSCCCCCCF 62a_100015922095_100011218270 [0,0,0,0,0,0|2,0,0]=2 934 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100000766143_100011218270 [0,0,0,0,0,0|2,0,0]=2 935 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100011218270_100000766143 [0,0,0,0,0,0|2,0,0]=2 936 B14R0.337 COC(=O)CCNCCCCCCCO 2230a_100011996573_100000204255 [0,0,0,0,0,0|2,0,0]=2 937 B14R0.337 COC(=O)CCNCCCCCCCO 34a_100011996573_100000742370 [0,0,0,0,0,0|2,0,0]=2 938 B14R0.337 COC(=O)CCNCCCOCCCO 2230a_100011310245_100000204255 [0,0,0,0,0,0|3,0,0]=3 939 B14R0.337 COC(=O)CCNCCCOCCCO 34a_100011310245_100000742370 [0,0,0,0,0,0|3,0,0]=3 940 B14R0.337 COC(=O)CCOCCCCCCCBr 34a_100000760002_100000742370 [0,0,0,0,0,0|2,0,0]=2 941 B14R0.337 COC(=O)CCOCCCCCCCBr 7a_100000760002_100000204255 [0,0,0,0,0,0|2,0,0]=2 942 B14R0.337 COC(=O)CCOCCCCCCCN 34a_100011996573_100000742370 [0,0,0,0,0,0|2,0,0]=2 943 B14R0.337 COC(=O)CCOCCCOCCCN 34a_100011310245_100000742370 [0,0,0,0,0,0|3,0,0]=3 944 B14R0.337 COC(=O)CCOCCOCCOCF 34a_100010982084_100015361967 [0,0,0,0,0,0|4,0,0]=4 945 B14R0.337 COC(=O)CCOCCOCCOCF 7a_100010982084_100015361967 [0,0,0,0,0,0|4,0,0]=4 946 B14R0.337 COC(=O)CCSCCCCCCC#N 62a_100000204255_100009813337 [0,0,0,0,0,0|2,0,1]=3 947 B14R0.337 COC(=O)CCSCCCCCCC#N 62a_100009813337_100000204255 [0,0,0,0,0,0|2,0,1]=3 948 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000204255_100000760002 [0,0,0,0,0,0|2,0,0]=2 949 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000760002_100000204255 [0,0,0,0,0,0|2,0,0]=2 950 B14R0.337 COC(=O)CNCCCCCCCCO 2230a_102515433106_100000747449 [0,0,0,0,0,0|2,0,0]=2 951 B14R0.337 COC(=O)CNCCCCCCCCO 34a_102515433106_100000747449 [0,0,0,0,0,0|2,0,0]=2 952 B14R0.337 COC(=O)CNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000747449 [0,0,0,0,0,0|4,0,0]=4 953 B14R0.337 COC(=O)CNCCOCCOCCO 2230a_100011998139_100000747449 [0,0,0,0,0,0|4,0,0]=4 954 B14R0.337 COC(=O)CNCCOCCOCCO 34a_100011998139_100000747449 [0,0,0,0,0,0|4,0,0]=4 955 B14R0.337 COC(=O)COCCCCCCCCBr 34a_100009813846_100000747449 [0,0,0,0,0,0|2,0,0]=2 956 B14R0.337 COC(=O)COCCCCCCCCBr 7a_100009813846_100000747449 [0,0,0,0,0,0|2,0,0]=2 957 B14R0.337 COC(=O)COCCCCCCCCCl 34a_100000033203_100000747449 [0,0,0,0,0,0|2,0,0]=2 958 B14R0.337 COC(=O)COCCCCCCCCCl 7a_100000033203_100000747449 [0,0,0,0,0,0|2,0,0]=2 959 B14R0.337 COC(=O)COCCCCCCCCN 34a_102515433106_100000747449 [0,0,0,0,0,0|2,0,0]=2 960 B14R0.337 COC(=O)COCCCCCNCCN 34a_103619048469_100000747449 [0,0,0,0,0,0|3,0,0]=3 961 B14R0.337 COC(=O)COCCNCCCCCO 2230a_100000762737_100000090808 [0,0,0,0,0,0|3,0,0]=3 962 B14R0.337 COC(=O)COCCNCCCCCO 34a_100000762737_100000090808 [0,0,0,0,0,0|3,0,0]=3 963 B14R0.337 COC(=O)COCCNCCOCCO 2230a_100000211614_100000090808 [0,0,0,0,0,0|4,0,0]=4 964 B14R0.337 COC(=O)COCCNCCOCCO 34a_100000211614_100000090808 [0,0,0,0,0,0|4,0,0]=4 965 B14R0.337 COC(=O)COCCNCCSCCO 2230a_100011219999_100000090808 [0,0,0,0,0,0|4,0,0]=4 966 B14R0.337 COC(=O)COCCOCCCCCBr 34a_100000746331_100000090808 [0,0,0,0,0,0|3,0,0]=3 967 B14R0.337 COC(=O)COCCOCCCCCBr 7a_100000746331_100000090808 [0,0,0,0,0,0|3,0,0]=3 968 B14R0.337 COC(=O)COCCOCCCCCCl 34a_100000746330_100000090808 [0,0,0,0,0,0|3,0,0]=3 969 B14R0.337 COC(=O)COCCOCCCCCCl 7a_100000746330_100000090808 [0,0,0,0,0,0|3,0,0]=3 970 B14R0.337 COC(=O)COCCOCCCCCI 34a_200012148887_100000090808 [0,0,0,0,0,0|3,0,0]=3 971 B14R0.337 COC(=O)COCCOCCCCCI 7a_200012148887_100000090808 [0,0,0,0,0,0|3,0,0]=3 972 B14R0.337 COC(=O)COCCOCCCCCN 34a_100000762737_100000090808 [0,0,0,0,0,0|3,0,0]=3 973 B14R0.337 COC(=O)COCCOCCCCSC 34a_100011217163_100000090808 [0,0,0,0,0,0|3,0,0]=3 974 B14R0.337 COC(=O)COCCOCCCCSC 7a_100011217163_100000090808 [0,0,0,0,0,0|3,0,0]=3 975 B14R0.337 COC(=O)COCCOCCOCCBr 34a_100000692535_100000090808 [0,0,0,0,0,0|4,0,0]=4 976 B14R0.337 COC(=O)COCCOCCOCCBr 34a_100010132937_100000747449 [0,0,0,0,0,0|4,0,0]=4 977 B14R0.337 COC(=O)COCCOCCOCCBr 7a_100000692535_100000090808 [0,0,0,0,0,0|4,0,0]=4 978 B14R0.337 COC(=O)COCCOCCOCCBr 7a_100010132937_100000747449 [0,0,0,0,0,0|4,0,0]=4 979 B14R0.337 COC(=O)COCCOCCOCCCl 34a_100000032323_100000747449 [0,0,0,0,0,0|4,0,0]=4 980 B14R0.337 COC(=O)COCCOCCOCCCl 34a_100011215305_100000090808 [0,0,0,0,0,0|4,0,0]=4 981 B14R0.337 COC(=O)COCCOCCOCCCl 7a_100000032323_100000747449 [0,0,0,0,0,0|4,0,0]=4 982 B14R0.337 COC(=O)COCCOCCOCCCl 7a_100011215305_100000090808 [0,0,0,0,0,0|4,0,0]=4 983 B14R0.337 COC(=O)COCCOCCOCCF 34a_100011023656_100011217306 [0,0,0,0,0,0|4,0,0]=4 984 B14R0.337 COC(=O)COCCOCCOCCF 34a_200015357709_100000090808 [0,0,0,0,0,0|4,0,0]=4 985 B14R0.337 COC(=O)COCCOCCOCCF 7a_100011023656_100011217306 [0,0,0,0,0,0|4,0,0]=4 986 B14R0.337 COC(=O)COCCOCCOCCF 7a_200015357709_100000090808 [0,0,0,0,0,0|4,0,0]=4 987 B14R0.337 COC(=O)COCCOCCOCCI 34a_100012149058_100000090808 [0,0,0,0,0,0|4,0,0]=4 988 B14R0.337 COC(=O)COCCOCCOCCI 7a_100012149058_100000090808 [0,0,0,0,0,0|4,0,0]=4 989 B14R0.337 COC(=O)COCCOCCOCCN 34a_100000211614_100000090808 [0,0,0,0,0,0|4,0,0]=4 990 B14R0.337 COC(=O)COCCOCCOCCN 34a_100011998139_100000747449 [0,0,0,0,0,0|4,0,0]=4 991 B14R0.337 COC(=O)COCCOCCOCCO 34a_100011023656_100000211926 [0,0,0,0,0,0|4,0,0]=4 992 B14R0.337 COC(=O)COCCOCCOCCO 7a_100011023656_100000211926 [0,0,0,0,0,0|4,0,0]=4 993 B14R0.337 COC(=O)COCCOCCOCSC 34a_100011023656_100011218213 [0,0,0,0,0,0|4,0,0]=4 994 B14R0.337 COC(=O)COCCSCCCCC#N 62a_100000090808_100000211819 [0,0,0,0,0,0|3,0,1]=4 995 B14R0.337 COC(=O)COCCSCCCCC#N 62a_100011219923_100000090808 [0,0,0,0,0,0|3,0,1]=4 996 B14R0.337 COC(=O)COCCSCCCCC=O 62a_100000090808_100000139335 [0,0,0,0,0,0|3,0,1]=4 997 B14R0.337 COC(=O)COCCSCCCCC=O 62a_100000139335_100000090808 [0,0,0,0,0,0|3,0,1]=4 998 B14R0.337 COC(=O)COCCSCCCCCF 62a_100000090808_100000729378 [0,0,0,0,0,0|3,0,0]=3 999 B14R0.337 COC(=O)COCCSCCCCCF 62a_100000729378_100000090808 [0,0,0,0,0,0|3,0,0]=3 1000 B14R0.337 COC(=O)COCCSCCCCCO 62a_100000090808_100000746330 [0,0,0,0,0,0|3,0,0]=3 1001 B14R0.337 COC(=O)COCCSCCCCCO 62a_100000746330_100000090808 [0,0,0,0,0,0|3,0,0]=3 1002 B14R0.337 COC(=O)COCCSCCOCCO 62a_100000090808_100011215305 [0,0,0,0,0,0|4,0,0]=4 1003 B14R0.337 COC(=O)COCCSCCOCCO 62a_100011215305_100000090808 [0,0,0,0,0,0|4,0,0]=4 1004 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000033203_100000747449 [0,0,0,0,0,0|2,0,0]=2 1005 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000747449_100000033203 [0,0,0,0,0,0|2,0,0]=2 1006 B14R0.337 COC(=O)CSCCOCCOCCO 62a_100000032323_100000747449 [0,0,0,0,0,0|4,0,0]=4 1007 B14R0.337 COC(=O)CSCCOCCOCCO 62a_100000747449_100000032323 [0,0,0,0,0,0|4,0,0]=4 1008 B14R0.337 COC(=O)NCCOCCCCCCF 34a_100000757965_100015922095 [0,0,0,0,0,0|3,0,0]=3 1009 B14R0.337 COC(=O)NCCOCCCCCCO 34a_100000757965_100000766143 [0,0,0,0,0,0|3,0,0]=3 1010 B14R0.337 COC(=O)OCCOCCCCCCF 34a_100010262106_100015922095 [0,0,0,0,0,0|3,0,0]=3 1011 B14R0.337 COC(=O)OCCOCCCCCCO 34a_100010262106_100000766143 [0,0,0,0,0,0|3,0,0]=3 1012 B14R0.337 COC(=O)OCSCCCCCCC#N 62a_100009813337_100000139417 [0,0,0,0,0,0|3,0,1]=4 1013 B14R0.337 COC(=O)OCSCCCCCCCO 62a_100000760002_100000139417 [0,0,0,0,0,0|3,0,0]=3 1014 B14R0.337 COC(C)CCOCCCCCCCO 7a_100000764861_100000760002 [0,0,0,0,0,0|3,0,1]=4 1015 B14R0.337 COC(C)COCCCCCCCCO 34a_100000690652_100000033203 [0,0,0,0,0,0|3,0,1]=4 1016 B14R0.337 COC(C)SCCCCCCCCCO 62a_100009813782_100009879195 [0,0,0,0,0,0|3,0,1]=4 1017 B14R0.337 COC(C)SCCCCCCCCCO 62a_100009879195_100009813782 [0,0,0,0,0,0|3,0,1]=4 1018 B14R0.337 COCCCCCCCCCC(=O)OC 34a_100138415774_100009813843 [0,0,0,0,0,0|1,0,0]=1 1019 B14R0.337 COCCCCCCOCCC(=O)OC 34a_200012092642_100000742370 [0,0,0,0,0,0|2,0,0]=2 1020 B14R0.337 COCCCCCCOCCC(=O)OC 7a_200012092642_100000204255 [0,0,0,0,0,0|2,0,0]=2 1021 B14R0.337 COCCCCCCOCCC(C)OC 7a_100000764861_100011998445 [0,0,0,0,0,0|3,0,1]=4 1022 B14R0.337 COCCCCCCSCCC(=O)OC 62a_100000204255_100011998445 [0,0,0,0,0,0|2,0,0]=2 1023 B14R0.337 COCCCCCCSCCC(=O)OC 62a_100011998445_100000204255 [0,0,0,0,0,0|2,0,0]=2 1024 B14R0.337 COCCCCCCSCOC(=O)OC 62a_100011998445_100000139417 [0,0,0,0,0,0|3,0,0]=3 1025 B14R0.337 COCCCCCNC/C=C/C(=O)OC 2230a_100000747528_100000742655 [0,0,0,0,0,0|2,0,2]=4 1026 B14R0.337 COCCCCCNC/C=C/C(=O)OC 34a_100000747528_100000742655 [0,0,0,0,0,0|2,0,2]=4 1027 B14R0.337 COCCCCCNCCCC(=O)OC 2230a_100000747528_100011218270 [0,0,0,0,0,0|2,0,0]=2 1028 B14R0.337 COCCCCCNCCCC(=O)OC 34a_100000747528_100000742333 [0,0,0,0,0,0|2,0,0]=2 1029 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000059025_100000755781 [0,0,0,0,0,0|2,0,0]=2 1030 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000740925_100000204269 [0,0,0,0,0,0|2,0,0]=2 1031 B14R0.337 COCCCCOCCCCC(=O)OC 7a_100000059025_100000730899 [0,0,0,0,0,0|2,0,0]=2 1032 B14R0.337 COCCCCOCCOCC(=O)OC 34a_100000740925_100000090808 [0,0,0,0,0,0|3,0,0]=3 1033 B14R0.337 COCCCCSCCCCC(=O)OC 62a_100000204269_100000730899 [0,0,0,0,0,0|2,0,0]=2 1034 B14R0.337 COCCCCSCCCCC(=O)OC 62a_100000730899_100000204269 [0,0,0,0,0,0|2,0,0]=2 1035 B14R0.337 COCCCCSCCOCC(=O)OC 62a_100000090808_100000730899 [0,0,0,0,0,0|3,0,0]=3 1036 B14R0.337 COCCCCSCCOCC(=O)OC 62a_100000730899_100000090808 [0,0,0,0,0,0|3,0,0]=3 1037 B14R0.337 COCCCNCCCCCC(=O)OC 34a_100150723488_100009816466 [0,0,0,0,0,0|2,0,0]=2 1038 B14R0.337 COCCCOCCCCCC(=O)OC 34a_100000074720_100000740836 [0,0,0,0,0,0|2,0,0]=2 1039 B14R0.337 COCCCOCCCCCC(=O)OC 34a_100000740835_100009816466 [0,0,0,0,0,0|2,0,0]=2 1040 B14R0.337 COCCCOCCCCCC(=O)OC 7a_100000074720_100000740836 [0,0,0,0,0,0|2,0,0]=2 1041 B14R0.337 COCCCOCCCOCC(=O)OC 34a_200011215475_100000747449 [0,0,0,0,0,0|3,0,0]=3 1042 B14R0.337 COCCCOCCCOCC(=O)OC 7a_200011215475_100000747449 [0,0,0,0,0,0|3,0,0]=3 1043 B14R0.337 COCCCSCCCCCC(=O)OC 62a_100000709357_100009816466 [0,0,0,0,0,0|2,0,0]=2 1044 B14R0.337 COCCCSCCCCCC(=O)OC 62a_100009816466_100000709357 [0,0,0,0,0,0|2,0,0]=2 1045 B14R0.337 COCCNCCCCCCC(=O)OC 2230a_100000209980_100009815986 [0,0,0,0,0,0|2,0,0]=2 1046 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100000210237_100009815986 [0,0,0,0,0,0|2,0,0]=2 1047 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100009863599_100011201679 [0,0,0,0,0,0|2,0,0]=2 1048 B14R0.337 COCCOCCCCCCC(=O)OC 7a_100009863599_100000233755 [0,0,0,0,0,0|2,0,0]=2 1049 B14R0.337 COCCOCCCNCCC(=O)OC 2230a_100000206027_100000204255 [0,0,0,0,0,0|3,0,0]=3 1050 B14R0.337 COCCOCCCNCCC(=O)OC 34a_100000206027_100000742370 [0,0,0,0,0,0|3,0,0]=3 1051 B14R0.337 COCCOCCCSCCC(=O)OC 62a_100000204255_100011216529 [0,0,0,0,0,0|3,0,0]=3 1052 B14R0.337 COCCOCCCSCCC(=O)OC 62a_100011216529_100000204255 [0,0,0,0,0,0|3,0,0]=3 1053 B14R0.337 COCCOCCCSCOC(=O)OC 62a_100011216529_100000139417 [0,0,0,0,0,0|4,0,0]=4 1054 B14R0.337 COCCOCCNCCCC(=O)OC 2230a_100000745349_100011218270 [0,0,0,0,0,0|3,0,0]=3 1055 B14R0.337 COCCOCCNCCCC(=O)OC 34a_100000745349_100000742333 [0,0,0,0,0,0|3,0,0]=3 1056 B14R0.337 COCCOCCOCCCC(=O)OC 34a_100011215163_100000742333 [0,0,0,0,0,0|3,0,0]=3 1057 B14R0.337 COCCOCCOCCCC(=O)OC 7a_100011215163_100011218270 [0,0,0,0,0,0|3,0,0]=3 1058 B14R0.337 COCCOCCOCCNC(=O)OC 34a_100000757965_100000695917 [0,0,0,0,0,0|4,0,0]=4 1059 B14R0.337 COCCOCCOCCOC(=O)OC 34a_100010262106_100000695917 [0,0,0,0,0,0|4,0,0]=4 1060 B14R0.337 COCCOCCSCCCC(=O)OC 62a_100000695917_100011218270 [0,0,0,0,0,0|3,0,0]=3 1061 B14R0.337 COCCOCCSCCCC(=O)OC 62a_100011218270_100000695917 [0,0,0,0,0,0|3,0,0]=3 1062 B14R0.337 COCCOCSCCCCC(=O)OC 62a_100000204269_100000231047 [0,0,0,0,0,0|3,0,0]=3 1063 B14R0.337 COCCOCSCCCCC(=O)OC 62a_100000231047_100000204269 [0,0,0,0,0,0|3,0,0]=3 1064 B14R0.337 COCCOCSCCOCC(=O)OC 62a_100000090808_100000231047 [0,0,0,0,0,0|4,0,0]=4 1065 B14R0.337 COCCOCSCCOCC(=O)OC 62a_100000231047_100000090808 [0,0,0,0,0,0|4,0,0]=4 1066 B14R0.337 COCCSCCCCCCC(=O)OC 62a_100000233755_100009815986 [0,0,0,0,0,0|2,0,0]=2 1067 B14R0.337 COCCSCCCCCCC(=O)OC 62a_100009815986_100000233755 [0,0,0,0,0,0|2,0,0]=2 1068 B14R0.337 COCSCCCCCCCC(=O)OC 62a_100000766300_100010004213 [0,0,0,0,0,0|2,0,0]=2 1069 B14R0.337 COCSCCCCCCCC(=O)OC 62a_100010004213_100000766300 [0,0,0,0,0,0|2,0,0]=2 1070 B14R0.337 CO[C@H](C)CNCCCCCCCCO 2230a_100020591295_100000033203 [0,0,0,0,0,0|3,0,1]=4 1071 B14R0.337 NNC(=O)CCCOCCCCCCF 34a_100000211488_100015922095 [0,0,0,0,0,0|4,0,0]=4 1072 B14R0.337 NNC(=O)CCCOCCCCCCO 34a_100000211488_100000766143 [0,0,0,0,0,0|4,0,0]=4 1073 B14R0.337 O=C(CO)CCCCCCCCCCO 1458a_100000210174_100009813290 [0,0,0,0,0,0|3,0,0]=3 1074 B14R0.337 O=C(CO)NCCCCCCCCCO 240690a_100000078944_100000210174 [0,0,0,0,0,0|4,0,0]=4 1075 B13R0.54 C#CCCCCCCCNCC(=O)O 269956a_100016091260_100153394163 [1,0,0,0,0,0|1,0,2]=4 1076 B13R0.54 C#CCCCCCCCOCC(=O)C 34a_100000211253_100153394163 [1,0,0,0,0,0|1,0,2]=4 1077 B13R0.54 C#CCCCCCCOCCC(=O)C 34a_100000759926_100012276617 [1,0,0,0,0,0|1,0,2]=4 1078 B13R0.54 C#CCCCCCCOCCC(=O)C 7a_100000759926_100012276617 [1,0,0,0,0,0|1,0,2]=4 1079 B13R0.54 C#CCCCCCCOCCC(=O)C 7a_100011217361_100000053229 [1,0,0,0,0,0|1,0,2]=4 1080 B13R0.54 C#CCCCCCCSCCC(=O)C 62a_100000053229_100012276617 [1,0,0,0,0,0|1,0,2]=4 1081 B13R0.54 C#CCCCCCCSCCC(=O)C 62a_100012276617_100000053229 [1,0,0,0,0,0|1,0,2]=4 1082 B13R0.54 C#CCCCCCOCCCC(=O)C 34a_100000759063_100012094781 [1,0,0,0,0,0|1,0,2]=4 1083 B13R0.54 C#CCCCCCOCCCC(=O)C 34a_100000766912_100000685027 [1,0,0,0,0,0|1,0,2]=4 1084 B13R0.54 C#CCCCCCOCCCC(=O)C 7a_100000759063_100012094781 [1,0,0,0,0,0|1,0,2]=4 1085 B13R0.54 C#CCCCCCOCCCC(=O)C 7a_100000766912_100011215641 [1,0,0,0,0,0|1,0,2]=4 1086 B13R0.54 C#CCCCCCSCCCC(=O)C 62a_100011215641_100012094781 [1,0,0,0,0,0|1,0,2]=4 1087 B13R0.54 C#CCCCCCSCCCC(=O)C 62a_100012094781_100011215641 [1,0,0,0,0,0|1,0,2]=4 1088 B13R0.54 C#CCCCCNCCCCC(=O)C 34a_100000706060_100009817362 [1,0,0,0,0,0|1,0,2]=4 1089 B13R0.54 C#CCCCCOCCCCC(=O)C 34a_100000766709_100009817362 [1,0,0,0,0,0|1,0,2]=4 1090 B13R0.54 C#CCCCCOCCCCC(=O)C 7a_100000766709_100000735457 [1,0,0,0,0,0|1,0,2]=4 1091 B13R0.54 C#CCCCCSCCCCC(=O)C 62a_100000735457_100010269958 [1,0,0,0,0,0|1,0,2]=4 1092 B13R0.54 C#CCCCCSCCCCC(=O)C 62a_100010269958_100000735457 [1,0,0,0,0,0|1,0,2]=4 1093 B13R0.54 C=C(Br)CCOCCCCCCCC 34a_100009813270_100000210759 [1,0,0,0,0,0|2,0,1]=4 1094 B13R0.54 C=C(C)CCNCCCCCCCC 2230a_100000229939_100000730704 [1,0,0,0,0,0|2,0,0]=3 1095 B13R0.54 C=C(C)CCNCCCCCCCC 34a_100000229939_100000730704 [1,0,0,0,0,0|2,0,0]=3 1096 B13R0.54 C=C(C)CCNCCCCCCCO 2230a_100011996573_100000730704 [1,0,0,0,0,0|3,0,0]=4 1097 B13R0.54 C=C(C)CCNCCCCCCCO 34a_100011996573_100000730704 [1,0,0,0,0,0|3,0,0]=4 1098 B13R0.54 C=C(C)CCNCCCOCCCC 2230a_200000211371_100000730704 [1,0,0,0,0,0|3,0,0]=4 1099 B13R0.54 C=C(C)CCNCCCOCCCC 34a_200000211371_100000730704 [1,0,0,0,0,0|3,0,0]=4 1100 B13R0.54 C=C(C)CCOCCCCCCCBr 34a_100000760002_100000730704 [1,0,0,0,0,0|3,0,0]=4 1101 B13R0.54 C=C(C)CCOCCCCCCCBr 7a_100000760002_100000730704 [1,0,0,0,0,0|3,0,0]=4 1102 B13R0.54 C=C(C)CCOCCCCCCCC 34a_100000210232_100000730704 [1,0,0,0,0,0|2,0,0]=3 1103 B13R0.54 C=C(C)CCOCCCCCCCC 34a_100000764851_100000210759 [1,0,0,0,0,0|2,0,0]=3 1104 B13R0.54 C=C(C)CCOCCCCCCCC 7a_100000210232_100000730704 [1,0,0,0,0,0|2,0,0]=3 1105 B13R0.54 C=C(C)CCOCCCCCCCN 34a_100011996573_100000730704 [1,0,0,0,0,0|3,0,0]=4 1106 B13R0.54 C=C(C)CCOCCCCCCCO 34a_100000764851_100000760002 [1,0,0,0,0,0|3,0,0]=4 1107 B13R0.54 C=C(C)CCOCCCCCCOC 34a_100000764851_100011998445 [1,0,0,0,0,0|3,0,0]=4 1108 B13R0.54 C=C(C)CCOCCCCCCOC 34a_200012092642_100000730704 [1,0,0,0,0,0|3,0,0]=4 1109 B13R0.54 C=C(C)CCOCCCCCCOC 7a_200012092642_100000730704 [1,0,0,0,0,0|3,0,0]=4 1110 B13R0.54 C=C(C)CCOCCCOCCCC 34a_200011215613_100000730704 [1,0,0,0,0,0|3,0,0]=4 1111 B13R0.54 C=C(C)CCOCCCOCCCC 7a_200011215613_100000730704 [1,0,0,0,0,0|3,0,0]=4 1112 B13R0.54 C=C(C)CCOCCNCCCCC 34a_100000224656_100000730704 [1,0,0,0,0,0|3,0,0]=4 1113 B13R0.54 C=C(C)CCOCCOCCCCC 34a_100011215259_100000730704 [1,0,0,0,0,0|3,0,0]=4 1114 B13R0.54 C=C(C)CCOCCOCCCCC 7a_100011215259_100000730704 [1,0,0,0,0,0|3,0,0]=4 1115 B13R0.54 C=C(C)CCSCCCCCCCC 62a_100000210759_100000730704 [1,0,0,0,0,0|2,0,0]=3 1116 B13R0.54 C=C(C)CCSCCCCCCCC 62a_100000730704_100000210317 [1,0,0,0,0,0|2,0,0]=3 1117 B13R0.54 C=C(C)CCSCCCCCCCO 62a_100000730704_100000760002 [1,0,0,0,0,0|3,0,0]=4 1118 B13R0.54 C=C(C)CCSCCCCCCCO 62a_100000760002_100000730704 [1,0,0,0,0,0|3,0,0]=4 1119 B13R0.54 C=C(C)CCSCCCCCCOC 62a_100000730704_100011998445 [1,0,0,0,0,0|3,0,0]=4 1120 B13R0.54 C=C(C)CCSCCCCCCOC 62a_100011998445_100000730704 [1,0,0,0,0,0|3,0,0]=4 1121 B13R0.54 C=C(C)CNCCCCCCCCC 2230a_100000212291_100000748629 [1,0,0,0,0,0|2,0,0]=3 1122 B13R0.54 C=C(C)CNCCCCCCCCC 34a_100000212291_100000748629 [1,0,0,0,0,0|2,0,0]=3 1123 B13R0.54 C=C(C)CNCCCCCCCCO 2230a_102515433106_100000748629 [1,0,0,0,0,0|3,0,0]=4 1124 B13R0.54 C=C(C)CNCCCCCCCCO 34a_102515433106_100000748629 [1,0,0,0,0,0|3,0,0]=4 1125 B13R0.54 C=C(C)COCCCCCCCCBr 34a_100009813846_100000748629 [1,0,0,0,0,0|3,0,0]=4 1126 B13R0.54 C=C(C)COCCCCCCCCBr 7a_100009813846_100000748629 [1,0,0,0,0,0|3,0,0]=4 1127 B13R0.54 C=C(C)COCCCCCCCCC 34a_100000210245_100011214924 [1,0,0,0,0,0|2,0,0]=3 1128 B13R0.54 C=C(C)COCCCCCCCCC 34a_100000210712_100000748629 [1,0,0,0,0,0|2,0,0]=3 1129 B13R0.54 C=C(C)COCCCCCCCCC 7a_100000210712_100000748629 [1,0,0,0,0,0|2,0,0]=3 1130 B13R0.54 C=C(C)COCCCCCCCCCl 34a_100000033203_100000748629 [1,0,0,0,0,0|3,0,0]=4 1131 B13R0.54 C=C(C)COCCCCCCCCCl 7a_100000033203_100000748629 [1,0,0,0,0,0|3,0,0]=4 1132 B13R0.54 C=C(C)COCCCCCCCCN 34a_102515433106_100000748629 [1,0,0,0,0,0|3,0,0]=4 1133 B13R0.54 C=C(C)COCCCCCCCCO 34a_100000210245_100000033203 [1,0,0,0,0,0|3,0,0]=4 1134 B13R0.54 C=C(C)COCCCCNCCCC 34a_200011216965_100000748629 [1,0,0,0,0,0|3,0,0]=4 1135 B13R0.54 C=C(C)COCCCCOCCCC 34a_200000760531_100000748629 [1,0,0,0,0,0|3,0,0]=4 1136 B13R0.54 C=C(C)COCCCCOCCCC 7a_200000760531_100000748629 [1,0,0,0,0,0|3,0,0]=4 1137 B13R0.54 C=C(C)COCCOCCCCCC 34a_100000691444_100000748629 [1,0,0,0,0,0|3,0,0]=4 1138 B13R0.54 C=C(C)COCCOCCCCCC 7a_100000691444_100000748629 [1,0,0,0,0,0|3,0,0]=4 1139 B13R0.54 C=C(C)CSCCCCCCCCC 62a_100000748629_100000210670 [1,0,0,0,0,0|2,0,0]=3 1140 B13R0.54 C=C(C)CSCCCCCCCCO 62a_100000033203_100000211660 [1,0,0,0,0,0|3,0,0]=4 1141 B13R0.54 C=C(C)CSCCCCCCCCO 62a_100000748629_100000033203 [1,0,0,0,0,0|3,0,0]=4 1142 B13R0.54 C=C(F)CNCCCCCCCCC 2230a_100000212291_100009893438 [1,0,0,0,0,0|2,0,1]=4 1143 B13R0.54 C=C(F)CNCCCCCCCCC 34a_100000212291_100009893438 [1,0,0,0,0,0|2,0,1]=4 1144 B13R0.54 C=C(F)COCCCCCCCCC 34a_100000210712_100009893438 [1,0,0,0,0,0|2,0,1]=4 1145 B13R0.54 C=C(F)COCCCCCCCCC 34a_200010262243_100011214924 [1,0,0,0,0,0|2,0,1]=4 1146 B13R0.54 C=C(F)COCCCCCCCCC 7a_100000210712_100000042424 [1,0,0,0,0,0|2,0,1]=4 1147 B13R0.54 C=C(F)CSCCCCCCCCC 62a_100000042424_100000210670 [1,0,0,0,0,0|2,0,1]=4 1148 B13R0.54 C=CCCCCCCCCCC(=O)C 1458a_100000070787_100009814027 [1,0,0,0,0,0|0,0,2]=3 1149 B13R0.54 C=CCCCCCCCNCC(=O)O 269956a_100016091260_100012355270 [1,0,0,0,0,0|1,0,2]=4 1150 B13R0.54 C=CCCCCCCCOCC(=O)C 34a_100000211253_100012355270 [1,0,0,0,0,0|1,0,2]=4 1151 B13R0.54 C=CCCCCCCOCCC(=O)C 34a_100000759926_100011215473 [1,0,0,0,0,0|1,0,2]=4 1152 B13R0.54 C=CCCCCCCOCCC(=O)C 7a_100000759926_100011215473 [1,0,0,0,0,0|1,0,2]=4 1153 B13R0.54 C=CCCCCCCOCCC(=O)C 7a_200011216477_100000053229 [1,0,0,0,0,0|1,0,2]=4 1154 B13R0.54 C=CCCCCCCSCCC(=O)C 62a_100000053229_100011215473 [1,0,0,0,0,0|1,0,2]=4 1155 B13R0.54 C=CCCCCCCSCCC(=O)C 62a_100011215473_100000053229 [1,0,0,0,0,0|1,0,2]=4 1156 B13R0.54 C=CCCCCCOCCCC(=O)C 34a_100000759063_100000700193 [1,0,0,0,0,0|1,0,2]=4 1157 B13R0.54 C=CCCCCCOCCCC(=O)C 34a_100011216702_100000685027 [1,0,0,0,0,0|1,0,2]=4 1158 B13R0.54 C=CCCCCCOCCCC(=O)C 7a_100000759063_100000700193 [1,0,0,0,0,0|1,0,2]=4 1159 B13R0.54 C=CCCCCCOCCCC(=O)C 7a_100011216702_100011215641 [1,0,0,0,0,0|1,0,2]=4 1160 B13R0.54 C=CCCCCCSCCCC(=O)C 62a_100000700193_100011215641 [1,0,0,0,0,0|1,0,2]=4 1161 B13R0.54 C=CCCCCCSCCCC(=O)C 62a_100011215641_100000700193 [1,0,0,0,0,0|1,0,2]=4 1162 B13R0.54 C=CCCCCNCCCCC(=O)C 34a_100000703577_100009817362 [1,0,0,0,0,0|1,0,2]=4 1163 B13R0.54 C=CCCCCOCCCCC(=O)C 34a_100000766645_100009817362 [1,0,0,0,0,0|1,0,2]=4 1164 B13R0.54 C=CCCCCOCCCCC(=O)C 7a_100000766645_100000735457 [1,0,0,0,0,0|1,0,2]=4 1165 B13R0.54 C=CCCCCSCCCCC(=O)C 62a_100000735457_100011215482 [1,0,0,0,0,0|1,0,2]=4 1166 B13R0.54 C=CCCCCSCCCCC(=O)C 62a_100011215482_100000735457 [1,0,0,0,0,0|1,0,2]=4 1167 B13R0.54 CC(=O)CCCCCCCCCCO 1458a_100000070787_100009813290 [1,0,0,0,0,0|1,0,0]=2 1168 B13R0.54 CC(=O)CCCCNCCCCCO 34a_100000762737_100009817362 [1,0,0,0,0,0|2,0,0]=3 1169 B13R0.54 CC(=O)CCCCNCCOCCO 34a_100000211614_100009817362 [1,0,0,0,0,0|3,0,0]=4 1170 B13R0.54 CC(=O)CCCCOCCCCCBr 34a_100000746331_100009817362 [1,0,0,0,0,0|2,0,0]=3 1171 B13R0.54 CC(=O)CCCCOCCCCCBr 7a_100000746331_100000735457 [1,0,0,0,0,0|2,0,0]=3 1172 B13R0.54 CC(=O)CCCCOCCCCCCl 34a_100000746330_100009817362 [1,0,0,0,0,0|2,0,0]=3 1173 B13R0.54 CC(=O)CCCCOCCCCCCl 7a_100000746330_100000735457 [1,0,0,0,0,0|2,0,0]=3 1174 B13R0.54 CC(=O)CCCCOCCCCCI 34a_200012148887_100009817362 [1,0,0,0,0,0|2,0,0]=3 1175 B13R0.54 CC(=O)CCCCOCCCCCI 7a_200012148887_100000735457 [1,0,0,0,0,0|2,0,0]=3 1176 B13R0.54 CC(=O)CCCCOCCCCCN 34a_100000762737_100009817362 [1,0,0,0,0,0|2,0,0]=3 1177 B13R0.54 CC(=O)CCCCOCCOCCBr 34a_100000692535_100009817362 [1,0,0,0,0,0|3,0,0]=4 1178 B13R0.54 CC(=O)CCCCOCCOCCBr 7a_100000692535_100000735457 [1,0,0,0,0,0|3,0,0]=4 1179 B13R0.54 CC(=O)CCCCOCCOCCCl 34a_100011215305_100009817362 [1,0,0,0,0,0|3,0,0]=4 1180 B13R0.54 CC(=O)CCCCOCCOCCCl 7a_100011215305_100000735457 [1,0,0,0,0,0|3,0,0]=4 1181 B13R0.54 CC(=O)CCCCOCCOCCF 34a_200015357709_100009817362 [1,0,0,0,0,0|3,0,0]=4 1182 B13R0.54 CC(=O)CCCCOCCOCCF 7a_200015357709_100000735457 [1,0,0,0,0,0|3,0,0]=4 1183 B13R0.54 CC(=O)CCCCOCCOCCI 34a_100012149058_100009817362 [1,0,0,0,0,0|3,0,0]=4 1184 B13R0.54 CC(=O)CCCCOCCOCCI 7a_100012149058_100000735457 [1,0,0,0,0,0|3,0,0]=4 1185 B13R0.54 CC(=O)CCCCOCCOCCN 34a_100000211614_100009817362 [1,0,0,0,0,0|3,0,0]=4 1186 B13R0.54 CC(=O)CCCCSCCCCC#N 62a_100000735457_100000211819 [1,0,0,0,0,0|2,0,1]=4 1187 B13R0.54 CC(=O)CCCCSCCCCC#N 62a_100011219923_100000735457 [1,0,0,0,0,0|2,0,1]=4 1188 B13R0.54 CC(=O)CCCCSCCCCC=O 62a_100000139335_100000735457 [1,0,0,0,0,0|2,0,1]=4 1189 B13R0.54 CC(=O)CCCCSCCCCC=O 62a_100000735457_100000139335 [1,0,0,0,0,0|2,0,1]=4 1190 B13R0.54 CC(=O)CCCCSCCCCCF 62a_100000729378_100000735457 [1,0,0,0,0,0|2,0,0]=3 1191 B13R0.54 CC(=O)CCCCSCCCCCF 62a_100000735457_100000729378 [1,0,0,0,0,0|2,0,0]=3 1192 B13R0.54 CC(=O)CCCCSCCCCCO 62a_100000735457_100000746330 [1,0,0,0,0,0|2,0,0]=3 1193 B13R0.54 CC(=O)CCCCSCCCCCO 62a_100000746330_100000735457 [1,0,0,0,0,0|2,0,0]=3 1194 B13R0.54 CC(=O)CCCCSCCOCCO 62a_100000735457_100011215305 [1,0,0,0,0,0|3,0,0]=4 1195 B13R0.54 CC(=O)CCCCSCCOCCO 62a_100011215305_100000735457 [1,0,0,0,0,0|3,0,0]=4 1196 B13R0.54 CC(=O)CCCNCCCCCCO 34a_100000686447_100000685027 [1,0,0,0,0,0|2,0,0]=3 1197 B13R0.54 CC(=O)CCCOCCCCCC#N 7a_100000759063_100009813376 [1,0,0,0,0,0|2,0,1]=4 1198 B13R0.54 CC(=O)CCCOCCCCCC=O 7a_100000759063_100000139337 [1,0,0,0,0,0|2,0,1]=4 1199 B13R0.54 CC(=O)CCCOCCCCCCBr 34a_100011215345_100000685027 [1,0,0,0,0,0|2,0,0]=3 1200 B13R0.54 CC(=O)CCCOCCCCCCBr 7a_100011215345_100011215641 [1,0,0,0,0,0|2,0,0]=3 1201 B13R0.54 CC(=O)CCCOCCCCCCCl 34a_100000766143_100000685027 [1,0,0,0,0,0|2,0,0]=3 1202 B13R0.54 CC(=O)CCCOCCCCCCCl 7a_100000766143_100011215641 [1,0,0,0,0,0|2,0,0]=3 1203 B13R0.54 CC(=O)CCCOCCCCCCF 34a_100000732779_100000685027 [1,0,0,0,0,0|2,0,0]=3 1204 B13R0.54 CC(=O)CCCOCCCCCCF 34a_100000759063_100015922095 [1,0,0,0,0,0|2,0,0]=3 1205 B13R0.54 CC(=O)CCCOCCCCCCF 7a_100000732779_100011215641 [1,0,0,0,0,0|2,0,0]=3 1206 B13R0.54 CC(=O)CCCOCCCCCCF 7a_100000759063_100015922095 [1,0,0,0,0,0|2,0,0]=3 1207 B13R0.54 CC(=O)CCCOCCCCCCN 34a_100000686447_100000685027 [1,0,0,0,0,0|2,0,0]=3 1208 B13R0.54 CC(=O)CCCOCCCCCCO 34a_100000759063_100000766143 [1,0,0,0,0,0|2,0,0]=3 1209 B13R0.54 CC(=O)CCCOCCCCCCO 7a_100000759063_100000766143 [1,0,0,0,0,0|2,0,0]=3 1210 B13R0.54 CC(=O)CCCSCCCCCC#N 62a_100009813376_100011215641 [1,0,0,0,0,0|2,0,1]=4 1211 B13R0.54 CC(=O)CCCSCCCCCC#N 62a_100011215641_100009813376 [1,0,0,0,0,0|2,0,1]=4 1212 B13R0.54 CC(=O)CCCSCCCCCC=O 62a_100000139337_100011215641 [1,0,0,0,0,0|2,0,1]=4 1213 B13R0.54 CC(=O)CCCSCCCCCC=O 62a_100011215641_100000139337 [1,0,0,0,0,0|2,0,1]=4 1214 B13R0.54 CC(=O)CCCSCCCCCCF 62a_100011215641_100015922095 [1,0,0,0,0,0|2,0,0]=3 1215 B13R0.54 CC(=O)CCCSCCCCCCF 62a_100015922095_100011215641 [1,0,0,0,0,0|2,0,0]=3 1216 B13R0.54 CC(=O)CCCSCCCCCCO 62a_100000766143_100011215641 [1,0,0,0,0,0|2,0,0]=3 1217 B13R0.54 CC(=O)CCCSCCCCCCO 62a_100011215641_100000766143 [1,0,0,0,0,0|2,0,0]=3 1218 B13R0.54 CC(=O)CCOCCCCCCC#N 7a_100000759926_100009813337 [1,0,0,0,0,0|2,0,1]=4 1219 B13R0.54 CC(=O)CCOCCCCCCCBr 7a_100000760002_100000053229 [1,0,0,0,0,0|2,0,0]=3 1220 B13R0.54 CC(=O)CCOCCCCCCCO 34a_100000759926_100000760002 [1,0,0,0,0,0|2,0,0]=3 1221 B13R0.54 CC(=O)CCOCCCCCCCO 7a_100000759926_100000760002 [1,0,0,0,0,0|2,0,0]=3 1222 B13R0.54 CC(=O)CCSCCCCCCC#N 62a_100000053229_100009813337 [1,0,0,0,0,0|2,0,1]=4 1223 B13R0.54 CC(=O)CCSCCCCCCC#N 62a_100009813337_100000053229 [1,0,0,0,0,0|2,0,1]=4 1224 B13R0.54 CC(=O)CCSCCCCCCCO 62a_100000053229_100000760002 [1,0,0,0,0,0|2,0,0]=3 1225 B13R0.54 CC(=O)CCSCCCCCCCO 62a_100000760002_100000053229 [1,0,0,0,0,0|2,0,0]=3 1226 B13R0.54 CC(=O)COCCCCCCCCO 34a_100000211253_100000033203 [1,0,0,0,0,0|2,0,0]=3 1227 B13R0.54 CC(=O)NCCCCCCCCCO 240690a_100000078944_100015343762 [1,0,0,0,0,0|2,0,0]=3 1228 B13R0.54 CC(=O)NCCCCCCNCCF 2230a_200011996284_100011217306 [1,0,0,0,0,0|3,0,0]=4 1229 B13R0.54 CC(=O)NCCCCCCNCCF 34a_200011996284_100011217306 [1,0,0,0,0,0|3,0,0]=4 1230 B13R0.54 CC(=O)NCCCCCCNCCO 2230a_200011996284_100000211926 [1,0,0,0,0,0|3,0,0]=4 1231 B13R0.54 CC(=O)NCCCCCCNCCO 34a_200011996284_100000211926 [1,0,0,0,0,0|3,0,0]=4 1232 B13R0.54 CC(=O)NCCCCCNCCCF 2230a_200012022750_100011934791 [1,0,0,0,0,0|3,0,0]=4 1233 B13R0.54 CC(=O)NCCCCCNCCCF 34a_200012022750_100011934791 [1,0,0,0,0,0|3,0,0]=4 1234 B13R0.54 CC(=O)NCCCCCNCCCO 2230a_200012022750_100000230001 [1,0,0,0,0,0|3,0,0]=4 1235 B13R0.54 CC(=O)NCCCCCNCCCO 34a_200012022750_100000230001 [1,0,0,0,0,0|3,0,0]=4 1236 B13R0.54 CC(=O)NCCCCNCCCCF 2230a_200011368371_100000729493 [1,0,0,0,0,0|3,0,0]=4 1237 B13R0.54 CC(=O)NCCCCNCCCCF 34a_200011368371_100000729493 [1,0,0,0,0,0|3,0,0]=4 1238 B13R0.54 CC(=O)NCCCCNCCCCO 2230a_200011368371_100000210776 [1,0,0,0,0,0|3,0,0]=4 1239 B13R0.54 CC(=O)NCCCCNCCCCO 34a_200011368371_100011216708 [1,0,0,0,0,0|3,0,0]=4 1240 B13R0.54 CC(=O)NCCCNCCCCCF 34a_100000736810_100000729378 [1,0,0,0,0,0|3,0,0]=4 1241 B13R0.54 CC(=O)NCCCNCCCCCO 34a_100000736810_100000746330 [1,0,0,0,0,0|3,0,0]=4 1242 B13R0.54 CC(=O)NCCCOCCCCCF 34a_100000752032_100000729378 [1,0,0,0,0,0|3,0,0]=4 1243 B13R0.54 CC(=O)NCCCOCCCCCO 34a_100000752032_100000746330 [1,0,0,0,0,0|3,0,0]=4 1244 B13R0.54 CC(=O)NCCNCCCCCCF 2230a_100000209853_100015922095 [1,0,0,0,0,0|3,0,0]=4 1245 B13R0.54 CC(=O)NCCNCCCCCCO 2230a_100000209853_100000766143 [1,0,0,0,0,0|3,0,0]=4 1246 B13R0.54 CC(=O)NCCNCCCCCCO 2230a_100000686447_100000189650 [1,0,0,0,0,0|3,0,0]=4 1247 B13R0.54 CC(=O)NCCOCCCCCCBr 7a_100011215345_100000189650 [1,0,0,0,0,0|3,0,0]=4 1248 B13R0.54 CC(=O)NCCOCCCCCCCl 7a_100000766143_100000189650 [1,0,0,0,0,0|3,0,0]=4 1249 B13R0.54 CC(=O)NCCOCCCCCCF 34a_100000158858_100015922095 [1,0,0,0,0,0|3,0,0]=4 1250 B13R0.54 CC(=O)NCCOCCCCCCF 7a_100000732779_100000189650 [1,0,0,0,0,0|3,0,0]=4 1251 B13R0.54 CC(=O)NCCOCCCCCCO 34a_100000158858_100000766143 [1,0,0,0,0,0|3,0,0]=4 1252 B13R0.54 CC(=O)NCCSCCCCCCF 62a_100000189650_100015922095 [1,0,0,0,0,0|3,0,0]=4 1253 B13R0.54 CC(=O)NCCSCCCCCCF 62a_100015922095_100000189650 [1,0,0,0,0,0|3,0,0]=4 1254 B13R0.54 CC(=O)NCCSCCCCCCO 62a_100000189650_100000766143 [1,0,0,0,0,0|3,0,0]=4 1255 B13R0.54 CC(=O)NCCSCCCCCCO 62a_100000766143_100000189650 [1,0,0,0,0,0|3,0,0]=4 1256 B13R0.54 CC(=O)OCCCCCNCCCF 2230a_100015189416_100009813381 [1,0,0,0,0,0|3,0,0]=4 1257 B13R0.54 CC(=O)OCCCCCNCCCF 34a_100015189416_100000033007 [1,0,0,0,0,0|3,0,0]=4 1258 B13R0.54 CC(=O)OCCCCCOCCCBr 34a_100011217188_100000033007 [1,0,0,0,0,0|3,0,0]=4 1259 B13R0.54 CC(=O)OCCCCCOCCCCl 34a_100000230001_100000033007 [1,0,0,0,0,0|3,0,0]=4 1260 B13R0.54 CC(=O)OCCCCCOCCCF 34a_100000759539_100000033007 [1,0,0,0,0,0|3,0,0]=4 1261 B13R0.54 CC(=O)OCCCCCOCCCN 34a_100000182051_100000033007 [1,0,0,0,0,0|3,0,0]=4 1262 B13R0.54 CC(=O)OCCCCCSCCCF 62a_100000033007_100011934791 [1,0,0,0,0,0|3,0,0]=4 1263 B13R0.54 CC(=O)OCCCCCSCCCF 62a_100011934791_100000033007 [1,0,0,0,0,0|3,0,0]=4 1264 B13R0.54 CC(=O)OCCCCCSCCCO 62a_100000033007_100011215043 [1,0,0,0,0,0|3,0,0]=4 1265 B13R0.54 CC(=O)OCCCCCSCCCO 62a_100011215043_100000033007 [1,0,0,0,0,0|3,0,0]=4 1266 B13R0.54 CC(=O)OCCCCNCCCCO 34a_100000750430_100000033659 [1,0,0,0,0,0|3,0,0]=4 1267 B13R0.54 CC(=O)OCCCCOCCCCBr 34a_100011216708_100000033659 [1,0,0,0,0,0|3,0,0]=4 1268 B13R0.54 CC(=O)OCCCCOCCCCCl 34a_100000210776_100000033659 [1,0,0,0,0,0|3,0,0]=4 1269 B13R0.54 CC(=O)OCCCCOCCCCCl 7a_100000210776_100000033659 [1,0,0,0,0,0|3,0,0]=4 1270 B13R0.54 CC(=O)OCCCCOCCCCF 34a_100000073216_100000729493 [1,0,0,0,0,0|3,0,0]=4 1271 B13R0.54 CC(=O)OCCCCOCCCCF 34a_100011995726_100000033659 [1,0,0,0,0,0|3,0,0]=4 1272 B13R0.54 CC(=O)OCCCCOCCCCF 7a_100000073216_100000729493 [1,0,0,0,0,0|3,0,0]=4 1273 B13R0.54 CC(=O)OCCCCOCCCCF 7a_100011995726_100000033659 [1,0,0,0,0,0|3,0,0]=4 1274 B13R0.54 CC(=O)OCCCCOCCCCI 34a_200012148704_100000033659 [1,0,0,0,0,0|3,0,0]=4 1275 B13R0.54 CC(=O)OCCCCOCCCCN 34a_100000750430_100000033659 [1,0,0,0,0,0|3,0,0]=4 1276 B13R0.54 CC(=O)OCCCCOCCCCO 34a_100000073216_100011216708 [1,0,0,0,0,0|3,0,0]=4 1277 B13R0.54 CC(=O)OCCCCOCCCCO 7a_100000073216_100000210776 [1,0,0,0,0,0|3,0,0]=4 1278 B13R0.54 CC(=O)OCCCCSCCCCF 62a_100000033659_100000729493 [1,0,0,0,0,0|3,0,0]=4 1279 B13R0.54 CC(=O)OCCCCSCCCCF 62a_100000729493_100000033659 [1,0,0,0,0,0|3,0,0]=4 1280 B13R0.54 CC(=O)OCCCCSCCCCO 62a_100000033659_100000210776 [1,0,0,0,0,0|3,0,0]=4 1281 B13R0.54 CC(=O)OCCCCSCCCCO 62a_100000210776_100000033659 [1,0,0,0,0,0|3,0,0]=4 1282 B13R0.54 CC(=O)OCCCNCCCCCO 34a_100000762737_100000042594 [1,0,0,0,0,0|3,0,0]=4 1283 B13R0.54 CC(=O)OCCCOCCCCCBr 34a_100000746331_100000042594 [1,0,0,0,0,0|3,0,0]=4 1284 B13R0.54 CC(=O)OCCCOCCCCCBr 7a_100000746331_100000042594 [1,0,0,0,0,0|3,0,0]=4 1285 B13R0.54 CC(=O)OCCCOCCCCCCl 34a_100000746330_100000042594 [1,0,0,0,0,0|3,0,0]=4 1286 B13R0.54 CC(=O)OCCCOCCCCCCl 7a_100000746330_100000042594 [1,0,0,0,0,0|3,0,0]=4 1287 B13R0.54 CC(=O)OCCCOCCCCCI 34a_200012148887_100000042594 [1,0,0,0,0,0|3,0,0]=4 1288 B13R0.54 CC(=O)OCCCOCCCCCI 7a_200012148887_100000042594 [1,0,0,0,0,0|3,0,0]=4 1289 B13R0.54 CC(=O)OCCCOCCCCCN 34a_100000762737_100000042594 [1,0,0,0,0,0|3,0,0]=4 1290 B13R0.54 CC(=O)OCCCSCCCCCF 62a_100000042594_100000729378 [1,0,0,0,0,0|3,0,0]=4 1291 B13R0.54 CC(=O)OCCCSCCCCCF 62a_100000729378_100000042594 [1,0,0,0,0,0|3,0,0]=4 1292 B13R0.54 CC(=O)OCCCSCCCCCO 62a_100000042594_100000746330 [1,0,0,0,0,0|3,0,0]=4 1293 B13R0.54 CC(=O)OCCCSCCCCCO 62a_100000746330_100000042594 [1,0,0,0,0,0|3,0,0]=4 1294 B13R0.54 CC(=O)OCCNCCCCCCO 34a_100000686447_100009814007 [1,0,0,0,0,0|3,0,0]=4 1295 B13R0.54 CC(=O)OCCOCCCCCCBr 34a_100011215345_100009814007 [1,0,0,0,0,0|3,0,0]=4 1296 B13R0.54 CC(=O)OCCOCCCCCCBr 7a_100011215345_100009814007 [1,0,0,0,0,0|3,0,0]=4 1297 B13R0.54 CC(=O)OCCOCCCCCCCl 34a_100000766143_100009814007 [1,0,0,0,0,0|3,0,0]=4 1298 B13R0.54 CC(=O)OCCOCCCCCCCl 7a_100000766143_100009814007 [1,0,0,0,0,0|3,0,0]=4 1299 B13R0.54 CC(=O)OCCOCCCCCCF 34a_100000732779_100009814007 [1,0,0,0,0,0|3,0,0]=4 1300 B13R0.54 CC(=O)OCCOCCCCCCF 7a_100000732779_100009814007 [1,0,0,0,0,0|3,0,0]=4 1301 B13R0.54 CC(=O)OCCOCCCCCCN 34a_100000686447_100009814007 [1,0,0,0,0,0|3,0,0]=4 1302 B13R0.54 CC(=O)OCCSCCCCCCF 62a_100009814007_100015922095 [1,0,0,0,0,0|3,0,0]=4 1303 B13R0.54 CC(=O)OCCSCCCCCCF 62a_100015922095_100009814007 [1,0,0,0,0,0|3,0,0]=4 1304 B13R0.54 CC(=O)OCCSCCCCCCO 62a_100000766143_100009814007 [1,0,0,0,0,0|3,0,0]=4 1305 B13R0.54 CC(=O)OCCSCCCCCCO 62a_100009814007_100000766143 [1,0,0,0,0,0|3,0,0]=4 1306 B13R0.54 CC(=O)OCNCCCCCCCO 34a_100011996573_100009813279 [1,0,0,0,0,0|3,0,0]=4 1307 B13R0.54 CC(=O)OCOCCCCCCCBr 34a_100000760002_100009813279 [1,0,0,0,0,0|3,0,0]=4 1308 B13R0.54 CC(=O)OCOCCCCCCCN 34a_100011996573_100009813279 [1,0,0,0,0,0|3,0,0]=4 1309 B13R0.54 CC(=O)OCSCCCCCCCO 62a_100000076356_100000760002 [1,0,0,0,0,0|3,0,0]=4 1310 B13R0.54 CC(=O)OCSCCCCCCCO 62a_100000760002_100000076356 [1,0,0,0,0,0|3,0,0]=4 1311 B13R0.54 CC(=O)SCCCCNCCCCO 2230a_100000750430_200010402107 [1,0,0,0,0,0|3,0,0]=4 1312 B13R0.54 CC(=O)SCCCCNCCCCO 34a_100000750430_200010402107 [1,0,0,0,0,0|3,0,0]=4 1313 B13R0.54 CC(=O)SCCCCOCCCCBr 34a_100011216708_200010402107 [1,0,0,0,0,0|3,0,0]=4 1314 B13R0.54 CC(=O)SCCCCOCCCCCl 34a_100000210776_200010402107 [1,0,0,0,0,0|3,0,0]=4 1315 B13R0.54 CC(=O)SCCCCOCCCCCl 7a_100000210776_200010402107 [1,0,0,0,0,0|3,0,0]=4 1316 B13R0.54 CC(=O)SCCCCOCCCCF 34a_100011995726_200010402107 [1,0,0,0,0,0|3,0,0]=4 1317 B13R0.54 CC(=O)SCCCCOCCCCF 7a_100011995726_200010402107 [1,0,0,0,0,0|3,0,0]=4 1318 B13R0.54 CC(=O)SCCCCOCCCCI 34a_200012148704_200010402107 [1,0,0,0,0,0|3,0,0]=4 1319 B13R0.54 CC(=O)SCCCCOCCCCN 34a_100000750430_200010402107 [1,0,0,0,0,0|3,0,0]=4 1320 B13R0.54 CC(=O)SCCCCSCCCCF 62a_100000729493_200010402107 [1,0,0,0,0,0|3,0,0]=4 1321 B13R0.54 CC(=O)SCCCCSCCCCF 62a_200010402107_100000729493 [1,0,0,0,0,0|3,0,0]=4 1322 B13R0.54 CC(=O)SCCCCSCCCCO 62a_100000210776_200010402107 [1,0,0,0,0,0|3,0,0]=4 1323 B13R0.54 CC(=O)SCCCCSCCCCO 62a_200010402107_100000210776 [1,0,0,0,0,0|3,0,0]=4 1324 B13R0.54 CC(=O)SCCCNCCCCCO 2230a_100000762737_100000038929 [1,0,0,0,0,0|3,0,0]=4 1325 B13R0.54 CC(=O)SCCCNCCCCCO 34a_100000762737_100000038929 [1,0,0,0,0,0|3,0,0]=4 1326 B13R0.54 CC(=O)SCCCOCCCCCBr 34a_100000746331_100000038929 [1,0,0,0,0,0|3,0,0]=4 1327 B13R0.54 CC(=O)SCCCOCCCCCBr 7a_100000746331_100000038929 [1,0,0,0,0,0|3,0,0]=4 1328 B13R0.54 CC(=O)SCCCOCCCCCCl 34a_100000746330_100000038929 [1,0,0,0,0,0|3,0,0]=4 1329 B13R0.54 CC(=O)SCCCOCCCCCCl 7a_100000746330_100000038929 [1,0,0,0,0,0|3,0,0]=4 1330 B13R0.54 CC(=O)SCCCOCCCCCI 34a_200012148887_100000038929 [1,0,0,0,0,0|3,0,0]=4 1331 B13R0.54 CC(=O)SCCCOCCCCCI 7a_200012148887_100000038929 [1,0,0,0,0,0|3,0,0]=4 1332 B13R0.54 CC(=O)SCCCOCCCCCN 34a_100000762737_100000038929 [1,0,0,0,0,0|3,0,0]=4 1333 B13R0.54 CC(=O)SCCCSCCCCCF 62a_100000038929_100000729378 [1,0,0,0,0,0|3,0,0]=4 1334 B13R0.54 CC(=O)SCCCSCCCCCF 62a_100000729378_100000038929 [1,0,0,0,0,0|3,0,0]=4 1335 B13R0.54 CC(=O)SCCCSCCCCCO 62a_100000038929_100000746330 [1,0,0,0,0,0|3,0,0]=4 1336 B13R0.54 CC(=O)SCCCSCCCCCO 62a_100000746330_100000038929 [1,0,0,0,0,0|3,0,0]=4 1337 B13R0.54 CC/C=C/CCCOCCCC(=O)C 34a_100016287902_100000685027 [1,0,0,0,0,0|1,0,2]=4 1338 B13R0.54 CC/C=C/CCCOCCCC(=O)C 7a_100016287902_100011215641 [1,0,0,0,0,0|1,0,2]=4 1339 B13R0.54 CC/C=C\CCCCOCCC(=O)C 7a_100016287862_100000053229 [1,0,0,0,0,0|1,0,2]=4 1340 B13R0.54 CC/C=C\CCOCCCCC(=O)C 34a_100016288707_100009817362 [1,0,0,0,0,0|1,0,2]=4 1341 B13R0.54 CC/C=C\CCOCCCCC(=O)C 7a_100016288707_100000735457 [1,0,0,0,0,0|1,0,2]=4 1342 B13R0.54 CC/C=C\CCSCCCCC(=O)C 62a_100000735457_100015370543 [1,0,0,0,0,0|1,0,2]=4 1343 B13R0.54 CC/C=C\CCSCCCCC(=O)C 62a_100015370543_100000735457 [1,0,0,0,0,0|1,0,2]=4 1344 B13R0.54 CC=CCCCOCCCCC(=O)C 34a_100020645299_100009817362 [1,0,0,0,0,0|1,0,2]=4 1345 B13R0.54 CCC#CCCOCCCCC(=O)C 34a_100000036655_100009817362 [1,0,0,0,0,0|1,0,2]=4 1346 B13R0.54 CCC#CCCOCCCCC(=O)C 7a_100000036655_100000735457 [1,0,0,0,0,0|1,0,2]=4 1347 B13R0.54 CCC/C=C/COCCCCC(=O)C 34a_100016278788_100009817362 [1,0,0,0,0,0|1,0,2]=4 1348 B13R0.54 CCC/C=C/COCCCCC(=O)C 7a_100016278788_100000735457 [1,0,0,0,0,0|1,0,2]=4 1349 B13R0.54 CCCC#CCCOCCCC(=O)C 34a_100000042726_100000685027 [1,0,0,0,0,0|1,0,2]=4 1350 B13R0.54 CCCC#CCCOCCCC(=O)C 7a_100000042726_100011215641 [1,0,0,0,0,0|1,0,2]=4 1351 B13R0.54 CCCC#CCOCCCCC(=O)C 34a_100000034806_100009817362 [1,0,0,0,0,0|1,0,2]=4 1352 B13R0.54 CCCC#CCOCCCCC(=O)C 7a_100000034806_100000735457 [1,0,0,0,0,0|1,0,2]=4 1353 B13R0.54 CCCC/C=C/COCCCC(=O)C 34a_200016272032_100000685027 [1,0,0,0,0,0|1,0,2]=4 1354 B13R0.54 CCCC/C=C/COCCCC(=O)C 7a_200016272032_100011215641 [1,0,0,0,0,0|1,0,2]=4 1355 B13R0.54 CCCC/C=C\CCOCCC(=O)C 7a_200016286491_100000053229 [1,0,0,0,0,0|1,0,2]=4 1356 B13R0.54 CCCCC#CCCCNCC(=O)O 269956a_100016091260_200000047210 [1,0,0,0,0,0|1,0,2]=4 1357 B13R0.54 CCCCC#CCCCOCC(=O)C 34a_100000211253_200000047210 [1,0,0,0,0,0|1,0,2]=4 1358 B13R0.54 CCCCC#CCCOCCC(=O)C 7a_100000037610_100000053229 [1,0,0,0,0,0|1,0,2]=4 1359 B13R0.54 CCCCC#CCOCCCC(=O)C 34a_200000034558_100000685027 [1,0,0,0,0,0|1,0,2]=4 1360 B13R0.54 CCCCC#CCOCCCC(=O)C 7a_200000034558_100011215641 [1,0,0,0,0,0|1,0,2]=4 1361 B13R0.54 CCCCC/C=C/COCCC(=O)C 7a_100016258190_100000053229 [1,0,0,0,0,0|1,0,2]=4 1362 B13R0.54 CCCCCC#CCOCCC(=O)C 34a_100000759926_100009816472 [1,0,0,0,0,0|1,0,2]=4 1363 B13R0.54 CCCCCC#CCOCCC(=O)C 7a_100000759926_100009816472 [1,0,0,0,0,0|1,0,2]=4 1364 B13R0.54 CCCCCC#CCOCCC(=O)C 7a_200000033628_100000053229 [1,0,0,0,0,0|1,0,2]=4 1365 B13R0.54 CCCCCC#CCSCCC(=O)C 62a_100000053229_100009816472 [1,0,0,0,0,0|1,0,2]=4 1366 B13R0.54 CCCCCC#CCSCCC(=O)C 62a_100009816472_100000053229 [1,0,0,0,0,0|1,0,2]=4 1367 B13R0.54 CCCCCCCCC=NNC(=O)C 4a_100000189765_100011218696 [1,0,0,0,0,0|2,0,1]=4 1368 B13R0.54 CCCCCCCCCC=CC(=O)C 1458a_200015352897_200000210301 [1,0,0,0,0,0|0,0,2]=3 1369 B13R0.54 CCCCCCCCCC=CC(=O)[13CH3] 1458a_200015352897_200025704644 [1,0,0,0,0,0|0,0,2]=3 1370 B13R0.54 CCCCCCCCCCCC(=O)C 1458a_100000070787_100011215454 [1,0,0,0,0,0|0,0,0]=1 1371 B13R0.54 CCCCCCCCCCCC(=O)C 1458a_100000210736_200000210301 [1,0,0,0,0,0|0,0,0]=1 1372 B13R0.54 CCCCCCCCCCCC(=O)[13CH3] 1458a_100000210736_200025704644 [1,0,0,0,0,0|0,0,0]=1 1373 B13R0.54 CCCCCCCCCCCN(C)C 2230a_100102631434_100011215454 [1,0,0,0,0,0|2,0,0]=3 1374 B13R0.54 CCCCCCCCCCCN(C)C 269982a_100102631434_100011215454 [1,0,0,0,0,0|2,0,0]=3 1375 B13R0.54 CCCCCCCCCCNC(=O)C 11a_100000684558_100015343762 [1,0,0,0,0,0|1,0,0]=2 1376 B13R0.54 CCCCCCCCCCNC(=O)C 1626a_100000684558_100015343762 [1,0,0,0,0,0|1,0,0]=2 1377 B13R0.54 CCCCCCCCCCNC(=O)C 240690a_100000684558_100015343762 [1,0,0,0,0,0|1,0,0]=2 1378 B13R0.54 CCCCCCCCCCNC(=O)C 527a_100000684558_100103153847 [1,0,0,0,0,0|1,0,0]=2 1379 B13R0.54 CCCCCCCCCCNC(C)C 2230a_100000684558_100000210206 [1,0,0,0,0,0|2,0,1]=4 1380 B13R0.54 CCCCCCCCCCNC(C)C 2230a_100138425928_100000210320 [1,0,0,0,0,0|2,0,1]=4 1381 B13R0.54 CCCCCCCCCCNC(C)C 34a_100000684558_100000210206 [1,0,0,0,0,0|2,0,1]=4 1382 B13R0.54 CCCCCCCCCCNC(C)C 34a_100138425928_100000210320 [1,0,0,0,0,0|2,0,1]=4 1383 B13R0.54 CCCCCCCCCCOC(C)C 34a_100000210711_100000210206 [1,0,0,0,0,0|2,0,1]=4 1384 B13R0.54 CCCCCCCCCCOC(C)C 34a_100000212225_100000210320 [1,0,0,0,0,0|2,0,1]=4 1385 B13R0.54 CCCCCCCCCCOC(C)C 7a_100000210711_100000210206 [1,0,0,0,0,0|2,0,1]=4 1386 B13R0.54 CCCCCCCCCCSC(C)C 62a_100000210206_100000210320 [1,0,0,0,0,0|2,0,1]=4 1387 B13R0.54 CCCCCCCCCNCC(=O)N 2230a_100000212291_100000747473 [1,0,0,0,0,0|2,0,0]=3 1388 B13R0.54 CCCCCCCCCNCC(=O)N 2230a_100000711301_100011214924 [1,0,0,0,0,0|2,0,0]=3 1389 B13R0.54 CCCCCCCCCNCC(=O)N 34a_100000212291_100000187820 [1,0,0,0,0,0|2,0,0]=3 1390 B13R0.54 CCCCCCCCCNCC(=O)O 269956a_100016091260_100000210670 [1,0,0,0,0,0|1,0,0]=2 1391 B13R0.54 CCCCCCCCCNCC(=O)[O-] 34a_100000212291_100020667443 [1,0,0,0,0,0|1,0,1]=3 1392 B13R0.54 CCCCCCCCCNCC(C)C 2230a_100000210953_100011214924 [1,0,0,0,0,0|2,0,1]=4 1393 B13R0.54 CCCCCCCCCNCC(C)C 2230a_100000212291_100000210760 [1,0,0,0,0,0|2,0,1]=4 1394 B13R0.54 CCCCCCCCCNCC(C)C 270004a_100000212291_100000210432 [1,0,0,0,0,0|2,0,1]=4 1395 B13R0.54 CCCCCCCCCNCC(C)C 34a_100000210953_100011214924 [1,0,0,0,0,0|2,0,1]=4 1396 B13R0.54 CCCCCCCCCNCC(C)C 34a_100000212291_100000210624 [1,0,0,0,0,0|2,0,1]=4 1397 B13R0.54 CCCCCCCCCNCC(C)O 2230a_100000210904_100011214924 [1,0,0,0,0,0|1,0,2]=4 1398 B13R0.54 CCCCCCCCCNCC(C)O 2230a_100000212291_100011218427 [1,0,0,0,0,0|1,0,2]=4 1399 B13R0.54 CCCCCCCCCNCC(C)O 34a_100000210904_100011214924 [1,0,0,0,0,0|1,0,2]=4 1400 B13R0.54 CCCCCCCCCNCC(C)O 34a_100000212291_100011218427 [1,0,0,0,0,0|1,0,2]=4 1401 B13R0.54 CCCCCCCCCNC[C@@H](C)O 2230a_100000212291_100009817552 [1,0,0,0,0,0|1,0,2]=4 1402 B13R0.54 CCCCCCCCCNC[C@@H](C)O 34a_100000212291_100009817552 [1,0,0,0,0,0|1,0,2]=4 1403 B13R0.54 CCCCCCCCCNC[N+](=O)[O-] 34a_100000212291_100000761209 [1,0,0,0,0,0|2,0,1]=4 1404 B13R0.54 CCCCCCCCCOCC(=O)C 34a_100000211253_100011214924 [1,0,0,0,0,0|1,0,0]=2 1405 B13R0.54 CCCCCCCCCOCC(=O)N 34a_100000210712_100000187820 [1,0,0,0,0,0|2,0,0]=3 1406 B13R0.54 CCCCCCCCCOCC(=O)N 7a_100000210712_100000187820 [1,0,0,0,0,0|2,0,0]=3 1407 B13R0.54 CCCCCCCCCOCC(=O)[O-] 34a_100000210712_100020667443 [1,0,0,0,0,0|1,0,1]=3 1408 B13R0.54 CCCCCCCCCOCC(C)Br 34a_100012180447_100011214924 [1,0,0,0,0,0|2,0,1]=4 1409 B13R0.54 CCCCCCCCCOCC(C)C 34a_100000210257_100011214924 [1,0,0,0,0,0|2,0,1]=4 1410 B13R0.54 CCCCCCCCCOCC(C)C 34a_100000210712_100000210624 [1,0,0,0,0,0|2,0,1]=4 1411 B13R0.54 CCCCCCCCCOCC(C)C 7a_100000210712_100000210760 [1,0,0,0,0,0|2,0,1]=4 1412 B13R0.54 CCCCCCCCCOCC(C)F 34a_100015925927_100011214924 [1,0,0,0,0,0|2,0,1]=4 1413 B13R0.54 CCCCCCCCCOCC(C)O 34a_100000210712_100011218427 [1,0,0,0,0,0|1,0,2]=4 1414 B13R0.54 CCCCCCCCCOCC(C)O 7a_100000210712_100011218427 [1,0,0,0,0,0|1,0,2]=4 1415 B13R0.54 CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011214924 [1,0,0,0,0,0|2,0,1]=4 1416 B13R0.54 CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011214924 [1,0,0,0,0,0|2,0,1]=4 1417 B13R0.54 CCCCCCCCCOC[C@@H](C)O 34a_100000210712_100009817552 [1,0,0,0,0,0|1,0,2]=4 1418 B13R0.54 CCCCCCCCCOC[C@@H](C)O 7a_100000210712_100009817552 [1,0,0,0,0,0|1,0,2]=4 1419 B13R0.54 CCCCCCCCCOC[N+](=O)[O-] 34a_100000210712_100000761209 [1,0,0,0,0,0|2,0,1]=4 1420 B13R0.54 CCCCCCCCCSCC(=O)N 62a_100000747473_100000210670 [1,0,0,0,0,0|2,0,0]=3 1421 B13R0.54 CCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210670 [1,0,0,0,0,0|1,0,1]=3 1422 B13R0.54 CCCCCCCCCSCC(C)C 62a_100000210624_100000210670 [1,0,0,0,0,0|2,0,1]=4 1423 B13R0.54 CCCCCCCCCSCC(C)O 62a_100011218427_100000210670 [1,0,0,0,0,0|1,0,2]=4 1424 B13R0.54 CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210670 [1,0,0,0,0,0|1,0,2]=4 1425 B13R0.54 CCCCCCCCNCC=C(C)C 2230a_100000229939_100000761012 [1,0,0,0,0,0|2,0,1]=4 1426 B13R0.54 CCCCCCCCNCC=C(C)C 34a_100000229939_100000761012 [1,0,0,0,0,0|2,0,1]=4 1427 B13R0.54 CCCCCCCCNCC=C(C)C 34a_100000718196_100000210759 [1,0,0,0,0,0|2,0,1]=4 1428 B13R0.54 CCCCCCCCNCCC(=O)N 2230a_100000229939_100000744528 [1,0,0,0,0,0|2,0,0]=3 1429 B13R0.54 CCCCCCCCNCCC(=O)N 34a_100000229939_100000731001 [1,0,0,0,0,0|2,0,0]=3 1430 B13R0.54 CCCCCCCCNCCC(C)C 2230a_100000229939_100000210312 [1,0,0,0,0,0|2,0,1]=4 1431 B13R0.54 CCCCCCCCNCCC(C)C 269862a_100000229939_100000185833 [1,0,0,0,0,0|2,0,1]=4 1432 B13R0.54 CCCCCCCCNCCC(C)C 34a_100000229939_100000210312 [1,0,0,0,0,0|2,0,1]=4 1433 B13R0.54 CCCCCCCCNCCC(C)O 2230a_100000229939_100012276601 [1,0,0,0,0,0|1,0,2]=4 1434 B13R0.54 CCCCCCCCNCCC(C)O 2230a_200000755665_100000210759 [1,0,0,0,0,0|1,0,2]=4 1435 B13R0.54 CCCCCCCCNCCC(C)O 34a_100000229939_100012276601 [1,0,0,0,0,0|1,0,2]=4 1436 B13R0.54 CCCCCCCCNCOC(=O)C 34a_100000229939_100009813279 [1,0,0,0,0,0|2,0,0]=3 1437 B13R0.54 CCCCCCCCNOCC(=O)O 269956a_100000106656_100000210759 [1,0,0,0,0,0|2,0,0]=3 1438 B13R0.54 CCCCCCCCOCC=C(C)C 34a_100000210232_100000761012 [1,0,0,0,0,0|2,0,1]=4 1439 B13R0.54 CCCCCCCCOCC=C(C)C 34a_100000753907_100000210759 [1,0,0,0,0,0|2,0,1]=4 1440 B13R0.54 CCCCCCCCOCC=C(C)C 7a_100000210232_100000761012 [1,0,0,0,0,0|2,0,1]=4 1441 B13R0.54 CCCCCCCCOCCC(=O)C 34a_100000759926_100000210759 [1,0,0,0,0,0|1,0,0]=2 1442 B13R0.54 CCCCCCCCOCCC(=O)C 7a_100000210232_100000053229 [1,0,0,0,0,0|1,0,0]=2 1443 B13R0.54 CCCCCCCCOCCC(=O)C 7a_100000759926_100000210759 [1,0,0,0,0,0|1,0,0]=2 1444 B13R0.54 CCCCCCCCOCCC(=O)N 34a_100000210232_100000731001 [1,0,0,0,0,0|2,0,0]=3 1445 B13R0.54 CCCCCCCCOCCC(=O)N 34a_100000757172_100000210759 [1,0,0,0,0,0|2,0,0]=3 1446 B13R0.54 CCCCCCCCOCCC(=O)N 7a_100000210232_100000744528 [1,0,0,0,0,0|2,0,0]=3 1447 B13R0.54 CCCCCCCCOCCC(=O)N 7a_100000757172_100000210759 [1,0,0,0,0,0|2,0,0]=3 1448 B13R0.54 CCCCCCCCOCCC(C)Br 34a_100009893172_100000210759 [1,0,0,0,0,0|2,0,1]=4 1449 B13R0.54 CCCCCCCCOCCC(C)C 34a_100000210232_100000210312 [1,0,0,0,0,0|2,0,1]=4 1450 B13R0.54 CCCCCCCCOCCC(C)C 34a_100000210254_100000210759 [1,0,0,0,0,0|2,0,1]=4 1451 B13R0.54 CCCCCCCCOCCC(C)C 7a_100000210232_100000210626 [1,0,0,0,0,0|2,0,1]=4 1452 B13R0.54 CCCCCCCCOCCC(C)C 7a_100000210254_100000210759 [1,0,0,0,0,0|2,0,1]=4 1453 B13R0.54 CCCCCCCCOCCC(C)O 34a_100000210232_100012276601 [1,0,0,0,0,0|1,0,2]=4 1454 B13R0.54 CCCCCCCCOCCC(C)O 7a_100000210232_100012276601 [1,0,0,0,0,0|1,0,2]=4 1455 B13R0.54 CCCCCCCCOCCN(C)C 7a_100000210232_100000755713 [1,0,0,0,0,0|3,0,0]=4 1456 B13R0.54 CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100000210759 [1,0,0,0,0,0|2,0,1]=4 1457 B13R0.54 CCCCCCCCOCOC(=O)C 34a_100000210232_100009813279 [1,0,0,0,0,0|2,0,0]=3 1458 B13R0.54 CCCCCCCCSCC=C(C)C 62a_100000210759_100000761012 [1,0,0,0,0,0|2,0,1]=4 1459 B13R0.54 CCCCCCCCSCC=C(C)C 62a_100000761012_100000210317 [1,0,0,0,0,0|2,0,1]=4 1460 B13R0.54 CCCCCCCCSCCC(=O)C 62a_100000053229_100000210317 [1,0,0,0,0,0|1,0,0]=2 1461 B13R0.54 CCCCCCCCSCCC(=O)C 62a_100000210759_100000053229 [1,0,0,0,0,0|1,0,0]=2 1462 B13R0.54 CCCCCCCCSCCC(=O)N 62a_100000210759_100000744528 [1,0,0,0,0,0|2,0,0]=3 1463 B13R0.54 CCCCCCCCSCCC(=O)N 62a_100000744528_100000210317 [1,0,0,0,0,0|2,0,0]=3 1464 B13R0.54 CCCCCCCCSCCC(C)C 62a_100000210312_100000210317 [1,0,0,0,0,0|2,0,1]=4 1465 B13R0.54 CCCCCCCCSCCC(C)C 62a_100000210759_100000210312 [1,0,0,0,0,0|2,0,1]=4 1466 B13R0.54 CCCCCCCCSCCC(C)O 62a_100000210759_100012276601 [1,0,0,0,0,0|1,0,2]=4 1467 B13R0.54 CCCCCCCCSCCC(C)O 62a_100012276601_100000210317 [1,0,0,0,0,0|1,0,2]=4 1468 B13R0.54 CCCCCCCCSCCN(C)C 62a_100000210759_100000755713 [1,0,0,0,0,0|3,0,0]=4 1469 B13R0.54 CCCCCCCCSCOC(=O)C 62a_100000076356_100000210317 [1,0,0,0,0,0|2,0,0]=3 1470 B13R0.54 CCCCCCCCSCOC(=O)C 62a_100000210759_100000076356 [1,0,0,0,0,0|2,0,0]=3 1471 B13R0.54 CCCCCCCNCCC=C(C)C 2230a_100000229938_100011217483 [1,0,0,0,0,0|2,0,1]=4 1472 B13R0.54 CCCCCCCNCCCC(=O)N 34a_100000739312_100000210614 [1,0,0,0,0,0|2,0,0]=3 1473 B13R0.54 CCCCCCCNCCCC(C)C 2230a_100000229938_100011214892 [1,0,0,0,0,0|2,0,1]=4 1474 B13R0.54 CCCCCCCNCCCC(C)C 2230a_200000737386_100000210681 [1,0,0,0,0,0|2,0,1]=4 1475 B13R0.54 CCCCCCCNCCCC(C)C 34a_200000737386_100000210614 [1,0,0,0,0,0|2,0,1]=4 1476 B13R0.54 CCCCCCCNCCCC(C)O 2230a_100000229938_200000718107 [1,0,0,0,0,0|1,0,2]=4 1477 B13R0.54 CCCCCCCNCCCS(=O)C 2230a_200000753449_100000210681 [1,0,0,0,0,0|2,0,0]=3 1478 B13R0.54 CCCCCCCNCCNC(=O)C 2230a_100000209853_100000210681 [1,0,0,0,0,0|2,0,0]=3 1479 B13R0.54 CCCCCCCNCCNC(=O)C 2230a_100000229938_100000189650 [1,0,0,0,0,0|2,0,0]=3 1480 B13R0.54 CCCCCCCNCCNC(=O)N 2230a_100000229938_200000034859 [1,0,0,0,0,0|3,0,0]=4 1481 B13R0.54 CCCCCCCNCCNC(=O)N 34a_100020590234_100000210614 [1,0,0,0,0,0|3,0,0]=4 1482 B13R0.54 CCCCCCCOCCC=C(C)C 34a_100000210272_100011217483 [1,0,0,0,0,0|2,0,1]=4 1483 B13R0.54 CCCCCCCOCCC=C(C)C 7a_100000210272_100011217483 [1,0,0,0,0,0|2,0,1]=4 1484 B13R0.54 CCCCCCCOCCCC(=O)C 34a_100000210272_100000685027 [1,0,0,0,0,0|1,0,0]=2 1485 B13R0.54 CCCCCCCOCCCC(=O)C 34a_100000759063_100000210614 [1,0,0,0,0,0|1,0,0]=2 1486 B13R0.54 CCCCCCCOCCCC(=O)C 7a_100000210272_100011215641 [1,0,0,0,0,0|1,0,0]=2 1487 B13R0.54 CCCCCCCOCCCC(=O)C 7a_100000759063_100000210614 [1,0,0,0,0,0|1,0,0]=2 1488 B13R0.54 CCCCCCCOCCCC(=O)N 34a_100000210272_100102525003 [1,0,0,0,0,0|2,0,0]=3 1489 B13R0.54 CCCCCCCOCCCC(=O)N 7a_100000210272_100102525003 [1,0,0,0,0,0|2,0,0]=3 1490 B13R0.54 CCCCCCCOCCCC(C)C 34a_100000210272_100011214892 [1,0,0,0,0,0|2,0,1]=4 1491 B13R0.54 CCCCCCCOCCCC(C)C 34a_100000210774_100000210614 [1,0,0,0,0,0|2,0,1]=4 1492 B13R0.54 CCCCCCCOCCCC(C)C 7a_100000210272_100011214892 [1,0,0,0,0,0|2,0,1]=4 1493 B13R0.54 CCCCCCCOCCCC(C)C 7a_100000210774_100000210614 [1,0,0,0,0,0|2,0,1]=4 1494 B13R0.54 CCCCCCCOCCCC(C)O 34a_100000210272_200000718107 [1,0,0,0,0,0|1,0,2]=4 1495 B13R0.54 CCCCCCCOCCCC(C)O 7a_100000210272_200000718107 [1,0,0,0,0,0|1,0,2]=4 1496 B13R0.54 CCCCCCCOCCCN(C)C 7a_100000210272_100000757444 [1,0,0,0,0,0|3,0,0]=4 1497 B13R0.54 CCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210614 [1,0,0,0,0,0|2,0,1]=4 1498 B13R0.54 CCCCCCCOCCNC(=O)C 34a_100000158858_100000210614 [1,0,0,0,0,0|2,0,0]=3 1499 B13R0.54 CCCCCCCOCCNC(=O)C 7a_100000210272_100000189650 [1,0,0,0,0,0|2,0,0]=3 1500 B13R0.54 CCCCCCCOCCNC(=O)N 34a_100000181757_100000210614 [1,0,0,0,0,0|3,0,0]=4 1501 B13R0.54 CCCCCCCOCCNC(=O)N 7a_100000210272_200000034859 [1,0,0,0,0,0|3,0,0]=4 1502 B13R0.54 CCCCCCCOCCOC(=O)C 34a_100000210272_100009814007 [1,0,0,0,0,0|2,0,0]=3 1503 B13R0.54 CCCCCCCOCCOC(=O)C 7a_100000210272_100009814007 [1,0,0,0,0,0|2,0,0]=3 1504 B13R0.54 CCCCCCCOCCOC(=O)N 34a_100000210272_200011214921 [1,0,0,0,0,0|3,0,0]=4 1505 B13R0.54 CCCCCCCOCCOC(=O)N 7a_100000210272_200011214921 [1,0,0,0,0,0|3,0,0]=4 1506 B13R0.54 CCCCCCCOCCOC(=O)N 7a_100000766696_100000210614 [1,0,0,0,0,0|3,0,0]=4 1507 B13R0.54 CCCCCCCSCCC=C(C)C 62a_100000210614_100011217483 [1,0,0,0,0,0|2,0,1]=4 1508 B13R0.54 CCCCCCCSCCC=C(C)C 62a_100011217483_100000210316 [1,0,0,0,0,0|2,0,1]=4 1509 B13R0.54 CCCCCCCSCCCC(=O)C 62a_100000210614_100011215641 [1,0,0,0,0,0|1,0,0]=2 1510 B13R0.54 CCCCCCCSCCCC(=O)C 62a_100011215641_100000210316 [1,0,0,0,0,0|1,0,0]=2 1511 B13R0.54 CCCCCCCSCCCC(=O)N 62a_100000210614_100102525003 [1,0,0,0,0,0|2,0,0]=3 1512 B13R0.54 CCCCCCCSCCCC(=O)N 62a_100102525003_100000210316 [1,0,0,0,0,0|2,0,0]=3 1513 B13R0.54 CCCCCCCSCCCC(C)C 62a_100000210614_100011214892 [1,0,0,0,0,0|2,0,1]=4 1514 B13R0.54 CCCCCCCSCCCC(C)C 62a_100011214892_100000210316 [1,0,0,0,0,0|2,0,1]=4 1515 B13R0.54 CCCCCCCSCCCC(C)O 62a_100000210614_200000718107 [1,0,0,0,0,0|1,0,2]=4 1516 B13R0.54 CCCCCCCSCCCC(C)O 62a_200000718107_100000210316 [1,0,0,0,0,0|1,0,2]=4 1517 B13R0.54 CCCCCCCSCCCN(C)C 62a_100000210614_100000757444 [1,0,0,0,0,0|3,0,0]=4 1518 B13R0.54 CCCCCCCSCCNC(=O)C 62a_100000189650_100000210316 [1,0,0,0,0,0|2,0,0]=3 1519 B13R0.54 CCCCCCCSCCNC(=O)C 62a_100000210614_100000189650 [1,0,0,0,0,0|2,0,0]=3 1520 B13R0.54 CCCCCCCSCCNC(=O)N 62a_100000210614_200000034859 [1,0,0,0,0,0|3,0,0]=4 1521 B13R0.54 CCCCCCCSCCNC(=O)N 62a_200000034859_100000210316 [1,0,0,0,0,0|3,0,0]=4 1522 B13R0.54 CCCCCCCSCCOC(=O)C 62a_100000210614_100009814007 [1,0,0,0,0,0|2,0,0]=3 1523 B13R0.54 CCCCCCCSCCOC(=O)C 62a_100009814007_100000210316 [1,0,0,0,0,0|2,0,0]=3 1524 B13R0.54 CCCCCCCSCCOC(=O)N 62a_100000210614_200011214921 [1,0,0,0,0,0|3,0,0]=4 1525 B13R0.54 CCCCCCCSCCOC(=O)N 62a_200011214921_100000210316 [1,0,0,0,0,0|3,0,0]=4 1526 B13R0.54 CCCCCCNCCCCB(O)O 2230a_100000210581_200009817182 [1,0,0,0,0,0|2,0,1]=4 1527 B13R0.54 CCCCCCNCCCCC(=O)N 34a_100000696515_100000210314 [1,0,0,0,0,0|2,0,0]=3 1528 B13R0.54 CCCCCCNCCCCC(C)C 2230a_100000210581_100011216152 [1,0,0,0,0,0|2,0,1]=4 1529 B13R0.54 CCCCCCNCCCNC(=O)C 34a_100000736810_100000210314 [1,0,0,0,0,0|2,0,0]=3 1530 B13R0.54 CCCCCCNCCCOC(=S)C 2230a_100000210581_200135323944 [1,0,0,0,0,0|2,1,0]=4 1531 B13R0.54 CCCCCCNCCCSC(=O)C 2230a_100000210581_100000038929 [1,0,0,0,0,0|2,0,0]=3 1532 B13R0.54 CCCCCCNCCOCC(=O)N 2230a_100000210581_100000076697 [1,0,0,0,0,0|3,0,0]=4 1533 B13R0.54 CCCCCCNCCOCC(=O)O 269956a_100000700818_100000210757 [1,0,0,0,0,0|2,0,0]=3 1534 B13R0.54 CCCCCCOCCCCB(O)O 34a_100000210259_200009817182 [1,0,0,0,0,0|2,0,1]=4 1535 B13R0.54 CCCCCCOCCCCB(O)O 7a_100000210259_200009817182 [1,0,0,0,0,0|2,0,1]=4 1536 B13R0.54 CCCCCCOCCCCC(=O)C 34a_100000210259_100009817362 [1,0,0,0,0,0|1,0,0]=2 1537 B13R0.54 CCCCCCOCCCCC(=O)C 7a_100000210259_100000735457 [1,0,0,0,0,0|1,0,0]=2 1538 B13R0.54 CCCCCCOCCCCC(=O)N 34a_100012022536_100000210314 [1,0,0,0,0,0|2,0,0]=3 1539 B13R0.54 CCCCCCOCCCCC(=O)N 7a_100012022536_100000210314 [1,0,0,0,0,0|2,0,0]=3 1540 B13R0.54 CCCCCCOCCCCC(C)C 34a_100000210259_100011216152 [1,0,0,0,0,0|2,0,1]=4 1541 B13R0.54 CCCCCCOCCCCC(C)C 34a_100011214890_100000210314 [1,0,0,0,0,0|2,0,1]=4 1542 B13R0.54 CCCCCCOCCCCC(C)C 7a_100000210259_100011216152 [1,0,0,0,0,0|2,0,1]=4 1543 B13R0.54 CCCCCCOCCCCC(C)C 7a_100011214890_100000210314 [1,0,0,0,0,0|2,0,1]=4 1544 B13R0.54 CCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210314 [1,0,0,0,0,0|2,0,1]=4 1545 B13R0.54 CCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210314 [1,0,0,0,0,0|2,0,1]=4 1546 B13R0.54 CCCCCCOCCCNC(=O)C 34a_100000752032_100000210314 [1,0,0,0,0,0|2,0,0]=3 1547 B13R0.54 CCCCCCOCCCOC(=O)C 34a_100000210259_100000042594 [1,0,0,0,0,0|2,0,0]=3 1548 B13R0.54 CCCCCCOCCCOC(=O)C 7a_100000210259_100000042594 [1,0,0,0,0,0|2,0,0]=3 1549 B13R0.54 CCCCCCOCCCOC(=S)C 34a_100000210259_200135323944 [1,0,0,0,0,0|2,1,0]=4 1550 B13R0.54 CCCCCCOCCCOC(=S)C 7a_100000210259_200135323944 [1,0,0,0,0,0|2,1,0]=4 1551 B13R0.54 CCCCCCOCCCSC(=O)C 34a_100000210259_100000038929 [1,0,0,0,0,0|2,0,0]=3 1552 B13R0.54 CCCCCCOCCCSC(=O)C 7a_100000210259_100000038929 [1,0,0,0,0,0|2,0,0]=3 1553 B13R0.54 CCCCCCOCCOCC(=O)N 34a_100000210259_100000076697 [1,0,0,0,0,0|3,0,0]=4 1554 B13R0.54 CCCCCCOCCOCC(=O)N 34a_100000691444_100000187820 [1,0,0,0,0,0|3,0,0]=4 1555 B13R0.54 CCCCCCOCCOCC(=O)N 7a_100000210259_100000076697 [1,0,0,0,0,0|3,0,0]=4 1556 B13R0.54 CCCCCCOCCOCC(=O)N 7a_100000691444_100000187820 [1,0,0,0,0,0|3,0,0]=4 1557 B13R0.54 CCCCCCOCCOCC(=O)[O-] 34a_100000691444_100020667443 [1,0,0,0,0,0|2,0,1]=4 1558 B13R0.54 CCCCCCSCCCCB(O)O 62a_100000210314_200009817182 [1,0,0,0,0,0|2,0,1]=4 1559 B13R0.54 CCCCCCSCCCCB(O)O 62a_200009817182_100000210757 [1,0,0,0,0,0|2,0,1]=4 1560 B13R0.54 CCCCCCSCCCCC(=O)C 62a_100000210314_100000735457 [1,0,0,0,0,0|1,0,0]=2 1561 B13R0.54 CCCCCCSCCCCC(=O)C 62a_100000735457_100000210757 [1,0,0,0,0,0|1,0,0]=2 1562 B13R0.54 CCCCCCSCCCCC(C)C 62a_100000210314_100011216152 [1,0,0,0,0,0|2,0,1]=4 1563 B13R0.54 CCCCCCSCCCCC(C)C 62a_100011216152_100000210757 [1,0,0,0,0,0|2,0,1]=4 1564 B13R0.54 CCCCCCSCCCCN(C)C 62a_100000210314_100000690147 [1,0,0,0,0,0|3,0,0]=4 1565 B13R0.54 CCCCCCSCCCOC(=O)C 62a_100000042594_100000210757 [1,0,0,0,0,0|2,0,0]=3 1566 B13R0.54 CCCCCCSCCCOC(=O)C 62a_100000210314_100000042594 [1,0,0,0,0,0|2,0,0]=3 1567 B13R0.54 CCCCCCSCCCOC(=S)C 62a_100000210314_200135323944 [1,0,0,0,0,0|2,1,0]=4 1568 B13R0.54 CCCCCCSCCCOC(=S)C 62a_200135323944_100000210757 [1,0,0,0,0,0|2,1,0]=4 1569 B13R0.54 CCCCCCSCCCSC(=O)C 62a_100000038929_100000210757 [1,0,0,0,0,0|2,0,0]=3 1570 B13R0.54 CCCCCCSCCCSC(=O)C 62a_100000210314_100000038929 [1,0,0,0,0,0|2,0,0]=3 1571 B13R0.54 CCCCCCSCCOCC(=O)N 62a_100000076697_100000210757 [1,0,0,0,0,0|3,0,0]=4 1572 B13R0.54 CCCCCCSCCOCC(=O)N 62a_100000210314_100000076697 [1,0,0,0,0,0|3,0,0]=4 1573 B13R0.54 CCCCCNCCCCCB(O)O 2230a_100000209983_200009817188 [1,0,0,0,0,0|2,0,1]=4 1574 B13R0.54 CCCCCNCCCCCC(=O)N 2230a_100000209983_100009817443 [1,0,0,0,0,0|2,0,0]=3 1575 B13R0.54 CCCCCNCCCCCC(C)C 2230a_100000209983_100000210682 [1,0,0,0,0,0|2,0,1]=4 1576 B13R0.54 CCCCCNCCCCCC(C)C 2230a_100011290863_100000210326 [1,0,0,0,0,0|2,0,1]=4 1577 B13R0.54 CCCCCNCCCCCC(C)C 34a_100011290863_100000718602 [1,0,0,0,0,0|2,0,1]=4 1578 B13R0.54 CCCCCNCCCCNC(=O)C 2230a_200011368371_100000210326 [1,0,0,0,0,0|2,0,0]=3 1579 B13R0.54 CCCCCNCCCCNC(=O)C 34a_200011368371_100000718602 [1,0,0,0,0,0|2,0,0]=3 1580 B13R0.54 CCCCCNCCCCSC(=O)C 2230a_100000209983_200010402107 [1,0,0,0,0,0|2,0,0]=3 1581 B13R0.54 CCCCCNCCOCCC(=O)N 34a_100000224656_100000731001 [1,0,0,0,0,0|3,0,0]=4 1582 B13R0.54 CCCCCNCCOCOC(=O)C 34a_100000224656_100009813279 [1,0,0,0,0,0|3,0,0]=4 1583 B13R0.54 CCCCCOCCCCCB(O)O 34a_100000210253_200009817188 [1,0,0,0,0,0|2,0,1]=4 1584 B13R0.54 CCCCCOCCCCCB(O)O 7a_100000210253_200009817188 [1,0,0,0,0,0|2,0,1]=4 1585 B13R0.54 CCCCCOCCCCCC(=O)N 34a_100000123541_100000718602 [1,0,0,0,0,0|2,0,0]=3 1586 B13R0.54 CCCCCOCCCCCC(=O)N 34a_100000210253_100009817443 [1,0,0,0,0,0|2,0,0]=3 1587 B13R0.54 CCCCCOCCCCCC(=O)N 7a_100000123541_100000210326 [1,0,0,0,0,0|2,0,0]=3 1588 B13R0.54 CCCCCOCCCCCC(=O)N 7a_100000210253_100009817443 [1,0,0,0,0,0|2,0,0]=3 1589 B13R0.54 CCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210326 [1,0,0,0,0,0|1,0,1]=3 1590 B13R0.54 CCCCCOCCCCCC(C)C 34a_100000210253_100000210682 [1,0,0,0,0,0|2,0,1]=4 1591 B13R0.54 CCCCCOCCCCCC(C)C 34a_100011995859_100000718602 [1,0,0,0,0,0|2,0,1]=4 1592 B13R0.54 CCCCCOCCCCCC(C)C 7a_100000210253_100000210682 [1,0,0,0,0,0|2,0,1]=4 1593 B13R0.54 CCCCCOCCCCCC(C)C 7a_100011995859_100000210326 [1,0,0,0,0,0|2,0,1]=4 1594 B13R0.54 CCCCCOCCCCOC(=O)C 34a_100000073216_100000718602 [1,0,0,0,0,0|2,0,0]=3 1595 B13R0.54 CCCCCOCCCCOC(=O)C 34a_100000210253_100000033659 [1,0,0,0,0,0|2,0,0]=3 1596 B13R0.54 CCCCCOCCCCOC(=O)C 7a_100000073216_100000210326 [1,0,0,0,0,0|2,0,0]=3 1597 B13R0.54 CCCCCOCCCCOC(=O)C 7a_100000210253_100000033659 [1,0,0,0,0,0|2,0,0]=3 1598 B13R0.54 CCCCCOCCCCSC(=O)C 34a_100000210253_200010402107 [1,0,0,0,0,0|2,0,0]=3 1599 B13R0.54 CCCCCOCCCCSC(=O)C 7a_100000210253_200010402107 [1,0,0,0,0,0|2,0,0]=3 1600 B13R0.54 CCCCCOCCOCCC(=O)C 7a_100011215259_100000053229 [1,0,0,0,0,0|2,0,0]=3 1601 B13R0.54 CCCCCOCCOCCC(=O)N 34a_100011215259_100000731001 [1,0,0,0,0,0|3,0,0]=4 1602 B13R0.54 CCCCCOCCOCCC(=O)N 7a_100011215259_100000744528 [1,0,0,0,0,0|3,0,0]=4 1603 B13R0.54 CCCCCOCCOCOC(=O)C 34a_100011215259_100009813279 [1,0,0,0,0,0|3,0,0]=4 1604 B13R0.54 CCCCCOCOCCOC(=O)C 34a_100000210253_100000076355 [1,0,0,0,0,0|3,0,0]=4 1605 B13R0.54 CCCCCSCCCCCB(O)O 62a_100000210326_200009817188 [1,0,0,0,0,0|2,0,1]=4 1606 B13R0.54 CCCCCSCCCCCB(O)O 62a_200009817188_100000210326 [1,0,0,0,0,0|2,0,1]=4 1607 B13R0.54 CCCCCSCCCCCC(=O)N 62a_100000210326_100009817443 [1,0,0,0,0,0|2,0,0]=3 1608 B13R0.54 CCCCCSCCCCCC(=O)N 62a_100009817443_100000210326 [1,0,0,0,0,0|2,0,0]=3 1609 B13R0.54 CCCCCSCCCCCC(C)C 62a_100000210326_100000210682 [1,0,0,0,0,0|2,0,1]=4 1610 B13R0.54 CCCCCSCCCCCC(C)C 62a_100000210682_100000210326 [1,0,0,0,0,0|2,0,1]=4 1611 B13R0.54 CCCCCSCCCCOC(=O)C 62a_100000033659_100000210326 [1,0,0,0,0,0|2,0,0]=3 1612 B13R0.54 CCCCCSCCCCOC(=O)C 62a_100000210326_100000033659 [1,0,0,0,0,0|2,0,0]=3 1613 B13R0.54 CCCCCSCCCCSC(=O)C 62a_100000210326_200010402107 [1,0,0,0,0,0|2,0,0]=3 1614 B13R0.54 CCCCCSCCCCSC(=O)C 62a_200010402107_100000210326 [1,0,0,0,0,0|2,0,0]=3 1615 B13R0.54 CCCCCSCOCCOC(=O)C 62a_100000076355_100000210326 [1,0,0,0,0,0|3,0,0]=4 1616 B13R0.54 CCCCCSCOCCOC(=O)C 62a_100000210326_100000076355 [1,0,0,0,0,0|3,0,0]=4 1617 B13R0.54 CCCCNCCCCCCB(O)O 2230a_100000102301_100009817187 [1,0,0,0,0,0|2,0,1]=4 1618 B13R0.54 CCCCNCCCCCCB(O)O 7a_106832991798_100009817187 [1,0,0,0,0,0|2,0,1]=4 1619 B13R0.54 CCCCNCCCCCCC(C)C 2230a_100000211014_100000210211 [1,0,0,0,0,0|2,0,1]=4 1620 B13R0.54 CCCCNCCCCCCC(C)C 34a_100000211014_100000210210 [1,0,0,0,0,0|2,0,1]=4 1621 B13R0.54 CCCCNCCCCCNC(=O)C 2230a_200012022750_100000210211 [1,0,0,0,0,0|2,0,0]=3 1622 B13R0.54 CCCCNCCCCCNC(=O)C 34a_200012022750_100000210210 [1,0,0,0,0,0|2,0,0]=3 1623 B13R0.54 CCCCNCCCCCOC(=O)C 2230a_100000102301_100009813381 [1,0,0,0,0,0|2,0,0]=3 1624 B13R0.54 CCCCNCCCCCOC(=O)C 7a_106832991798_100000033007 [1,0,0,0,0,0|2,0,0]=3 1625 B13R0.54 CCCCNCCCCOCC(=O)N 34a_200011216965_100000187820 [1,0,0,0,0,0|3,0,0]=4 1626 B13R0.54 CCCCNCCCCOCC(=O)[O-] 34a_200011216965_100020667443 [1,0,0,0,0,0|2,0,1]=4 1627 B13R0.54 CCCCNCCOCCOC(=O)C 2230a_100000102301_200000083610 [1,0,0,0,0,0|3,0,0]=4 1628 B13R0.54 CCCCNCCOCCOC(=O)C 7a_106832991798_200000083610 [1,0,0,0,0,0|3,0,0]=4 1629 B13R0.54 CCCCOCCCCCCB(O)O 34a_100000210227_100009817187 [1,0,0,0,0,0|2,0,1]=4 1630 B13R0.54 CCCCOCCCCCCB(O)O 7a_100000210227_100009817187 [1,0,0,0,0,0|2,0,1]=4 1631 B13R0.54 CCCCOCCCCCOC(=O)C 34a_100000210227_100000033007 [1,0,0,0,0,0|2,0,0]=3 1632 B13R0.54 CCCCOCCCCCOC(=O)C 7a_100000210227_100000033007 [1,0,0,0,0,0|2,0,0]=3 1633 B13R0.54 CCCCOCCCCOCC(=O)N 34a_200000760531_100000187820 [1,0,0,0,0,0|3,0,0]=4 1634 B13R0.54 CCCCOCCCCOCC(=O)N 7a_200000760531_100000187820 [1,0,0,0,0,0|3,0,0]=4 1635 B13R0.54 CCCCOCCCCOCC(=O)[O-] 34a_200000760531_100020667443 [1,0,0,0,0,0|2,0,1]=4 1636 B13R0.54 CCCCOCCCNCCC(=O)N 2230a_200000211371_100000744528 [1,0,0,0,0,0|3,0,0]=4 1637 B13R0.54 CCCCOCCCNCCC(=O)N 34a_200000211371_100000731001 [1,0,0,0,0,0|3,0,0]=4 1638 B13R0.54 CCCCOCCCNCOC(=O)C 34a_200000211371_100009813279 [1,0,0,0,0,0|3,0,0]=4 1639 B13R0.54 CCCCOCCCOCCC(=O)C 7a_200011215613_100000053229 [1,0,0,0,0,0|2,0,0]=3 1640 B13R0.54 CCCCOCCCOCCC(=O)N 34a_200011215613_100000731001 [1,0,0,0,0,0|3,0,0]=4 1641 B13R0.54 CCCCOCCCOCCC(=O)N 7a_200011215613_100000744528 [1,0,0,0,0,0|3,0,0]=4 1642 B13R0.54 CCCCOCCCOCOC(=O)C 34a_200011215613_100009813279 [1,0,0,0,0,0|3,0,0]=4 1643 B13R0.54 CCCCOCCNCCCC(=O)N 34a_100000739312_100000743108 [1,0,0,0,0,0|3,0,0]=4 1644 B13R0.54 CCCCOCCNCCCS(=O)C 2230a_200000753449_100000743108 [1,0,0,0,0,0|3,0,0]=4 1645 B13R0.54 CCCCOCCNCCNC(=O)C 2230a_100000209853_100000743108 [1,0,0,0,0,0|3,0,0]=4 1646 B13R0.54 CCCCOCCOCCCC(=O)C 34a_100000210238_100000685027 [1,0,0,0,0,0|2,0,0]=3 1647 B13R0.54 CCCCOCCOCCCC(=O)C 34a_100000759063_100000743108 [1,0,0,0,0,0|2,0,0]=3 1648 B13R0.54 CCCCOCCOCCCC(=O)C 7a_100000210238_100011215641 [1,0,0,0,0,0|2,0,0]=3 1649 B13R0.54 CCCCOCCOCCCC(=O)C 7a_100000759063_100000743108 [1,0,0,0,0,0|2,0,0]=3 1650 B13R0.54 CCCCOCCOCCCC(=O)N 34a_100000210238_100102525003 [1,0,0,0,0,0|3,0,0]=4 1651 B13R0.54 CCCCOCCOCCCC(=O)N 7a_100000210238_100102525003 [1,0,0,0,0,0|3,0,0]=4 1652 B13R0.54 CCCCOCCOCCNC(=O)C 34a_100000158858_100000743108 [1,0,0,0,0,0|3,0,0]=4 1653 B13R0.54 CCCCOCCOCCNC(=O)C 7a_100000210238_100000189650 [1,0,0,0,0,0|3,0,0]=4 1654 B13R0.54 CCCCOCCOCCOC(=O)C 34a_100000210227_200000083610 [1,0,0,0,0,0|3,0,0]=4 1655 B13R0.54 CCCCOCCOCCOC(=O)C 34a_100000210238_100009814007 [1,0,0,0,0,0|3,0,0]=4 1656 B13R0.54 CCCCOCCOCCOC(=O)C 7a_100000210227_200000083610 [1,0,0,0,0,0|3,0,0]=4 1657 B13R0.54 CCCCOCCOCCOC(=O)C 7a_100000210238_100009814007 [1,0,0,0,0,0|3,0,0]=4 1658 B13R0.54 CCCCOCCSCCCC(=O)C 62a_100000743108_100011215641 [1,0,0,0,0,0|2,0,0]=3 1659 B13R0.54 CCCCOCCSCCCC(=O)C 62a_100011215641_100000743108 [1,0,0,0,0,0|2,0,0]=3 1660 B13R0.54 CCCCOCCSCCCC(=O)N 62a_100000743108_100102525003 [1,0,0,0,0,0|3,0,0]=4 1661 B13R0.54 CCCCOCCSCCCC(=O)N 62a_100102525003_100000743108 [1,0,0,0,0,0|3,0,0]=4 1662 B13R0.54 CCCCOCCSCCNC(=O)C 62a_100000189650_100000743108 [1,0,0,0,0,0|3,0,0]=4 1663 B13R0.54 CCCCOCCSCCNC(=O)C 62a_100000743108_100000189650 [1,0,0,0,0,0|3,0,0]=4 1664 B13R0.54 CCCCOCCSCCOC(=O)C 62a_100000743108_100009814007 [1,0,0,0,0,0|3,0,0]=4 1665 B13R0.54 CCCCOCCSCCOC(=O)C 62a_100009814007_100000743108 [1,0,0,0,0,0|3,0,0]=4 1666 B13R0.54 CCCCOCNCCCCC(=O)N 34a_100000696515_100011995733 [1,0,0,0,0,0|3,0,0]=4 1667 B13R0.54 CCCCOCNCCCNC(=O)C 34a_100000736810_100011995733 [1,0,0,0,0,0|3,0,0]=4 1668 B13R0.54 CCCCOCNCCOCC(=O)O 269956a_100000700818_100011995733 [1,0,0,0,0,0|3,0,0]=4 1669 B13R0.54 CCCCOCOCCCCC(=O)N 34a_100012022536_100011995733 [1,0,0,0,0,0|3,0,0]=4 1670 B13R0.54 CCCCOCOCCCNC(=O)C 34a_100000752032_100011995733 [1,0,0,0,0,0|3,0,0]=4 1671 B13R0.54 CCCCOCSCCCCC(=O)C 62a_100000735457_100011995733 [1,0,0,0,0,0|2,0,0]=3 1672 B13R0.54 CCCCOCSCCCCC(=O)C 62a_100011995733_100000735457 [1,0,0,0,0,0|2,0,0]=3 1673 B13R0.54 CCCCOCSCCCOC(=O)C 62a_100000042594_100011995733 [1,0,0,0,0,0|3,0,0]=4 1674 B13R0.54 CCCCOCSCCCOC(=O)C 62a_100011995733_100000042594 [1,0,0,0,0,0|3,0,0]=4 1675 B13R0.54 CCCCOCSCCCSC(=O)C 62a_100000038929_100011995733 [1,0,0,0,0,0|3,0,0]=4 1676 B13R0.54 CCCCOCSCCCSC(=O)C 62a_100011995733_100000038929 [1,0,0,0,0,0|3,0,0]=4 1677 B13R0.54 CCCCSCCCCCCB(O)O 62a_100000210211_100009817187 [1,0,0,0,0,0|2,0,1]=4 1678 B13R0.54 CCCCSCCCCCCB(O)O 62a_100009817187_100000210210 [1,0,0,0,0,0|2,0,1]=4 1679 B13R0.54 CCCCSCCCCCOC(=O)C 62a_100000033007_100000210210 [1,0,0,0,0,0|2,0,0]=3 1680 B13R0.54 CCCCSCCCCCOC(=O)C 62a_100000210211_100000033007 [1,0,0,0,0,0|2,0,0]=3 1681 B13R0.54 CCCCSCCNCCNC(=O)C 2230a_100025743550_100000189650 [1,0,0,0,0,0|3,0,0]=4 1682 B13R0.54 CCCCSCCOCCCC(=O)C 34a_200000230436_100000685027 [1,0,0,0,0,0|2,0,0]=3 1683 B13R0.54 CCCCSCCOCCCC(=O)C 7a_200000230436_100011215641 [1,0,0,0,0,0|2,0,0]=3 1684 B13R0.54 CCCCSCCOCCCC(=O)N 34a_200000230436_100102525003 [1,0,0,0,0,0|3,0,0]=4 1685 B13R0.54 CCCCSCCOCCCC(=O)N 7a_200000230436_100102525003 [1,0,0,0,0,0|3,0,0]=4 1686 B13R0.54 CCCCSCCOCCNC(=O)C 7a_200000230436_100000189650 [1,0,0,0,0,0|3,0,0]=4 1687 B13R0.54 CCCCSCCOCCOC(=O)C 34a_200000230436_100009814007 [1,0,0,0,0,0|3,0,0]=4 1688 B13R0.54 CCCCSCCOCCOC(=O)C 62a_100000210211_200000083610 [1,0,0,0,0,0|3,0,0]=4 1689 B13R0.54 CCCCSCCOCCOC(=O)C 62a_200000083610_100000210210 [1,0,0,0,0,0|3,0,0]=4 1690 B13R0.54 CCCCSCCOCCOC(=O)C 7a_200000230436_100009814007 [1,0,0,0,0,0|3,0,0]=4 1691 B13R0.54 CCCNCCCCCCNC(=O)C 2230a_200011996284_100000210303 [1,0,0,0,0,0|2,0,0]=3 1692 B13R0.54 CCCNCCCCCCNC(=O)C 34a_200011996284_100000210303 [1,0,0,0,0,0|2,0,0]=3 1693 B13R0.54 CCCNCCOCCOCC(=O)O 269956a_100009854275_100000210207 [1,0,0,0,0,0|3,0,0]=4 1694 B13R0.54 CCCOCCCCCCCC(C)C 34a_200000210741_100000210303 [1,0,0,0,0,0|2,0,1]=4 1695 B13R0.54 CCCOCCCCCCCC(C)C 7a_200000210741_100000210303 [1,0,0,0,0,0|2,0,1]=4 1696 B13R0.54 CCCOCCCNCCCC(=O)C 34a_100011217757_100000685027 [1,0,0,0,0,0|2,0,0]=3 1697 B13R0.54 CCCOCCCNCCCC(=O)N 34a_100011217757_100102525003 [1,0,0,0,0,0|3,0,0]=4 1698 B13R0.54 CCCOCCCNCCNC(=O)C 2230a_100011217757_100000189650 [1,0,0,0,0,0|3,0,0]=4 1699 B13R0.54 CCCOCCCNCCOC(=O)C 34a_100011217757_100009814007 [1,0,0,0,0,0|3,0,0]=4 1700 B13R0.54 CCCOCCNCCCCC(=O)C 34a_100161115042_100009817362 [1,0,0,0,0,0|2,0,0]=3 1701 B13R0.54 CCCOCCNCCCCC(=O)N 34a_100000696515_100011215938 [1,0,0,0,0,0|3,0,0]=4 1702 B13R0.54 CCCOCCNCCCNC(=O)C 34a_100000736810_100011215938 [1,0,0,0,0,0|3,0,0]=4 1703 B13R0.54 CCCOCCNCCCOC(=O)C 34a_100161115042_100000042594 [1,0,0,0,0,0|3,0,0]=4 1704 B13R0.54 CCCOCCNCCCSC(=O)C 2230a_100161115042_100000038929 [1,0,0,0,0,0|3,0,0]=4 1705 B13R0.54 CCCOCCNCCCSC(=O)C 34a_100161115042_100000038929 [1,0,0,0,0,0|3,0,0]=4 1706 B13R0.54 CCCOCCNCCOCC(=O)O 269956a_100000700818_100011215938 [1,0,0,0,0,0|3,0,0]=4 1707 B13R0.54 CCCOCCOCCCCC(=O)C 34a_100000752267_100009817362 [1,0,0,0,0,0|2,0,0]=3 1708 B13R0.54 CCCOCCOCCCCC(=O)C 7a_100000752267_100000735457 [1,0,0,0,0,0|2,0,0]=3 1709 B13R0.54 CCCOCCOCCCCC(=O)N 34a_100012022536_100011215938 [1,0,0,0,0,0|3,0,0]=4 1710 B13R0.54 CCCOCCOCCCCC(=O)N 7a_100012022536_100011215938 [1,0,0,0,0,0|3,0,0]=4 1711 B13R0.54 CCCOCCOCCCNC(=O)C 34a_100000752032_100011215938 [1,0,0,0,0,0|3,0,0]=4 1712 B13R0.54 CCCOCCOCCCOC(=O)C 34a_100000752267_100000042594 [1,0,0,0,0,0|3,0,0]=4 1713 B13R0.54 CCCOCCOCCCOC(=O)C 7a_100000752267_100000042594 [1,0,0,0,0,0|3,0,0]=4 1714 B13R0.54 CCCOCCOCCCSC(=O)C 34a_100000752267_100000038929 [1,0,0,0,0,0|3,0,0]=4 1715 B13R0.54 CCCOCCOCCCSC(=O)C 7a_100000752267_100000038929 [1,0,0,0,0,0|3,0,0]=4 1716 B13R0.54 CCCOCCSCCCCC(=O)C 62a_100000735457_100011215938 [1,0,0,0,0,0|2,0,0]=3 1717 B13R0.54 CCCOCCSCCCCC(=O)C 62a_100011215938_100000735457 [1,0,0,0,0,0|2,0,0]=3 1718 B13R0.54 CCCOCCSCCCOC(=O)C 62a_100000042594_100011215938 [1,0,0,0,0,0|3,0,0]=4 1719 B13R0.54 CCCOCCSCCCOC(=O)C 62a_100011215938_100000042594 [1,0,0,0,0,0|3,0,0]=4 1720 B13R0.54 CCCOCCSCCCSC(=O)C 62a_100000038929_100011215938 [1,0,0,0,0,0|3,0,0]=4 1721 B13R0.54 CCCOCCSCCCSC(=O)C 62a_100011215938_100000038929 [1,0,0,0,0,0|3,0,0]=4 1722 B13R0.54 CCCSCCNCCCSC(=O)C 2230a_100020603323_100000038929 [1,0,0,0,0,0|3,0,0]=4 1723 B13R0.54 CCCSCCOCCCCC(=O)C 34a_200000230433_100009817362 [1,0,0,0,0,0|2,0,0]=3 1724 B13R0.54 CCCSCCOCCCCC(=O)C 7a_200000230433_100000735457 [1,0,0,0,0,0|2,0,0]=3 1725 B13R0.54 CCCSCCOCCCOC(=O)C 34a_200000230433_100000042594 [1,0,0,0,0,0|3,0,0]=4 1726 B13R0.54 CCCSCCOCCCOC(=O)C 7a_200000230433_100000042594 [1,0,0,0,0,0|3,0,0]=4 1727 B13R0.54 CCCSCCOCCCSC(=O)C 34a_200000230433_100000038929 [1,0,0,0,0,0|3,0,0]=4 1728 B13R0.54 CCCSCCOCCCSC(=O)C 7a_200000230433_100000038929 [1,0,0,0,0,0|3,0,0]=4 1729 B13R0.54 CCOCCCNCCCCC(=O)C 34a_100000210961_100009817362 [1,0,0,0,0,0|2,0,0]=3 1730 B13R0.54 CCOCCCNCCCCC(=O)N 34a_100000696515_100012232248 [1,0,0,0,0,0|3,0,0]=4 1731 B13R0.54 CCOCCCNCCCNC(=O)C 34a_100000736810_100012232248 [1,0,0,0,0,0|3,0,0]=4 1732 B13R0.54 CCOCCCNCCCOC(=O)C 34a_100000210961_100000042594 [1,0,0,0,0,0|3,0,0]=4 1733 B13R0.54 CCOCCCNCCCSC(=O)C 2230a_100000210961_100000038929 [1,0,0,0,0,0|3,0,0]=4 1734 B13R0.54 CCOCCCNCCCSC(=O)C 34a_100000210961_100000038929 [1,0,0,0,0,0|3,0,0]=4 1735 B13R0.54 CCOCCCNCCOCC(=O)O 269956a_100000700818_100012232248 [1,0,0,0,0,0|3,0,0]=4 1736 B13R0.54 CCOCCCOCCCCC(=O)C 34a_100000757476_100009817362 [1,0,0,0,0,0|2,0,0]=3 1737 B13R0.54 CCOCCCOCCCCC(=O)C 7a_100000757476_100000735457 [1,0,0,0,0,0|2,0,0]=3 1738 B13R0.54 CCOCCCOCCCCC(=O)N 34a_100012022536_100012232248 [1,0,0,0,0,0|3,0,0]=4 1739 B13R0.54 CCOCCCOCCCCC(=O)N 7a_100012022536_100012232248 [1,0,0,0,0,0|3,0,0]=4 1740 B13R0.54 CCOCCCOCCCNC(=O)C 34a_100000752032_100012232248 [1,0,0,0,0,0|3,0,0]=4 1741 B13R0.54 CCOCCCOCCCOC(=O)C 34a_100000757476_100000042594 [1,0,0,0,0,0|3,0,0]=4 1742 B13R0.54 CCOCCCOCCCOC(=O)C 7a_100000757476_100000042594 [1,0,0,0,0,0|3,0,0]=4 1743 B13R0.54 CCOCCCOCCCSC(=O)C 34a_100000757476_100000038929 [1,0,0,0,0,0|3,0,0]=4 1744 B13R0.54 CCOCCCOCCCSC(=O)C 7a_100000757476_100000038929 [1,0,0,0,0,0|3,0,0]=4 1745 B13R0.54 CCOCCCSCCCCC(=O)C 62a_100000735457_100012232248 [1,0,0,0,0,0|2,0,0]=3 1746 B13R0.54 CCOCCCSCCCCC(=O)C 62a_100012232248_100000735457 [1,0,0,0,0,0|2,0,0]=3 1747 B13R0.54 CCOCCCSCCCOC(=O)C 62a_100000042594_100012232248 [1,0,0,0,0,0|3,0,0]=4 1748 B13R0.54 CCOCCCSCCCOC(=O)C 62a_100012232248_100000042594 [1,0,0,0,0,0|3,0,0]=4 1749 B13R0.54 CCOCCCSCCCSC(=O)C 62a_100000038929_100012232248 [1,0,0,0,0,0|3,0,0]=4 1750 B13R0.54 CCOCCCSCCCSC(=O)C 62a_100012232248_100000038929 [1,0,0,0,0,0|3,0,0]=4 1751 B13R0.54 CCOCCNCCCCCC(=O)N 2230a_102516460346_100009817443 [1,0,0,0,0,0|3,0,0]=4 1752 B13R0.54 CCOCCNCCCCCC(=O)N 34a_102516460346_100009817443 [1,0,0,0,0,0|3,0,0]=4 1753 B13R0.54 CCOCCNCCCCNC(=O)C 2230a_200011368371_100011215890 [1,0,0,0,0,0|3,0,0]=4 1754 B13R0.54 CCOCCNCCCCNC(=O)C 34a_200011368371_100000210147 [1,0,0,0,0,0|3,0,0]=4 1755 B13R0.54 CCOCCNCCCCOC(=O)C 34a_102516460346_100000033659 [1,0,0,0,0,0|3,0,0]=4 1756 B13R0.54 CCOCCNCCCCSC(=O)C 2230a_102516460346_200010402107 [1,0,0,0,0,0|3,0,0]=4 1757 B13R0.54 CCOCCNCCCCSC(=O)C 34a_102516460346_200010402107 [1,0,0,0,0,0|3,0,0]=4 1758 B13R0.54 CCOCCOCCCCCC(=O)N 34a_100000123541_100000210147 [1,0,0,0,0,0|3,0,0]=4 1759 B13R0.54 CCOCCOCCCCCC(=O)N 34a_100000210136_100009817443 [1,0,0,0,0,0|3,0,0]=4 1760 B13R0.54 CCOCCOCCCCCC(=O)N 7a_100000123541_100011215890 [1,0,0,0,0,0|3,0,0]=4 1761 B13R0.54 CCOCCOCCCCCC(=O)N 7a_100000210136_100009817443 [1,0,0,0,0,0|3,0,0]=4 1762 B13R0.54 CCOCCOCCCCCC(=O)[O-] 7a_100102619762_100011215890 [1,0,0,0,0,0|2,0,1]=4 1763 B13R0.54 CCOCCOCCCCOC(=O)C 34a_100000073216_100000210147 [1,0,0,0,0,0|3,0,0]=4 1764 B13R0.54 CCOCCOCCCCOC(=O)C 34a_100000210136_100000033659 [1,0,0,0,0,0|3,0,0]=4 1765 B13R0.54 CCOCCOCCCCOC(=O)C 7a_100000073216_100011215890 [1,0,0,0,0,0|3,0,0]=4 1766 B13R0.54 CCOCCOCCCCOC(=O)C 7a_100000210136_100000033659 [1,0,0,0,0,0|3,0,0]=4 1767 B13R0.54 CCOCCOCCCCSC(=O)C 34a_100000210136_200010402107 [1,0,0,0,0,0|3,0,0]=4 1768 B13R0.54 CCOCCOCCCCSC(=O)C 7a_100000210136_200010402107 [1,0,0,0,0,0|3,0,0]=4 1769 B13R0.54 CCOCCOCCOCCC(=O)C 34a_100000759926_100011211534 [1,0,0,0,0,0|3,0,0]=4 1770 B13R0.54 CCOCCOCCOCCC(=O)C 7a_100000210240_100000053229 [1,0,0,0,0,0|3,0,0]=4 1771 B13R0.54 CCOCCOCCOCCC(=O)C 7a_100000759926_100011211534 [1,0,0,0,0,0|3,0,0]=4 1772 B13R0.54 CCOCCOCCSCCC(=O)C 62a_100000053229_100011211534 [1,0,0,0,0,0|3,0,0]=4 1773 B13R0.54 CCOCCOCCSCCC(=O)C 62a_100011211534_100000053229 [1,0,0,0,0,0|3,0,0]=4 1774 B13R0.54 CCOCCSCCCCCC(=O)N 62a_100000210147_100009817443 [1,0,0,0,0,0|3,0,0]=4 1775 B13R0.54 CCOCCSCCCCCC(=O)N 62a_100009817443_100011215890 [1,0,0,0,0,0|3,0,0]=4 1776 B13R0.54 CCOCCSCCCCOC(=O)C 62a_100000033659_100011215890 [1,0,0,0,0,0|3,0,0]=4 1777 B13R0.54 CCOCCSCCCCOC(=O)C 62a_100000210147_100000033659 [1,0,0,0,0,0|3,0,0]=4 1778 B13R0.54 CCOCCSCCCCSC(=O)C 62a_100000210147_200010402107 [1,0,0,0,0,0|3,0,0]=4 1779 B13R0.54 CCOCCSCCCCSC(=O)C 62a_200010402107_100011215890 [1,0,0,0,0,0|3,0,0]=4 1780 B13R0.54 CCOCSCCCCCOC(=O)C 62a_100000033007_100000739092 [1,0,0,0,0,0|3,0,0]=4 1781 B13R0.54 CCOCSCCCCCOC(=O)C 62a_100000739092_100000033007 [1,0,0,0,0,0|3,0,0]=4 1782 B13R0.54 CCSCCCOCCCCC(=O)C 34a_100011216438_100009817362 [1,0,0,0,0,0|2,0,0]=3 1783 B13R0.54 CCSCCCOCCCCC(=O)C 7a_100011216438_100000735457 [1,0,0,0,0,0|2,0,0]=3 1784 B13R0.54 CCSCCCOCCCOC(=O)C 34a_100011216438_100000042594 [1,0,0,0,0,0|3,0,0]=4 1785 B13R0.54 CCSCCCOCCCOC(=O)C 7a_100011216438_100000042594 [1,0,0,0,0,0|3,0,0]=4 1786 B13R0.54 CCSCCCOCCCSC(=O)C 34a_100011216438_100000038929 [1,0,0,0,0,0|3,0,0]=4 1787 B13R0.54 CCSCCCOCCCSC(=O)C 7a_100011216438_100000038929 [1,0,0,0,0,0|3,0,0]=4 1788 B13R0.54 CCSCCNCCCCCC(=O)N 2230a_100000106463_100009817443 [1,0,0,0,0,0|3,0,0]=4 1789 B13R0.54 CCSCCNCCCCNC(=O)C 2230a_200011368371_100000757381 [1,0,0,0,0,0|3,0,0]=4 1790 B13R0.54 CCSCCNCCCCNC(=O)C 34a_200011368371_100000757381 [1,0,0,0,0,0|3,0,0]=4 1791 B13R0.54 CCSCCNCCCCSC(=O)C 2230a_100000106463_200010402107 [1,0,0,0,0,0|3,0,0]=4 1792 B13R0.54 CCSCCOCCCCCC(=O)N 34a_100000123541_100000757381 [1,0,0,0,0,0|3,0,0]=4 1793 B13R0.54 CCSCCOCCCCCC(=O)N 34a_100000212035_100009817443 [1,0,0,0,0,0|3,0,0]=4 1794 B13R0.54 CCSCCOCCCCCC(=O)N 7a_100000123541_100000757381 [1,0,0,0,0,0|3,0,0]=4 1795 B13R0.54 CCSCCOCCCCCC(=O)N 7a_100000212035_100009817443 [1,0,0,0,0,0|3,0,0]=4 1796 B13R0.54 CCSCCOCCCCCC(=O)[O-] 7a_100102619762_100000757381 [1,0,0,0,0,0|2,0,1]=4 1797 B13R0.54 CCSCCOCCCCOC(=O)C 34a_100000073216_100000757381 [1,0,0,0,0,0|3,0,0]=4 1798 B13R0.54 CCSCCOCCCCOC(=O)C 34a_100000212035_100000033659 [1,0,0,0,0,0|3,0,0]=4 1799 B13R0.54 CCSCCOCCCCOC(=O)C 7a_100000073216_100000757381 [1,0,0,0,0,0|3,0,0]=4 1800 B13R0.54 CCSCCOCCCCOC(=O)C 7a_100000212035_100000033659 [1,0,0,0,0,0|3,0,0]=4 1801 B13R0.54 CCSCCOCCCCSC(=O)C 34a_100000212035_200010402107 [1,0,0,0,0,0|3,0,0]=4 1802 B13R0.54 CCSCCOCCCCSC(=O)C 7a_100000212035_200010402107 [1,0,0,0,0,0|3,0,0]=4 1803 B13R0.54 CCSCCSCCCCCC(=O)N 62a_100000757381_100009817443 [1,0,0,0,0,0|3,0,0]=4 1804 B13R0.54 CCSCCSCCCCCC(=O)N 62a_100009817443_100000757381 [1,0,0,0,0,0|3,0,0]=4 1805 B13R0.54 CCSCCSCCCCOC(=O)C 62a_100000033659_100000757381 [1,0,0,0,0,0|3,0,0]=4 1806 B13R0.54 CCSCCSCCCCOC(=O)C 62a_100000757381_100000033659 [1,0,0,0,0,0|3,0,0]=4 1807 B13R0.54 CCSCCSCCCCSC(=O)C 62a_100000757381_200010402107 [1,0,0,0,0,0|3,0,0]=4 1808 B13R0.54 CCSCCSCCCCSC(=O)C 62a_200010402107_100000757381 [1,0,0,0,0,0|3,0,0]=4 1809 B13R0.54 CN(C)CCCCCCCCCCO 2230a_100102631434_100009813290 [1,0,0,0,0,0|3,0,0]=4 1810 B13R0.54 CN(C)CCCCCCCCCCO 269982a_100102631434_100009813290 [1,0,0,0,0,0|3,0,0]=4 1811 B13R0.54 CNCCCCCOCCCC(=O)C 34a_100000722520_100000685027 [1,0,0,0,0,0|2,0,0]=3 1812 B13R0.54 CNCCCCCOCCCC(=O)N 34a_100000722520_100102525003 [1,0,0,0,0,0|3,0,0]=4 1813 B13R0.54 CNCCCCCOCCOC(=O)C 34a_100000722520_100009814007 [1,0,0,0,0,0|3,0,0]=4 1814 B13R0.54 CNCCCOCCCCCC(=O)N 34a_100000213112_100009817443 [1,0,0,0,0,0|3,0,0]=4 1815 B13R0.54 CNCCCOCCCCOC(=O)C 34a_100000213112_100000033659 [1,0,0,0,0,0|3,0,0]=4 1816 B13R0.54 CNCCCOCCCCSC(=O)C 34a_100000213112_200010402107 [1,0,0,0,0,0|3,0,0]=4 1817 B13R0.54 CNCCOCCOCCCC(=O)C 34a_100000228057_100000685027 [1,0,0,0,0,0|3,0,0]=4 1818 B13R0.54 COCCCCCCNOCC(=O)O 269956a_100000106656_100011998445 [1,0,0,0,0,0|3,0,0]=4 1819 B13R0.54 COCCCCCCOCCC(=O)C 34a_100000759926_100011998445 [1,0,0,0,0,0|2,0,0]=3 1820 B13R0.54 COCCCCCCOCCC(=O)C 7a_100000759926_100011998445 [1,0,0,0,0,0|2,0,0]=3 1821 B13R0.54 COCCCCCCOCCC(=O)C 7a_200012092642_100000053229 [1,0,0,0,0,0|2,0,0]=3 1822 B13R0.54 COCCCCCCOCCC(=O)N 34a_100000757172_100011998445 [1,0,0,0,0,0|3,0,0]=4 1823 B13R0.54 COCCCCCCOCCC(=O)N 34a_200012092642_100000731001 [1,0,0,0,0,0|3,0,0]=4 1824 B13R0.54 COCCCCCCOCCC(=O)N 7a_100000757172_100011998445 [1,0,0,0,0,0|3,0,0]=4 1825 B13R0.54 COCCCCCCOCCC(=O)N 7a_200012092642_100000744528 [1,0,0,0,0,0|3,0,0]=4 1826 B13R0.54 COCCCCCCOCOC(=O)C 34a_200012092642_100009813279 [1,0,0,0,0,0|3,0,0]=4 1827 B13R0.54 COCCCCCCSCCC(=O)C 62a_100000053229_100011998445 [1,0,0,0,0,0|2,0,0]=3 1828 B13R0.54 COCCCCCCSCCC(=O)C 62a_100011998445_100000053229 [1,0,0,0,0,0|2,0,0]=3 1829 B13R0.54 COCCCCCCSCCC(=O)N 62a_100000744528_100011998445 [1,0,0,0,0,0|3,0,0]=4 1830 B13R0.54 COCCCCCCSCCC(=O)N 62a_100011998445_100000744528 [1,0,0,0,0,0|3,0,0]=4 1831 B13R0.54 COCCCCCCSCOC(=O)C 62a_100000076356_100011998445 [1,0,0,0,0,0|3,0,0]=4 1832 B13R0.54 COCCCCCCSCOC(=O)C 62a_100011998445_100000076356 [1,0,0,0,0,0|3,0,0]=4 1833 B13R0.54 COCCCCCNCCCC(=O)C 34a_100000747528_100000685027 [1,0,0,0,0,0|2,0,0]=3 1834 B13R0.54 COCCCCCNCCCC(=O)N 34a_100000747528_100102525003 [1,0,0,0,0,0|3,0,0]=4 1835 B13R0.54 COCCCCCNCCNC(=O)C 2230a_100000747528_100000189650 [1,0,0,0,0,0|3,0,0]=4 1836 B13R0.54 COCCCCCNCCOC(=O)C 34a_100000747528_100009814007 [1,0,0,0,0,0|3,0,0]=4 1837 B13R0.54 COCCCCNCCCCC(=O)N 34a_100000696515_100000755781 [1,0,0,0,0,0|3,0,0]=4 1838 B13R0.54 COCCCCNCCCNC(=O)C 34a_100000736810_100000755781 [1,0,0,0,0,0|3,0,0]=4 1839 B13R0.54 COCCCCNCCOCC(=O)O 269956a_100000700818_100000730899 [1,0,0,0,0,0|3,0,0]=4 1840 B13R0.54 COCCCCOCCCCC(=O)C 34a_100000740925_100009817362 [1,0,0,0,0,0|2,0,0]=3 1841 B13R0.54 COCCCCOCCCCC(=O)N 34a_100012022536_100000755781 [1,0,0,0,0,0|3,0,0]=4 1842 B13R0.54 COCCCCOCCCCC(=O)N 7a_100012022536_100000730899 [1,0,0,0,0,0|3,0,0]=4 1843 B13R0.54 COCCCCOCCCNC(=O)C 34a_100000752032_100000755781 [1,0,0,0,0,0|3,0,0]=4 1844 B13R0.54 COCCCCOCCCOC(=O)C 34a_100000740925_100000042594 [1,0,0,0,0,0|3,0,0]=4 1845 B13R0.54 COCCCCOCCCSC(=O)C 34a_100000740925_100000038929 [1,0,0,0,0,0|3,0,0]=4 1846 B13R0.54 COCCCCSCCCCC(=O)C 62a_100000730899_100000735457 [1,0,0,0,0,0|2,0,0]=3 1847 B13R0.54 COCCCCSCCCCC(=O)C 62a_100000735457_100000730899 [1,0,0,0,0,0|2,0,0]=3 1848 B13R0.54 COCCCCSCCCOC(=O)C 62a_100000042594_100000730899 [1,0,0,0,0,0|3,0,0]=4 1849 B13R0.54 COCCCCSCCCOC(=O)C 62a_100000730899_100000042594 [1,0,0,0,0,0|3,0,0]=4 1850 B13R0.54 COCCCCSCCCSC(=O)C 62a_100000038929_100000730899 [1,0,0,0,0,0|3,0,0]=4 1851 B13R0.54 COCCCCSCCCSC(=O)C 62a_100000730899_100000038929 [1,0,0,0,0,0|3,0,0]=4 1852 B13R0.54 COCCCNCCCCCC(=O)N 34a_100150723488_100009817443 [1,0,0,0,0,0|3,0,0]=4 1853 B13R0.54 COCCCNCCCCNC(=O)C 2230a_200011368371_100000740836 [1,0,0,0,0,0|3,0,0]=4 1854 B13R0.54 COCCCNCCCCNC(=O)C 34a_200011368371_100000740836 [1,0,0,0,0,0|3,0,0]=4 1855 B13R0.54 COCCCNCCCCOC(=O)C 34a_100150723488_100000033659 [1,0,0,0,0,0|3,0,0]=4 1856 B13R0.54 COCCCNCCCCSC(=O)C 34a_100150723488_200010402107 [1,0,0,0,0,0|3,0,0]=4 1857 B13R0.54 COCCCOCCCCCC(=O)N 34a_100000123541_100000740836 [1,0,0,0,0,0|3,0,0]=4 1858 B13R0.54 COCCCOCCCCCC(=O)N 34a_100000740835_100009817443 [1,0,0,0,0,0|3,0,0]=4 1859 B13R0.54 COCCCOCCCCCC(=O)N 7a_100000123541_100000740836 [1,0,0,0,0,0|3,0,0]=4 1860 B13R0.54 COCCCOCCCCCC(=O)[O-] 7a_100102619762_100000740836 [1,0,0,0,0,0|2,0,1]=4 1861 B13R0.54 COCCCOCCCCOC(=O)C 34a_100000073216_100000740836 [1,0,0,0,0,0|3,0,0]=4 1862 B13R0.54 COCCCOCCCCOC(=O)C 34a_100000740835_100000033659 [1,0,0,0,0,0|3,0,0]=4 1863 B13R0.54 COCCCOCCCCOC(=O)C 7a_100000073216_100000740836 [1,0,0,0,0,0|3,0,0]=4 1864 B13R0.54 COCCCOCCCCSC(=O)C 34a_100000740835_200010402107 [1,0,0,0,0,0|3,0,0]=4 1865 B13R0.54 COCCCSCCCCCC(=O)N 62a_100000709357_100009817443 [1,0,0,0,0,0|3,0,0]=4 1866 B13R0.54 COCCCSCCCCCC(=O)N 62a_100009817443_100000709357 [1,0,0,0,0,0|3,0,0]=4 1867 B13R0.54 COCCCSCCCCOC(=O)C 62a_100000033659_100000709357 [1,0,0,0,0,0|3,0,0]=4 1868 B13R0.54 COCCCSCCCCOC(=O)C 62a_100000709357_100000033659 [1,0,0,0,0,0|3,0,0]=4 1869 B13R0.54 COCCCSCCCCSC(=O)C 62a_100000709357_200010402107 [1,0,0,0,0,0|3,0,0]=4 1870 B13R0.54 COCCCSCCCCSC(=O)C 62a_200010402107_100000709357 [1,0,0,0,0,0|3,0,0]=4 1871 B13R0.54 COCCNCCCCCNC(=O)C 2230a_200012022750_100011201679 [1,0,0,0,0,0|3,0,0]=4 1872 B13R0.54 COCCNCCCCCNC(=O)C 34a_200012022750_100011201679 [1,0,0,0,0,0|3,0,0]=4 1873 B13R0.54 COCCNCCCCCOC(=O)C 2230a_100000209980_100009813381 [1,0,0,0,0,0|3,0,0]=4 1874 B13R0.54 COCCOCCCCCOC(=O)C 34a_100000210237_100000033007 [1,0,0,0,0,0|3,0,0]=4 1875 B13R0.54 COCCOCCCOCCC(=O)C 34a_100000759926_100011216529 [1,0,0,0,0,0|3,0,0]=4 1876 B13R0.54 COCCOCCCOCCC(=O)C 7a_100000759926_100011216529 [1,0,0,0,0,0|3,0,0]=4 1877 B13R0.54 COCCOCCCSCCC(=O)C 62a_100000053229_100011216529 [1,0,0,0,0,0|3,0,0]=4 1878 B13R0.54 COCCOCCCSCCC(=O)C 62a_100011216529_100000053229 [1,0,0,0,0,0|3,0,0]=4 1879 B13R0.54 COCCOCCNCCCC(=O)C 34a_100000745349_100000685027 [1,0,0,0,0,0|3,0,0]=4 1880 B13R0.54 COCCOCCOCCCC(=O)C 34a_100000759063_100000695917 [1,0,0,0,0,0|3,0,0]=4 1881 B13R0.54 COCCOCCOCCCC(=O)C 34a_100011215163_100000685027 [1,0,0,0,0,0|3,0,0]=4 1882 B13R0.54 COCCOCCOCCCC(=O)C 7a_100000759063_100000695917 [1,0,0,0,0,0|3,0,0]=4 1883 B13R0.54 COCCOCCOCCCC(=O)C 7a_100011215163_100011215641 [1,0,0,0,0,0|3,0,0]=4 1884 B13R0.54 COCCOCCSCCCC(=O)C 62a_100000695917_100011215641 [1,0,0,0,0,0|3,0,0]=4 1885 B13R0.54 COCCOCCSCCCC(=O)C 62a_100011215641_100000695917 [1,0,0,0,0,0|3,0,0]=4 1886 B13R0.54 COCCOCSCCCCC(=O)C 62a_100000231047_100000735457 [1,0,0,0,0,0|3,0,0]=4 1887 B13R0.54 COCCOCSCCCCC(=O)C 62a_100000735457_100000231047 [1,0,0,0,0,0|3,0,0]=4 1888 B13R0.54 COCCSCCCCCOC(=O)C 62a_100000033007_100000233755 [1,0,0,0,0,0|3,0,0]=4 1889 B13R0.54 COCCSCCCCCOC(=O)C 62a_100000233755_100000033007 [1,0,0,0,0,0|3,0,0]=4 1890 B13R0.54 COCNCCCCCCNC(=O)C 2230a_200011996284_100000766300 [1,0,0,0,0,0|3,0,0]=4 1891 B13R0.54 CS(=O)CCCNCCCCCCF 2230a_200000753449_100015922095 [1,0,0,0,0,0|3,0,0]=4 1892 B13R0.54 CS(=O)CCCNCCCCCCO 2230a_200000753449_100000766143 [1,0,0,0,0,0|3,0,0]=4 1893 B13R0.54 CSCCCCOCCCCC(=O)C 34a_100011217163_100009817362 [1,0,0,0,0,0|2,0,0]=3 1894 B13R0.54 CSCCCCOCCCCC(=O)C 7a_100011217163_100000735457 [1,0,0,0,0,0|2,0,0]=3 1895 B13R0.54 CSCCCCOCCCOC(=O)C 34a_100011217163_100000042594 [1,0,0,0,0,0|3,0,0]=4 1896 B13R0.54 CSCCCCOCCCOC(=O)C 7a_100011217163_100000042594 [1,0,0,0,0,0|3,0,0]=4 1897 B13R0.54 CSCCCCOCCCSC(=O)C 34a_100011217163_100000038929 [1,0,0,0,0,0|3,0,0]=4 1898 B13R0.54 CSCCCCOCCCSC(=O)C 7a_100011217163_100000038929 [1,0,0,0,0,0|3,0,0]=4 1899 B13R0.54 CSCCCNCCCCCC(=O)N 2230a_100000749238_100009817443 [1,0,0,0,0,0|3,0,0]=4 1900 B13R0.54 CSCCCNCCCCSC(=O)C 2230a_100000749238_200010402107 [1,0,0,0,0,0|3,0,0]=4 1901 B13R0.54 CSCCCOCCCCCC(=O)N 34a_100000690336_100009817443 [1,0,0,0,0,0|3,0,0]=4 1902 B13R0.54 CSCCCOCCCCCC(=O)N 7a_100000690336_100009817443 [1,0,0,0,0,0|3,0,0]=4 1903 B13R0.54 CSCCCOCCCCOC(=O)C 34a_100000690336_100000033659 [1,0,0,0,0,0|3,0,0]=4 1904 B13R0.54 CSCCCOCCCCOC(=O)C 7a_100000690336_100000033659 [1,0,0,0,0,0|3,0,0]=4 1905 B13R0.54 CSCCCOCCCCSC(=O)C 34a_100000690336_200010402107 [1,0,0,0,0,0|3,0,0]=4 1906 B13R0.54 CSCCCOCCCCSC(=O)C 7a_100000690336_200010402107 [1,0,0,0,0,0|3,0,0]=4 1907 B13R0.54 CSCCNCCCCCNC(=O)C 2230a_200012022750_100000751147 [1,0,0,0,0,0|3,0,0]=4 1908 B13R0.54 CSCCNCCCCCNC(=O)C 34a_200012022750_100000212216 [1,0,0,0,0,0|3,0,0]=4 1909 B13R0.54 CSCCNCCCCCOC(=O)C 2230a_100020590264_100009813381 [1,0,0,0,0,0|3,0,0]=4 1910 B13R0.54 CSCCOCCCCCOC(=O)C 34a_100000230434_100000033007 [1,0,0,0,0,0|3,0,0]=4 1911 B13R0.54 CSCCOCCCCCOC(=O)C 7a_100000230434_100000033007 [1,0,0,0,0,0|3,0,0]=4 1912 B13R0.54 CSCCSCCCCCOC(=O)C 62a_100000033007_100000751147 [1,0,0,0,0,0|3,0,0]=4 1913 B13R0.54 CSCCSCCCCCOC(=O)C 62a_100000212216_100000033007 [1,0,0,0,0,0|3,0,0]=4 1914 B13R0.54 CSCNCCCCCCNC(=O)C 2230a_200011996284_100011218213 [1,0,0,0,0,0|3,0,0]=4 1915 B13R0.54 CSCNCCCCCCNC(=O)C 34a_200011996284_100011218213 [1,0,0,0,0,0|3,0,0]=4 1916 B13R0.54 NC(=O)CCCCCNCCCCO 2230a_100000750430_100009817443 [1,0,0,0,0,0|3,0,0]=4 1917 B13R0.54 NC(=O)CCCCCNCCCCO 34a_100000750430_100009817443 [1,0,0,0,0,0|3,0,0]=4 1918 B13R0.54 NC(=O)CCCCCOCCCCBr 34a_100011216708_100009817443 [1,0,0,0,0,0|3,0,0]=4 1919 B13R0.54 NC(=O)CCCCCOCCCCCl 34a_100000210776_100009817443 [1,0,0,0,0,0|3,0,0]=4 1920 B13R0.54 NC(=O)CCCCCOCCCCCl 7a_100000210776_100009817443 [1,0,0,0,0,0|3,0,0]=4 1921 B13R0.54 NC(=O)CCCCCOCCCCF 34a_100000123541_100000729493 [1,0,0,0,0,0|3,0,0]=4 1922 B13R0.54 NC(=O)CCCCCOCCCCF 34a_100011995726_100009817443 [1,0,0,0,0,0|3,0,0]=4 1923 B13R0.54 NC(=O)CCCCCOCCCCF 7a_100000123541_100000729493 [1,0,0,0,0,0|3,0,0]=4 1924 B13R0.54 NC(=O)CCCCCOCCCCF 7a_100011995726_100009817443 [1,0,0,0,0,0|3,0,0]=4 1925 B13R0.54 NC(=O)CCCCCOCCCCI 34a_200012148704_100009817443 [1,0,0,0,0,0|3,0,0]=4 1926 B13R0.54 NC(=O)CCCCCOCCCCO 34a_100000123541_100011216708 [1,0,0,0,0,0|3,0,0]=4 1927 B13R0.54 NC(=O)CCCCCOCCCCO 7a_100000123541_100000210776 [1,0,0,0,0,0|3,0,0]=4 1928 B13R0.54 NC(=O)CCCCCSCCCCF 62a_100000729493_100009817443 [1,0,0,0,0,0|3,0,0]=4 1929 B13R0.54 NC(=O)CCCCCSCCCCF 62a_100009817443_100000729493 [1,0,0,0,0,0|3,0,0]=4 1930 B13R0.54 NC(=O)CCCCCSCCCCO 62a_100000210776_100009817443 [1,0,0,0,0,0|3,0,0]=4 1931 B13R0.54 NC(=O)CCCCCSCCCCO 62a_100009817443_100000210776 [1,0,0,0,0,0|3,0,0]=4 1932 B13R0.54 NC(=O)CCCCNCCCCCF 34a_100000696515_100000729378 [1,0,0,0,0,0|3,0,0]=4 1933 B13R0.54 NC(=O)CCCCNCCCCCO 34a_100000696515_100000746330 [1,0,0,0,0,0|3,0,0]=4 1934 B13R0.54 NC(=O)CCCCOCCCCCF 34a_100012022536_100000729378 [1,0,0,0,0,0|3,0,0]=4 1935 B13R0.54 NC(=O)CCCCOCCCCCF 7a_100012022536_100000729378 [1,0,0,0,0,0|3,0,0]=4 1936 B13R0.54 NC(=O)CCCCOCCCCCO 34a_100012022536_100000746330 [1,0,0,0,0,0|3,0,0]=4 1937 B13R0.54 NC(=O)CCCCOCCCCCO 7a_100012022536_100000746330 [1,0,0,0,0,0|3,0,0]=4 1938 B13R0.54 NC(=O)CCCNCCCCCCF 34a_100000739312_100015922095 [1,0,0,0,0,0|3,0,0]=4 1939 B13R0.54 NC(=O)CCCNCCCCCCO 34a_100000686447_100102525003 [1,0,0,0,0,0|3,0,0]=4 1940 B13R0.54 NC(=O)CCCNCCCCCCO 34a_100000739312_100000766143 [1,0,0,0,0,0|3,0,0]=4 1941 B13R0.54 NC(=O)CCCOCCCCCCBr 34a_100011215345_100102525003 [1,0,0,0,0,0|3,0,0]=4 1942 B13R0.54 NC(=O)CCCOCCCCCCBr 7a_100011215345_100102525003 [1,0,0,0,0,0|3,0,0]=4 1943 B13R0.54 NC(=O)CCCOCCCCCCCl 34a_100000766143_100102525003 [1,0,0,0,0,0|3,0,0]=4 1944 B13R0.54 NC(=O)CCCOCCCCCCCl 7a_100000766143_100102525003 [1,0,0,0,0,0|3,0,0]=4 1945 B13R0.54 NC(=O)CCCOCCCCCCF 34a_100000732779_100102525003 [1,0,0,0,0,0|3,0,0]=4 1946 B13R0.54 NC(=O)CCCOCCCCCCF 7a_100000732779_100102525003 [1,0,0,0,0,0|3,0,0]=4 1947 B13R0.54 NC(=O)CCCSCCCCCCF 62a_100015922095_100102525003 [1,0,0,0,0,0|3,0,0]=4 1948 B13R0.54 NC(=O)CCCSCCCCCCF 62a_100102525003_100015922095 [1,0,0,0,0,0|3,0,0]=4 1949 B13R0.54 NC(=O)CCCSCCCCCCO 62a_100000766143_100102525003 [1,0,0,0,0,0|3,0,0]=4 1950 B13R0.54 NC(=O)CCCSCCCCCCO 62a_100102525003_100000766143 [1,0,0,0,0,0|3,0,0]=4 1951 B13R0.54 NC(=O)CCNCCCCCCCO 2230a_100011996573_100000744528 [1,0,0,0,0,0|3,0,0]=4 1952 B13R0.54 NC(=O)CCNCCCCCCCO 34a_100011996573_100000731001 [1,0,0,0,0,0|3,0,0]=4 1953 B13R0.54 NC(=O)CCOCCCCCCCBr 34a_100000760002_100000731001 [1,0,0,0,0,0|3,0,0]=4 1954 B13R0.54 NC(=O)CCOCCCCCCCBr 7a_100000760002_100000744528 [1,0,0,0,0,0|3,0,0]=4 1955 B13R0.54 NC(=O)CCOCCCCCCCO 34a_100000757172_100000760002 [1,0,0,0,0,0|3,0,0]=4 1956 B13R0.54 NC(=O)CCOCCCCCCCO 7a_100000757172_100000760002 [1,0,0,0,0,0|3,0,0]=4 1957 B13R0.54 NC(=O)CCSCCCCCCCO 62a_100000744528_100000760002 [1,0,0,0,0,0|3,0,0]=4 1958 B13R0.54 NC(=O)CCSCCCCCCCO 62a_100000760002_100000744528 [1,0,0,0,0,0|3,0,0]=4 1959 B13R0.54 NC(=O)CNCCCCCCCCO 2230a_100000711301_100000033203 [1,0,0,0,0,0|3,0,0]=4 1960 B13R0.54 NC(=O)CNCCCCCCCCO 2230a_102515433106_100000747473 [1,0,0,0,0,0|3,0,0]=4 1961 B13R0.54 NC(=O)CNCCCCCCCCO 34a_102515433106_100000187820 [1,0,0,0,0,0|3,0,0]=4 1962 B13R0.54 NC(=O)COCCCCCCCCBr 34a_100009813846_100000187820 [1,0,0,0,0,0|3,0,0]=4 1963 B13R0.54 NC(=O)COCCCCCCCCBr 7a_100009813846_100000187820 [1,0,0,0,0,0|3,0,0]=4 1964 B13R0.54 NC(=O)COCCCCCCCCCl 34a_100000033203_100000187820 [1,0,0,0,0,0|3,0,0]=4 1965 B13R0.54 NC(=O)COCCCCCCCCCl 7a_100000033203_100000187820 [1,0,0,0,0,0|3,0,0]=4 1966 B13R0.54 NC(=O)CSCCCCCCCCO 62a_100000033203_100000747473 [1,0,0,0,0,0|3,0,0]=4 1967 B13R0.54 NC(=O)CSCCCCCCCCO 62a_100000747473_100000033203 [1,0,0,0,0,0|3,0,0]=4 1968 B13R0.54 NCCCCCCCCOCC(=O)N 34a_102515433106_100000187820 [1,0,0,0,0,0|3,0,0]=4 1969 B13R0.54 NCCCCCCCCOCC(=O)[O-] 34a_102515433106_100020667443 [1,0,0,0,0,0|2,0,1]=4 1970 B13R0.54 NCCCCCCCOCCC(=O)N 34a_100011996573_100000731001 [1,0,0,0,0,0|3,0,0]=4 1971 B13R0.54 NCCCCCCOCCCC(=O)N 34a_100000686447_100102525003 [1,0,0,0,0,0|3,0,0]=4 1972 B13R0.54 NCCCCOCCCCCC(=O)N 34a_100000750430_100009817443 [1,0,0,0,0,0|3,0,0]=4 1973 B13R0.54 O=C(O)CNCCCCCCCCO 269956a_100016091260_100000033203 [1,0,0,0,0,0|2,0,0]=3 1974 B13R0.54 O=C(O)COCCNCCCCCF 269956a_100000700818_100000729378 [1,0,0,0,0,0|3,0,0]=4 1975 B13R0.54 O=C(O)COCCNCCCCCO 269956a_100000700818_100000746330 [1,0,0,0,0,0|3,0,0]=4 1976 B13R0.54 O=C(O)CONCCCCCCCO 269956a_100000106656_100000760002 [1,0,0,0,0,0|3,0,0]=4 1977 B13R0.54 O=C([O-])CCCCCOCCCCF 7a_100102619762_100000729493 [1,0,0,0,0,0|2,0,1]=4 1978 B13R0.54 O=C([O-])CCCCCOCCCCO 7a_100102619762_100000210776 [1,0,0,0,0,0|2,0,1]=4 1979 B13R0.54 O=C([O-])CNCCCCCCCCO 34a_102515433106_100020667443 [1,0,0,0,0,0|2,0,1]=4 1980 B13R0.54 O=C([O-])COCCCCCCCCBr 34a_100009813846_100020667443 [1,0,0,0,0,0|2,0,1]=4 1981 B13R0.54 O=C([O-])COCCCCCCCCCl 34a_100000033203_100020667443 [1,0,0,0,0,0|2,0,1]=4 1982 B13R0.54 O=C([O-])CSCCCCCCCCO 62a_100000033203_100020667443 [1,0,0,0,0,0|2,0,1]=4 1983 B13R0.54 O=C([O-])CSCCCCCCCCO 62a_100020667443_100000033203 [1,0,0,0,0,0|2,0,1]=4 1984 B13R0.147 C#CC(=O)CCCCCCCCCC 1458a_100000211873_100000210319 [1,0,0,0,0,0|1,0,1]=3 1985 B13R0.147 C#CC(=O)CCCCCCCCCO 1458a_100000211873_100009813782 [1,0,0,0,0,0|2,0,1]=4 1986 B13R0.147 C#CCCCCCCCCC(=O)CC 1458a_100000029693_100000210202 [1,0,0,0,0,0|1,0,2]=4 1987 B13R0.147 C#CCCCCCCCCC(=O)NC 11a_106832991635_100000029693 [1,0,0,0,0,0|1,0,2]=4 1988 B13R0.147 C#CCCCCCCCCC(=O)NC 1626a_100102657272_100000029693 [1,0,0,0,0,0|1,0,2]=4 1989 B13R0.147 C#CCCCCCCCCC(=O)NC 240690a_100102657272_100000029693 [1,0,0,0,0,0|1,0,2]=4 1990 B13R0.147 C#CCCCCCCCCC(=O)NC 527a_100102657272_100000029693 [1,0,0,0,0,0|1,0,2]=4 1991 B13R0.147 C#CCCCCCCOCC(=O)OC 34a_100011217361_100000747449 [1,0,0,0,0,0|1,0,2]=4 1992 B13R0.147 C#CCCCCCCOCC(=O)OC 7a_100011217361_100000747449 [1,0,0,0,0,0|1,0,2]=4 1993 B13R0.147 C#CCCCCCCSCC(=O)OC 62a_100000747449_100012276617 [1,0,0,0,0,0|1,0,2]=4 1994 B13R0.147 C#CCCCCCCSCC(=O)OC 62a_100012276617_100000747449 [1,0,0,0,0,0|1,0,2]=4 1995 B13R0.147 C#CCCCCCOCCC(=O)OC 34a_100000766912_100000742370 [1,0,0,0,0,0|1,0,2]=4 1996 B13R0.147 C#CCCCCCOCCC(=O)OC 7a_100000766912_100000204255 [1,0,0,0,0,0|1,0,2]=4 1997 B13R0.147 C#CCCCCCSCCC(=O)OC 62a_100000204255_100012094781 [1,0,0,0,0,0|1,0,2]=4 1998 B13R0.147 C#CCCCCCSCCC(=O)OC 62a_100012094781_100000204255 [1,0,0,0,0,0|1,0,2]=4 1999 B13R0.147 C#CCCCCNCCCC(=O)OC 2230a_100000706060_100011218270 [1,0,0,0,0,0|1,0,2]=4 2000 B13R0.147 C#CCCCCNCCCC(=O)OC 34a_100000706060_100000742333 [1,0,0,0,0,0|1,0,2]=4 2001 B13R0.147 C#CCCCCOCCCC(=O)OC 34a_100000766709_100000742333 [1,0,0,0,0,0|1,0,2]=4 2002 B13R0.147 C#CCCCCOCCCC(=O)OC 7a_100000766709_100011218270 [1,0,0,0,0,0|1,0,2]=4 2003 B13R0.147 C#CCCCCSCCCC(=O)OC 62a_100010269958_100011218270 [1,0,0,0,0,0|1,0,2]=4 2004 B13R0.147 C#CCCCCSCCCC(=O)OC 62a_100011218270_100010269958 [1,0,0,0,0,0|1,0,2]=4 2005 B13R0.147 C#CCCCNCCCCC(=O)OC 34a_100000718082_100000204269 [1,0,0,0,0,0|1,0,2]=4 2006 B13R0.147 C#CCCCOCCCCC(=O)OC 34a_100000059025_100000695029 [1,0,0,0,0,0|1,0,2]=4 2007 B13R0.147 C#CCCCOCCCCC(=O)OC 34a_100000215630_100000204269 [1,0,0,0,0,0|1,0,2]=4 2008 B13R0.147 C#CCCCOCCCCC(=O)OC 7a_100000059025_100011215417 [1,0,0,0,0,0|1,0,2]=4 2009 B13R0.147 C#CCCCOCCCCC(=O)OC 7a_100000215630_100000204269 [1,0,0,0,0,0|1,0,2]=4 2010 B13R0.147 C#CCCCSCCCCC(=O)OC 62a_100000204269_100011215417 [1,0,0,0,0,0|1,0,2]=4 2011 B13R0.147 C#CCCCSCCCCC(=O)OC 62a_100011215417_100000204269 [1,0,0,0,0,0|1,0,2]=4 2012 B13R0.147 C#CCCNCCCCCC(=O)OC 34a_100000755551_100009816466 [1,0,0,0,0,0|1,0,2]=4 2013 B13R0.147 C#CCCOCCCCCC(=O)OC 34a_100000074720_100000688953 [1,0,0,0,0,0|1,0,2]=4 2014 B13R0.147 C#CCCOCCCCCC(=O)OC 34a_100011215631_100009816466 [1,0,0,0,0,0|1,0,2]=4 2015 B13R0.147 C#CCCOCCCCCC(=O)OC 7a_100000074720_100000688953 [1,0,0,0,0,0|1,0,2]=4 2016 B13R0.147 C#CCCSCCCCCC(=O)OC 62a_100000688953_100009816466 [1,0,0,0,0,0|1,0,2]=4 2017 B13R0.147 C#CCCSCCCCCC(=O)OC 62a_100009816466_100000688953 [1,0,0,0,0,0|1,0,2]=4 2018 B13R0.147 C#CCNCCCCCCC(=O)OC 34a_100000212058_100009815986 [1,0,0,0,0,0|1,0,2]=4 2019 B13R0.147 C#CCOCCCCCCC(=O)OC 34a_100000210247_100009815986 [1,0,0,0,0,0|1,0,2]=4 2020 B13R0.147 C#CCOCCCCCCC(=O)OC 34a_100009863599_100000184674 [1,0,0,0,0,0|1,0,2]=4 2021 B13R0.147 C#CCOCCCCCCC(=O)OC 7a_100009863599_100000038162 [1,0,0,0,0,0|1,0,2]=4 2022 B13R0.147 C#CCSCCCCCCC(=O)OC 62a_100000038162_100009815986 [1,0,0,0,0,0|1,0,2]=4 2023 B13R0.147 C/C=C/CCOCCCCC(=O)OC 34a_100016278192_100000204269 [1,0,0,0,0,0|1,0,2]=4 2024 B13R0.147 C/C=C/COCCCCCC(=O)OC 34a_100000074720_100102629194 [1,0,0,0,0,0|1,0,2]=4 2025 B13R0.147 C/C=C/COCCCCCC(=O)OC 34a_100016270725_100009816466 [1,0,0,0,0,0|1,0,2]=4 2026 B13R0.147 C/C=C/COCCCCCC(=O)OC 7a_100000074720_100102629194 [1,0,0,0,0,0|1,0,2]=4 2027 B13R0.147 C/C=C/CSCCCCCC(=O)OC 62a_100009816466_100102629194 [1,0,0,0,0,0|1,0,2]=4 2028 B13R0.147 C/C=C/CSCCCCCC(=O)OC 62a_100102629194_100009816466 [1,0,0,0,0,0|1,0,2]=4 2029 B13R0.147 C=CC(=O)CCCCCCCCCC 1458a_100000185746_100000210319 [1,0,0,0,0,0|1,0,1]=3 2030 B13R0.147 C=CC(=O)CCCCCCCCCO 1458a_100000185746_100009813782 [1,0,0,0,0,0|2,0,1]=4 2031 B13R0.147 C=CC(=O)NCCCCCCCCC 1626a_100000212291_100000185746 [1,0,0,0,0,0|2,0,1]=4 2032 B13R0.147 C=CC(=O)NCCCCCCCCC 240690a_100000212291_200121576911 [1,0,0,0,0,0|2,0,1]=4 2033 B13R0.147 C=CCCCCCCCCC(=O)CC 1458a_100000210414_100011933949 [1,0,0,0,0,0|1,0,2]=4 2034 B13R0.147 C=CCCCCCCCCC(=O)CC 1458a_100000211349_100000210202 [1,0,0,0,0,0|1,0,2]=4 2035 B13R0.147 C=CCCCCCCCCC(=O)NC 11a_106832991635_100000211349 [1,0,0,0,0,0|1,0,2]=4 2036 B13R0.147 C=CCCCCCCCCC(=O)NC 1626a_100102657272_100000211349 [1,0,0,0,0,0|1,0,2]=4 2037 B13R0.147 C=CCCCCCCCCC(=O)NC 240690a_100102657272_100000211349 [1,0,0,0,0,0|1,0,2]=4 2038 B13R0.147 C=CCCCCCCCCC(=O)NC 527a_100102657272_100000211349 [1,0,0,0,0,0|1,0,2]=4 2039 B13R0.147 C=CCCCCCCOCC(=O)OC 34a_200011216477_100000747449 [1,0,0,0,0,0|1,0,2]=4 2040 B13R0.147 C=CCCCCCCOCC(=O)OC 7a_200011216477_100000747449 [1,0,0,0,0,0|1,0,2]=4 2041 B13R0.147 C=CCCCCCCSCC(=O)OC 62a_100000747449_100011215473 [1,0,0,0,0,0|1,0,2]=4 2042 B13R0.147 C=CCCCCCCSCC(=O)OC 62a_100011215473_100000747449 [1,0,0,0,0,0|1,0,2]=4 2043 B13R0.147 C=CCCCCCOCCC(=O)OC 34a_100011216702_100000742370 [1,0,0,0,0,0|1,0,2]=4 2044 B13R0.147 C=CCCCCCOCCC(=O)OC 7a_100011216702_100000204255 [1,0,0,0,0,0|1,0,2]=4 2045 B13R0.147 C=CCCCCCSCCC(=O)OC 62a_100000204255_100000700193 [1,0,0,0,0,0|1,0,2]=4 2046 B13R0.147 C=CCCCCCSCCC(=O)OC 62a_100000700193_100000204255 [1,0,0,0,0,0|1,0,2]=4 2047 B13R0.147 C=CCCCCNCCCC(=O)OC 2230a_100000703577_100011218270 [1,0,0,0,0,0|1,0,2]=4 2048 B13R0.147 C=CCCCCNCCCC(=O)OC 34a_100000703577_100000742333 [1,0,0,0,0,0|1,0,2]=4 2049 B13R0.147 C=CCCCCOCCCC(=O)OC 34a_100000766645_100000742333 [1,0,0,0,0,0|1,0,2]=4 2050 B13R0.147 C=CCCCCOCCCC(=O)OC 7a_100000766645_100011218270 [1,0,0,0,0,0|1,0,2]=4 2051 B13R0.147 C=CCCCCSCCCC(=O)OC 62a_100011215482_100011218270 [1,0,0,0,0,0|1,0,2]=4 2052 B13R0.147 C=CCCCCSCCCC(=O)OC 62a_100011218270_100011215482 [1,0,0,0,0,0|1,0,2]=4 2053 B13R0.147 C=CCCCNCCCCC(=O)OC 2230a_100000700776_100000204269 [1,0,0,0,0,0|1,0,2]=4 2054 B13R0.147 C=CCCCNCCCCC(=O)OC 34a_100000700776_100000204269 [1,0,0,0,0,0|1,0,2]=4 2055 B13R0.147 C=CCCCOCCCCC(=O)OC 34a_100000059025_100000757094 [1,0,0,0,0,0|1,0,2]=4 2056 B13R0.147 C=CCCCOCCCCC(=O)OC 34a_100000758997_100000204269 [1,0,0,0,0,0|1,0,2]=4 2057 B13R0.147 C=CCCCOCCCCC(=O)OC 7a_100000059025_100000757094 [1,0,0,0,0,0|1,0,2]=4 2058 B13R0.147 C=CCCCOCCCCC(=O)OC 7a_100000758997_100000204269 [1,0,0,0,0,0|1,0,2]=4 2059 B13R0.147 C=CCCCSCCCCC(=O)OC 62a_100000204269_100000757094 [1,0,0,0,0,0|1,0,2]=4 2060 B13R0.147 C=CCCCSCCCCC(=O)OC 62a_100011713584_100000204269 [1,0,0,0,0,0|1,0,2]=4 2061 B13R0.147 C=CCCNCCCCCC(=O)OC 2230a_100015191253_100009816466 [1,0,0,0,0,0|1,0,2]=4 2062 B13R0.147 C=CCCOCCCCCC(=O)OC 34a_100000074720_100000754431 [1,0,0,0,0,0|1,0,2]=4 2063 B13R0.147 C=CCCOCCCCCC(=O)OC 34a_100011205117_100009816466 [1,0,0,0,0,0|1,0,2]=4 2064 B13R0.147 C=CCCOCCCCCC(=O)OC 7a_100000074720_100000754431 [1,0,0,0,0,0|1,0,2]=4 2065 B13R0.147 C=CCCSCCCCCC(=O)OC 62a_100000754431_100009816466 [1,0,0,0,0,0|1,0,2]=4 2066 B13R0.147 C=CCCSCCCCCC(=O)OC 62a_100009816466_100000754431 [1,0,0,0,0,0|1,0,2]=4 2067 B13R0.147 C=CCNCCCCCCC(=O)OC 2230a_100020586998_100009815986 [1,0,0,0,0,0|1,0,2]=4 2068 B13R0.147 C=CCOCCCCCCC(=O)OC 34a_100009863599_100015514636 [1,0,0,0,0,0|1,0,2]=4 2069 B13R0.147 C=CCOCCCCCCC(=O)OC 34a_200000210373_100009815986 [1,0,0,0,0,0|1,0,2]=4 2070 B13R0.147 C=CCOCCCCCCC(=O)OC 7a_100009863599_100015514636 [1,0,0,0,0,0|1,0,2]=4 2071 B13R0.147 C=CCSCCCCCCC(=O)OC 62a_100000210623_100009815986 [1,0,0,0,0,0|1,0,2]=4 2072 B13R0.147 C=CCSCCCCCCC(=O)OC 62a_100009815986_100000210623 [1,0,0,0,0,0|1,0,2]=4 2073 B13R0.147 CC#CCCCCCCCC(=O)CC 1458a_100000066323_100000210202 [1,0,0,0,0,0|1,0,2]=4 2074 B13R0.147 CC#CCCCCCCCC(=O)NC 11a_106832991635_100000066323 [1,0,0,0,0,0|1,0,2]=4 2075 B13R0.147 CC#CCCCCCCCC(=O)NC 1626a_100102657272_100000066323 [1,0,0,0,0,0|1,0,2]=4 2076 B13R0.147 CC#CCCCCCCCC(=O)NC 240690a_100102657272_100000066323 [1,0,0,0,0,0|1,0,2]=4 2077 B13R0.147 CC#CCCCCCCCC(=O)NC 527a_100102657272_100000066323 [1,0,0,0,0,0|1,0,2]=4 2078 B13R0.147 CC#CCCOCCCCC(=O)OC 34a_100000750427_100000204269 [1,0,0,0,0,0|1,0,2]=4 2079 B13R0.147 CC#CCNCCCCCC(=O)OC 2230a_100000685387_100009816466 [1,0,0,0,0,0|1,0,2]=4 2080 B13R0.147 CC#CCNCCCCCC(=O)OC 34a_100000685387_100009816466 [1,0,0,0,0,0|1,0,2]=4 2081 B13R0.147 CC#CCOCCCCCC(=O)OC 34a_100000074720_100000748600 [1,0,0,0,0,0|1,0,2]=4 2082 B13R0.147 CC#CCOCCCCCC(=O)OC 34a_100000761923_100009816466 [1,0,0,0,0,0|1,0,2]=4 2083 B13R0.147 CC#CCOCCCCCC(=O)OC 7a_100000074720_100000748600 [1,0,0,0,0,0|1,0,2]=4 2084 B13R0.147 CC#CCSCCCCCC(=O)OC 62a_100000748600_100009816466 [1,0,0,0,0,0|1,0,2]=4 2085 B13R0.147 CC#CCSCCCCCC(=O)OC 62a_100009816466_100000748600 [1,0,0,0,0,0|1,0,2]=4 2086 B13R0.147 CC/C=C/CCCOCCC(=O)OC 34a_100016287902_100000742370 [1,0,0,0,0,0|1,0,2]=4 2087 B13R0.147 CC/C=C/CCCOCCC(=O)OC 7a_100016287902_100000204255 [1,0,0,0,0,0|1,0,2]=4 2088 B13R0.147 CC/C=C\CCCCOCC(=O)OC 34a_100016287862_100000747449 [1,0,0,0,0,0|1,0,2]=4 2089 B13R0.147 CC/C=C\CCCCOCC(=O)OC 7a_100016287862_100000747449 [1,0,0,0,0,0|1,0,2]=4 2090 B13R0.147 CC/C=C\CCOCCCC(=O)OC 34a_100016288707_100000742333 [1,0,0,0,0,0|1,0,2]=4 2091 B13R0.147 CC/C=C\CCOCCCC(=O)OC 7a_100016288707_100011218270 [1,0,0,0,0,0|1,0,2]=4 2092 B13R0.147 CC/C=C\CCSCCCC(=O)OC 62a_100011218270_100015370543 [1,0,0,0,0,0|1,0,2]=4 2093 B13R0.147 CC/C=C\CCSCCCC(=O)OC 62a_100015370543_100011218270 [1,0,0,0,0,0|1,0,2]=4 2094 B13R0.147 CC/C=C\COCCCCC(=O)OC 34a_100000059025_100103147603 [1,0,0,0,0,0|1,0,2]=4 2095 B13R0.147 CC/C=C\COCCCCC(=O)OC 34a_100016268518_100000204269 [1,0,0,0,0,0|1,0,2]=4 2096 B13R0.147 CC/C=C\COCCCCC(=O)OC 7a_100000059025_100103147603 [1,0,0,0,0,0|1,0,2]=4 2097 B13R0.147 CC/C=C\CSCCCCC(=O)OC 62a_100000204269_100103147603 [1,0,0,0,0,0|1,0,2]=4 2098 B13R0.147 CC/C=C\CSCCCCC(=O)OC 62a_100103147603_100000204269 [1,0,0,0,0,0|1,0,2]=4 2099 B13R0.147 CC=CCCCOCCCC(=O)OC 34a_100020645299_100000742333 [1,0,0,0,0,0|1,0,2]=4 2100 B13R0.147 CC=CCOCCCCCC(=O)OC 34a_100000074720_100000070051 [1,0,0,0,0,0|1,0,2]=4 2101 B13R0.147 CC=CCOCCCCCC(=O)OC 7a_100000074720_100000070051 [1,0,0,0,0,0|1,0,2]=4 2102 B13R0.147 CC=CCSCCCCCC(=O)OC 62a_100000070051_100009816466 [1,0,0,0,0,0|1,0,2]=4 2103 B13R0.147 CC=CCSCCCCCC(=O)OC 62a_100009816466_100000070051 [1,0,0,0,0,0|1,0,2]=4 2104 B13R0.147 CCC#CCCCCCCC(=O)CC 1458a_100000210414_200000036426 [1,0,0,0,0,0|1,0,2]=4 2105 B13R0.147 CCC#CCCOCCCC(=O)OC 34a_100000036655_100000742333 [1,0,0,0,0,0|1,0,2]=4 2106 B13R0.147 CCC#CCCOCCCC(=O)OC 7a_100000036655_100011218270 [1,0,0,0,0,0|1,0,2]=4 2107 B13R0.147 CCC#CCOCCCCC(=O)OC 34a_100000032950_100000204269 [1,0,0,0,0,0|1,0,2]=4 2108 B13R0.147 CCC#CCOCCCCC(=O)OC 34a_100000059025_100009813939 [1,0,0,0,0,0|1,0,2]=4 2109 B13R0.147 CCC#CCOCCCCC(=O)OC 7a_100000059025_100009813939 [1,0,0,0,0,0|1,0,2]=4 2110 B13R0.147 CCC#CCSCCCCC(=O)OC 62a_100000204269_100009813939 [1,0,0,0,0,0|1,0,2]=4 2111 B13R0.147 CCC#CCSCCCCC(=O)OC 62a_100009813939_100000204269 [1,0,0,0,0,0|1,0,2]=4 2112 B13R0.147 CCC(=O)CCCCCCCCCF 1458a_200009909015_100000210202 [1,0,0,0,0,0|2,0,0]=3 2113 B13R0.147 CCC(=O)CCCCCCCCCO 1458a_100000210414_100009813782 [1,0,0,0,0,0|2,0,0]=3 2114 B13R0.147 CCC(=O)COCCCCCCCBr 7a_100000760002_100000747405 [1,0,0,0,0,0|3,0,0]=4 2115 B13R0.147 CCC(=O)COCCCCCCCO 34a_100000725409_100000760002 [1,0,0,0,0,0|3,0,0]=4 2116 B13R0.147 CCC(=O)COCCCCCCOC 34a_100000725409_100011998445 [1,0,0,0,0,0|3,0,0]=4 2117 B13R0.147 CCC(=O)COCCCCCCOC 7a_200012092642_100000747405 [1,0,0,0,0,0|3,0,0]=4 2118 B13R0.147 CCC(=O)CSCCCCCCCO 62a_100000747405_100000760002 [1,0,0,0,0,0|3,0,0]=4 2119 B13R0.147 CCC(=O)CSCCCCCCCO 62a_100000760002_100000747405 [1,0,0,0,0,0|3,0,0]=4 2120 B13R0.147 CCC(=O)CSCCCCCCOC 62a_100000747405_100011998445 [1,0,0,0,0,0|3,0,0]=4 2121 B13R0.147 CCC(=O)CSCCCCCCOC 62a_100011998445_100000747405 [1,0,0,0,0,0|3,0,0]=4 2122 B13R0.147 CCC(=O)NCCCCCCCCO 240690a_102515433106_100000210414 [1,0,0,0,0,0|3,0,0]=4 2123 B13R0.147 CCC/C=C/COCCCC(=O)OC 34a_100016278788_100000742333 [1,0,0,0,0,0|1,0,2]=4 2124 B13R0.147 CCC/C=C/COCCCC(=O)OC 7a_100016278788_100011218270 [1,0,0,0,0,0|1,0,2]=4 2125 B13R0.147 CCCC#CCCOCCC(=O)OC 34a_100000042726_100000742370 [1,0,0,0,0,0|1,0,2]=4 2126 B13R0.147 CCCC#CCCOCCC(=O)OC 7a_100000042726_100000204255 [1,0,0,0,0,0|1,0,2]=4 2127 B13R0.147 CCCC#CCOCCCC(=O)OC 34a_100000034806_100000742333 [1,0,0,0,0,0|1,0,2]=4 2128 B13R0.147 CCCC#CCOCCCC(=O)OC 7a_100000034806_100011218270 [1,0,0,0,0,0|1,0,2]=4 2129 B13R0.147 CCCC/C=C/COCCC(=O)OC 34a_200016272032_100000742370 [1,0,0,0,0,0|1,0,2]=4 2130 B13R0.147 CCCC/C=C/COCCC(=O)OC 7a_200016272032_100000204255 [1,0,0,0,0,0|1,0,2]=4 2131 B13R0.147 CCCC/C=C\CCOCC(=O)OC 34a_200016286491_100000747449 [1,0,0,0,0,0|1,0,2]=4 2132 B13R0.147 CCCC/C=C\CCOCC(=O)OC 7a_200016286491_100000747449 [1,0,0,0,0,0|1,0,2]=4 2133 B13R0.147 CCCCC#CCCOCC(=O)OC 34a_100000037610_100000747449 [1,0,0,0,0,0|1,0,2]=4 2134 B13R0.147 CCCCC#CCCOCC(=O)OC 7a_100000037610_100000747449 [1,0,0,0,0,0|1,0,2]=4 2135 B13R0.147 CCCCC#CCOCCC(=O)OC 34a_200000034558_100000742370 [1,0,0,0,0,0|1,0,2]=4 2136 B13R0.147 CCCCC#CCOCCC(=O)OC 7a_200000034558_100000204255 [1,0,0,0,0,0|1,0,2]=4 2137 B13R0.147 CCCCC/C=C/COCC(=O)OC 34a_100016258190_100000747449 [1,0,0,0,0,0|1,0,2]=4 2138 B13R0.147 CCCCC/C=C/COCC(=O)OC 7a_100016258190_100000747449 [1,0,0,0,0,0|1,0,2]=4 2139 B13R0.147 CCCCCC#CCOCC(=O)OC 34a_200000033628_100000747449 [1,0,0,0,0,0|1,0,2]=4 2140 B13R0.147 CCCCCC#CCOCC(=O)OC 7a_200000033628_100000747449 [1,0,0,0,0,0|1,0,2]=4 2141 B13R0.147 CCCCCC#CCSCC(=O)OC 62a_100000747449_100009816472 [1,0,0,0,0,0|1,0,2]=4 2142 B13R0.147 CCCCCC#CCSCC(=O)OC 62a_100009816472_100000747449 [1,0,0,0,0,0|1,0,2]=4 2143 B13R0.147 CCCCCCCCC=CC(=O)CC 1458a_100015345288_100000210202 [1,0,0,0,0,0|1,0,2]=4 2144 B13R0.147 CCCCCCCCC=CC(=O)NC 11a_106832991635_100015345288 [1,0,0,0,0,0|1,0,2]=4 2145 B13R0.147 CCCCCCCCC=CC(=O)NC 1626a_100102657272_100015345288 [1,0,0,0,0,0|1,0,2]=4 2146 B13R0.147 CCCCCCCCC=CC(=O)NC 240690a_100102657272_100015345288 [1,0,0,0,0,0|1,0,2]=4 2147 B13R0.147 CCCCCCCCCCC(=O)CC 1458a_100000210375_100000210202 [1,0,0,0,0,0|1,0,0]=2 2148 B13R0.147 CCCCCCCCCCC(=O)CC 1458a_100000210414_100000210319 [1,0,0,0,0,0|1,0,0]=2 2149 B13R0.147 CCCCCCCCCCC(=O)CF 1458a_100000210375_100015361967 [1,0,0,0,0,0|2,0,0]=3 2150 B13R0.147 CCCCCCCCCCC(=O)CO 1458a_100000210174_100000210319 [1,0,0,0,0,0|2,0,0]=3 2151 B13R0.147 CCCCCCCCCCC(=O)NC 11a_106832991635_100000210375 [1,0,0,0,0,0|1,0,0]=2 2152 B13R0.147 CCCCCCCCCCC(=O)NC 1626a_100102657272_100000210375 [1,0,0,0,0,0|1,0,0]=2 2153 B13R0.147 CCCCCCCCCCC(=O)NC 240690a_100102657272_100000210375 [1,0,0,0,0,0|1,0,0]=2 2154 B13R0.147 CCCCCCCCCCC(C)NC 270004a_106832991635_200011219864 [1,0,0,0,0,0|2,0,1]=4 2155 B13R0.147 CCCCCCCCCCC(C)OC 34a_100011215000_200000210301 [1,0,0,0,0,0|1,0,1]=3 2156 B13R0.147 CCCCCCCCCCC(C)OC 7a_100011215000_200000210301 [1,0,0,0,0,0|1,0,1]=3 2157 B13R0.147 CCCCCCCCCCC(C)O[13CH3] 34a_100011215000_200025704644 [1,0,0,0,0,0|1,0,1]=3 2158 B13R0.147 CCCCCCCCCCC(C)O[13CH3] 7a_100011215000_200025704644 [1,0,0,0,0,0|1,0,1]=3 2159 B13R0.147 CCCCCCCCCCN(C)CC 2230a_100000207566_100000210202 [1,0,0,0,0,0|3,0,0]=4 2160 B13R0.147 CCCCCCCCCCN(C)CC 2230a_100000225621_100000210320 [1,0,0,0,0,0|3,0,0]=4 2161 B13R0.147 CCCCCCCCCCN(C)CC 269982a_100000207566_100000204670 [1,0,0,0,0,0|3,0,0]=4 2162 B13R0.147 CCCCCCCCCCN(C)CC 269982a_100000225621_100000210320 [1,0,0,0,0,0|3,0,0]=4 2163 B13R0.147 CCCCCCCCCNC(=O)CC 11a_100000212291_100000210414 [1,0,0,0,0,0|2,0,0]=3 2164 B13R0.147 CCCCCCCCCNC(=O)CC 1626a_100000212291_100000210414 [1,0,0,0,0,0|2,0,0]=3 2165 B13R0.147 CCCCCCCCCNC(=O)CC 240690a_100000212291_100000210414 [1,0,0,0,0,0|2,0,0]=3 2166 B13R0.147 CCCCCCCCCNC(=O)CC 527a_100000212291_100000210414 [1,0,0,0,0,0|2,0,0]=3 2167 B13R0.147 CCCCCCCCCNC(=O)CO 240690a_100000212291_100000210174 [1,0,0,0,0,0|3,0,0]=4 2168 B13R0.147 CCCCCCCCCNC(=O)CO 527a_100000212291_100000210174 [1,0,0,0,0,0|3,0,0]=4 2169 B13R0.147 CCCCCCCCCNC(=O)NC 2708a_100000212291_106832991635 [1,0,0,0,0,0|2,0,0]=3 2170 B13R0.147 CCCCCCCCCNC(=O)NC 2708a_100102657272_100000212291 [1,0,0,0,0,0|2,0,0]=3 2171 B13R0.147 CCCCCCCCCNC(=O)NC 273464a_100000212291_100102657272 [1,0,0,0,0,0|2,0,0]=3 2172 B13R0.147 CCCCCCCCCNC(=O)NC 273464a_100102657272_100000212291 [1,0,0,0,0,0|2,0,0]=3 2173 B13R0.147 CCCCCCCCCNC(=O)NC 512a_100000212291_100102657272 [1,0,0,0,0,0|2,0,0]=3 2174 B13R0.147 CCCCCCCCCNC(=O)NC 512a_106832991638_100000212291 [1,0,0,0,0,0|2,0,0]=3 2175 B13R0.147 CCCCCCCCCSC(C)OC 62a_100009879195_100000210670 [1,0,0,0,0,0|2,0,1]=4 2176 B13R0.147 CCCCCCCCNCC(=O)NC 2230a_100000229939_100000183359 [1,0,0,0,0,0|2,0,0]=3 2177 B13R0.147 CCCCCCCCNCC(=O)NC 2230a_100000693194_100000210759 [1,0,0,0,0,0|2,0,0]=3 2178 B13R0.147 CCCCCCCCNCC(=O)NC 34a_100000229939_100000183359 [1,0,0,0,0,0|2,0,0]=3 2179 B13R0.147 CCCCCCCCNCC(=O)OC 2230a_100000229939_100000747449 [1,0,0,0,0,0|1,0,0]=2 2180 B13R0.147 CCCCCCCCNCC(=O)OC 34a_100000229939_100000747449 [1,0,0,0,0,0|1,0,0]=2 2181 B13R0.147 CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210759 [1,0,0,0,0,0|2,0,1]=4 2182 B13R0.147 CCCCCCCCOCC(=O)CC 1458a_100000759886_100000210202 [1,0,0,0,0,0|2,0,0]=3 2183 B13R0.147 CCCCCCCCOCC(=O)CC 34a_100000725409_100000210759 [1,0,0,0,0,0|2,0,0]=3 2184 B13R0.147 CCCCCCCCOCC(=O)CC 7a_100000210232_100000747405 [1,0,0,0,0,0|2,0,0]=3 2185 B13R0.147 CCCCCCCCOCC(=O)CF 1458a_100000759886_100015361967 [1,0,0,0,0,0|3,0,0]=4 2186 B13R0.147 CCCCCCCCOCC(=O)NC 11a_106832991635_100000759886 [1,0,0,0,0,0|2,0,0]=3 2187 B13R0.147 CCCCCCCCOCC(=O)NC 1626a_100102657272_100000759886 [1,0,0,0,0,0|2,0,0]=3 2188 B13R0.147 CCCCCCCCOCC(=O)NC 240690a_100102657272_100000759886 [1,0,0,0,0,0|2,0,0]=3 2189 B13R0.147 CCCCCCCCOCC(=O)NC 34a_100000210232_100000183359 [1,0,0,0,0,0|2,0,0]=3 2190 B13R0.147 CCCCCCCCOCC(=O)NC 34a_100000750040_100000210759 [1,0,0,0,0,0|2,0,0]=3 2191 B13R0.147 CCCCCCCCOCC(=O)NC 527a_100102657272_100000759886 [1,0,0,0,0,0|2,0,0]=3 2192 B13R0.147 CCCCCCCCOCC(=O)NC 7a_100000210232_100000183359 [1,0,0,0,0,0|2,0,0]=3 2193 B13R0.147 CCCCCCCCOCC(=O)OC 34a_100000210232_100000747449 [1,0,0,0,0,0|1,0,0]=2 2194 B13R0.147 CCCCCCCCOCC(=O)OC 7a_100000210232_100000747449 [1,0,0,0,0,0|1,0,0]=2 2195 B13R0.147 CCCCCCCCOCC(C)OC 34a_100000690652_100000210759 [1,0,0,0,0,0|2,0,1]=4 2196 B13R0.147 CCCCCCCCSCC(=O)CC 62a_100000210759_100000747405 [1,0,0,0,0,0|2,0,0]=3 2197 B13R0.147 CCCCCCCCSCC(=O)CC 62a_100000747405_100000210317 [1,0,0,0,0,0|2,0,0]=3 2198 B13R0.147 CCCCCCCCSCC(=O)NC 62a_100000183359_100000210317 [1,0,0,0,0,0|2,0,0]=3 2199 B13R0.147 CCCCCCCCSCC(=O)NC 62a_100000210759_100000183359 [1,0,0,0,0,0|2,0,0]=3 2200 B13R0.147 CCCCCCCCSCC(=O)OC 62a_100000210759_100000747449 [1,0,0,0,0,0|1,0,0]=2 2201 B13R0.147 CCCCCCCCSCC(=O)OC 62a_100000747449_100000210317 [1,0,0,0,0,0|1,0,0]=2 2202 B13R0.147 CCCCCCCNCCC(=O)NC 2230a_100000229938_100000737683 [1,0,0,0,0,0|2,0,0]=3 2203 B13R0.147 CCCCCCCNCCC(=O)NC 2230a_100000738227_100000210681 [1,0,0,0,0,0|2,0,0]=3 2204 B13R0.147 CCCCCCCNCCC(=O)NC 34a_100000738227_100000210614 [1,0,0,0,0,0|2,0,0]=3 2205 B13R0.147 CCCCCCCNCCC(=O)OC 2230a_100000229938_100000204255 [1,0,0,0,0,0|1,0,0]=2 2206 B13R0.147 CCCCCCCOCCC(=O)NC 34a_100000210272_100012179268 [1,0,0,0,0,0|2,0,0]=3 2207 B13R0.147 CCCCCCCOCCC(=O)NC 34a_100000754576_100000210614 [1,0,0,0,0,0|2,0,0]=3 2208 B13R0.147 CCCCCCCOCCC(=O)NC 7a_100000210272_100000737683 [1,0,0,0,0,0|2,0,0]=3 2209 B13R0.147 CCCCCCCOCCC(=O)OC 34a_100000210272_100000742370 [1,0,0,0,0,0|1,0,0]=2 2210 B13R0.147 CCCCCCCOCCC(=O)OC 7a_100000210272_100000204255 [1,0,0,0,0,0|1,0,0]=2 2211 B13R0.147 CCCCCCCOCCC(C)OC 7a_100000764861_100000210614 [1,0,0,0,0,0|2,0,1]=4 2212 B13R0.147 CCCCCCCSCCC(=O)NC 62a_100000210614_100000737683 [1,0,0,0,0,0|2,0,0]=3 2213 B13R0.147 CCCCCCCSCCC(=O)NC 62a_100000737683_100000210316 [1,0,0,0,0,0|2,0,0]=3 2214 B13R0.147 CCCCCCCSCCC(=O)OC 62a_100000204255_100000210316 [1,0,0,0,0,0|1,0,0]=2 2215 B13R0.147 CCCCCCCSCCC(=O)OC 62a_100000210614_100000204255 [1,0,0,0,0,0|1,0,0]=2 2216 B13R0.147 CCCCCCCSCOC(=O)OC 62a_100000210614_100000139417 [1,0,0,0,0,0|2,0,0]=3 2217 B13R0.147 CCCCCCNC/C=C/C(=O)OC 2230a_100000210581_100000742655 [1,0,0,0,0,0|1,0,2]=4 2218 B13R0.147 CCCCCCNCCCC(=O)NC 2230a_100000210581_100000741757 [1,0,0,0,0,0|2,0,0]=3 2219 B13R0.147 CCCCCCNCCCC(=O)NC 2230a_100000740002_100000210314 [1,0,0,0,0,0|2,0,0]=3 2220 B13R0.147 CCCCCCNCCCC(=O)NC 34a_100000740002_100000210314 [1,0,0,0,0,0|2,0,0]=3 2221 B13R0.147 CCCCCCNCCCC(=O)OC 2230a_100000210581_100011218270 [1,0,0,0,0,0|1,0,0]=2 2222 B13R0.147 CCCCCCNCCNC(=O)CC 34a_100132302217_100000210314 [1,0,0,0,0,0|3,0,0]=4 2223 B13R0.147 CCCCCCNCCNC(=O)NC 34a_100015205895_100000210314 [1,0,0,0,0,0|3,0,0]=4 2224 B13R0.147 CCCCCCOC/C=C/C(=O)OC 34a_100000210259_100000742655 [1,0,0,0,0,0|1,0,2]=4 2225 B13R0.147 CCCCCCOC/C=C/C(=O)OC 7a_100000210259_100000742655 [1,0,0,0,0,0|1,0,2]=4 2226 B13R0.147 CCCCCCOCCCC(=O)NC 34a_100000210259_100000741757 [1,0,0,0,0,0|2,0,0]=3 2227 B13R0.147 CCCCCCOCCCC(=O)NC 7a_100000210259_100000741757 [1,0,0,0,0,0|2,0,0]=3 2228 B13R0.147 CCCCCCOCCCC(=O)NN 34a_100000211488_100000210314 [1,0,0,0,0,0|3,0,0]=4 2229 B13R0.147 CCCCCCOCCCC(=O)OC 34a_100000210259_100000742333 [1,0,0,0,0,0|1,0,0]=2 2230 B13R0.147 CCCCCCOCCCC(=O)OC 7a_100000210259_100011218270 [1,0,0,0,0,0|1,0,0]=2 2231 B13R0.147 CCCCCCOCCNC(=O)CC 34a_200000158885_100000210314 [1,0,0,0,0,0|3,0,0]=4 2232 B13R0.147 CCCCCCOCCNC(=O)CC 7a_200000158885_100000210314 [1,0,0,0,0,0|3,0,0]=4 2233 B13R0.147 CCCCCCOCCNC(=O)OC 34a_100000757965_100000210314 [1,0,0,0,0,0|2,0,0]=3 2234 B13R0.147 CCCCCCOCCOC(=O)CC 7a_200000031056_100000210314 [1,0,0,0,0,0|3,0,0]=4 2235 B13R0.147 CCCCCCOCCOC(=O)NC 34a_100000210259_200011997002 [1,0,0,0,0,0|3,0,0]=4 2236 B13R0.147 CCCCCCOCCOC(=O)NC 7a_100000210259_200011997002 [1,0,0,0,0,0|3,0,0]=4 2237 B13R0.147 CCCCCCOCCOC(=O)OC 34a_100010262106_100000210314 [1,0,0,0,0,0|2,0,0]=3 2238 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000210314_100000742655 [1,0,0,0,0,0|1,0,2]=4 2239 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210757 [1,0,0,0,0,0|1,0,2]=4 2240 B13R0.147 CCCCCCSCCCC(=O)NC 62a_100000210314_100000741757 [1,0,0,0,0,0|2,0,0]=3 2241 B13R0.147 CCCCCCSCCCC(=O)NC 62a_100000741757_100000210757 [1,0,0,0,0,0|2,0,0]=3 2242 B13R0.147 CCCCCCSCCCC(=O)OC 62a_100000210314_100011218270 [1,0,0,0,0,0|1,0,0]=2 2243 B13R0.147 CCCCCCSCCCC(=O)OC 62a_100011218270_100000210757 [1,0,0,0,0,0|1,0,0]=2 2244 B13R0.147 CCCCCCSCCOC(=O)NC 62a_100000210314_200011997002 [1,0,0,0,0,0|3,0,0]=4 2245 B13R0.147 CCCCCCSCCOC(=O)NC 62a_200011997002_100000210757 [1,0,0,0,0,0|3,0,0]=4 2246 B13R0.147 CCCCCNCCCCC(=O)OC 2230a_100000209983_100000204269 [1,0,0,0,0,0|1,0,0]=2 2247 B13R0.147 CCCCCNCCOCC(=O)NC 34a_100000224656_100000183359 [1,0,0,0,0,0|3,0,0]=4 2248 B13R0.147 CCCCCNCCOCC(=O)OC 2230a_100000209983_100000090808 [1,0,0,0,0,0|2,0,0]=3 2249 B13R0.147 CCCCCNCCOCC(=O)OC 34a_100000224656_100000747449 [1,0,0,0,0,0|2,0,0]=3 2250 B13R0.147 CCCCCNN=CCCC(=O)OC 4a_100000694160_100012047195 [1,0,0,0,0,0|2,0,1]=4 2251 B13R0.147 CCCCCOCCCCC(=O)OC 34a_100000059025_100000718602 [1,0,0,0,0,0|1,0,0]=2 2252 B13R0.147 CCCCCOCCCCC(=O)OC 34a_100000210253_100000204269 [1,0,0,0,0,0|1,0,0]=2 2253 B13R0.147 CCCCCOCCCCC(=O)OC 7a_100000059025_100000210326 [1,0,0,0,0,0|1,0,0]=2 2254 B13R0.147 CCCCCOCCCCC(=O)OC 7a_100000210253_100000204269 [1,0,0,0,0,0|1,0,0]=2 2255 B13R0.147 CCCCCOCCOCC(=O)CC 7a_100011215259_100000747405 [1,0,0,0,0,0|3,0,0]=4 2256 B13R0.147 CCCCCOCCOCC(=O)NC 34a_100011215259_100000183359 [1,0,0,0,0,0|3,0,0]=4 2257 B13R0.147 CCCCCOCCOCC(=O)NC 7a_100011215259_100000183359 [1,0,0,0,0,0|3,0,0]=4 2258 B13R0.147 CCCCCOCCOCC(=O)OC 34a_100000210253_100000090808 [1,0,0,0,0,0|2,0,0]=3 2259 B13R0.147 CCCCCOCCOCC(=O)OC 34a_100011215259_100000747449 [1,0,0,0,0,0|2,0,0]=3 2260 B13R0.147 CCCCCOCCOCC(=O)OC 7a_100000210253_100000090808 [1,0,0,0,0,0|2,0,0]=3 2261 B13R0.147 CCCCCOCCOCC(=O)OC 7a_100011215259_100000747449 [1,0,0,0,0,0|2,0,0]=3 2262 B13R0.147 CCCCCSCCCCC(=O)OC 62a_100000204269_100000210326 [1,0,0,0,0,0|1,0,0]=2 2263 B13R0.147 CCCCCSCCCCC(=O)OC 62a_100000210326_100000204269 [1,0,0,0,0,0|1,0,0]=2 2264 B13R0.147 CCCCCSCCOCC(=O)OC 62a_100000090808_100000210326 [1,0,0,0,0,0|2,0,0]=3 2265 B13R0.147 CCCCCSCCOCC(=O)OC 62a_100000210326_100000090808 [1,0,0,0,0,0|2,0,0]=3 2266 B13R0.147 CCCCNCCCCCC(=O)OC 2230a_100000102301_100009816466 [1,0,0,0,0,0|1,0,0]=2 2267 B13R0.147 CCCCNCCCCCC(=O)OC 7a_106832991798_100009816466 [1,0,0,0,0,0|1,0,0]=2 2268 B13R0.147 CCCCNN=CCCCC(=O)OC 4a_100025702795_100000094087 [1,0,0,0,0,0|2,0,1]=4 2269 B13R0.147 CCCCOCCCCCC(=O)OC 34a_100000074720_100000210210 [1,0,0,0,0,0|1,0,0]=2 2270 B13R0.147 CCCCOCCCCCC(=O)OC 34a_100000210227_100009816466 [1,0,0,0,0,0|1,0,0]=2 2271 B13R0.147 CCCCOCCCCCC(=O)OC 7a_100000074720_100000210211 [1,0,0,0,0,0|1,0,0]=2 2272 B13R0.147 CCCCOCCCCCC(=O)OC 7a_100000210227_100009816466 [1,0,0,0,0,0|1,0,0]=2 2273 B13R0.147 CCCCOCCCNCC(=O)NC 2230a_200000211371_100000183359 [1,0,0,0,0,0|3,0,0]=4 2274 B13R0.147 CCCCOCCCNCC(=O)NC 34a_200000211371_100000183359 [1,0,0,0,0,0|3,0,0]=4 2275 B13R0.147 CCCCOCCCNCC(=O)OC 2230a_200000211371_100000747449 [1,0,0,0,0,0|2,0,0]=3 2276 B13R0.147 CCCCOCCCNCC(=O)OC 34a_200000211371_100000747449 [1,0,0,0,0,0|2,0,0]=3 2277 B13R0.147 CCCCOCCCOCC(=O)CC 7a_200011215613_100000747405 [1,0,0,0,0,0|3,0,0]=4 2278 B13R0.147 CCCCOCCCOCC(=O)NC 34a_200011215613_100000183359 [1,0,0,0,0,0|3,0,0]=4 2279 B13R0.147 CCCCOCCCOCC(=O)NC 7a_200011215613_100000183359 [1,0,0,0,0,0|3,0,0]=4 2280 B13R0.147 CCCCOCCCOCC(=O)OC 34a_200011215613_100000747449 [1,0,0,0,0,0|2,0,0]=3 2281 B13R0.147 CCCCOCCCOCC(=O)OC 7a_200011215613_100000747449 [1,0,0,0,0,0|2,0,0]=3 2282 B13R0.147 CCCCOCCNCCC(=O)NC 2230a_100000738227_100000743108 [1,0,0,0,0,0|3,0,0]=4 2283 B13R0.147 CCCCOCCNCCC(=O)NC 34a_100000738227_100000743108 [1,0,0,0,0,0|3,0,0]=4 2284 B13R0.147 CCCCOCCOCCC(=O)NC 34a_100000210238_100012179268 [1,0,0,0,0,0|3,0,0]=4 2285 B13R0.147 CCCCOCCOCCC(=O)NC 34a_100000754576_100000743108 [1,0,0,0,0,0|3,0,0]=4 2286 B13R0.147 CCCCOCCOCCC(=O)NC 7a_100000210238_100000737683 [1,0,0,0,0,0|3,0,0]=4 2287 B13R0.147 CCCCOCCOCCC(=O)OC 34a_100000210238_100000742370 [1,0,0,0,0,0|2,0,0]=3 2288 B13R0.147 CCCCOCCOCCC(=O)OC 7a_100000210238_100000204255 [1,0,0,0,0,0|2,0,0]=3 2289 B13R0.147 CCCCOCCSCCC(=O)NC 62a_100000737683_100000743108 [1,0,0,0,0,0|3,0,0]=4 2290 B13R0.147 CCCCOCCSCCC(=O)NC 62a_100000743108_100000737683 [1,0,0,0,0,0|3,0,0]=4 2291 B13R0.147 CCCCOCCSCCC(=O)OC 62a_100000204255_100000743108 [1,0,0,0,0,0|2,0,0]=3 2292 B13R0.147 CCCCOCCSCCC(=O)OC 62a_100000743108_100000204255 [1,0,0,0,0,0|2,0,0]=3 2293 B13R0.147 CCCCOCCSCOC(=O)OC 62a_100000743108_100000139417 [1,0,0,0,0,0|3,0,0]=4 2294 B13R0.147 CCCCOCNCCCC(=O)NC 2230a_100000740002_100011995733 [1,0,0,0,0,0|3,0,0]=4 2295 B13R0.147 CCCCOCNCCCC(=O)NC 34a_100000740002_100011995733 [1,0,0,0,0,0|3,0,0]=4 2296 B13R0.147 CCCCOCOCCNC(=O)OC 34a_100000757965_100011995733 [1,0,0,0,0,0|3,0,0]=4 2297 B13R0.147 CCCCOCOCCOC(=O)OC 34a_100010262106_100011995733 [1,0,0,0,0,0|3,0,0]=4 2298 B13R0.147 CCCCOCSCCCC(=O)NC 62a_100000741757_100011995733 [1,0,0,0,0,0|3,0,0]=4 2299 B13R0.147 CCCCOCSCCCC(=O)NC 62a_100011995733_100000741757 [1,0,0,0,0,0|3,0,0]=4 2300 B13R0.147 CCCCOCSCCCC(=O)OC 62a_100011218270_100011995733 [1,0,0,0,0,0|2,0,0]=3 2301 B13R0.147 CCCCOCSCCCC(=O)OC 62a_100011995733_100011218270 [1,0,0,0,0,0|2,0,0]=3 2302 B13R0.147 CCCCSCCCCCC(=O)OC 62a_100000210211_100009816466 [1,0,0,0,0,0|1,0,0]=2 2303 B13R0.147 CCCCSCCCCCC(=O)OC 62a_100009816466_100000210210 [1,0,0,0,0,0|1,0,0]=2 2304 B13R0.147 CCCCSCCNCCC(=O)NC 2230a_100025743550_100000737683 [1,0,0,0,0,0|3,0,0]=4 2305 B13R0.147 CCCCSCCNCCC(=O)OC 2230a_100025743550_100000204255 [1,0,0,0,0,0|2,0,0]=3 2306 B13R0.147 CCCCSCCOCCC(=O)NC 34a_200000230436_100012179268 [1,0,0,0,0,0|3,0,0]=4 2307 B13R0.147 CCCCSCCOCCC(=O)NC 7a_200000230436_100000737683 [1,0,0,0,0,0|3,0,0]=4 2308 B13R0.147 CCCCSCCOCCC(=O)OC 34a_200000230436_100000742370 [1,0,0,0,0,0|2,0,0]=3 2309 B13R0.147 CCCCSCCOCCC(=O)OC 7a_200000230436_100000204255 [1,0,0,0,0,0|2,0,0]=3 2310 B13R0.147 CCCNN=CCCCCC(=O)OC 4a_100000740057_100000052768 [1,0,0,0,0,0|2,0,1]=4 2311 B13R0.147 CCCOCCCCCCC(=O)OC 34a_100000210258_100009815986 [1,0,0,0,0,0|1,0,0]=2 2312 B13R0.147 CCCOCCCCCCC(=O)OC 34a_100009863599_100000210303 [1,0,0,0,0,0|1,0,0]=2 2313 B13R0.147 CCCOCCCCCCC(=O)OC 7a_100009863599_100000210303 [1,0,0,0,0,0|1,0,0]=2 2314 B13R0.147 CCCOCCCNCCC(=O)NC 2230a_100011217757_100000737683 [1,0,0,0,0,0|3,0,0]=4 2315 B13R0.147 CCCOCCCNCCC(=O)NC 34a_100011217757_100012179268 [1,0,0,0,0,0|3,0,0]=4 2316 B13R0.147 CCCOCCCNCCC(=O)OC 2230a_100011217757_100000204255 [1,0,0,0,0,0|2,0,0]=3 2317 B13R0.147 CCCOCCCNCCC(=O)OC 34a_100011217757_100000742370 [1,0,0,0,0,0|2,0,0]=3 2318 B13R0.147 CCCOCCNCCCC(=O)NC 2230a_100000740002_100011215938 [1,0,0,0,0,0|3,0,0]=4 2319 B13R0.147 CCCOCCNCCCC(=O)NC 2230a_100161115042_100000741757 [1,0,0,0,0,0|3,0,0]=4 2320 B13R0.147 CCCOCCNCCCC(=O)NC 34a_100000740002_100011215938 [1,0,0,0,0,0|3,0,0]=4 2321 B13R0.147 CCCOCCNCCCC(=O)NC 34a_100161115042_100000741757 [1,0,0,0,0,0|3,0,0]=4 2322 B13R0.147 CCCOCCNCCCC(=O)OC 2230a_100161115042_100011218270 [1,0,0,0,0,0|2,0,0]=3 2323 B13R0.147 CCCOCCNCCCC(=O)OC 34a_100161115042_100000742333 [1,0,0,0,0,0|2,0,0]=3 2324 B13R0.147 CCCOCCOCCCC(=O)NC 34a_100000752267_100000741757 [1,0,0,0,0,0|3,0,0]=4 2325 B13R0.147 CCCOCCOCCCC(=O)NC 7a_100000752267_100000741757 [1,0,0,0,0,0|3,0,0]=4 2326 B13R0.147 CCCOCCOCCCC(=O)OC 34a_100000752267_100000742333 [1,0,0,0,0,0|2,0,0]=3 2327 B13R0.147 CCCOCCOCCCC(=O)OC 7a_100000752267_100011218270 [1,0,0,0,0,0|2,0,0]=3 2328 B13R0.147 CCCOCCOCCNC(=O)OC 34a_100000757965_100011215938 [1,0,0,0,0,0|3,0,0]=4 2329 B13R0.147 CCCOCCOCCOC(=O)OC 34a_100010262106_100011215938 [1,0,0,0,0,0|3,0,0]=4 2330 B13R0.147 CCCOCCSCCCC(=O)NC 62a_100000741757_100011215938 [1,0,0,0,0,0|3,0,0]=4 2331 B13R0.147 CCCOCCSCCCC(=O)NC 62a_100011215938_100000741757 [1,0,0,0,0,0|3,0,0]=4 2332 B13R0.147 CCCOCCSCCCC(=O)OC 62a_100011215938_100011218270 [1,0,0,0,0,0|2,0,0]=3 2333 B13R0.147 CCCOCCSCCCC(=O)OC 62a_100011218270_100011215938 [1,0,0,0,0,0|2,0,0]=3 2334 B13R0.147 CCCSCCCCCCC(=O)OC 62a_100000210303_100009815986 [1,0,0,0,0,0|1,0,0]=2 2335 B13R0.147 CCCSCCCCCCC(=O)OC 62a_100009815986_100000210303 [1,0,0,0,0,0|1,0,0]=2 2336 B13R0.147 CCCSCCNCCCC(=O)NC 2230a_100020603323_100000741757 [1,0,0,0,0,0|3,0,0]=4 2337 B13R0.147 CCCSCCNCCCC(=O)OC 2230a_100020603323_100011218270 [1,0,0,0,0,0|2,0,0]=3 2338 B13R0.147 CCCSCCOCCCC(=O)NC 34a_200000230433_100000741757 [1,0,0,0,0,0|3,0,0]=4 2339 B13R0.147 CCCSCCOCCCC(=O)NC 7a_200000230433_100000741757 [1,0,0,0,0,0|3,0,0]=4 2340 B13R0.147 CCCSCCOCCCC(=O)OC 34a_200000230433_100000742333 [1,0,0,0,0,0|2,0,0]=3 2341 B13R0.147 CCCSCCOCCCC(=O)OC 7a_200000230433_100011218270 [1,0,0,0,0,0|2,0,0]=3 2342 B13R0.147 CCNCCCCCCCC(=O)OC 2230a_100015525214_100010004213 [1,0,0,0,0,0|1,0,0]=2 2343 B13R0.147 CCOCCCCCCCC(=O)OC 34a_100011022521_100000210202 [1,0,0,0,0,0|1,0,0]=2 2344 B13R0.147 CCOCCCCCCCC(=O)OC 34a_100121572206_100010004213 [1,0,0,0,0,0|1,0,0]=2 2345 B13R0.147 CCOCCCCCCCC(=O)OC 7a_100011022521_100000210202 [1,0,0,0,0,0|1,0,0]=2 2346 B13R0.147 CCOCCCNCCCC(=O)NC 2230a_100000210961_100000741757 [1,0,0,0,0,0|3,0,0]=4 2347 B13R0.147 CCOCCCNCCCC(=O)NC 2230a_100000740002_100012232248 [1,0,0,0,0,0|3,0,0]=4 2348 B13R0.147 CCOCCCNCCCC(=O)NC 34a_100000210961_100000741757 [1,0,0,0,0,0|3,0,0]=4 2349 B13R0.147 CCOCCCNCCCC(=O)NC 34a_100000740002_100012232248 [1,0,0,0,0,0|3,0,0]=4 2350 B13R0.147 CCOCCCNCCCC(=O)OC 2230a_100000210961_100011218270 [1,0,0,0,0,0|2,0,0]=3 2351 B13R0.147 CCOCCCNCCCC(=O)OC 34a_100000210961_100000742333 [1,0,0,0,0,0|2,0,0]=3 2352 B13R0.147 CCOCCCOCCCC(=O)NC 34a_100000757476_100000741757 [1,0,0,0,0,0|3,0,0]=4 2353 B13R0.147 CCOCCCOCCCC(=O)NC 7a_100000757476_100000741757 [1,0,0,0,0,0|3,0,0]=4 2354 B13R0.147 CCOCCCOCCCC(=O)OC 34a_100000757476_100000742333 [1,0,0,0,0,0|2,0,0]=3 2355 B13R0.147 CCOCCCOCCCC(=O)OC 7a_100000757476_100011218270 [1,0,0,0,0,0|2,0,0]=3 2356 B13R0.147 CCOCCCOCCNC(=O)OC 34a_100000757965_100012232248 [1,0,0,0,0,0|3,0,0]=4 2357 B13R0.147 CCOCCCOCCOC(=O)OC 34a_100010262106_100012232248 [1,0,0,0,0,0|3,0,0]=4 2358 B13R0.147 CCOCCCSCCCC(=O)NC 62a_100000741757_100012232248 [1,0,0,0,0,0|3,0,0]=4 2359 B13R0.147 CCOCCCSCCCC(=O)NC 62a_100012232248_100000741757 [1,0,0,0,0,0|3,0,0]=4 2360 B13R0.147 CCOCCCSCCCC(=O)OC 62a_100011218270_100012232248 [1,0,0,0,0,0|2,0,0]=3 2361 B13R0.147 CCOCCCSCCCC(=O)OC 62a_100012232248_100011218270 [1,0,0,0,0,0|2,0,0]=3 2362 B13R0.147 CCOCCNCCCCC(=O)OC 2230a_102516460346_100000204269 [1,0,0,0,0,0|2,0,0]=3 2363 B13R0.147 CCOCCNCCCCC(=O)OC 34a_102516460346_100000204269 [1,0,0,0,0,0|2,0,0]=3 2364 B13R0.147 CCOCCNCCOCC(=O)OC 2230a_102516460346_100000090808 [1,0,0,0,0,0|3,0,0]=4 2365 B13R0.147 CCOCCNCCOCC(=O)OC 34a_102516460346_100000090808 [1,0,0,0,0,0|3,0,0]=4 2366 B13R0.147 CCOCCOCCCCC(=O)OC 34a_100000059025_100000210147 [1,0,0,0,0,0|2,0,0]=3 2367 B13R0.147 CCOCCOCCCCC(=O)OC 34a_100000210136_100000204269 [1,0,0,0,0,0|2,0,0]=3 2368 B13R0.147 CCOCCOCCCCC(=O)OC 7a_100000059025_100011215890 [1,0,0,0,0,0|2,0,0]=3 2369 B13R0.147 CCOCCOCCCCC(=O)OC 7a_100000210136_100000204269 [1,0,0,0,0,0|2,0,0]=3 2370 B13R0.147 CCOCCOCCNCC(=O)OC 2230a_100102712874_100000747449 [1,0,0,0,0,0|3,0,0]=4 2371 B13R0.147 CCOCCOCCNCC(=O)OC 34a_100102712874_100000747449 [1,0,0,0,0,0|3,0,0]=4 2372 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100000210136_100000090808 [1,0,0,0,0,0|3,0,0]=4 2373 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100000210240_100000747449 [1,0,0,0,0,0|3,0,0]=4 2374 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100011023656_100000210202 [1,0,0,0,0,0|3,0,0]=4 2375 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100000210136_100000090808 [1,0,0,0,0,0|3,0,0]=4 2376 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100000210240_100000747449 [1,0,0,0,0,0|3,0,0]=4 2377 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100011023656_100000210202 [1,0,0,0,0,0|3,0,0]=4 2378 B13R0.147 CCOCCOCCSCC(=O)OC 62a_100000747449_100011211534 [1,0,0,0,0,0|3,0,0]=4 2379 B13R0.147 CCOCCOCCSCC(=O)OC 62a_100011211534_100000747449 [1,0,0,0,0,0|3,0,0]=4 2380 B13R0.147 CCOCCSCCCCC(=O)OC 62a_100000204269_100011215890 [1,0,0,0,0,0|2,0,0]=3 2381 B13R0.147 CCOCCSCCCCC(=O)OC 62a_100000210147_100000204269 [1,0,0,0,0,0|2,0,0]=3 2382 B13R0.147 CCOCCSCCOCC(=O)OC 62a_100000090808_100011215890 [1,0,0,0,0,0|3,0,0]=4 2383 B13R0.147 CCOCCSCCOCC(=O)OC 62a_100000210147_100000090808 [1,0,0,0,0,0|3,0,0]=4 2384 B13R0.147 CCOCSCCCCCC(=O)OC 62a_100000739092_100009816466 [1,0,0,0,0,0|2,0,0]=3 2385 B13R0.147 CCOCSCCCCCC(=O)OC 62a_100009816466_100000739092 [1,0,0,0,0,0|2,0,0]=3 2386 B13R0.147 CCSCCCCCCCC(=O)OC 62a_100000210202_100010004213 [1,0,0,0,0,0|1,0,0]=2 2387 B13R0.147 CCSCCCCCCCC(=O)OC 62a_100010004213_100000210202 [1,0,0,0,0,0|1,0,0]=2 2388 B13R0.147 CCSCCCOCCCC(=O)NC 34a_100011216438_100000741757 [1,0,0,0,0,0|3,0,0]=4 2389 B13R0.147 CCSCCCOCCCC(=O)NC 7a_100011216438_100000741757 [1,0,0,0,0,0|3,0,0]=4 2390 B13R0.147 CCSCCCOCCCC(=O)OC 34a_100011216438_100000742333 [1,0,0,0,0,0|2,0,0]=3 2391 B13R0.147 CCSCCCOCCCC(=O)OC 7a_100011216438_100011218270 [1,0,0,0,0,0|2,0,0]=3 2392 B13R0.147 CCSCCNCCCCC(=O)OC 2230a_100000106463_100000204269 [1,0,0,0,0,0|2,0,0]=3 2393 B13R0.147 CCSCCNCCOCC(=O)OC 2230a_100000106463_100000090808 [1,0,0,0,0,0|3,0,0]=4 2394 B13R0.147 CCSCCOCCCCC(=O)OC 34a_100000059025_100000757381 [1,0,0,0,0,0|2,0,0]=3 2395 B13R0.147 CCSCCOCCCCC(=O)OC 34a_100000212035_100000204269 [1,0,0,0,0,0|2,0,0]=3 2396 B13R0.147 CCSCCOCCCCC(=O)OC 7a_100000059025_100000757381 [1,0,0,0,0,0|2,0,0]=3 2397 B13R0.147 CCSCCOCCCCC(=O)OC 7a_100000212035_100000204269 [1,0,0,0,0,0|2,0,0]=3 2398 B13R0.147 CCSCCOCCOCC(=O)OC 34a_100000212035_100000090808 [1,0,0,0,0,0|3,0,0]=4 2399 B13R0.147 CCSCCOCCOCC(=O)OC 7a_100000212035_100000090808 [1,0,0,0,0,0|3,0,0]=4 2400 B13R0.147 CCSCCSCCCCC(=O)OC 62a_100000204269_100000757381 [1,0,0,0,0,0|2,0,0]=3 2401 B13R0.147 CCSCCSCCCCC(=O)OC 62a_100000757381_100000204269 [1,0,0,0,0,0|2,0,0]=3 2402 B13R0.147 CCSCCSCCOCC(=O)OC 62a_100000090808_100000757381 [1,0,0,0,0,0|3,0,0]=4 2403 B13R0.147 CCSCCSCCOCC(=O)OC 62a_100000757381_100000090808 [1,0,0,0,0,0|3,0,0]=4 2404 B13R0.147 CNC(=O)CCCCCCCCCF 11a_106832991635_200009909015 [1,0,0,0,0,0|2,0,0]=3 2405 B13R0.147 CNC(=O)CCCCCCCCCF 240690a_100102657272_200009909015 [1,0,0,0,0,0|2,0,0]=3 2406 B13R0.147 CNC(=O)CCCCCCCCCF 527a_100102657272_200009909015 [1,0,0,0,0,0|2,0,0]=3 2407 B13R0.147 CNC(=O)CCCCCCCCCO 240690a_100102657272_100000032657 [1,0,0,0,0,0|2,0,0]=3 2408 B13R0.147 CNC(=O)CCCNCCCCCF 2230a_100000740002_100000729378 [1,0,0,0,0,0|3,0,0]=4 2409 B13R0.147 CNC(=O)CCCNCCCCCF 34a_100000740002_100000729378 [1,0,0,0,0,0|3,0,0]=4 2410 B13R0.147 CNC(=O)CCCNCCCCCO 2230a_100000740002_100000746330 [1,0,0,0,0,0|3,0,0]=4 2411 B13R0.147 CNC(=O)CCCNCCCCCO 2230a_100000762737_100000741757 [1,0,0,0,0,0|3,0,0]=4 2412 B13R0.147 CNC(=O)CCCNCCCCCO 34a_100000740002_100000746330 [1,0,0,0,0,0|3,0,0]=4 2413 B13R0.147 CNC(=O)CCCNCCCCCO 34a_100000762737_100000741757 [1,0,0,0,0,0|3,0,0]=4 2414 B13R0.147 CNC(=O)CCCNCCCCOC 2230a_100000740002_100000730899 [1,0,0,0,0,0|3,0,0]=4 2415 B13R0.147 CNC(=O)CCCNCCCCOC 34a_100000740002_100000755781 [1,0,0,0,0,0|3,0,0]=4 2416 B13R0.147 CNC(=O)CCCOCCCCCBr 34a_100000746331_100000741757 [1,0,0,0,0,0|3,0,0]=4 2417 B13R0.147 CNC(=O)CCCOCCCCCBr 7a_100000746331_100000741757 [1,0,0,0,0,0|3,0,0]=4 2418 B13R0.147 CNC(=O)CCCOCCCCCCl 34a_100000746330_100000741757 [1,0,0,0,0,0|3,0,0]=4 2419 B13R0.147 CNC(=O)CCCOCCCCCCl 7a_100000746330_100000741757 [1,0,0,0,0,0|3,0,0]=4 2420 B13R0.147 CNC(=O)CCCOCCCCCI 34a_200012148887_100000741757 [1,0,0,0,0,0|3,0,0]=4 2421 B13R0.147 CNC(=O)CCCOCCCCCI 7a_200012148887_100000741757 [1,0,0,0,0,0|3,0,0]=4 2422 B13R0.147 CNC(=O)CCCOCCCCCN 34a_100000762737_100000741757 [1,0,0,0,0,0|3,0,0]=4 2423 B13R0.147 CNC(=O)CCCOCCCCOC 34a_100000740925_100000741757 [1,0,0,0,0,0|3,0,0]=4 2424 B13R0.147 CNC(=O)CCCOCCCCSC 34a_100011217163_100000741757 [1,0,0,0,0,0|3,0,0]=4 2425 B13R0.147 CNC(=O)CCCOCCCCSC 7a_100011217163_100000741757 [1,0,0,0,0,0|3,0,0]=4 2426 B13R0.147 CNC(=O)CCCSCCCCCF 62a_100000729378_100000741757 [1,0,0,0,0,0|3,0,0]=4 2427 B13R0.147 CNC(=O)CCCSCCCCCF 62a_100000741757_100000729378 [1,0,0,0,0,0|3,0,0]=4 2428 B13R0.147 CNC(=O)CCCSCCCCCO 62a_100000741757_100000746330 [1,0,0,0,0,0|3,0,0]=4 2429 B13R0.147 CNC(=O)CCCSCCCCCO 62a_100000746330_100000741757 [1,0,0,0,0,0|3,0,0]=4 2430 B13R0.147 CNC(=O)CCCSCCCCOC 62a_100000730899_100000741757 [1,0,0,0,0,0|3,0,0]=4 2431 B13R0.147 CNC(=O)CCCSCCCCOC 62a_100000741757_100000730899 [1,0,0,0,0,0|3,0,0]=4 2432 B13R0.147 CNC(=O)CCNCCCCCCF 2230a_100000738227_100015922095 [1,0,0,0,0,0|3,0,0]=4 2433 B13R0.147 CNC(=O)CCNCCCCCCF 34a_100000738227_100015922095 [1,0,0,0,0,0|3,0,0]=4 2434 B13R0.147 CNC(=O)CCNCCCCCCO 2230a_100000686447_100000737683 [1,0,0,0,0,0|3,0,0]=4 2435 B13R0.147 CNC(=O)CCNCCCCCCO 2230a_100000738227_100000766143 [1,0,0,0,0,0|3,0,0]=4 2436 B13R0.147 CNC(=O)CCNCCCCCCO 34a_100000686447_100012179268 [1,0,0,0,0,0|3,0,0]=4 2437 B13R0.147 CNC(=O)CCNCCCCCCO 34a_100000738227_100000766143 [1,0,0,0,0,0|3,0,0]=4 2438 B13R0.147 CNC(=O)CCNCCCCCOC 2230a_100000747528_100000737683 [1,0,0,0,0,0|3,0,0]=4 2439 B13R0.147 CNC(=O)CCNCCCCCOC 34a_100000747528_100012179268 [1,0,0,0,0,0|3,0,0]=4 2440 B13R0.147 CNC(=O)CCOCCCCCCBr 34a_100011215345_100012179268 [1,0,0,0,0,0|3,0,0]=4 2441 B13R0.147 CNC(=O)CCOCCCCCCBr 7a_100011215345_100000737683 [1,0,0,0,0,0|3,0,0]=4 2442 B13R0.147 CNC(=O)CCOCCCCCCCl 34a_100000766143_100012179268 [1,0,0,0,0,0|3,0,0]=4 2443 B13R0.147 CNC(=O)CCOCCCCCCCl 7a_100000766143_100000737683 [1,0,0,0,0,0|3,0,0]=4 2444 B13R0.147 CNC(=O)CCOCCCCCCF 34a_100000732779_100012179268 [1,0,0,0,0,0|3,0,0]=4 2445 B13R0.147 CNC(=O)CCOCCCCCCF 34a_100000754576_100015922095 [1,0,0,0,0,0|3,0,0]=4 2446 B13R0.147 CNC(=O)CCOCCCCCCF 7a_100000732779_100000737683 [1,0,0,0,0,0|3,0,0]=4 2447 B13R0.147 CNC(=O)CCOCCCCCCN 34a_100000686447_100012179268 [1,0,0,0,0,0|3,0,0]=4 2448 B13R0.147 CNC(=O)CCOCCCCCCO 34a_100000754576_100000766143 [1,0,0,0,0,0|3,0,0]=4 2449 B13R0.147 CNC(=O)CCSCCCCCCF 62a_100000737683_100015922095 [1,0,0,0,0,0|3,0,0]=4 2450 B13R0.147 CNC(=O)CCSCCCCCCF 62a_100015922095_100000737683 [1,0,0,0,0,0|3,0,0]=4 2451 B13R0.147 CNC(=O)CCSCCCCCCO 62a_100000737683_100000766143 [1,0,0,0,0,0|3,0,0]=4 2452 B13R0.147 CNC(=O)CCSCCCCCCO 62a_100000766143_100000737683 [1,0,0,0,0,0|3,0,0]=4 2453 B13R0.147 CNC(=O)CNCCCCCCCO 2230a_100000693194_100000760002 [1,0,0,0,0,0|3,0,0]=4 2454 B13R0.147 CNC(=O)CNCCCCCCCO 2230a_100011996573_100000183359 [1,0,0,0,0,0|3,0,0]=4 2455 B13R0.147 CNC(=O)CNCCCCCCCO 34a_100011996573_100000183359 [1,0,0,0,0,0|3,0,0]=4 2456 B13R0.147 CNC(=O)CNCCCCCCOC 2230a_100000693194_100011998445 [1,0,0,0,0,0|3,0,0]=4 2457 B13R0.147 CNC(=O)COCCCCCCCBr 34a_100000760002_100000183359 [1,0,0,0,0,0|3,0,0]=4 2458 B13R0.147 CNC(=O)COCCCCCCCBr 7a_100000760002_100000183359 [1,0,0,0,0,0|3,0,0]=4 2459 B13R0.147 CNC(=O)COCCCCCCCN 34a_100011996573_100000183359 [1,0,0,0,0,0|3,0,0]=4 2460 B13R0.147 CNC(=O)COCCCCCCCO 34a_100000750040_100000760002 [1,0,0,0,0,0|3,0,0]=4 2461 B13R0.147 CNC(=O)COCCCCCCOC 34a_100000750040_100011998445 [1,0,0,0,0,0|3,0,0]=4 2462 B13R0.147 CNC(=O)COCCCCCCOC 34a_200012092642_100000183359 [1,0,0,0,0,0|3,0,0]=4 2463 B13R0.147 CNC(=O)COCCCCCCOC 7a_200012092642_100000183359 [1,0,0,0,0,0|3,0,0]=4 2464 B13R0.147 CNC(=O)CSCCCCCCCO 62a_100000183359_100000760002 [1,0,0,0,0,0|3,0,0]=4 2465 B13R0.147 CNC(=O)CSCCCCCCCO 62a_100000760002_100000183359 [1,0,0,0,0,0|3,0,0]=4 2466 B13R0.147 CNC(=O)CSCCCCCCOC 62a_100000183359_100011998445 [1,0,0,0,0,0|3,0,0]=4 2467 B13R0.147 CNC(=O)CSCCCCCCOC 62a_100011998445_100000183359 [1,0,0,0,0,0|3,0,0]=4 2468 B13R0.147 CNC(=O)NCCCCCCCCO 2708a_100102657272_102515433106 [1,0,0,0,0,0|3,0,0]=4 2469 B13R0.147 CNC(=O)NCCCCCCCCO 2708a_102515433106_106832991635 [1,0,0,0,0,0|3,0,0]=4 2470 B13R0.147 CNC(=O)NCCCCCCCCO 273464a_100102657272_102515433106 [1,0,0,0,0,0|3,0,0]=4 2471 B13R0.147 CNC(=O)NCCCCCCCCO 273464a_102515433106_100102657272 [1,0,0,0,0,0|3,0,0]=4 2472 B13R0.147 CNC(=O)NCCCCCCCCO 512a_102515433106_100102657272 [1,0,0,0,0,0|3,0,0]=4 2473 B13R0.147 CNC(=O)NCCCCCCCCO 512a_106832991638_102515433106 [1,0,0,0,0,0|3,0,0]=4 2474 B13R0.147 CNCCCCCCCCC(=O)OC 2230a_106832991635_100010282707 [1,0,0,0,0,0|1,0,0]=2 2475 B13R0.147 CNCCCCCCCCC(=O)OC 34a_100102657272_100010282707 [1,0,0,0,0,0|1,0,0]=2 2476 B13R0.147 CNCCCCCCCCC(=O)OC 7a_106832991635_100010282707 [1,0,0,0,0,0|1,0,0]=2 2477 B13R0.147 CNCCCCCOCCC(=O)NC 34a_100000722520_100012179268 [1,0,0,0,0,0|3,0,0]=4 2478 B13R0.147 CNCCCCCOCCC(=O)OC 34a_100000722520_100000742370 [1,0,0,0,0,0|2,0,0]=3 2479 B13R0.147 CNCCCOCCCCC(=O)OC 34a_100000213112_100000204269 [1,0,0,0,0,0|2,0,0]=3 2480 B13R0.147 CNCCCOCCOCC(=O)OC 34a_100000213112_100000090808 [1,0,0,0,0,0|3,0,0]=4 2481 B13R0.147 CNCCOCCOCCC(=O)OC 34a_100000228057_100000742370 [1,0,0,0,0,0|3,0,0]=4 2482 B13R0.147 COC(=O)CCCCCCCCO[13CH3] 34a_100000035544_200025704644 [1,0,0,0,0,0|1,0,0]=2 2483 B13R0.147 COC(=O)CCCCCCCCO[13CH3] 7a_100000035544_200025704644 [1,0,0,0,0,0|1,0,0]=2 2484 B13R0.147 COC(=O)CCCCCCCCSC 62a_100010282707_200000210301 [1,0,0,0,0,0|1,0,0]=2 2485 B13R0.147 COC(=O)CCCCCCCCSC 62a_200000210301_100010282707 [1,0,0,0,0,0|1,0,0]=2 2486 B13R0.147 COC(=O)CCCCCCCCS[13CH3] 62a_100010282707_200025704644 [1,0,0,0,0,0|1,0,0]=2 2487 B13R0.147 COC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100010282707 [1,0,0,0,0,0|1,0,0]=2 2488 B13R0.147 COC(=O)CCCCCCCOCF 34a_100011022521_100015361967 [1,0,0,0,0,0|2,0,0]=3 2489 B13R0.147 COC(=O)CCCCCCCOCF 7a_100011022521_100015361967 [1,0,0,0,0,0|2,0,0]=3 2490 B13R0.147 COC(=O)CCCCCCCSCF 62a_100010004213_100015361967 [1,0,0,0,0,0|2,0,0]=3 2491 B13R0.147 COC(=O)CCCCCCCSCF 62a_100015361967_100010004213 [1,0,0,0,0,0|2,0,0]=3 2492 B13R0.147 COC(=O)CCCCCCNCCF 34a_100000724931_100009815986 [1,0,0,0,0,0|2,0,0]=3 2493 B13R0.147 COC(=O)CCCCCCNCCO 2230a_100016997473_100009815986 [1,0,0,0,0,0|2,0,0]=3 2494 B13R0.147 COC(=O)CCCCCCNCCO 34a_100016990907_100009815986 [1,0,0,0,0,0|2,0,0]=3 2495 B13R0.147 COC(=O)CCCCCCOCC#N 7a_100009863599_100011215382 [1,0,0,0,0,0|2,0,1]=4 2496 B13R0.147 COC(=O)CCCCCCOCC=O 34a_100009863599_200009817547 [1,0,0,0,0,0|2,0,1]=4 2497 B13R0.147 COC(=O)CCCCCCOCC=O 7a_100009863599_200015260668 [1,0,0,0,0,0|2,0,1]=4 2498 B13R0.147 COC(=O)CCCCCCOCCBr 34a_100000211926_100009815986 [1,0,0,0,0,0|2,0,0]=3 2499 B13R0.147 COC(=O)CCCCCCOCCF 34a_100009863599_100011217306 [1,0,0,0,0,0|2,0,0]=3 2500 B13R0.147 COC(=O)CCCCCCOCCF 7a_100009863599_100011217306 [1,0,0,0,0,0|2,0,0]=3 2501 B13R0.147 COC(=O)CCCCCCOCCN 34a_100000210304_100009815986 [1,0,0,0,0,0|2,0,0]=3 2502 B13R0.147 COC(=O)CCCCCCOCCO 34a_100009863599_100000211926 [1,0,0,0,0,0|2,0,0]=3 2503 B13R0.147 COC(=O)CCCCCCOCCO 7a_100009863599_100000211926 [1,0,0,0,0,0|2,0,0]=3 2504 B13R0.147 COC(=O)CCCCCCOCSC 34a_100009863599_100011218213 [1,0,0,0,0,0|2,0,0]=3 2505 B13R0.147 COC(=O)CCCCCCSCC#N 62a_100009815986_100011215382 [1,0,0,0,0,0|2,0,1]=4 2506 B13R0.147 COC(=O)CCCCCCSCC#N 62a_100011215382_100009815986 [1,0,0,0,0,0|2,0,1]=4 2507 B13R0.147 COC(=O)CCCCCCSCC=O 62a_100009815986_200015260668 [1,0,0,0,0,0|2,0,1]=4 2508 B13R0.147 COC(=O)CCCCCCSCC=O 62a_200015260668_100009815986 [1,0,0,0,0,0|2,0,1]=4 2509 B13R0.147 COC(=O)CCCCCCSCCF 62a_100009815986_100011217306 [1,0,0,0,0,0|2,0,0]=3 2510 B13R0.147 COC(=O)CCCCCCSCCF 62a_100011217306_100009815986 [1,0,0,0,0,0|2,0,0]=3 2511 B13R0.147 COC(=O)CCCCCCSCCO 62a_100000211926_100009815986 [1,0,0,0,0,0|2,0,0]=3 2512 B13R0.147 COC(=O)CCCCCCSCCO 62a_100009815986_100000211926 [1,0,0,0,0,0|2,0,0]=3 2513 B13R0.147 COC(=O)CCCCCCSCSC 62a_100009815986_100011218213 [1,0,0,0,0,0|2,0,0]=3 2514 B13R0.147 COC(=O)CCCCCCSCSC 62a_100011218213_100009815986 [1,0,0,0,0,0|2,0,0]=3 2515 B13R0.147 COC(=O)CCCCCNCCCF 2230a_100015189416_100009816466 [1,0,0,0,0,0|2,0,0]=3 2516 B13R0.147 COC(=O)CCCCCNCCCF 34a_100015189416_100009816466 [1,0,0,0,0,0|2,0,0]=3 2517 B13R0.147 COC(=O)CCCCCNCCSC 2230a_100020590264_100009816466 [1,0,0,0,0,0|2,0,0]=3 2518 B13R0.147 COC(=O)CCCCCOCCC#N 7a_100000074720_100000184422 [1,0,0,0,0,0|2,0,1]=4 2519 B13R0.147 COC(=O)CCCCCOCCCBr 34a_100011217188_100009816466 [1,0,0,0,0,0|2,0,0]=3 2520 B13R0.147 COC(=O)CCCCCOCCCCl 34a_100000230001_100009816466 [1,0,0,0,0,0|2,0,0]=3 2521 B13R0.147 COC(=O)CCCCCOCCCF 34a_100000074720_100011934791 [1,0,0,0,0,0|2,0,0]=3 2522 B13R0.147 COC(=O)CCCCCOCCCF 34a_100000759539_100009816466 [1,0,0,0,0,0|2,0,0]=3 2523 B13R0.147 COC(=O)CCCCCOCCCF 7a_100000074720_100011934791 [1,0,0,0,0,0|2,0,0]=3 2524 B13R0.147 COC(=O)CCCCCOCCCN 34a_100000182051_100009816466 [1,0,0,0,0,0|2,0,0]=3 2525 B13R0.147 COC(=O)CCCCCOCCCO 34a_100000074720_100000230001 [1,0,0,0,0,0|2,0,0]=3 2526 B13R0.147 COC(=O)CCCCCOCCCO 7a_100000074720_100011215043 [1,0,0,0,0,0|2,0,0]=3 2527 B13R0.147 COC(=O)CCCCCOCCON 34a_100000700252_100009816466 [1,0,0,0,0,0|3,0,0]=4 2528 B13R0.147 COC(=O)CCCCCOCCSC 34a_100000074720_100000212216 [1,0,0,0,0,0|2,0,0]=3 2529 B13R0.147 COC(=O)CCCCCOCCSC 34a_100000230434_100009816466 [1,0,0,0,0,0|2,0,0]=3 2530 B13R0.147 COC(=O)CCCCCOCCSC 7a_100000074720_100000212216 [1,0,0,0,0,0|2,0,0]=3 2531 B13R0.147 COC(=O)CCCCCOCCSC 7a_100000230434_100009816466 [1,0,0,0,0,0|2,0,0]=3 2532 B13R0.147 COC(=O)CCCCCSCCC#N 62a_100009816466_100011215226 [1,0,0,0,0,0|2,0,1]=4 2533 B13R0.147 COC(=O)CCCCCSCCC#N 62a_100011215226_100009816466 [1,0,0,0,0,0|2,0,1]=4 2534 B13R0.147 COC(=O)CCCCCSCCCF 62a_100009816466_100011934791 [1,0,0,0,0,0|2,0,0]=3 2535 B13R0.147 COC(=O)CCCCCSCCCF 62a_100011934791_100009816466 [1,0,0,0,0,0|2,0,0]=3 2536 B13R0.147 COC(=O)CCCCCSCCCO 62a_100009816466_100011215043 [1,0,0,0,0,0|2,0,0]=3 2537 B13R0.147 COC(=O)CCCCCSCCCO 62a_100011215043_100009816466 [1,0,0,0,0,0|2,0,0]=3 2538 B13R0.147 COC(=O)CCCCCSCCSC 62a_100000212216_100009816466 [1,0,0,0,0,0|2,0,0]=3 2539 B13R0.147 COC(=O)CCCCCSCCSC 62a_100009816466_100000751147 [1,0,0,0,0,0|2,0,0]=3 2540 B13R0.147 COC(=O)CCCCNCCCCO 2230a_100000750430_100000204269 [1,0,0,0,0,0|2,0,0]=3 2541 B13R0.147 COC(=O)CCCCNCCCCO 34a_100000750430_100000204269 [1,0,0,0,0,0|2,0,0]=3 2542 B13R0.147 COC(=O)CCCCNCCCSC 2230a_100000749238_100000204269 [1,0,0,0,0,0|2,0,0]=3 2543 B13R0.147 COC(=O)CCCCOCCCC#N 7a_100000059025_100000687738 [1,0,0,0,0,0|2,0,1]=4 2544 B13R0.147 COC(=O)CCCCOCCCC=O 7a_100000059025_200011292268 [1,0,0,0,0,0|2,0,1]=4 2545 B13R0.147 COC(=O)CCCCOCCCCBr 34a_100011216708_100000204269 [1,0,0,0,0,0|2,0,0]=3 2546 B13R0.147 COC(=O)CCCCOCCCCCl 34a_100000210776_100000204269 [1,0,0,0,0,0|2,0,0]=3 2547 B13R0.147 COC(=O)CCCCOCCCCCl 7a_100000210776_100000204269 [1,0,0,0,0,0|2,0,0]=3 2548 B13R0.147 COC(=O)CCCCOCCCCF 34a_100000059025_100000729493 [1,0,0,0,0,0|2,0,0]=3 2549 B13R0.147 COC(=O)CCCCOCCCCF 34a_100011995726_100000204269 [1,0,0,0,0,0|2,0,0]=3 2550 B13R0.147 COC(=O)CCCCOCCCCF 7a_100000059025_100000729493 [1,0,0,0,0,0|2,0,0]=3 2551 B13R0.147 COC(=O)CCCCOCCCCF 7a_100011995726_100000204269 [1,0,0,0,0,0|2,0,0]=3 2552 B13R0.147 COC(=O)CCCCOCCCCI 34a_200012148704_100000204269 [1,0,0,0,0,0|2,0,0]=3 2553 B13R0.147 COC(=O)CCCCOCCCCN 34a_100000750430_100000204269 [1,0,0,0,0,0|2,0,0]=3 2554 B13R0.147 COC(=O)CCCCOCCCCO 34a_100000059025_100011216708 [1,0,0,0,0,0|2,0,0]=3 2555 B13R0.147 COC(=O)CCCCOCCCCO 7a_100000059025_100000210776 [1,0,0,0,0,0|2,0,0]=3 2556 B13R0.147 COC(=O)CCCCOCCCSC 34a_100000690336_100000204269 [1,0,0,0,0,0|2,0,0]=3 2557 B13R0.147 COC(=O)CCCCOCCCSC 7a_100000690336_100000204269 [1,0,0,0,0,0|2,0,0]=3 2558 B13R0.147 COC(=O)CCCCSCCCC#N 62a_100000204269_100000687738 [1,0,0,0,0,0|2,0,1]=4 2559 B13R0.147 COC(=O)CCCCSCCCC#N 62a_100000687738_100000204269 [1,0,0,0,0,0|2,0,1]=4 2560 B13R0.147 COC(=O)CCCCSCCCC=O 62a_100000204269_200011292268 [1,0,0,0,0,0|2,0,1]=4 2561 B13R0.147 COC(=O)CCCCSCCCC=O 62a_200011292268_100000204269 [1,0,0,0,0,0|2,0,1]=4 2562 B13R0.147 COC(=O)CCCCSCCCCF 62a_100000204269_100000729493 [1,0,0,0,0,0|2,0,0]=3 2563 B13R0.147 COC(=O)CCCCSCCCCF 62a_100000729493_100000204269 [1,0,0,0,0,0|2,0,0]=3 2564 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000204269_100000210776 [1,0,0,0,0,0|2,0,0]=3 2565 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000210776_100000204269 [1,0,0,0,0,0|2,0,0]=3 2566 B13R0.147 COC(=O)CCCNCCCCCO 2230a_100000762737_100011218270 [1,0,0,0,0,0|2,0,0]=3 2567 B13R0.147 COC(=O)CCCNCCCCCO 34a_100000762737_100000742333 [1,0,0,0,0,0|2,0,0]=3 2568 B13R0.147 COC(=O)CCCNCCOCCO 2230a_100000211614_100011218270 [1,0,0,0,0,0|3,0,0]=4 2569 B13R0.147 COC(=O)CCCNCCOCCO 34a_100000211614_100000742333 [1,0,0,0,0,0|3,0,0]=4 2570 B13R0.147 COC(=O)CCCNCCSCCO 2230a_100011219999_100011218270 [1,0,0,0,0,0|3,0,0]=4 2571 B13R0.147 COC(=O)CCCOCCCCCBr 34a_100000746331_100000742333 [1,0,0,0,0,0|2,0,0]=3 2572 B13R0.147 COC(=O)CCCOCCCCCBr 7a_100000746331_100011218270 [1,0,0,0,0,0|2,0,0]=3 2573 B13R0.147 COC(=O)CCCOCCCCCCl 34a_100000746330_100000742333 [1,0,0,0,0,0|2,0,0]=3 2574 B13R0.147 COC(=O)CCCOCCCCCCl 7a_100000746330_100011218270 [1,0,0,0,0,0|2,0,0]=3 2575 B13R0.147 COC(=O)CCCOCCCCCI 34a_200012148887_100000742333 [1,0,0,0,0,0|2,0,0]=3 2576 B13R0.147 COC(=O)CCCOCCCCCI 7a_200012148887_100011218270 [1,0,0,0,0,0|2,0,0]=3 2577 B13R0.147 COC(=O)CCCOCCCCCN 34a_100000762737_100000742333 [1,0,0,0,0,0|2,0,0]=3 2578 B13R0.147 COC(=O)CCCOCCCCSC 34a_100011217163_100000742333 [1,0,0,0,0,0|2,0,0]=3 2579 B13R0.147 COC(=O)CCCOCCCCSC 7a_100011217163_100011218270 [1,0,0,0,0,0|2,0,0]=3 2580 B13R0.147 COC(=O)CCCOCCOCCBr 34a_100000692535_100000742333 [1,0,0,0,0,0|3,0,0]=4 2581 B13R0.147 COC(=O)CCCOCCOCCBr 7a_100000692535_100011218270 [1,0,0,0,0,0|3,0,0]=4 2582 B13R0.147 COC(=O)CCCOCCOCCCl 34a_100011215305_100000742333 [1,0,0,0,0,0|3,0,0]=4 2583 B13R0.147 COC(=O)CCCOCCOCCCl 7a_100011215305_100011218270 [1,0,0,0,0,0|3,0,0]=4 2584 B13R0.147 COC(=O)CCCOCCOCCF 34a_200015357709_100000742333 [1,0,0,0,0,0|3,0,0]=4 2585 B13R0.147 COC(=O)CCCOCCOCCF 7a_200015357709_100011218270 [1,0,0,0,0,0|3,0,0]=4 2586 B13R0.147 COC(=O)CCCOCCOCCI 34a_100012149058_100000742333 [1,0,0,0,0,0|3,0,0]=4 2587 B13R0.147 COC(=O)CCCOCCOCCI 7a_100012149058_100011218270 [1,0,0,0,0,0|3,0,0]=4 2588 B13R0.147 COC(=O)CCCOCCOCCN 34a_100000211614_100000742333 [1,0,0,0,0,0|3,0,0]=4 2589 B13R0.147 COC(=O)CCCSCCCCC#N 62a_100011218270_100000211819 [1,0,0,0,0,0|2,0,1]=4 2590 B13R0.147 COC(=O)CCCSCCCCC#N 62a_100011219923_100011218270 [1,0,0,0,0,0|2,0,1]=4 2591 B13R0.147 COC(=O)CCCSCCCCC=O 62a_100000139335_100011218270 [1,0,0,0,0,0|2,0,1]=4 2592 B13R0.147 COC(=O)CCCSCCCCC=O 62a_100011218270_100000139335 [1,0,0,0,0,0|2,0,1]=4 2593 B13R0.147 COC(=O)CCCSCCCCCF 62a_100000729378_100011218270 [1,0,0,0,0,0|2,0,0]=3 2594 B13R0.147 COC(=O)CCCSCCCCCF 62a_100011218270_100000729378 [1,0,0,0,0,0|2,0,0]=3 2595 B13R0.147 COC(=O)CCCSCCCCCO 62a_100000746330_100011218270 [1,0,0,0,0,0|2,0,0]=3 2596 B13R0.147 COC(=O)CCCSCCCCCO 62a_100011218270_100000746330 [1,0,0,0,0,0|2,0,0]=3 2597 B13R0.147 COC(=O)CCCSCCOCCO 62a_100011215305_100011218270 [1,0,0,0,0,0|3,0,0]=4 2598 B13R0.147 COC(=O)CCCSCCOCCO 62a_100011218270_100011215305 [1,0,0,0,0,0|3,0,0]=4 2599 B13R0.147 COC(=O)CCNCCCCCCO 2230a_100000686447_100000204255 [1,0,0,0,0,0|2,0,0]=3 2600 B13R0.147 COC(=O)CCNCCCCCCO 34a_100000686447_100000742370 [1,0,0,0,0,0|2,0,0]=3 2601 B13R0.147 COC(=O)CCOCCCCCCBr 34a_100011215345_100000742370 [1,0,0,0,0,0|2,0,0]=3 2602 B13R0.147 COC(=O)CCOCCCCCCBr 7a_100011215345_100000204255 [1,0,0,0,0,0|2,0,0]=3 2603 B13R0.147 COC(=O)CCOCCCCCCCl 34a_100000766143_100000742370 [1,0,0,0,0,0|2,0,0]=3 2604 B13R0.147 COC(=O)CCOCCCCCCCl 7a_100000766143_100000204255 [1,0,0,0,0,0|2,0,0]=3 2605 B13R0.147 COC(=O)CCOCCCCCCF 34a_100000732779_100000742370 [1,0,0,0,0,0|2,0,0]=3 2606 B13R0.147 COC(=O)CCOCCCCCCF 7a_100000732779_100000204255 [1,0,0,0,0,0|2,0,0]=3 2607 B13R0.147 COC(=O)CCOCCCCCCN 34a_100000686447_100000742370 [1,0,0,0,0,0|2,0,0]=3 2608 B13R0.147 COC(=O)CCOCCOCCO[13CH3] 34a_100010982084_200025704644 [1,0,0,0,0,0|3,0,0]=4 2609 B13R0.147 COC(=O)CCOCCOCCO[13CH3] 7a_100010982084_200025704644 [1,0,0,0,0,0|3,0,0]=4 2610 B13R0.147 COC(=O)CCSCCCCCC#N 62a_100000204255_100009813376 [1,0,0,0,0,0|2,0,1]=4 2611 B13R0.147 COC(=O)CCSCCCCCC#N 62a_100009813376_100000204255 [1,0,0,0,0,0|2,0,1]=4 2612 B13R0.147 COC(=O)CCSCCCCCC=O 62a_100000139337_100000204255 [1,0,0,0,0,0|2,0,1]=4 2613 B13R0.147 COC(=O)CCSCCCCCC=O 62a_100000204255_100000139337 [1,0,0,0,0,0|2,0,1]=4 2614 B13R0.147 COC(=O)CCSCCCCCCF 62a_100000204255_100015922095 [1,0,0,0,0,0|2,0,0]=3 2615 B13R0.147 COC(=O)CCSCCCCCCF 62a_100015922095_100000204255 [1,0,0,0,0,0|2,0,0]=3 2616 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000204255_100000766143 [1,0,0,0,0,0|2,0,0]=3 2617 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000766143_100000204255 [1,0,0,0,0,0|2,0,0]=3 2618 B13R0.147 COC(=O)CNCCCCCCCO 2230a_100011996573_100000747449 [1,0,0,0,0,0|2,0,0]=3 2619 B13R0.147 COC(=O)CNCCCCCCCO 34a_100011996573_100000747449 [1,0,0,0,0,0|2,0,0]=3 2620 B13R0.147 COC(=O)CNCCCOCCCO 2230a_100011310245_100000747449 [1,0,0,0,0,0|3,0,0]=4 2621 B13R0.147 COC(=O)CNCCCOCCCO 34a_100011310245_100000747449 [1,0,0,0,0,0|3,0,0]=4 2622 B13R0.147 COC(=O)COCCCCCCCBr 34a_100000760002_100000747449 [1,0,0,0,0,0|2,0,0]=3 2623 B13R0.147 COC(=O)COCCCCCCCBr 7a_100000760002_100000747449 [1,0,0,0,0,0|2,0,0]=3 2624 B13R0.147 COC(=O)COCCCCCCCN 34a_100011996573_100000747449 [1,0,0,0,0,0|2,0,0]=3 2625 B13R0.147 COC(=O)COCCCOCCCN 34a_100011310245_100000747449 [1,0,0,0,0,0|3,0,0]=4 2626 B13R0.147 COC(=O)COCCNCCCCO 2230a_100000750430_100000090808 [1,0,0,0,0,0|3,0,0]=4 2627 B13R0.147 COC(=O)COCCNCCCCO 34a_100000750430_100000090808 [1,0,0,0,0,0|3,0,0]=4 2628 B13R0.147 COC(=O)COCCNCCCSC 2230a_100000749238_100000090808 [1,0,0,0,0,0|3,0,0]=4 2629 B13R0.147 COC(=O)COCCOCCCCBr 34a_100011216708_100000090808 [1,0,0,0,0,0|3,0,0]=4 2630 B13R0.147 COC(=O)COCCOCCCCCl 34a_100000210776_100000090808 [1,0,0,0,0,0|3,0,0]=4 2631 B13R0.147 COC(=O)COCCOCCCCCl 7a_100000210776_100000090808 [1,0,0,0,0,0|3,0,0]=4 2632 B13R0.147 COC(=O)COCCOCCCCF 34a_100011995726_100000090808 [1,0,0,0,0,0|3,0,0]=4 2633 B13R0.147 COC(=O)COCCOCCCCF 7a_100011995726_100000090808 [1,0,0,0,0,0|3,0,0]=4 2634 B13R0.147 COC(=O)COCCOCCCCI 34a_200012148704_100000090808 [1,0,0,0,0,0|3,0,0]=4 2635 B13R0.147 COC(=O)COCCOCCCCN 34a_100000750430_100000090808 [1,0,0,0,0,0|3,0,0]=4 2636 B13R0.147 COC(=O)COCCOCCCSC 34a_100000690336_100000090808 [1,0,0,0,0,0|3,0,0]=4 2637 B13R0.147 COC(=O)COCCOCCCSC 7a_100000690336_100000090808 [1,0,0,0,0,0|3,0,0]=4 2638 B13R0.147 COC(=O)COCCSCCCCF 62a_100000090808_100000729493 [1,0,0,0,0,0|3,0,0]=4 2639 B13R0.147 COC(=O)COCCSCCCCF 62a_100000729493_100000090808 [1,0,0,0,0,0|3,0,0]=4 2640 B13R0.147 COC(=O)COCCSCCCCO 62a_100000090808_100000210776 [1,0,0,0,0,0|3,0,0]=4 2641 B13R0.147 COC(=O)COCCSCCCCO 62a_100000210776_100000090808 [1,0,0,0,0,0|3,0,0]=4 2642 B13R0.147 COC(=O)CSCCCCCCC#N 62a_100000747449_100009813337 [1,0,0,0,0,0|2,0,1]=4 2643 B13R0.147 COC(=O)CSCCCCCCC#N 62a_100009813337_100000747449 [1,0,0,0,0,0|2,0,1]=4 2644 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000747449_100000760002 [1,0,0,0,0,0|2,0,0]=3 2645 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000760002_100000747449 [1,0,0,0,0,0|2,0,0]=3 2646 B13R0.147 COC(=O)NCCOCCCCCF 34a_100000757965_100000729378 [1,0,0,0,0,0|3,0,0]=4 2647 B13R0.147 COC(=O)NCCOCCCCCO 34a_100000757965_100000746330 [1,0,0,0,0,0|3,0,0]=4 2648 B13R0.147 COC(=O)OCCOCCCCCF 34a_100010262106_100000729378 [1,0,0,0,0,0|3,0,0]=4 2649 B13R0.147 COC(=O)OCCOCCCCCO 34a_100010262106_100000746330 [1,0,0,0,0,0|3,0,0]=4 2650 B13R0.147 COC(=O)OCSCCCCCCF 62a_100015922095_100000139417 [1,0,0,0,0,0|3,0,0]=4 2651 B13R0.147 COC(=O)OCSCCCCCCO 62a_100000766143_100000139417 [1,0,0,0,0,0|3,0,0]=4 2652 B13R0.147 COCCCCCCCCC(=O)OC 34a_100000035544_200000210301 [1,0,0,0,0,0|1,0,0]=2 2653 B13R0.147 COCCCCCCCCC(=O)OC 34a_100138415774_100010282707 [1,0,0,0,0,0|1,0,0]=2 2654 B13R0.147 COCCCCCCCCC(=O)OC 7a_100000035544_200000210301 [1,0,0,0,0,0|1,0,0]=2 2655 B13R0.147 COCCCCCCOCC(=O)OC 34a_200012092642_100000747449 [1,0,0,0,0,0|2,0,0]=3 2656 B13R0.147 COCCCCCCOCC(=O)OC 7a_200012092642_100000747449 [1,0,0,0,0,0|2,0,0]=3 2657 B13R0.147 COCCCCCCSCC(=O)OC 62a_100000747449_100011998445 [1,0,0,0,0,0|2,0,0]=3 2658 B13R0.147 COCCCCCCSCC(=O)OC 62a_100011998445_100000747449 [1,0,0,0,0,0|2,0,0]=3 2659 B13R0.147 COCCCCCNCCC(=O)OC 2230a_100000747528_100000204255 [1,0,0,0,0,0|2,0,0]=3 2660 B13R0.147 COCCCCCNCCC(=O)OC 34a_100000747528_100000742370 [1,0,0,0,0,0|2,0,0]=3 2661 B13R0.147 COCCCCOCCCC(=O)OC 34a_100000740925_100000742333 [1,0,0,0,0,0|2,0,0]=3 2662 B13R0.147 COCCCCOCCNC(=O)OC 34a_100000757965_100000755781 [1,0,0,0,0,0|3,0,0]=4 2663 B13R0.147 COCCCCOCCOC(=O)OC 34a_100010262106_100000755781 [1,0,0,0,0,0|3,0,0]=4 2664 B13R0.147 COCCCCSCCCC(=O)OC 62a_100000730899_100011218270 [1,0,0,0,0,0|2,0,0]=3 2665 B13R0.147 COCCCCSCCCC(=O)OC 62a_100011218270_100000730899 [1,0,0,0,0,0|2,0,0]=3 2666 B13R0.147 COCCCNCCCCC(=O)OC 34a_100150723488_100000204269 [1,0,0,0,0,0|2,0,0]=3 2667 B13R0.147 COCCCNCCOCC(=O)OC 34a_100150723488_100000090808 [1,0,0,0,0,0|3,0,0]=4 2668 B13R0.147 COCCCOCCCCC(=O)OC 34a_100000059025_100000740836 [1,0,0,0,0,0|2,0,0]=3 2669 B13R0.147 COCCCOCCCCC(=O)OC 34a_100000740835_100000204269 [1,0,0,0,0,0|2,0,0]=3 2670 B13R0.147 COCCCOCCCCC(=O)OC 7a_100000059025_100000740836 [1,0,0,0,0,0|2,0,0]=3 2671 B13R0.147 COCCCOCCOCC(=O)OC 34a_100000740835_100000090808 [1,0,0,0,0,0|3,0,0]=4 2672 B13R0.147 COCCCSCCCCC(=O)OC 62a_100000204269_100000709357 [1,0,0,0,0,0|2,0,0]=3 2673 B13R0.147 COCCCSCCCCC(=O)OC 62a_100000709357_100000204269 [1,0,0,0,0,0|2,0,0]=3 2674 B13R0.147 COCCCSCCOCC(=O)OC 62a_100000090808_100000709357 [1,0,0,0,0,0|3,0,0]=4 2675 B13R0.147 COCCCSCCOCC(=O)OC 62a_100000709357_100000090808 [1,0,0,0,0,0|3,0,0]=4 2676 B13R0.147 COCCNCCCCCC(=O)OC 2230a_100000209980_100009816466 [1,0,0,0,0,0|2,0,0]=3 2677 B13R0.147 COCCOCCCCCC(=O)OC 34a_100000074720_100011201679 [1,0,0,0,0,0|2,0,0]=3 2678 B13R0.147 COCCOCCCCCC(=O)OC 34a_100000210237_100009816466 [1,0,0,0,0,0|2,0,0]=3 2679 B13R0.147 COCCOCCCCCC(=O)OC 7a_100000074720_100000233755 [1,0,0,0,0,0|2,0,0]=3 2680 B13R0.147 COCCOCCCNCC(=O)OC 2230a_100000206027_100000747449 [1,0,0,0,0,0|3,0,0]=4 2681 B13R0.147 COCCOCCCNCC(=O)OC 34a_100000206027_100000747449 [1,0,0,0,0,0|3,0,0]=4 2682 B13R0.147 COCCOCCCSCC(=O)OC 62a_100000747449_100011216529 [1,0,0,0,0,0|3,0,0]=4 2683 B13R0.147 COCCOCCCSCC(=O)OC 62a_100011216529_100000747449 [1,0,0,0,0,0|3,0,0]=4 2684 B13R0.147 COCCOCCNCCC(=O)OC 2230a_100000745349_100000204255 [1,0,0,0,0,0|3,0,0]=4 2685 B13R0.147 COCCOCCNCCC(=O)OC 34a_100000745349_100000742370 [1,0,0,0,0,0|3,0,0]=4 2686 B13R0.147 COCCOCCOCCC(=O)OC 34a_100010982084_200000210301 [1,0,0,0,0,0|3,0,0]=4 2687 B13R0.147 COCCOCCOCCC(=O)OC 34a_100011215163_100000742370 [1,0,0,0,0,0|3,0,0]=4 2688 B13R0.147 COCCOCCOCCC(=O)OC 7a_100010982084_200000210301 [1,0,0,0,0,0|3,0,0]=4 2689 B13R0.147 COCCOCCOCCC(=O)OC 7a_100011215163_100000204255 [1,0,0,0,0,0|3,0,0]=4 2690 B13R0.147 COCCOCCSCCC(=O)OC 62a_100000204255_100000695917 [1,0,0,0,0,0|3,0,0]=4 2691 B13R0.147 COCCOCCSCCC(=O)OC 62a_100000695917_100000204255 [1,0,0,0,0,0|3,0,0]=4 2692 B13R0.147 COCCOCSCCCC(=O)OC 62a_100000231047_100011218270 [1,0,0,0,0,0|3,0,0]=4 2693 B13R0.147 COCCOCSCCCC(=O)OC 62a_100011218270_100000231047 [1,0,0,0,0,0|3,0,0]=4 2694 B13R0.147 COCCSCCCCCC(=O)OC 62a_100000233755_100009816466 [1,0,0,0,0,0|2,0,0]=3 2695 B13R0.147 COCCSCCCCCC(=O)OC 62a_100009816466_100000233755 [1,0,0,0,0,0|2,0,0]=3 2696 B13R0.147 COCSCCCCCCC(=O)OC 62a_100000766300_100009815986 [1,0,0,0,0,0|2,0,0]=3 2697 B13R0.147 COCSCCCCCCC(=O)OC 62a_100009815986_100000766300 [1,0,0,0,0,0|2,0,0]=3 2698 B13R0.147 O=C(CF)CCCCCCCCCF 1458a_200009909015_100015361967 [1,0,0,0,0,0|3,0,0]=4 2699 B13R0.147 O=C(CO)CCCCCCCCCO 1458a_100000210174_100009813782 [1,0,0,0,0,0|3,0,0]=4 2700 B13R0.336 C#CCCCCCCCCCCOC 34a_100000054667_200000210301 [1,0,0,0,0,0|0,0,3]=4 2701 B13R0.336 C#CCCCCCCCCCCOC 7a_100000054667_200000210301 [1,0,0,0,0,0|0,0,3]=4 2702 B13R0.336 C#CCCCCCCCCCCO[13CH3] 34a_100000054667_200025704644 [1,0,0,0,0,0|0,0,3]=4 2703 B13R0.336 C#CCCCCCCCCCCO[13CH3] 7a_100000054667_200025704644 [1,0,0,0,0,0|0,0,3]=4 2704 B13R0.336 C/C=C/CCOCCCCCCCC 34a_100016278192_100000210759 [1,0,0,0,0,0|2,0,0]=3 2705 B13R0.336 C/C=C/CCOCCCCCCCO 34a_100016278192_100000760002 [1,0,0,0,0,0|3,0,0]=4 2706 B13R0.336 C/C=C/CCOCCCCCCOC 34a_100016278192_100011998445 [1,0,0,0,0,0|3,0,0]=4 2707 B13R0.336 C/C=C/CNCCCCCCCCC 34a_100000212291_100102629194 [1,0,0,0,0,0|2,0,0]=3 2708 B13R0.336 C/C=C/CNCCCCCCCCO 34a_102515433106_100102629194 [1,0,0,0,0,0|3,0,0]=4 2709 B13R0.336 C/C=C/COCCCCCCCCBr 34a_100009813846_100102629194 [1,0,0,0,0,0|3,0,0]=4 2710 B13R0.336 C/C=C/COCCCCCCCCBr 7a_100009813846_100102629194 [1,0,0,0,0,0|3,0,0]=4 2711 B13R0.336 C/C=C/COCCCCCCCCC 34a_100000210712_100102629194 [1,0,0,0,0,0|2,0,0]=3 2712 B13R0.336 C/C=C/COCCCCCCCCC 34a_100016270725_100011214924 [1,0,0,0,0,0|2,0,0]=3 2713 B13R0.336 C/C=C/COCCCCCCCCC 7a_100000210712_100102629194 [1,0,0,0,0,0|2,0,0]=3 2714 B13R0.336 C/C=C/COCCCCCCCCCl 34a_100000033203_100102629194 [1,0,0,0,0,0|3,0,0]=4 2715 B13R0.336 C/C=C/COCCCCCCCCCl 7a_100000033203_100102629194 [1,0,0,0,0,0|3,0,0]=4 2716 B13R0.336 C/C=C/COCCCCCCCCN 34a_102515433106_100102629194 [1,0,0,0,0,0|3,0,0]=4 2717 B13R0.336 C/C=C/COCCCCCCCCO 34a_100016270725_100000033203 [1,0,0,0,0,0|3,0,0]=4 2718 B13R0.336 C/C=C/COCCCCNCCCC 34a_200011216965_100102629194 [1,0,0,0,0,0|3,0,0]=4 2719 B13R0.336 C/C=C/COCCCCOCCCC 34a_200000760531_100102629194 [1,0,0,0,0,0|3,0,0]=4 2720 B13R0.336 C/C=C/COCCCCOCCCC 7a_200000760531_100102629194 [1,0,0,0,0,0|3,0,0]=4 2721 B13R0.336 C/C=C/COCCOCCCCCC 34a_100000691444_100102629194 [1,0,0,0,0,0|3,0,0]=4 2722 B13R0.336 C/C=C/COCCOCCCCCC 7a_100000691444_100102629194 [1,0,0,0,0,0|3,0,0]=4 2723 B13R0.336 C/C=C/CSCCCCCCCCC 62a_100102629194_100000210670 [1,0,0,0,0,0|2,0,0]=3 2724 B13R0.336 C/C=C/CSCCCCCCCCO 62a_100000033203_100102629194 [1,0,0,0,0,0|3,0,0]=4 2725 B13R0.336 C/C=C/CSCCCCCCCCO 62a_100102629194_100000033203 [1,0,0,0,0,0|3,0,0]=4 2726 B13R0.336 C=CCCCCCCCCCCOC 34a_100138415774_100011093070 [1,0,0,0,0,0|0,0,3]=4 2727 B13R0.336 CC#CCCOCCCCCCCC 34a_100000750427_100000210759 [1,0,0,0,0,0|2,0,1]=4 2728 B13R0.336 CC#CCNCCCCCCCCC 2230a_100000212291_100000748600 [1,0,0,0,0,0|2,0,1]=4 2729 B13R0.336 CC#CCNCCCCCCCCC 2230a_100000685387_100011214924 [1,0,0,0,0,0|2,0,1]=4 2730 B13R0.336 CC#CCNCCCCCCCCC 34a_100000212291_100000748600 [1,0,0,0,0,0|2,0,1]=4 2731 B13R0.336 CC#CCNCCCCCCCCC 34a_100000685387_100011214924 [1,0,0,0,0,0|2,0,1]=4 2732 B13R0.336 CC#CCOCCCCCCCCC 34a_100000210712_100000748600 [1,0,0,0,0,0|2,0,1]=4 2733 B13R0.336 CC#CCOCCCCCCCCC 34a_100000761923_100011214924 [1,0,0,0,0,0|2,0,1]=4 2734 B13R0.336 CC#CCOCCCCCCCCC 7a_100000210712_100000748600 [1,0,0,0,0,0|2,0,1]=4 2735 B13R0.336 CC#CCSCCCCCCCCC 62a_100000748600_100000210670 [1,0,0,0,0,0|2,0,1]=4 2736 B13R0.336 CC/C=C/CCCOCCCCCC 34a_100016287902_100000210314 [1,0,0,0,0,0|2,0,1]=4 2737 B13R0.336 CC/C=C/CCCOCCCCCC 7a_100016287902_100000210314 [1,0,0,0,0,0|2,0,1]=4 2738 B13R0.336 CC/C=C\CCCCCCCNCC 269862a_100015525214_200025770492 [1,0,0,0,0,0|2,0,1]=4 2739 B13R0.336 CC/C=C\CCCCCNCCCC 269862a_100000102301_100016288537 [1,0,0,0,0,0|2,0,1]=4 2740 B13R0.336 CC/C=C\CCCCCOCCCC 34a_100016268722_100000210210 [1,0,0,0,0,0|2,0,1]=4 2741 B13R0.336 CC/C=C\CCCCCOCCCC 7a_100016268722_100000210211 [1,0,0,0,0,0|2,0,1]=4 2742 B13R0.336 CC/C=C\CCCCOCCCCC 34a_100016287862_100000718602 [1,0,0,0,0,0|2,0,1]=4 2743 B13R0.336 CC/C=C\CCCCOCCCCC 7a_100016287862_100000210326 [1,0,0,0,0,0|2,0,1]=4 2744 B13R0.336 CC/C=C\CCNCCCCCCC 2230a_100000229938_100015370543 [1,0,0,0,0,0|2,0,1]=4 2745 B13R0.336 CC/C=C\CCOCCCCCCC 34a_100000210272_100015370543 [1,0,0,0,0,0|2,0,1]=4 2746 B13R0.336 CC/C=C\CCOCCCCCCC 34a_100016288707_100000210614 [1,0,0,0,0,0|2,0,1]=4 2747 B13R0.336 CC/C=C\CCOCCCCCCC 7a_100000210272_100015370543 [1,0,0,0,0,0|2,0,1]=4 2748 B13R0.336 CC/C=C\CCOCCCCCCC 7a_100016288707_100000210614 [1,0,0,0,0,0|2,0,1]=4 2749 B13R0.336 CC/C=C\CCSCCCCCCC 62a_100000210614_100015370543 [1,0,0,0,0,0|2,0,1]=4 2750 B13R0.336 CC/C=C\CCSCCCCCCC 62a_100015370543_100000210316 [1,0,0,0,0,0|2,0,1]=4 2751 B13R0.336 CC/C=C\CNCCCCCCCC 2230a_100000229939_100103147603 [1,0,0,0,0,0|2,0,1]=4 2752 B13R0.336 CC/C=C\CNCCCCCCCC 34a_100000229939_100103147603 [1,0,0,0,0,0|2,0,1]=4 2753 B13R0.336 CC/C=C\COCCCCCCCC 34a_100000210232_100103147603 [1,0,0,0,0,0|2,0,1]=4 2754 B13R0.336 CC/C=C\COCCCCCCCC 34a_100016268518_100000210759 [1,0,0,0,0,0|2,0,1]=4 2755 B13R0.336 CC/C=C\COCCCCCCCC 7a_100000210232_100103147603 [1,0,0,0,0,0|2,0,1]=4 2756 B13R0.336 CC/C=C\CSCCCCCCCC 62a_100000210759_100103147603 [1,0,0,0,0,0|2,0,1]=4 2757 B13R0.336 CC/C=C\CSCCCCCCCC 62a_100103147603_100000210317 [1,0,0,0,0,0|2,0,1]=4 2758 B13R0.336 CC=CCCCOCCCCCCC 34a_100020645299_100000210614 [1,0,0,0,0,0|2,0,0]=3 2759 B13R0.336 CC=CCCCOCCCCCCF 34a_100020645299_100015922095 [1,0,0,0,0,0|3,0,0]=4 2760 B13R0.336 CC=CCCCOCCCCCCO 34a_100020645299_100000766143 [1,0,0,0,0,0|3,0,0]=4 2761 B13R0.336 CC=CCCCOCCOCCCC 34a_100020645299_100000743108 [1,0,0,0,0,0|3,0,0]=4 2762 B13R0.336 CC=CCNCCCCCCCCC 2230a_100000212291_100000070051 [1,0,0,0,0,0|2,0,0]=3 2763 B13R0.336 CC=CCNCCCCCCCCC 34a_100000212291_100000070051 [1,0,0,0,0,0|2,0,0]=3 2764 B13R0.336 CC=CCNCCCCCCCCO 2230a_102515433106_100000070051 [1,0,0,0,0,0|3,0,0]=4 2765 B13R0.336 CC=CCNCCCCCCCCO 34a_102515433106_100000070051 [1,0,0,0,0,0|3,0,0]=4 2766 B13R0.336 CC=CCOCCCCCCCCBr 34a_100009813846_100000070051 [1,0,0,0,0,0|3,0,0]=4 2767 B13R0.336 CC=CCOCCCCCCCCBr 7a_100009813846_100000070051 [1,0,0,0,0,0|3,0,0]=4 2768 B13R0.336 CC=CCOCCCCCCCCC 34a_100000210712_100000070051 [1,0,0,0,0,0|2,0,0]=3 2769 B13R0.336 CC=CCOCCCCCCCCC 7a_100000210712_100000070051 [1,0,0,0,0,0|2,0,0]=3 2770 B13R0.336 CC=CCOCCCCCCCCCl 34a_100000033203_100000070051 [1,0,0,0,0,0|3,0,0]=4 2771 B13R0.336 CC=CCOCCCCCCCCCl 7a_100000033203_100000070051 [1,0,0,0,0,0|3,0,0]=4 2772 B13R0.336 CC=CCOCCCCCCCCN 34a_102515433106_100000070051 [1,0,0,0,0,0|3,0,0]=4 2773 B13R0.336 CC=CCOCCCCNCCCC 34a_200011216965_100000070051 [1,0,0,0,0,0|3,0,0]=4 2774 B13R0.336 CC=CCOCCCCOCCCC 34a_200000760531_100000070051 [1,0,0,0,0,0|3,0,0]=4 2775 B13R0.336 CC=CCOCCCCOCCCC 7a_200000760531_100000070051 [1,0,0,0,0,0|3,0,0]=4 2776 B13R0.336 CC=CCOCCOCCCCCC 34a_100000691444_100000070051 [1,0,0,0,0,0|3,0,0]=4 2777 B13R0.336 CC=CCOCCOCCCCCC 7a_100000691444_100000070051 [1,0,0,0,0,0|3,0,0]=4 2778 B13R0.336 CC=CCSCCCCCCCCC 62a_100000070051_100000210670 [1,0,0,0,0,0|2,0,0]=3 2779 B13R0.336 CC=CCSCCCCCCCCO 62a_100000033203_100000070051 [1,0,0,0,0,0|3,0,0]=4 2780 B13R0.336 CC=CCSCCCCCCCCO 62a_100000070051_100000033203 [1,0,0,0,0,0|3,0,0]=4 2781 B13R0.336 CCC#CCCCCCCCCOC 34a_200000031908_200000210301 [1,0,0,0,0,0|0,0,3]=4 2782 B13R0.336 CCC#CCCCCCCCCOC 7a_200000031908_200000210301 [1,0,0,0,0,0|0,0,3]=4 2783 B13R0.336 CCC#CCCCCCCCCO[13CH3] 34a_200000031908_200025704644 [1,0,0,0,0,0|0,0,3]=4 2784 B13R0.336 CCC#CCCCCCCCCO[13CH3] 7a_200000031908_200025704644 [1,0,0,0,0,0|0,0,3]=4 2785 B13R0.336 CCCCC#CCCCCCCOC 34a_100138415774_200000043322 [1,0,0,0,0,0|0,0,3]=4 2786 B13R0.336 CCCCCCCCC/C=C/COC 34a_100015232335_200000210301 [1,0,0,0,0,0|0,0,3]=4 2787 B13R0.336 CCCCCCCCC/C=C/COC 7a_100015232335_200000210301 [1,0,0,0,0,0|0,0,3]=4 2788 B13R0.336 CCCCCCCCC/C=C/CO[13CH3] 34a_100015232335_200025704644 [1,0,0,0,0,0|0,0,3]=4 2789 B13R0.336 CCCCCCCCC/C=C/CO[13CH3] 7a_100015232335_200025704644 [1,0,0,0,0,0|0,0,3]=4 2790 B13R0.336 CCCCCCCCCCCCNC 2230a_100000210451_200000210301 [1,0,0,0,0,0|1,0,1]=3 2791 B13R0.336 CCCCCCCCCCCCNC 2230a_106832991635_100011215052 [1,0,0,0,0,0|1,0,1]=3 2792 B13R0.336 CCCCCCCCCCCCNC 270004a_106832991635_100011218549 [1,0,0,0,0,0|1,0,1]=3 2793 B13R0.336 CCCCCCCCCCCCNC 34a_100000210451_200000210301 [1,0,0,0,0,0|1,0,1]=3 2794 B13R0.336 CCCCCCCCCCCCNC 34a_100102657272_100000759014 [1,0,0,0,0,0|1,0,1]=3 2795 B13R0.336 CCCCCCCCCCCCNC 7a_106832991635_100000759014 [1,0,0,0,0,0|1,0,1]=3 2796 B13R0.336 CCCCCCCCCCCCN[13CH3] 2230a_100000210451_200025704644 [1,0,0,0,0,0|1,0,1]=3 2797 B13R0.336 CCCCCCCCCCCCN[13CH3] 34a_100000210451_200025704644 [1,0,0,0,0,0|1,0,1]=3 2798 B13R0.336 CCCCCCCCCCCCOC 34a_100000210810_200000210301 [1,0,0,0,0,0|0,0,1]=2 2799 B13R0.336 CCCCCCCCCCCCOC 34a_100138415774_100000759014 [1,0,0,0,0,0|0,0,1]=2 2800 B13R0.336 CCCCCCCCCCCCOC 7a_100000210810_200000210301 [1,0,0,0,0,0|0,0,1]=2 2801 B13R0.336 CCCCCCCCCCCCO[13CH3] 34a_100000210810_200025704644 [1,0,0,0,0,0|0,0,1]=2 2802 B13R0.336 CCCCCCCCCCCCO[13CH3] 7a_100000210810_200025704644 [1,0,0,0,0,0|0,0,1]=2 2803 B13R0.336 CCCCCCCCCCCCSC 62a_200000210301_100000759014 [1,0,0,0,0,0|0,1,1]=3 2804 B13R0.336 CCCCCCCCCCCCS[13CH3] 62a_200025704644_100000759014 [1,0,0,0,0,0|0,1,1]=3 2805 B13R0.336 CCCCCCCCCCCNCC 2230a_100015525214_100011215454 [1,0,0,0,0,0|2,0,0]=3 2806 B13R0.336 CCCCCCCCCCCNCC 2230a_200011215754_100000210202 [1,0,0,0,0,0|2,0,0]=3 2807 B13R0.336 CCCCCCCCCCCNCC 34a_200011215754_100000210202 [1,0,0,0,0,0|2,0,0]=3 2808 B13R0.336 CCCCCCCCCCCNCF 34a_200011215754_100015361967 [1,0,0,0,0,0|3,0,0]=4 2809 B13R0.336 CCCCCCCCCCCOCC 34a_100000210809_100000210202 [1,0,0,0,0,0|2,0,0]=3 2810 B13R0.336 CCCCCCCCCCCOCC 34a_100121572206_100011215454 [1,0,0,0,0,0|2,0,0]=3 2811 B13R0.336 CCCCCCCCCCCOCC 7a_100000210809_100000210202 [1,0,0,0,0,0|2,0,0]=3 2812 B13R0.336 CCCCCCCCCCCOCF 34a_100000210809_100015361967 [1,0,0,0,0,0|3,0,0]=4 2813 B13R0.336 CCCCCCCCCCCOCF 7a_100000210809_100015361967 [1,0,0,0,0,0|3,0,0]=4 2814 B13R0.336 CCCCCCCCCCCSCC 62a_100000210202_100011215454 [1,0,0,0,0,0|2,0,0]=3 2815 B13R0.336 CCCCCCCCCCCSCF 62a_100015361967_100011215454 [1,0,0,0,0,0|3,0,0]=4 2816 B13R0.336 CCCCCCCCCCNCCC 2230a_100000684558_100000210303 [1,0,0,0,0,0|2,0,1]=4 2817 B13R0.336 CCCCCCCCCCNCCC 34a_100000684558_100000210303 [1,0,0,0,0,0|2,0,1]=4 2818 B13R0.336 CCCCCCCCCCNCOC 2230a_100000684558_100000766300 [1,0,0,0,0,0|1,0,1]=3 2819 B13R0.336 CCCCCCCCCCNCSC 2230a_100000684558_100011218213 [1,0,0,0,0,0|1,1,1]=4 2820 B13R0.336 CCCCCCCCCCNCSC 34a_100000684558_100011218213 [1,0,0,0,0,0|1,1,1]=4 2821 B13R0.336 CCCCCCCCCCOCCC 34a_100000210258_100000210320 [1,0,0,0,0,0|2,0,1]=4 2822 B13R0.336 CCCCCCCCCCOCCC 34a_100000210711_100000210303 [1,0,0,0,0,0|2,0,1]=4 2823 B13R0.336 CCCCCCCCCCOCCC 7a_100000210711_100000210303 [1,0,0,0,0,0|2,0,1]=4 2824 B13R0.336 CCCCCCCCCCOCSC 34a_100000210711_100011218213 [1,0,0,0,0,0|1,1,1]=4 2825 B13R0.336 CCCCCCCCCCSCCC 62a_100000210303_100000210320 [1,0,0,0,0,0|2,0,1]=4 2826 B13R0.336 CCCCCCCCCCSCOC 62a_100000766300_100000210320 [1,0,0,0,0,0|1,0,1]=3 2827 B13R0.336 CCCCCCCCCCSCSC 62a_100011218213_100000210320 [1,0,0,0,0,0|1,1,1]=4 2828 B13R0.336 CCCCCCCCCNCCCC 2230a_100000102301_100011214924 [1,0,0,0,0,0|2,0,1]=4 2829 B13R0.336 CCCCCCCCCNCCCC 2230a_100000212291_100000210211 [1,0,0,0,0,0|2,0,1]=4 2830 B13R0.336 CCCCCCCCCNCCCC 34a_100000212291_100000210210 [1,0,0,0,0,0|2,0,1]=4 2831 B13R0.336 CCCCCCCCCNCCCC 7a_106832991798_100000210328 [1,0,0,0,0,0|2,0,1]=4 2832 B13R0.336 CCCCCCCCCNCCOC 2230a_100000209980_100011214924 [1,0,0,0,0,0|1,0,1]=3 2833 B13R0.336 CCCCCCCCCNCCOC 2230a_100000212291_100011201679 [1,0,0,0,0,0|1,0,1]=3 2834 B13R0.336 CCCCCCCCCNCCOC 34a_100000212291_100011201679 [1,0,0,0,0,0|1,0,1]=3 2835 B13R0.336 CCCCCCCCCNCCSC 2230a_100000212291_100000751147 [1,0,0,0,0,0|1,1,1]=4 2836 B13R0.336 CCCCCCCCCNCCSC 2230a_100020590264_100011214924 [1,0,0,0,0,0|1,1,1]=4 2837 B13R0.336 CCCCCCCCCNCCSC 34a_100000212291_100000212216 [1,0,0,0,0,0|1,1,1]=4 2838 B13R0.336 CCCCCCCCCOCCCC 34a_100000210227_100011214924 [1,0,0,0,0,0|2,0,1]=4 2839 B13R0.336 CCCCCCCCCOCCCC 34a_100000210712_100000210210 [1,0,0,0,0,0|2,0,1]=4 2840 B13R0.336 CCCCCCCCCOCCCC 7a_100000210227_100000210328 [1,0,0,0,0,0|2,0,1]=4 2841 B13R0.336 CCCCCCCCCOCCCC 7a_100000210712_100000210211 [1,0,0,0,0,0|2,0,1]=4 2842 B13R0.336 CCCCCCCCCOCCOC 34a_100000210237_100011214924 [1,0,0,0,0,0|1,0,1]=3 2843 B13R0.336 CCCCCCCCCOCCOC 34a_100000210712_100011201679 [1,0,0,0,0,0|1,0,1]=3 2844 B13R0.336 CCCCCCCCCOCCOC 7a_100000210712_100000233755 [1,0,0,0,0,0|1,0,1]=3 2845 B13R0.336 CCCCCCCCCOCCON 34a_100000700252_100011214924 [1,0,0,0,0,0|2,0,1]=4 2846 B13R0.336 CCCCCCCCCOCCSC 34a_100000210712_100000212216 [1,0,0,0,0,0|1,1,1]=4 2847 B13R0.336 CCCCCCCCCOCCSC 34a_100000230434_100011214924 [1,0,0,0,0,0|1,1,1]=4 2848 B13R0.336 CCCCCCCCCOCCSC 7a_100000210712_100000212216 [1,0,0,0,0,0|1,1,1]=4 2849 B13R0.336 CCCCCCCCCOCCSC 7a_100000230434_100000210328 [1,0,0,0,0,0|1,1,1]=4 2850 B13R0.336 CCCCCCCCCSCCCC 62a_100000210211_100000210670 [1,0,0,0,0,0|2,0,1]=4 2851 B13R0.336 CCCCCCCCCSCCOC 62a_100000233755_100000210670 [1,0,0,0,0,0|1,0,1]=3 2852 B13R0.336 CCCCCCCCCSCCSC 62a_100000212216_100000210670 [1,0,0,0,0,0|1,1,1]=4 2853 B13R0.336 CCCCCCCCCSCOCC 62a_100000739092_100000210670 [1,0,0,0,0,0|3,0,0]=4 2854 B13R0.336 CCCCCCCCNCCCCC 2230a_100000209983_100000210759 [1,0,0,0,0,0|2,0,1]=4 2855 B13R0.336 CCCCCCCCNCCCCC 2230a_100000229939_100000210326 [1,0,0,0,0,0|2,0,1]=4 2856 B13R0.336 CCCCCCCCNCCCCC 34a_100000229939_100000718602 [1,0,0,0,0,0|2,0,1]=4 2857 B13R0.336 CCCCCCCCNCCCOC 2230a_100000229939_100000740836 [1,0,0,0,0,0|1,0,1]=3 2858 B13R0.336 CCCCCCCCNCCCOC 34a_100000229939_100000740836 [1,0,0,0,0,0|1,0,1]=3 2859 B13R0.336 CCCCCCCCNCCCOC 34a_100150723488_100000210759 [1,0,0,0,0,0|1,0,1]=3 2860 B13R0.336 CCCCCCCCNCCCSC 2230a_100000749238_100000210759 [1,0,0,0,0,0|1,1,1]=4 2861 B13R0.336 CCCCCCCCNCCOCC 2230a_100000229939_100011215890 [1,0,0,0,0,0|3,0,0]=4 2862 B13R0.336 CCCCCCCCNCCOCC 2230a_102516460346_100000210759 [1,0,0,0,0,0|3,0,0]=4 2863 B13R0.336 CCCCCCCCNCCOCC 34a_100000229939_100000210147 [1,0,0,0,0,0|3,0,0]=4 2864 B13R0.336 CCCCCCCCNCCOCC 34a_102516460346_100000210759 [1,0,0,0,0,0|3,0,0]=4 2865 B13R0.336 CCCCCCCCNCCSCC 2230a_100000106463_100000210759 [1,0,0,0,0,0|3,0,0]=4 2866 B13R0.336 CCCCCCCCNCCSCC 2230a_100000229939_100000757381 [1,0,0,0,0,0|3,0,0]=4 2867 B13R0.336 CCCCCCCCNCCSCC 34a_100000229939_100000757381 [1,0,0,0,0,0|3,0,0]=4 2868 B13R0.336 CCCCCCCCOCCCCC 34a_100000210232_100000718602 [1,0,0,0,0,0|2,0,1]=4 2869 B13R0.336 CCCCCCCCOCCCCC 34a_100000210253_100000210759 [1,0,0,0,0,0|2,0,1]=4 2870 B13R0.336 CCCCCCCCOCCCCC 7a_100000210232_100000210326 [1,0,0,0,0,0|2,0,1]=4 2871 B13R0.336 CCCCCCCCOCCCCC 7a_100000210253_100000210759 [1,0,0,0,0,0|2,0,1]=4 2872 B13R0.336 CCCCCCCCOCCCNC 34a_100000213112_100000210759 [1,0,0,0,0,0|2,0,1]=4 2873 B13R0.336 CCCCCCCCOCCCOC 34a_100000210232_100000740836 [1,0,0,0,0,0|1,0,1]=3 2874 B13R0.336 CCCCCCCCOCCCOC 34a_100000740835_100000210759 [1,0,0,0,0,0|1,0,1]=3 2875 B13R0.336 CCCCCCCCOCCCOC 7a_100000210232_100000740836 [1,0,0,0,0,0|1,0,1]=3 2876 B13R0.336 CCCCCCCCOCCCSC 34a_100000690336_100000210759 [1,0,0,0,0,0|1,1,1]=4 2877 B13R0.336 CCCCCCCCOCCCSC 7a_100000690336_100000210759 [1,0,0,0,0,0|1,1,1]=4 2878 B13R0.336 CCCCCCCCOCCOCC 34a_100000210136_100000210759 [1,0,0,0,0,0|3,0,0]=4 2879 B13R0.336 CCCCCCCCOCCOCC 34a_100000210232_100000210147 [1,0,0,0,0,0|3,0,0]=4 2880 B13R0.336 CCCCCCCCOCCOCC 7a_100000210136_100000210759 [1,0,0,0,0,0|3,0,0]=4 2881 B13R0.336 CCCCCCCCOCCOCC 7a_100000210232_100011215890 [1,0,0,0,0,0|3,0,0]=4 2882 B13R0.336 CCCCCCCCOCCSCC 34a_100000210232_100000757381 [1,0,0,0,0,0|3,0,0]=4 2883 B13R0.336 CCCCCCCCOCCSCC 34a_100000212035_100000210759 [1,0,0,0,0,0|3,0,0]=4 2884 B13R0.336 CCCCCCCCOCCSCC 7a_100000210232_100000757381 [1,0,0,0,0,0|3,0,0]=4 2885 B13R0.336 CCCCCCCCOCCSCC 7a_100000212035_100000210759 [1,0,0,0,0,0|3,0,0]=4 2886 B13R0.336 CCCCCCCCSCCCCC 62a_100000210326_100000210317 [1,0,0,0,0,0|2,0,1]=4 2887 B13R0.336 CCCCCCCCSCCCCC 62a_100000210759_100000210326 [1,0,0,0,0,0|2,0,1]=4 2888 B13R0.336 CCCCCCCCSCCCOC 62a_100000210759_100000709357 [1,0,0,0,0,0|1,0,1]=3 2889 B13R0.336 CCCCCCCCSCCCOC 62a_100000709357_100000210317 [1,0,0,0,0,0|1,0,1]=3 2890 B13R0.336 CCCCCCCCSCCOCC 62a_100000210147_100000210317 [1,0,0,0,0,0|3,0,0]=4 2891 B13R0.336 CCCCCCCCSCCOCC 62a_100000210759_100011215890 [1,0,0,0,0,0|3,0,0]=4 2892 B13R0.336 CCCCCCCCSCCSCC 62a_100000210759_100000757381 [1,0,0,0,0,0|3,0,0]=4 2893 B13R0.336 CCCCCCCCSCCSCC 62a_100000757381_100000210317 [1,0,0,0,0,0|3,0,0]=4 2894 B13R0.336 CCCCCCCNCCCCCC 2230a_100000210581_100000210681 [1,0,0,0,0,0|2,0,1]=4 2895 B13R0.336 CCCCCCCNCCCCCC 2230a_100000229938_100000210314 [1,0,0,0,0,0|2,0,1]=4 2896 B13R0.336 CCCCCCCNCCCCOC 2230a_100000229938_100000730899 [1,0,0,0,0,0|1,0,1]=3 2897 B13R0.336 CCCCCCCNCCCOCC 2230a_100000210961_100000210681 [1,0,0,0,0,0|3,0,0]=4 2898 B13R0.336 CCCCCCCNCCCOCC 2230a_100000229938_100012232248 [1,0,0,0,0,0|3,0,0]=4 2899 B13R0.336 CCCCCCCNCCCOCC 34a_100000210961_100000210614 [1,0,0,0,0,0|3,0,0]=4 2900 B13R0.336 CCCCCCCNCOCCOC 2230a_100000229938_100000231047 [1,0,0,0,0,0|2,0,1]=4 2901 B13R0.336 CCCCCCCOCCCCCC 34a_100000210259_100000210614 [1,0,0,0,0,0|2,0,1]=4 2902 B13R0.336 CCCCCCCOCCCCCC 34a_100000210272_100000210314 [1,0,0,0,0,0|2,0,1]=4 2903 B13R0.336 CCCCCCCOCCCCCC 7a_100000210259_100000210614 [1,0,0,0,0,0|2,0,1]=4 2904 B13R0.336 CCCCCCCOCCCCCC 7a_100000210272_100000210314 [1,0,0,0,0,0|2,0,1]=4 2905 B13R0.336 CCCCCCCOCCCCOC 34a_100000210272_100000755781 [1,0,0,0,0,0|1,0,1]=3 2906 B13R0.336 CCCCCCCOCCCCOC 34a_100000740925_100000210614 [1,0,0,0,0,0|1,0,1]=3 2907 B13R0.336 CCCCCCCOCCCCOC 7a_100000210272_100000730899 [1,0,0,0,0,0|1,0,1]=3 2908 B13R0.336 CCCCCCCOCCCCSC 34a_100011217163_100000210614 [1,0,0,0,0,0|1,1,1]=4 2909 B13R0.336 CCCCCCCOCCCCSC 7a_100011217163_100000210614 [1,0,0,0,0,0|1,1,1]=4 2910 B13R0.336 CCCCCCCOCCCOCC 34a_100000210272_100012232248 [1,0,0,0,0,0|3,0,0]=4 2911 B13R0.336 CCCCCCCOCCCOCC 34a_100000757476_100000210614 [1,0,0,0,0,0|3,0,0]=4 2912 B13R0.336 CCCCCCCOCCCOCC 7a_100000210272_100012232248 [1,0,0,0,0,0|3,0,0]=4 2913 B13R0.336 CCCCCCCOCCCOCC 7a_100000757476_100000210614 [1,0,0,0,0,0|3,0,0]=4 2914 B13R0.336 CCCCCCCOCCCSCC 34a_100011216438_100000210614 [1,0,0,0,0,0|3,0,0]=4 2915 B13R0.336 CCCCCCCOCCCSCC 7a_100011216438_100000210614 [1,0,0,0,0,0|3,0,0]=4 2916 B13R0.336 CCCCCCCSCCCCCC 62a_100000210314_100000210316 [1,0,0,0,0,0|2,0,1]=4 2917 B13R0.336 CCCCCCCSCCCCCC 62a_100000210614_100000210757 [1,0,0,0,0,0|2,0,1]=4 2918 B13R0.336 CCCCCCCSCCCCOC 62a_100000210614_100000730899 [1,0,0,0,0,0|1,0,1]=3 2919 B13R0.336 CCCCCCCSCCCCOC 62a_100000730899_100000210316 [1,0,0,0,0,0|1,0,1]=3 2920 B13R0.336 CCCCCCCSCCCOCC 62a_100000210614_100012232248 [1,0,0,0,0,0|3,0,0]=4 2921 B13R0.336 CCCCCCCSCCCOCC 62a_100012232248_100000210316 [1,0,0,0,0,0|3,0,0]=4 2922 B13R0.336 CCCCCCCSCOCCOC 62a_100000210614_100000231047 [1,0,0,0,0,0|2,0,1]=4 2923 B13R0.336 CCCCCCCSCOCCOC 62a_100000231047_100000210316 [1,0,0,0,0,0|2,0,1]=4 2924 B13R0.336 CCCCCCNCCCCCOC 2230a_100000747528_100000210314 [1,0,0,0,0,0|1,0,1]=3 2925 B13R0.336 CCCCCCNCCCCCOC 34a_100000747528_100000210314 [1,0,0,0,0,0|1,0,1]=3 2926 B13R0.336 CCCCCCNCCOCCOC 2230a_100000210581_100000695917 [1,0,0,0,0,0|2,0,1]=4 2927 B13R0.336 CCCCCCNCCOCCOC 2230a_100000745349_100000210314 [1,0,0,0,0,0|2,0,1]=4 2928 B13R0.336 CCCCCCNCCOCCOC 34a_100000745349_100000210314 [1,0,0,0,0,0|2,0,1]=4 2929 B13R0.336 CCCCCCOCCCCCNC 34a_100000722520_100000210314 [1,0,0,0,0,0|2,0,1]=4 2930 B13R0.336 CCCCCCOCCOCCOC 34a_100000032842_200000210301 [1,0,0,0,0,0|2,0,1]=4 2931 B13R0.336 CCCCCCOCCOCCOC 34a_100000210259_100000695917 [1,0,0,0,0,0|2,0,1]=4 2932 B13R0.336 CCCCCCOCCOCCOC 34a_100000691444_100011201679 [1,0,0,0,0,0|2,0,1]=4 2933 B13R0.336 CCCCCCOCCOCCOC 34a_100011215163_100000210314 [1,0,0,0,0,0|2,0,1]=4 2934 B13R0.336 CCCCCCOCCOCCOC 7a_100000032842_200000210301 [1,0,0,0,0,0|2,0,1]=4 2935 B13R0.336 CCCCCCOCCOCCOC 7a_100000210259_100000695917 [1,0,0,0,0,0|2,0,1]=4 2936 B13R0.336 CCCCCCOCCOCCOC 7a_100000691444_100000233755 [1,0,0,0,0,0|2,0,1]=4 2937 B13R0.336 CCCCCCOCCOCCOC 7a_100011215163_100000210314 [1,0,0,0,0,0|2,0,1]=4 2938 B13R0.336 CCCCCCOCCOCCO[13CH3] 34a_100000032842_200025704644 [1,0,0,0,0,0|2,0,1]=4 2939 B13R0.336 CCCCCCOCCOCCO[13CH3] 7a_100000032842_200025704644 [1,0,0,0,0,0|2,0,1]=4 2940 B13R0.336 CCCCCCSCCOCCOC 62a_100000210314_100000695917 [1,0,0,0,0,0|2,0,1]=4 2941 B13R0.336 CCCCCCSCCOCCOC 62a_100000695917_100000210757 [1,0,0,0,0,0|2,0,1]=4 2942 B13R0.336 CCCCCNCCCCCCOC 2230a_100000209983_100011998445 [1,0,0,0,0,0|1,0,1]=3 2943 B13R0.336 CCCCCNCCCOCCOC 2230a_100000206027_100000210326 [1,0,0,0,0,0|2,0,1]=4 2944 B13R0.336 CCCCCNCCCOCCOC 2230a_100000209983_100011216529 [1,0,0,0,0,0|2,0,1]=4 2945 B13R0.336 CCCCCNCCCOCCOC 34a_100000206027_100000718602 [1,0,0,0,0,0|2,0,1]=4 2946 B13R0.336 CCCCCNCCOCCCOC 34a_100000224656_100000740836 [1,0,0,0,0,0|2,0,1]=4 2947 B13R0.336 CCCCCOCCCCCCOC 34a_100000210253_100011998445 [1,0,0,0,0,0|1,0,1]=3 2948 B13R0.336 CCCCCOCCCCCCOC 34a_200012092642_100000718602 [1,0,0,0,0,0|1,0,1]=3 2949 B13R0.336 CCCCCOCCCCCCOC 7a_100000210253_100011998445 [1,0,0,0,0,0|1,0,1]=3 2950 B13R0.336 CCCCCOCCCCCCOC 7a_200012092642_100000210326 [1,0,0,0,0,0|1,0,1]=3 2951 B13R0.336 CCCCCOCCCOCCOC 34a_100000210253_100011216529 [1,0,0,0,0,0|2,0,1]=4 2952 B13R0.336 CCCCCOCCCOCCOC 7a_100000210253_100011216529 [1,0,0,0,0,0|2,0,1]=4 2953 B13R0.336 CCCCCOCCOCCCOC 34a_100011215259_100000740836 [1,0,0,0,0,0|2,0,1]=4 2954 B13R0.336 CCCCCOCCOCCCOC 7a_100011215259_100000740836 [1,0,0,0,0,0|2,0,1]=4 2955 B13R0.336 CCCCCSCCCCCCOC 62a_100000210326_100011998445 [1,0,0,0,0,0|1,0,1]=3 2956 B13R0.336 CCCCCSCCCCCCOC 62a_100011998445_100000210326 [1,0,0,0,0,0|1,0,1]=3 2957 B13R0.336 CCCCCSCCCOCCOC 62a_100000210326_100011216529 [1,0,0,0,0,0|2,0,1]=4 2958 B13R0.336 CCCCCSCCCOCCOC 62a_100011216529_100000210326 [1,0,0,0,0,0|2,0,1]=4 2959 B13R0.336 CCCCNCCCCOCCOC 34a_200011216965_100011201679 [1,0,0,0,0,0|2,0,1]=4 2960 B13R0.336 CCCCOCCCCOCCOC 34a_200000760531_100011201679 [1,0,0,0,0,0|2,0,1]=4 2961 B13R0.336 CCCCOCCCCOCCOC 7a_200000760531_100000233755 [1,0,0,0,0,0|2,0,1]=4 2962 B13R0.336 CCCCOCCCNCCCOC 2230a_200000211371_100000740836 [1,0,0,0,0,0|2,0,1]=4 2963 B13R0.336 CCCCOCCCNCCCOC 34a_200000211371_100000740836 [1,0,0,0,0,0|2,0,1]=4 2964 B13R0.336 CCCCOCCCOCCCOC 34a_200011215475_100000210210 [1,0,0,0,0,0|2,0,1]=4 2965 B13R0.336 CCCCOCCCOCCCOC 34a_200011215613_100000740836 [1,0,0,0,0,0|2,0,1]=4 2966 B13R0.336 CCCCOCCCOCCCOC 7a_200011215475_100000210211 [1,0,0,0,0,0|2,0,1]=4 2967 B13R0.336 CCCCOCCCOCCCOC 7a_200011215613_100000740836 [1,0,0,0,0,0|2,0,1]=4 2968 B13R0.336 CCCCOCCOCCCCOC 34a_100000210238_100000755781 [1,0,0,0,0,0|2,0,1]=4 2969 B13R0.336 CCCCOCCOCCCCOC 34a_100000740925_100000743108 [1,0,0,0,0,0|2,0,1]=4 2970 B13R0.336 CCCCOCCOCCCCOC 7a_100000210238_100000730899 [1,0,0,0,0,0|2,0,1]=4 2971 B13R0.336 CCCCOCCSCCCCOC 62a_100000730899_100000743108 [1,0,0,0,0,0|2,0,1]=4 2972 B13R0.336 CCCCOCCSCCCCOC 62a_100000743108_100000730899 [1,0,0,0,0,0|2,0,1]=4 2973 B13R0.336 CCCCOCNCCCCCOC 2230a_100000747528_100011995733 [1,0,0,0,0,0|2,0,1]=4 2974 B13R0.336 CCCCOCNCCCCCOC 34a_100000747528_100011995733 [1,0,0,0,0,0|2,0,1]=4 2975 B13R0.336 CCCCSCCNCCCCOC 2230a_100025743550_100000730899 [1,0,0,0,0,0|2,0,1]=4 2976 B13R0.336 CCCCSCCOCCCCOC 34a_200000230436_100000755781 [1,0,0,0,0,0|2,0,1]=4 2977 B13R0.336 CCCCSCCOCCCCOC 7a_200000230436_100000730899 [1,0,0,0,0,0|2,0,1]=4 2978 B13R0.336 CCCOCCCNCCCCOC 2230a_100011217757_100000730899 [1,0,0,0,0,0|2,0,1]=4 2979 B13R0.336 CCCOCCCNCCCCOC 34a_100011217757_100000755781 [1,0,0,0,0,0|2,0,1]=4 2980 B13R0.336 CCCOCCNCCCCCOC 2230a_100000747528_100011215938 [1,0,0,0,0,0|2,0,1]=4 2981 B13R0.336 CCCOCCNCCCCCOC 34a_100000747528_100011215938 [1,0,0,0,0,0|2,0,1]=4 2982 B13R0.336 CCNCCCCCCCCCCO 2230a_100000066964_100000210202 [1,0,0,0,0,0|3,0,0]=4 2983 B13R0.336 CCNCCCCCCCCCCO 2230a_100015525214_100009813290 [1,0,0,0,0,0|3,0,0]=4 2984 B13R0.336 CCNCCCCCCCCCCO 34a_100000066964_100000210202 [1,0,0,0,0,0|3,0,0]=4 2985 B13R0.336 CCOCCCCCCCCCCBr 34a_100009813290_100000210202 [1,0,0,0,0,0|3,0,0]=4 2986 B13R0.336 CCOCCCCCCCCCCBr 7a_100009813290_100000210202 [1,0,0,0,0,0|3,0,0]=4 2987 B13R0.336 CCOCCCCCCCCCCCl 34a_200000033068_100000210202 [1,0,0,0,0,0|3,0,0]=4 2988 B13R0.336 CCOCCCCCCCCCCCl 7a_200000033068_100000210202 [1,0,0,0,0,0|3,0,0]=4 2989 B13R0.336 CCOCCCCCCCCCCN 34a_100000066964_100000210202 [1,0,0,0,0,0|3,0,0]=4 2990 B13R0.336 CCOCCCCCCCCCCO 34a_100121572206_100009813290 [1,0,0,0,0,0|3,0,0]=4 2991 B13R0.336 CCOCCCCCCCCCOC 34a_100009875440_200000210301 [1,0,0,0,0,0|1,0,1]=3 2992 B13R0.336 CCOCCCCCCCCCOC 7a_100009875440_200000210301 [1,0,0,0,0,0|1,0,1]=3 2993 B13R0.336 CCOCCCCCCCCCO[13CH3] 34a_100009875440_200025704644 [1,0,0,0,0,0|1,0,1]=3 2994 B13R0.336 CCOCCCCCCCCCO[13CH3] 7a_100009875440_200025704644 [1,0,0,0,0,0|1,0,1]=3 2995 B13R0.336 CCOCCCNCCCCCOC 2230a_100000747528_100012232248 [1,0,0,0,0,0|2,0,1]=4 2996 B13R0.336 CCOCCCNCCCCCOC 34a_100000747528_100012232248 [1,0,0,0,0,0|2,0,1]=4 2997 B13R0.336 CCOCCNCCCCCCOC 2230a_102516460346_100011998445 [1,0,0,0,0,0|2,0,1]=4 2998 B13R0.336 CCOCCNCCCCCCOC 34a_102516460346_100011998445 [1,0,0,0,0,0|2,0,1]=4 2999 B13R0.336 CCOCCOCCCCCCOC 34a_100000210136_100011998445 [1,0,0,0,0,0|2,0,1]=4 3000 B13R0.336 CCOCCOCCCCCCOC 34a_200012092642_100000210147 [1,0,0,0,0,0|2,0,1]=4 3001 B13R0.336 CCOCCOCCCCCCOC 7a_100000210136_100011998445 [1,0,0,0,0,0|2,0,1]=4 3002 B13R0.336 CCOCCOCCCCCCOC 7a_200012092642_100011215890 [1,0,0,0,0,0|2,0,1]=4 3003 B13R0.336 CCOCCSCCCCCCOC 62a_100000210147_100011998445 [1,0,0,0,0,0|2,0,1]=4 3004 B13R0.336 CCOCCSCCCCCCOC 62a_100011998445_100011215890 [1,0,0,0,0,0|2,0,1]=4 3005 B13R0.336 CCSCCCCCCCCCCO 62a_100000210202_200000033068 [1,0,0,0,0,0|3,0,0]=4 3006 B13R0.336 CCSCCCCCCCCCCO 62a_100009813290_100000210202 [1,0,0,0,0,0|3,0,0]=4 3007 B13R0.336 CCSCCNCCCCCCOC 2230a_100000106463_100011998445 [1,0,0,0,0,0|2,0,1]=4 3008 B13R0.336 CCSCCOCCCCCCOC 34a_100000212035_100011998445 [1,0,0,0,0,0|2,0,1]=4 3009 B13R0.336 CCSCCOCCCCCCOC 34a_200012092642_100000757381 [1,0,0,0,0,0|2,0,1]=4 3010 B13R0.336 CCSCCOCCCCCCOC 7a_100000212035_100011998445 [1,0,0,0,0,0|2,0,1]=4 3011 B13R0.336 CCSCCOCCCCCCOC 7a_200012092642_100000757381 [1,0,0,0,0,0|2,0,1]=4 3012 B13R0.336 CCSCCSCCCCCCOC 62a_100000757381_100011998445 [1,0,0,0,0,0|2,0,1]=4 3013 B13R0.336 CCSCCSCCCCCCOC 62a_100011998445_100000757381 [1,0,0,0,0,0|2,0,1]=4 3014 B13R0.336 CNCCCCCCCCCCCO 2230a_106832991635_100009812471 [1,0,0,0,0,0|2,0,1]=4 3015 B13R0.336 CNCCCCCCCCCCCO 34a_100102657272_100009812471 [1,0,0,0,0,0|2,0,1]=4 3016 B13R0.336 CNCCCCCCCCCCCO 7a_106832991635_100009812471 [1,0,0,0,0,0|2,0,1]=4 3017 B13R0.336 CNCCCCCOCCCCOC 34a_100000722520_100000755781 [1,0,0,0,0,0|2,0,1]=4 3018 B13R0.336 CNCCCOCCCCCCOC 34a_100000213112_100011998445 [1,0,0,0,0,0|2,0,1]=4 3019 B13R0.336 COCCCCCCCCCCCBr 34a_100009812471_200000210301 [1,0,0,0,0,0|1,0,1]=3 3020 B13R0.336 COCCCCCCCCCCCBr 7a_100009812471_200000210301 [1,0,0,0,0,0|1,0,1]=3 3021 B13R0.336 COCCCCCCCCCCCO 34a_100138415774_100009812471 [1,0,0,0,0,0|1,0,1]=3 3022 B13R0.336 COCCCCCCNCCCCO 2230a_100000750430_100011998445 [1,0,0,0,0,0|2,0,1]=4 3023 B13R0.336 COCCCCCCNCCCCO 34a_100000750430_100011998445 [1,0,0,0,0,0|2,0,1]=4 3024 B13R0.336 COCCCCCCNCCCOC 34a_100150723488_100011998445 [1,0,0,0,0,0|2,0,1]=4 3025 B13R0.336 COCCCCCCNCCCSC 2230a_100000749238_100011998445 [1,0,0,0,0,0|2,0,1]=4 3026 B13R0.336 COCCCCCCOCCCCBr 34a_100011216708_100011998445 [1,0,0,0,0,0|2,0,1]=4 3027 B13R0.336 COCCCCCCOCCCCCl 34a_100000210776_100011998445 [1,0,0,0,0,0|2,0,1]=4 3028 B13R0.336 COCCCCCCOCCCCCl 7a_100000210776_100011998445 [1,0,0,0,0,0|2,0,1]=4 3029 B13R0.336 COCCCCCCOCCCCF 34a_100011995726_100011998445 [1,0,0,0,0,0|2,0,1]=4 3030 B13R0.336 COCCCCCCOCCCCF 34a_200012092642_100000729493 [1,0,0,0,0,0|2,0,1]=4 3031 B13R0.336 COCCCCCCOCCCCF 7a_100011995726_100011998445 [1,0,0,0,0,0|2,0,1]=4 3032 B13R0.336 COCCCCCCOCCCCF 7a_200012092642_100000729493 [1,0,0,0,0,0|2,0,1]=4 3033 B13R0.336 COCCCCCCOCCCCI 34a_200012148704_100011998445 [1,0,0,0,0,0|2,0,1]=4 3034 B13R0.336 COCCCCCCOCCCCN 34a_100000750430_100011998445 [1,0,0,0,0,0|2,0,1]=4 3035 B13R0.336 COCCCCCCOCCCCO 34a_200012092642_100011216708 [1,0,0,0,0,0|2,0,1]=4 3036 B13R0.336 COCCCCCCOCCCCO 7a_200012092642_100000210776 [1,0,0,0,0,0|2,0,1]=4 3037 B13R0.336 COCCCCCCOCCCOC 34a_100000740835_100011998445 [1,0,0,0,0,0|2,0,1]=4 3038 B13R0.336 COCCCCCCOCCCOC 34a_200012092642_100000740836 [1,0,0,0,0,0|2,0,1]=4 3039 B13R0.336 COCCCCCCOCCCOC 7a_200012092642_100000740836 [1,0,0,0,0,0|2,0,1]=4 3040 B13R0.336 COCCCCCCOCCCSC 34a_100000690336_100011998445 [1,0,0,0,0,0|2,0,1]=4 3041 B13R0.336 COCCCCCCOCCCSC 7a_100000690336_100011998445 [1,0,0,0,0,0|2,0,1]=4 3042 B13R0.336 COCCCCCCSCCCCF 62a_100000729493_100011998445 [1,0,0,0,0,0|2,0,1]=4 3043 B13R0.336 COCCCCCCSCCCCF 62a_100011998445_100000729493 [1,0,0,0,0,0|2,0,1]=4 3044 B13R0.336 COCCCCCCSCCCCO 62a_100000210776_100011998445 [1,0,0,0,0,0|2,0,1]=4 3045 B13R0.336 COCCCCCCSCCCCO 62a_100011998445_100000210776 [1,0,0,0,0,0|2,0,1]=4 3046 B13R0.336 COCCCCCCSCCCOC 62a_100000709357_100011998445 [1,0,0,0,0,0|2,0,1]=4 3047 B13R0.336 COCCCCCCSCCCOC 62a_100011998445_100000709357 [1,0,0,0,0,0|2,0,1]=4 3048 B13R0.336 COCCCCCNCCCCCF 2230a_100000747528_100000729378 [1,0,0,0,0,0|2,0,1]=4 3049 B13R0.336 COCCCCCNCCCCCF 34a_100000747528_100000729378 [1,0,0,0,0,0|2,0,1]=4 3050 B13R0.336 COCCCCCNCCCCCO 2230a_100000747528_100000746330 [1,0,0,0,0,0|2,0,1]=4 3051 B13R0.336 COCCCCCNCCCCCO 34a_100000747528_100000746330 [1,0,0,0,0,0|2,0,1]=4 3052 B13R0.336 COCCCCCNCCCCOC 2230a_100000747528_100000730899 [1,0,0,0,0,0|2,0,1]=4 3053 B13R0.336 COCCCCCNCCCCOC 34a_100000747528_100000755781 [1,0,0,0,0,0|2,0,1]=4 3054 B13R0.336 COCCCCNCCCCCCO 2230a_100000686447_100000730899 [1,0,0,0,0,0|2,0,1]=4 3055 B13R0.336 COCCCCNCCCCCCO 34a_100000686447_100000755781 [1,0,0,0,0,0|2,0,1]=4 3056 B13R0.336 COCCCCOCCCCCCBr 34a_100011215345_100000755781 [1,0,0,0,0,0|2,0,1]=4 3057 B13R0.336 COCCCCOCCCCCCBr 7a_100011215345_100000730899 [1,0,0,0,0,0|2,0,1]=4 3058 B13R0.336 COCCCCOCCCCCCCl 34a_100000766143_100000755781 [1,0,0,0,0,0|2,0,1]=4 3059 B13R0.336 COCCCCOCCCCCCCl 7a_100000766143_100000730899 [1,0,0,0,0,0|2,0,1]=4 3060 B13R0.336 COCCCCOCCCCCCF 34a_100000732779_100000755781 [1,0,0,0,0,0|2,0,1]=4 3061 B13R0.336 COCCCCOCCCCCCF 34a_100000740925_100015922095 [1,0,0,0,0,0|2,0,1]=4 3062 B13R0.336 COCCCCOCCCCCCF 7a_100000732779_100000730899 [1,0,0,0,0,0|2,0,1]=4 3063 B13R0.336 COCCCCOCCCCCCN 34a_100000686447_100000755781 [1,0,0,0,0,0|2,0,1]=4 3064 B13R0.336 COCCCCOCCCCCCO 34a_100000740925_100000766143 [1,0,0,0,0,0|2,0,1]=4 3065 B13R0.336 COCCCCSCCCCCCF 62a_100000730899_100015922095 [1,0,0,0,0,0|2,0,1]=4 3066 B13R0.336 COCCCCSCCCCCCF 62a_100015922095_100000730899 [1,0,0,0,0,0|2,0,1]=4 3067 B13R0.336 COCCCCSCCCCCCO 62a_100000730899_100000766143 [1,0,0,0,0,0|2,0,1]=4 3068 B13R0.336 COCCCCSCCCCCCO 62a_100000766143_100000730899 [1,0,0,0,0,0|2,0,1]=4 3069 B13R0.336 COCCCNCCCCCCCO 2230a_100011996573_100000740836 [1,0,0,0,0,0|2,0,1]=4 3070 B13R0.336 COCCCNCCCCCCCO 34a_100011996573_100000740836 [1,0,0,0,0,0|2,0,1]=4 3071 B13R0.336 COCCCNCCCCCCCO 34a_100150723488_100000760002 [1,0,0,0,0,0|2,0,1]=4 3072 B13R0.336 COCCCOCCCCCCCBr 34a_100000760002_100000740836 [1,0,0,0,0,0|2,0,1]=4 3073 B13R0.336 COCCCOCCCCCCCBr 7a_100000760002_100000740836 [1,0,0,0,0,0|2,0,1]=4 3074 B13R0.336 COCCCOCCCCCCCN 34a_100011996573_100000740836 [1,0,0,0,0,0|2,0,1]=4 3075 B13R0.336 COCCCOCCCCCCCO 34a_100000740835_100000760002 [1,0,0,0,0,0|2,0,1]=4 3076 B13R0.336 COCCCSCCCCCCCO 62a_100000709357_100000760002 [1,0,0,0,0,0|2,0,1]=4 3077 B13R0.336 COCCCSCCCCCCCO 62a_100000760002_100000709357 [1,0,0,0,0,0|2,0,1]=4 3078 B13R0.336 COCCNCCCCCCCCO 2230a_100000209980_100000033203 [1,0,0,0,0,0|2,0,1]=4 3079 B13R0.336 COCCNCCCCCCCCO 2230a_102515433106_100011201679 [1,0,0,0,0,0|2,0,1]=4 3080 B13R0.336 COCCNCCCCCCCCO 34a_102515433106_100011201679 [1,0,0,0,0,0|2,0,1]=4 3081 B13R0.336 COCCOCCCCCCCCBr 34a_100009813846_100011201679 [1,0,0,0,0,0|2,0,1]=4 3082 B13R0.336 COCCOCCCCCCCCBr 7a_100009813846_100000233755 [1,0,0,0,0,0|2,0,1]=4 3083 B13R0.336 COCCOCCCCCCCCCl 34a_100000033203_100011201679 [1,0,0,0,0,0|2,0,1]=4 3084 B13R0.336 COCCOCCCCCCCCCl 7a_100000033203_100000233755 [1,0,0,0,0,0|2,0,1]=4 3085 B13R0.336 COCCOCCCCCCCCN 34a_102515433106_100011201679 [1,0,0,0,0,0|2,0,1]=4 3086 B13R0.336 COCCOCCCCCCCCO 34a_100000210237_100000033203 [1,0,0,0,0,0|2,0,1]=4 3087 B13R0.336 COCCSCCCCCCCCO 62a_100000033203_100000233755 [1,0,0,0,0,0|2,0,1]=4 3088 B13R0.336 COCCSCCCCCCCCO 62a_100000233755_100000033203 [1,0,0,0,0,0|2,0,1]=4 3089 B13R0.336 COCNCCCCCCCCCO 2230a_100000078944_100000766300 [1,0,0,0,0,0|2,0,1]=4 3090 B13R0.336 COCSCCCCCCCCCO 62a_100000766300_100009813782 [1,0,0,0,0,0|2,0,1]=4 3091 B13R0.336 COCSCCCCCCCCCO 62a_100009813782_100000766300 [1,0,0,0,0,0|2,0,1]=4 3092 B13R0.336 CSCCCCCCCCCCCO 62a_100009812471_200000210301 [1,0,0,0,0,0|1,1,1]=4 3093 B13R0.336 [13CH3]OCCCCCCCCCCCBr 34a_100009812471_200025704644 [1,0,0,0,0,0|1,0,1]=3 3094 B13R0.336 [13CH3]OCCCCCCCCCCCBr 7a_100009812471_200025704644 [1,0,0,0,0,0|1,0,1]=3 3095 B13R0.336 [13CH3]SCCCCCCCCCCCO 62a_100009812471_200025704644 [1,0,0,0,0,0|1,1,1]=4 3096 B15R0.81 C#CC(=O)CCCCCCC#CCCCC 1458a_100000211873_200000043322 [0,1,0,0,0,0|1,0,2]=4 3097 B15R0.81 C#CC(=O)CCCCCCCCCCC=C 1458a_100000211873_100011093070 [0,1,0,0,0,0|1,0,2]=4 3098 B15R0.81 C#CC(=O)CCCCCCCCCCCC 1458a_100000211873_100000759014 [0,1,0,0,0,0|1,0,1]=3 3099 B15R0.81 C#CC(=O)CCCCCCCCCCCO 1458a_100000211873_100009812471 [0,1,0,0,0,0|1,0,1]=3 3100 B15R0.81 C#CCCCCCCCCOCC(=O)CC 7a_100000065265_100000747405 [0,1,0,0,0,0|1,0,2]=4 3101 B15R0.81 C#CCCCCCCCCOCC(=O)NC 34a_100000065265_100000183359 [0,1,0,0,0,0|1,0,2]=4 3102 B15R0.81 C#CCCCCCCCCOCC(=O)NC 7a_100000065265_100000183359 [0,1,0,0,0,0|1,0,2]=4 3103 B15R0.81 C#CCCCCCCCCOCC(=O)OC 34a_100000065265_100000747449 [0,1,0,0,0,0|0,0,2]=3 3104 B15R0.81 C#CCCCCCCCCOCC(=O)OC 7a_100000065265_100000747449 [0,1,0,0,0,0|0,0,2]=3 3105 B15R0.81 C#CCCCCCCCNCCC(=O)NC 2230a_100000738227_100153394163 [0,1,0,0,0,0|1,0,2]=4 3106 B15R0.81 C#CCCCCCCCNCCC(=O)NC 34a_100000738227_100153394163 [0,1,0,0,0,0|1,0,2]=4 3107 B15R0.81 C#CCCCCCCCOCCC(=O)NC 34a_100000054614_100012179268 [0,1,0,0,0,0|1,0,2]=4 3108 B15R0.81 C#CCCCCCCCOCCC(=O)NC 34a_100000754576_100153394163 [0,1,0,0,0,0|1,0,2]=4 3109 B15R0.81 C#CCCCCCCCOCCC(=O)NC 7a_100000054614_100000737683 [0,1,0,0,0,0|1,0,2]=4 3110 B15R0.81 C#CCCCCCCCOCCC(=O)OC 34a_100000054614_100000742370 [0,1,0,0,0,0|0,0,2]=3 3111 B15R0.81 C#CCCCCCCCOCCC(=O)OC 7a_100000054614_100000204255 [0,1,0,0,0,0|0,0,2]=3 3112 B15R0.81 C#CCCCCCCCSCCC(=O)NC 62a_100000737683_100153394163 [0,1,0,0,0,0|1,0,2]=4 3113 B15R0.81 C#CCCCCCCCSCCC(=O)NC 62a_100153394163_100000737683 [0,1,0,0,0,0|1,0,2]=4 3114 B15R0.81 C#CCCCCCCCSCCC(=O)OC 62a_100000204255_100153394163 [0,1,0,0,0,0|0,0,2]=3 3115 B15R0.81 C#CCCCCCCCSCCC(=O)OC 62a_100153394163_100000204255 [0,1,0,0,0,0|0,0,2]=3 3116 B15R0.81 C#CCCCCCCCSCOC(=O)OC 62a_100153394163_100000139417 [0,1,0,0,0,0|1,0,2]=4 3117 B15R0.81 C#CCCCCCCNCCCC(=O)NC 2230a_100000740002_100012276617 [0,1,0,0,0,0|1,0,2]=4 3118 B15R0.81 C#CCCCCCCNCCCC(=O)NC 34a_100000740002_100012276617 [0,1,0,0,0,0|1,0,2]=4 3119 B15R0.81 C#CCCCCCCOCCCC(=O)NC 34a_100011217361_100000741757 [0,1,0,0,0,0|1,0,2]=4 3120 B15R0.81 C#CCCCCCCOCCCC(=O)NC 7a_100011217361_100000741757 [0,1,0,0,0,0|1,0,2]=4 3121 B15R0.81 C#CCCCCCCOCCCC(=O)OC 34a_100011217361_100000742333 [0,1,0,0,0,0|0,0,2]=3 3122 B15R0.81 C#CCCCCCCOCCCC(=O)OC 7a_100011217361_100011218270 [0,1,0,0,0,0|0,0,2]=3 3123 B15R0.81 C#CCCCCCCOCCNC(=O)OC 34a_100000757965_100012276617 [0,1,0,0,0,0|1,0,2]=4 3124 B15R0.81 C#CCCCCCCOCCOC(=O)OC 34a_100010262106_100012276617 [0,1,0,0,0,0|1,0,2]=4 3125 B15R0.81 C#CCCCCCCSCCCC(=O)NC 62a_100000741757_100012276617 [0,1,0,0,0,0|1,0,2]=4 3126 B15R0.81 C#CCCCCCCSCCCC(=O)NC 62a_100012276617_100000741757 [0,1,0,0,0,0|1,0,2]=4 3127 B15R0.81 C#CCCCCCCSCCCC(=O)OC 62a_100011218270_100012276617 [0,1,0,0,0,0|0,0,2]=3 3128 B15R0.81 C#CCCCCCCSCCCC(=O)OC 62a_100012276617_100011218270 [0,1,0,0,0,0|0,0,2]=3 3129 B15R0.81 C#CCCCCCOCCCCC(=O)OC 34a_100000059025_100012094781 [0,1,0,0,0,0|0,0,2]=3 3130 B15R0.81 C#CCCCCCOCCCCC(=O)OC 34a_100000766912_100000204269 [0,1,0,0,0,0|0,0,2]=3 3131 B15R0.81 C#CCCCCCOCCCCC(=O)OC 7a_100000059025_100012094781 [0,1,0,0,0,0|0,0,2]=3 3132 B15R0.81 C#CCCCCCOCCCCC(=O)OC 7a_100000766912_100000204269 [0,1,0,0,0,0|0,0,2]=3 3133 B15R0.81 C#CCCCCCOCCOCC(=O)OC 34a_100000766912_100000090808 [0,1,0,0,0,0|1,0,2]=4 3134 B15R0.81 C#CCCCCCOCCOCC(=O)OC 7a_100000766912_100000090808 [0,1,0,0,0,0|1,0,2]=4 3135 B15R0.81 C#CCCCCCSCCCCC(=O)OC 62a_100000204269_100012094781 [0,1,0,0,0,0|0,0,2]=3 3136 B15R0.81 C#CCCCCCSCCCCC(=O)OC 62a_100012094781_100000204269 [0,1,0,0,0,0|0,0,2]=3 3137 B15R0.81 C#CCCCCCSCCOCC(=O)OC 62a_100000090808_100012094781 [0,1,0,0,0,0|1,0,2]=4 3138 B15R0.81 C#CCCCCCSCCOCC(=O)OC 62a_100012094781_100000090808 [0,1,0,0,0,0|1,0,2]=4 3139 B15R0.81 C#CCCCCNCCCCCC(=O)OC 2230a_100000706060_100009816466 [0,1,0,0,0,0|0,0,2]=3 3140 B15R0.81 C#CCCCCNCCCCCC(=O)OC 34a_100000706060_100009816466 [0,1,0,0,0,0|0,0,2]=3 3141 B15R0.81 C#CCCCCOCCCCCC(=O)OC 34a_100000074720_100010269958 [0,1,0,0,0,0|0,0,2]=3 3142 B15R0.81 C#CCCCCOCCCCCC(=O)OC 34a_100000766709_100009816466 [0,1,0,0,0,0|0,0,2]=3 3143 B15R0.81 C#CCCCCOCCCCCC(=O)OC 7a_100000074720_100010269958 [0,1,0,0,0,0|0,0,2]=3 3144 B15R0.81 C#CCCCCOCCCCCC(=O)OC 7a_100000766709_100009816466 [0,1,0,0,0,0|0,0,2]=3 3145 B15R0.81 C#CCCCCSCCCCCC(=O)OC 62a_100009816466_100010269958 [0,1,0,0,0,0|0,0,2]=3 3146 B15R0.81 C#CCCCCSCCCCCC(=O)OC 62a_100010269958_100009816466 [0,1,0,0,0,0|0,0,2]=3 3147 B15R0.81 C#CCCCNCCCCCCC(=O)OC 34a_100000718082_100009815986 [0,1,0,0,0,0|0,0,2]=3 3148 B15R0.81 C#CCCCOCCCCCCC(=O)OC 34a_100000215630_100009815986 [0,1,0,0,0,0|0,0,2]=3 3149 B15R0.81 C#CCCCOCCCCCCC(=O)OC 34a_100009863599_100000695029 [0,1,0,0,0,0|0,0,2]=3 3150 B15R0.81 C#CCCCOCCCCCCC(=O)OC 7a_100000215630_100009815986 [0,1,0,0,0,0|0,0,2]=3 3151 B15R0.81 C#CCCCOCCCCCCC(=O)OC 7a_100009863599_100011215417 [0,1,0,0,0,0|0,0,2]=3 3152 B15R0.81 C#CCCCSCCCCCCC(=O)OC 62a_100009815986_100011215417 [0,1,0,0,0,0|0,0,2]=3 3153 B15R0.81 C#CCCCSCCCCCCC(=O)OC 62a_100011215417_100009815986 [0,1,0,0,0,0|0,0,2]=3 3154 B15R0.81 C#CCCNCCCCCCCC(=O)OC 34a_100000755551_100010004213 [0,1,0,0,0,0|0,0,2]=3 3155 B15R0.81 C#CCCOCCCCCCCC(=O)OC 34a_100011022521_100000688953 [0,1,0,0,0,0|0,0,2]=3 3156 B15R0.81 C#CCCOCCCCCCCC(=O)OC 34a_100011215631_100010004213 [0,1,0,0,0,0|0,0,2]=3 3157 B15R0.81 C#CCCOCCCCCCCC(=O)OC 7a_100011022521_100000688953 [0,1,0,0,0,0|0,0,2]=3 3158 B15R0.81 C#CCCSCCCCCCCC(=O)OC 62a_100000688953_100010004213 [0,1,0,0,0,0|0,0,2]=3 3159 B15R0.81 C#CCCSCCCCCCCC(=O)OC 62a_100010004213_100000688953 [0,1,0,0,0,0|0,0,2]=3 3160 B15R0.81 C#CCNCCCCCCCCC(=O)OC 34a_100000212058_100010282707 [0,1,0,0,0,0|0,0,2]=3 3161 B15R0.81 C#CCOCCCCCCCCC(=O)OC 34a_100000035544_100000184674 [0,1,0,0,0,0|0,0,2]=3 3162 B15R0.81 C#CCOCCCCCCCCC(=O)OC 34a_100000210247_100010282707 [0,1,0,0,0,0|0,0,2]=3 3163 B15R0.81 C#CCOCCCCCCCCC(=O)OC 7a_100000035544_100000038162 [0,1,0,0,0,0|0,0,2]=3 3164 B15R0.81 C#CCOCCCCCCOCC(=O)OC 34a_200011021349_100000747449 [0,1,0,0,0,0|1,0,2]=4 3165 B15R0.81 C#CCOCCCCCCOCC(=O)OC 7a_200011021349_100000747449 [0,1,0,0,0,0|1,0,2]=4 3166 B15R0.81 C#CCOCCNCCCCCC(=O)OC 2230a_100000700922_100009816466 [0,1,0,0,0,0|1,0,2]=4 3167 B15R0.81 C#CCOCCNCCCCCC(=O)OC 34a_100000700922_100009816466 [0,1,0,0,0,0|1,0,2]=4 3168 B15R0.81 C#CCOCCOCCCCCC(=O)OC 34a_100000054580_100009816466 [0,1,0,0,0,0|1,0,2]=4 3169 B15R0.81 C#CCOCCOCCCCCC(=O)OC 34a_100000074720_100010402529 [0,1,0,0,0,0|1,0,2]=4 3170 B15R0.81 C#CCOCCOCCCCCC(=O)OC 7a_100000054580_100009816466 [0,1,0,0,0,0|1,0,2]=4 3171 B15R0.81 C#CCOCCOCCCCCC(=O)OC 7a_100000074720_100010402529 [0,1,0,0,0,0|1,0,2]=4 3172 B15R0.81 C#CCOCCSCCCCCC(=O)OC 62a_100009816466_100010402529 [0,1,0,0,0,0|1,0,2]=4 3173 B15R0.81 C#CCOCCSCCCCCC(=O)OC 62a_100010402529_100009816466 [0,1,0,0,0,0|1,0,2]=4 3174 B15R0.81 C#CCSCCCCCCCCC(=O)OC 62a_100000038162_100010282707 [0,1,0,0,0,0|0,0,2]=3 3175 B15R0.81 C/C=C/CCOCCCCCCC(=O)OC 34a_100016278192_100009815986 [0,1,0,0,0,0|0,0,2]=3 3176 B15R0.81 C/C=C/COCCCCCCCC(=O)OC 34a_100011022521_100102629194 [0,1,0,0,0,0|0,0,2]=3 3177 B15R0.81 C/C=C/COCCCCCCCC(=O)OC 34a_100016270725_100010004213 [0,1,0,0,0,0|0,0,2]=3 3178 B15R0.81 C/C=C/COCCCCCCCC(=O)OC 7a_100011022521_100102629194 [0,1,0,0,0,0|0,0,2]=3 3179 B15R0.81 C/C=C/CSCCCCCCCC(=O)OC 62a_100010004213_100102629194 [0,1,0,0,0,0|0,0,2]=3 3180 B15R0.81 C/C=C/CSCCCCCCCC(=O)OC 62a_100102629194_100010004213 [0,1,0,0,0,0|0,0,2]=3 3181 B15R0.81 C=C(C#N)CNCCCCCCCCCC 2230a_100000684558_100000694840 [0,1,0,0,0,0|3,0,0]=4 3182 B15R0.81 C=C(C#N)CNCCCCCCCCCC 34a_100000684558_100000694840 [0,1,0,0,0,0|3,0,0]=4 3183 B15R0.81 C=C(C#N)COCCCCCCCCCC 34a_100000210711_100000694840 [0,1,0,0,0,0|3,0,0]=4 3184 B15R0.81 C=CC(=O)CCCCCCC#CCCCC 1458a_100000185746_200000043322 [0,1,0,0,0,0|1,0,2]=4 3185 B15R0.81 C=CC(=O)CCCCCCCCCCCC 1458a_100000185746_100000759014 [0,1,0,0,0,0|1,0,1]=3 3186 B15R0.81 C=CC(=O)CCCCCCCCCCCO 1458a_100000185746_100009812471 [0,1,0,0,0,0|1,0,1]=3 3187 B15R0.81 C=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000185746 [0,1,0,0,0,0|1,0,1]=3 3188 B15R0.81 C=CC(=O)NCCCCCCCCCCC 240690a_200011215754_200121576911 [0,1,0,0,0,0|1,0,1]=3 3189 B15R0.81 C=CC(=O)NCCCCCCCCCCO 240690a_100000066964_200121576911 [0,1,0,0,0,0|2,0,1]=4 3190 B15R0.81 C=CC(=O)NCCCCOCCCCCC 34a_100014118770_100000210314 [0,1,0,0,0,0|2,0,1]=4 3191 B15R0.81 C=CC(=O)NCCNCCCCCCCC 2230a_114873766552_100000210759 [0,1,0,0,0,0|2,0,1]=4 3192 B15R0.81 C=CC(=O)NCCOCCCCCCCC 34a_100011304386_100000210759 [0,1,0,0,0,0|2,0,1]=4 3193 B15R0.81 C=CC(=O)OCCCCCCNCCCC 2230a_100000102301_100009894100 [0,1,0,0,0,0|2,0,1]=4 3194 B15R0.81 C=CC(=O)OCCCCCCNCCCC 7a_106832991798_100009894100 [0,1,0,0,0,0|2,0,1]=4 3195 B15R0.81 C=CC(=O)OCCCCCCOCCCC 34a_100000210227_100009894100 [0,1,0,0,0,0|2,0,1]=4 3196 B15R0.81 C=CC(=O)OCCCCCCOCCCC 7a_100000210227_100009894100 [0,1,0,0,0,0|2,0,1]=4 3197 B15R0.81 C=CC(=O)OCCCCCCSCCCC 62a_100000210211_100009894100 [0,1,0,0,0,0|2,0,1]=4 3198 B15R0.81 C=CC(=O)OCCCCCCSCCCC 62a_100009894100_100000210210 [0,1,0,0,0,0|2,0,1]=4 3199 B15R0.81 C=CC(=O)OCCCCCOCCCCC 7a_200011023508_100000210326 [0,1,0,0,0,0|2,0,1]=4 3200 B15R0.81 C=CC(=O)OCCNCCCCCCCC 2230a_100000229939_100009813456 [0,1,0,0,0,0|2,0,1]=4 3201 B15R0.81 C=CC(=O)OCCNCCCCCCCC 34a_100000229939_100009813456 [0,1,0,0,0,0|2,0,1]=4 3202 B15R0.81 C=CC(=O)OCCOCCCCCCCC 34a_100000210232_100009813456 [0,1,0,0,0,0|2,0,1]=4 3203 B15R0.81 C=CC(=O)OCCOCCCCCCCC 7a_100000210232_100009813456 [0,1,0,0,0,0|2,0,1]=4 3204 B15R0.81 C=CC(=O)OCCSCCCCCCCC 62a_100000210759_100009813456 [0,1,0,0,0,0|2,0,1]=4 3205 B15R0.81 C=CC(=O)OCCSCCCCCCCC 62a_100009813456_100000210317 [0,1,0,0,0,0|2,0,1]=4 3206 B15R0.81 C=CCCCCCCCCCCC(=O)C=C 1458a_100000185746_100011093070 [0,1,0,0,0,0|1,0,2]=4 3207 B15R0.81 C=CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011093070 [0,1,0,0,0,0|1,0,1]=3 3208 B15R0.81 C=CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011093070 [0,1,0,0,0,0|2,0,1]=4 3209 B15R0.81 C=CCCCCCCCCCNC(=O)CC 11a_100000081888_100000210414 [0,1,0,0,0,0|1,0,2]=4 3210 B15R0.81 C=CCCCCCCCCCNC(=O)CC 1626a_100000081888_100000210414 [0,1,0,0,0,0|1,0,2]=4 3211 B15R0.81 C=CCCCCCCCCCNC(=O)CC 240690a_100000081888_100000210414 [0,1,0,0,0,0|1,0,2]=4 3212 B15R0.81 C=CCCCCCCCCCNC(=O)CC 527a_100000081888_100000210414 [0,1,0,0,0,0|1,0,2]=4 3213 B15R0.81 C=CCCCCCCCCCNC(=O)NC 2708a_100000081888_106832991635 [0,1,0,0,0,0|1,0,2]=4 3214 B15R0.81 C=CCCCCCCCCCNC(=O)NC 2708a_100102657272_100000081888 [0,1,0,0,0,0|1,0,2]=4 3215 B15R0.81 C=CCCCCCCCCCNC(=O)NC 273464a_100000081888_100102657272 [0,1,0,0,0,0|1,0,2]=4 3216 B15R0.81 C=CCCCCCCCCCNC(=O)NC 273464a_100102657272_100000081888 [0,1,0,0,0,0|1,0,2]=4 3217 B15R0.81 C=CCCCCCCCCCNC(=O)NC 512a_100000081888_100102657272 [0,1,0,0,0,0|1,0,2]=4 3218 B15R0.81 C=CCCCCCCCCCNC(=O)NC 512a_106832991638_100000081888 [0,1,0,0,0,0|1,0,2]=4 3219 B15R0.81 C=CCCCCCCCCNCC(=O)NC 2230a_100000693194_100011933949 [0,1,0,0,0,0|1,0,2]=4 3220 B15R0.81 C=CCCCCCCCCOCC(=O)CC 34a_100000725409_100011933949 [0,1,0,0,0,0|1,0,2]=4 3221 B15R0.81 C=CCCCCCCCCOCC(=O)CC 7a_100011215194_100000747405 [0,1,0,0,0,0|1,0,2]=4 3222 B15R0.81 C=CCCCCCCCCOCC(=O)NC 34a_100000750040_100011933949 [0,1,0,0,0,0|1,0,2]=4 3223 B15R0.81 C=CCCCCCCCCOCC(=O)NC 34a_100011215194_100000183359 [0,1,0,0,0,0|1,0,2]=4 3224 B15R0.81 C=CCCCCCCCCOCC(=O)NC 7a_100011215194_100000183359 [0,1,0,0,0,0|1,0,2]=4 3225 B15R0.81 C=CCCCCCCCCOCC(=O)OC 34a_100011215194_100000747449 [0,1,0,0,0,0|0,0,2]=3 3226 B15R0.81 C=CCCCCCCCCOCC(=O)OC 7a_100011215194_100000747449 [0,1,0,0,0,0|0,0,2]=3 3227 B15R0.81 C=CCCCCCCCCSCC(=O)CC 62a_100000747405_100011933949 [0,1,0,0,0,0|1,0,2]=4 3228 B15R0.81 C=CCCCCCCCCSCC(=O)CC 62a_100011933949_100000747405 [0,1,0,0,0,0|1,0,2]=4 3229 B15R0.81 C=CCCCCCCCCSCC(=O)NC 62a_100000183359_100011933949 [0,1,0,0,0,0|1,0,2]=4 3230 B15R0.81 C=CCCCCCCCCSCC(=O)NC 62a_100011933949_100000183359 [0,1,0,0,0,0|1,0,2]=4 3231 B15R0.81 C=CCCCCCCCCSCC(=O)OC 62a_100000747449_100011933949 [0,1,0,0,0,0|0,0,2]=3 3232 B15R0.81 C=CCCCCCCCCSCC(=O)OC 62a_100011933949_100000747449 [0,1,0,0,0,0|0,0,2]=3 3233 B15R0.81 C=CCCCCCCCNCCC(=O)NC 2230a_100000738227_100012355270 [0,1,0,0,0,0|1,0,2]=4 3234 B15R0.81 C=CCCCCCCCNCCC(=O)NC 34a_100000738227_100012355270 [0,1,0,0,0,0|1,0,2]=4 3235 B15R0.81 C=CCCCCCCCOCCC(=O)NC 34a_100000730831_100012179268 [0,1,0,0,0,0|1,0,2]=4 3236 B15R0.81 C=CCCCCCCCOCCC(=O)NC 34a_100000754576_100012355270 [0,1,0,0,0,0|1,0,2]=4 3237 B15R0.81 C=CCCCCCCCOCCC(=O)NC 7a_100000730831_100000737683 [0,1,0,0,0,0|1,0,2]=4 3238 B15R0.81 C=CCCCCCCCOCCC(=O)OC 34a_100000730831_100000742370 [0,1,0,0,0,0|0,0,2]=3 3239 B15R0.81 C=CCCCCCCCOCCC(=O)OC 7a_100000730831_100000204255 [0,1,0,0,0,0|0,0,2]=3 3240 B15R0.81 C=CCCCCCCCSCCC(=O)NC 62a_100000737683_100012355270 [0,1,0,0,0,0|1,0,2]=4 3241 B15R0.81 C=CCCCCCCCSCCC(=O)NC 62a_100012355270_100000737683 [0,1,0,0,0,0|1,0,2]=4 3242 B15R0.81 C=CCCCCCCCSCCC(=O)OC 62a_100000204255_100012355270 [0,1,0,0,0,0|0,0,2]=3 3243 B15R0.81 C=CCCCCCCCSCCC(=O)OC 62a_100012355270_100000204255 [0,1,0,0,0,0|0,0,2]=3 3244 B15R0.81 C=CCCCCCCCSCOC(=O)OC 62a_100012355270_100000139417 [0,1,0,0,0,0|1,0,2]=4 3245 B15R0.81 C=CCCCCCCNCCCC(=O)NC 2230a_100000740002_100011215473 [0,1,0,0,0,0|1,0,2]=4 3246 B15R0.81 C=CCCCCCCNCCCC(=O)NC 34a_100000740002_100011215473 [0,1,0,0,0,0|1,0,2]=4 3247 B15R0.81 C=CCCCCCCOCCCC(=O)NC 34a_200011216477_100000741757 [0,1,0,0,0,0|1,0,2]=4 3248 B15R0.81 C=CCCCCCCOCCCC(=O)NC 7a_200011216477_100000741757 [0,1,0,0,0,0|1,0,2]=4 3249 B15R0.81 C=CCCCCCCOCCCC(=O)OC 34a_200011216477_100000742333 [0,1,0,0,0,0|0,0,2]=3 3250 B15R0.81 C=CCCCCCCOCCCC(=O)OC 7a_200011216477_100011218270 [0,1,0,0,0,0|0,0,2]=3 3251 B15R0.81 C=CCCCCCCOCCNC(=O)OC 34a_100000757965_100011215473 [0,1,0,0,0,0|1,0,2]=4 3252 B15R0.81 C=CCCCCCCOCCOC(=O)OC 34a_100010262106_100011215473 [0,1,0,0,0,0|1,0,2]=4 3253 B15R0.81 C=CCCCCCCSCCCC(=O)NC 62a_100000741757_100011215473 [0,1,0,0,0,0|1,0,2]=4 3254 B15R0.81 C=CCCCCCCSCCCC(=O)NC 62a_100011215473_100000741757 [0,1,0,0,0,0|1,0,2]=4 3255 B15R0.81 C=CCCCCCCSCCCC(=O)OC 62a_100011215473_100011218270 [0,1,0,0,0,0|0,0,2]=3 3256 B15R0.81 C=CCCCCCCSCCCC(=O)OC 62a_100011218270_100011215473 [0,1,0,0,0,0|0,0,2]=3 3257 B15R0.81 C=CCCCCCOCCCCC(=O)OC 34a_100000059025_100000700193 [0,1,0,0,0,0|0,0,2]=3 3258 B15R0.81 C=CCCCCCOCCCCC(=O)OC 34a_100011216702_100000204269 [0,1,0,0,0,0|0,0,2]=3 3259 B15R0.81 C=CCCCCCOCCCCC(=O)OC 7a_100000059025_100000700193 [0,1,0,0,0,0|0,0,2]=3 3260 B15R0.81 C=CCCCCCOCCCCC(=O)OC 7a_100011216702_100000204269 [0,1,0,0,0,0|0,0,2]=3 3261 B15R0.81 C=CCCCCCOCCOCC(=O)OC 34a_100011216702_100000090808 [0,1,0,0,0,0|1,0,2]=4 3262 B15R0.81 C=CCCCCCOCCOCC(=O)OC 7a_100011216702_100000090808 [0,1,0,0,0,0|1,0,2]=4 3263 B15R0.81 C=CCCCCCSCCCCC(=O)OC 62a_100000204269_100000700193 [0,1,0,0,0,0|0,0,2]=3 3264 B15R0.81 C=CCCCCCSCCCCC(=O)OC 62a_100000700193_100000204269 [0,1,0,0,0,0|0,0,2]=3 3265 B15R0.81 C=CCCCCCSCCOCC(=O)OC 62a_100000090808_100000700193 [0,1,0,0,0,0|1,0,2]=4 3266 B15R0.81 C=CCCCCCSCCOCC(=O)OC 62a_100000700193_100000090808 [0,1,0,0,0,0|1,0,2]=4 3267 B15R0.81 C=CCCCCNCCCCCC(=O)OC 2230a_100000703577_100009816466 [0,1,0,0,0,0|0,0,2]=3 3268 B15R0.81 C=CCCCCNCCCCCC(=O)OC 34a_100000703577_100009816466 [0,1,0,0,0,0|0,0,2]=3 3269 B15R0.81 C=CCCCCOCCCCCC(=O)OC 34a_100000074720_100011215482 [0,1,0,0,0,0|0,0,2]=3 3270 B15R0.81 C=CCCCCOCCCCCC(=O)OC 34a_100000766645_100009816466 [0,1,0,0,0,0|0,0,2]=3 3271 B15R0.81 C=CCCCCOCCCCCC(=O)OC 7a_100000074720_100011215482 [0,1,0,0,0,0|0,0,2]=3 3272 B15R0.81 C=CCCCCOCCCCCC(=O)OC 7a_100000766645_100009816466 [0,1,0,0,0,0|0,0,2]=3 3273 B15R0.81 C=CCCCCSCCCCCC(=O)OC 62a_100009816466_100011215482 [0,1,0,0,0,0|0,0,2]=3 3274 B15R0.81 C=CCCCCSCCCCCC(=O)OC 62a_100011215482_100009816466 [0,1,0,0,0,0|0,0,2]=3 3275 B15R0.81 C=CCCCNCCCCCCC(=O)OC 2230a_100000700776_100009815986 [0,1,0,0,0,0|0,0,2]=3 3276 B15R0.81 C=CCCCNCCCCCCC(=O)OC 34a_100000700776_100009815986 [0,1,0,0,0,0|0,0,2]=3 3277 B15R0.81 C=CCCCOCCCCCCC(=O)OC 34a_100000758997_100009815986 [0,1,0,0,0,0|0,0,2]=3 3278 B15R0.81 C=CCCCOCCCCCCC(=O)OC 34a_100009863599_100000757094 [0,1,0,0,0,0|0,0,2]=3 3279 B15R0.81 C=CCCCOCCCCCCC(=O)OC 7a_100000758997_100009815986 [0,1,0,0,0,0|0,0,2]=3 3280 B15R0.81 C=CCCCOCCCCCCC(=O)OC 7a_100009863599_100000757094 [0,1,0,0,0,0|0,0,2]=3 3281 B15R0.81 C=CCCCSCCCCCCC(=O)OC 62a_100009815986_100000757094 [0,1,0,0,0,0|0,0,2]=3 3282 B15R0.81 C=CCCCSCCCCCCC(=O)OC 62a_100011713584_100009815986 [0,1,0,0,0,0|0,0,2]=3 3283 B15R0.81 C=CCCNCCCCCCCC(=O)OC 2230a_100015191253_100010004213 [0,1,0,0,0,0|0,0,2]=3 3284 B15R0.81 C=CCCOCCCCCCCC(=O)OC 34a_100011022521_100000754431 [0,1,0,0,0,0|0,0,2]=3 3285 B15R0.81 C=CCCOCCCCCCCC(=O)OC 34a_100011205117_100010004213 [0,1,0,0,0,0|0,0,2]=3 3286 B15R0.81 C=CCCOCCCCCCCC(=O)OC 7a_100011022521_100000754431 [0,1,0,0,0,0|0,0,2]=3 3287 B15R0.81 C=CCCSCCCCCCCC(=O)OC 62a_100000754431_100010004213 [0,1,0,0,0,0|0,0,2]=3 3288 B15R0.81 C=CCCSCCCCCCCC(=O)OC 62a_100010004213_100000754431 [0,1,0,0,0,0|0,0,2]=3 3289 B15R0.81 C=CCNCCCCCCCCC(=O)OC 2230a_100020586998_100010282707 [0,1,0,0,0,0|0,0,2]=3 3290 B15R0.81 C=CCOCCCCCCCCC(=O)OC 34a_100000035544_100015514636 [0,1,0,0,0,0|0,0,2]=3 3291 B15R0.81 C=CCOCCCCCCCCC(=O)OC 34a_200000210373_100010282707 [0,1,0,0,0,0|0,0,2]=3 3292 B15R0.81 C=CCOCCCCCCCCC(=O)OC 7a_100000035544_100015514636 [0,1,0,0,0,0|0,0,2]=3 3293 B15R0.81 C=CCOCCOCCCCCC(=O)OC 34a_100000037705_100009816466 [0,1,0,0,0,0|1,0,2]=4 3294 B15R0.81 C=CCOCCOCCCCCC(=O)OC 7a_100000037705_100009816466 [0,1,0,0,0,0|1,0,2]=4 3295 B15R0.81 C=CCSCCCCCCCCC(=O)OC 62a_100000210623_100010282707 [0,1,0,0,0,0|0,0,2]=3 3296 B15R0.81 C=CCSCCCCCCCCC(=O)OC 62a_100010282707_100000210623 [0,1,0,0,0,0|0,0,2]=3 3297 B15R0.81 C=COCCCCOCCCCC(=O)OC 34a_100000031558_100000204269 [0,1,0,0,0,0|1,0,2]=4 3298 B15R0.81 C=COCCCCOCCCCC(=O)OC 7a_100000031558_100000204269 [0,1,0,0,0,0|1,0,2]=4 3299 B15R0.81 C=COCCCNCCCCCC(=O)OC 2230a_100000210767_100009816466 [0,1,0,0,0,0|1,0,2]=4 3300 B15R0.81 C=COCCCNCCCCCC(=O)OC 34a_100000210767_100009816466 [0,1,0,0,0,0|1,0,2]=4 3301 B15R0.81 C=COCCOCCCCCCC(=O)OC 34a_100000033082_100009815986 [0,1,0,0,0,0|1,0,2]=4 3302 B15R0.81 C=COCCOCCCCCCC(=O)OC 34a_100009863599_100000039644 [0,1,0,0,0,0|1,0,2]=4 3303 B15R0.81 C=COCCOCCCCCCC(=O)OC 7a_100009863599_100000039644 [0,1,0,0,0,0|1,0,2]=4 3304 B15R0.81 C=COCCSCCCCCCC(=O)OC 62a_100000039644_100009815986 [0,1,0,0,0,0|1,0,2]=4 3305 B15R0.81 C=COCCSCCCCCCC(=O)OC 62a_100009815986_100000039644 [0,1,0,0,0,0|1,0,2]=4 3306 B15R0.81 CC#CCCOCCCCCCC(=O)OC 34a_100000750427_100009815986 [0,1,0,0,0,0|0,0,2]=3 3307 B15R0.81 CC#CCNCCCCCCCC(=O)OC 2230a_100000685387_100010004213 [0,1,0,0,0,0|0,0,2]=3 3308 B15R0.81 CC#CCNCCCCCCCC(=O)OC 34a_100000685387_100010004213 [0,1,0,0,0,0|0,0,2]=3 3309 B15R0.81 CC#CCOCCCCCCCC(=O)OC 34a_100000761923_100010004213 [0,1,0,0,0,0|0,0,2]=3 3310 B15R0.81 CC#CCOCCCCCCCC(=O)OC 34a_100011022521_100000748600 [0,1,0,0,0,0|0,0,2]=3 3311 B15R0.81 CC#CCOCCCCCCCC(=O)OC 7a_100011022521_100000748600 [0,1,0,0,0,0|0,0,2]=3 3312 B15R0.81 CC#CCSCCCCCCCC(=O)OC 62a_100000748600_100010004213 [0,1,0,0,0,0|0,0,2]=3 3313 B15R0.81 CC#CCSCCCCCCCC(=O)OC 62a_100010004213_100000748600 [0,1,0,0,0,0|0,0,2]=3 3314 B15R0.81 CC/C=C/CCCOCCCCC(=O)OC 34a_100016287902_100000204269 [0,1,0,0,0,0|0,0,2]=3 3315 B15R0.81 CC/C=C/CCCOCCCCC(=O)OC 7a_100016287902_100000204269 [0,1,0,0,0,0|0,0,2]=3 3316 B15R0.81 CC/C=C/CCCOCCOCC(=O)OC 34a_100016287902_100000090808 [0,1,0,0,0,0|1,0,2]=4 3317 B15R0.81 CC/C=C/CCCOCCOCC(=O)OC 7a_100016287902_100000090808 [0,1,0,0,0,0|1,0,2]=4 3318 B15R0.81 CC/C=C\CCCCCNCCC(=O)NC 269862a_100000738227_100016288537 [0,1,0,0,0,0|1,0,2]=4 3319 B15R0.81 CC/C=C\CCCCCOCCC(=O)NC 34a_100016268722_100012179268 [0,1,0,0,0,0|1,0,2]=4 3320 B15R0.81 CC/C=C\CCCCCOCCC(=O)NC 7a_100016268722_100000737683 [0,1,0,0,0,0|1,0,2]=4 3321 B15R0.81 CC/C=C\CCCCCOCCC(=O)OC 34a_100016268722_100000742370 [0,1,0,0,0,0|0,0,2]=3 3322 B15R0.81 CC/C=C\CCCCCOCCC(=O)OC 7a_100016268722_100000204255 [0,1,0,0,0,0|0,0,2]=3 3323 B15R0.81 CC/C=C\CCCCOCCCC(=O)NC 34a_100016287862_100000741757 [0,1,0,0,0,0|1,0,2]=4 3324 B15R0.81 CC/C=C\CCCCOCCCC(=O)NC 7a_100016287862_100000741757 [0,1,0,0,0,0|1,0,2]=4 3325 B15R0.81 CC/C=C\CCCCOCCCC(=O)OC 34a_100016287862_100000742333 [0,1,0,0,0,0|0,0,2]=3 3326 B15R0.81 CC/C=C\CCCCOCCCC(=O)OC 7a_100016287862_100011218270 [0,1,0,0,0,0|0,0,2]=3 3327 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 34a_100000074720_100015370543 [0,1,0,0,0,0|0,0,2]=3 3328 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 34a_100016288707_100009816466 [0,1,0,0,0,0|0,0,2]=3 3329 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 7a_100000074720_100015370543 [0,1,0,0,0,0|0,0,2]=3 3330 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 7a_100016288707_100009816466 [0,1,0,0,0,0|0,0,2]=3 3331 B15R0.81 CC/C=C\CCSCCCCCC(=O)OC 62a_100009816466_100015370543 [0,1,0,0,0,0|0,0,2]=3 3332 B15R0.81 CC/C=C\CCSCCCCCC(=O)OC 62a_100015370543_100009816466 [0,1,0,0,0,0|0,0,2]=3 3333 B15R0.81 CC/C=C\COCCCCCCC(=O)OC 34a_100009863599_100103147603 [0,1,0,0,0,0|0,0,2]=3 3334 B15R0.81 CC/C=C\COCCCCCCC(=O)OC 34a_100016268518_100009815986 [0,1,0,0,0,0|0,0,2]=3 3335 B15R0.81 CC/C=C\COCCCCCCC(=O)OC 7a_100009863599_100103147603 [0,1,0,0,0,0|0,0,2]=3 3336 B15R0.81 CC/C=C\CSCCCCCCC(=O)OC 62a_100009815986_100103147603 [0,1,0,0,0,0|0,0,2]=3 3337 B15R0.81 CC/C=C\CSCCCCCCC(=O)OC 62a_100103147603_100009815986 [0,1,0,0,0,0|0,0,2]=3 3338 B15R0.81 CC=C=CCCOCCCCCC(=O)OC 34a_100011020354_100009816466 [0,1,0,0,0,0|0,0,3]=4 3339 B15R0.81 CC=CCCCOCCCCCC(=O)OC 34a_100020645299_100009816466 [0,1,0,0,0,0|0,0,2]=3 3340 B15R0.81 CC=CCOCCCCCCCC(=O)OC 34a_100011022521_100000070051 [0,1,0,0,0,0|0,0,2]=3 3341 B15R0.81 CC=CCOCCCCCCCC(=O)OC 7a_100011022521_100000070051 [0,1,0,0,0,0|0,0,2]=3 3342 B15R0.81 CC=CCSCCCCCCCC(=O)OC 62a_100000070051_100010004213 [0,1,0,0,0,0|0,0,2]=3 3343 B15R0.81 CC=CCSCCCCCCCC(=O)OC 62a_100010004213_100000070051 [0,1,0,0,0,0|0,0,2]=3 3344 B15R0.81 CCC#CCCCCCCNCC(=O)NC 2230a_100000693194_200000036426 [0,1,0,0,0,0|1,0,2]=4 3345 B15R0.81 CCC#CCCCCCCOCC(=O)CC 34a_100000725409_200000036426 [0,1,0,0,0,0|1,0,2]=4 3346 B15R0.81 CCC#CCCCCCCOCC(=O)NC 34a_100000750040_200000036426 [0,1,0,0,0,0|1,0,2]=4 3347 B15R0.81 CCC#CCCCCCCSCC(=O)CC 62a_100000747405_200000036426 [0,1,0,0,0,0|1,0,2]=4 3348 B15R0.81 CCC#CCCCCCCSCC(=O)CC 62a_200000036426_100000747405 [0,1,0,0,0,0|1,0,2]=4 3349 B15R0.81 CCC#CCCCCCCSCC(=O)NC 62a_100000183359_200000036426 [0,1,0,0,0,0|1,0,2]=4 3350 B15R0.81 CCC#CCCCCCCSCC(=O)NC 62a_200000036426_100000183359 [0,1,0,0,0,0|1,0,2]=4 3351 B15R0.81 CCC#CCCCCCCSCC(=O)OC 62a_100000747449_200000036426 [0,1,0,0,0,0|0,0,2]=3 3352 B15R0.81 CCC#CCCCCCCSCC(=O)OC 62a_200000036426_100000747449 [0,1,0,0,0,0|0,0,2]=3 3353 B15R0.81 CCC#CCCOCCCCCC(=O)OC 34a_100000036655_100009816466 [0,1,0,0,0,0|0,0,2]=3 3354 B15R0.81 CCC#CCCOCCCCCC(=O)OC 7a_100000036655_100009816466 [0,1,0,0,0,0|0,0,2]=3 3355 B15R0.81 CCC#CCOCCCCCCC(=O)OC 34a_100000032950_100009815986 [0,1,0,0,0,0|0,0,2]=3 3356 B15R0.81 CCC#CCOCCCCCCC(=O)OC 34a_100009863599_100009813939 [0,1,0,0,0,0|0,0,2]=3 3357 B15R0.81 CCC#CCOCCCCCCC(=O)OC 7a_100009863599_100009813939 [0,1,0,0,0,0|0,0,2]=3 3358 B15R0.81 CCC#CCSCCCCCCC(=O)OC 62a_100009813939_100009815986 [0,1,0,0,0,0|0,0,2]=3 3359 B15R0.81 CCC#CCSCCCCCCC(=O)OC 62a_100009815986_100009813939 [0,1,0,0,0,0|0,0,2]=3 3360 B15R0.81 CCC(=O)CCCCCCCCCCCO 1458a_100000210414_100009812471 [0,1,0,0,0,0|1,0,0]=2 3361 B15R0.81 CCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747405 [0,1,0,0,0,0|2,0,0]=3 3362 B15R0.81 CCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747405 [0,1,0,0,0,0|2,0,0]=3 3363 B15R0.81 CCC(=O)COCCCCCCCCCO 34a_100000725409_100009813782 [0,1,0,0,0,0|2,0,0]=3 3364 B15R0.81 CCC(=O)CSCCCCCCCCCO 62a_100000747405_100009813782 [0,1,0,0,0,0|2,0,0]=3 3365 B15R0.81 CCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747405 [0,1,0,0,0,0|2,0,0]=3 3366 B15R0.81 CCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210414 [0,1,0,0,0,0|2,0,0]=3 3367 B15R0.81 CCC(=O)NCCNCCCCCCCO 34a_100132302217_100000760002 [0,1,0,0,0,0|3,0,0]=4 3368 B15R0.81 CCC(=O)NCCNCCCCCCOC 34a_100132302217_100011998445 [0,1,0,0,0,0|3,0,0]=4 3369 B15R0.81 CCC(=O)NCCOCCCCCCCO 34a_200000158885_100000760002 [0,1,0,0,0,0|3,0,0]=4 3370 B15R0.81 CCC(=O)NCCOCCCCCCCO 7a_200000158885_100000760002 [0,1,0,0,0,0|3,0,0]=4 3371 B15R0.81 CCC(=O)NCCOCCCCCCOC 34a_200000158885_100011998445 [0,1,0,0,0,0|3,0,0]=4 3372 B15R0.81 CCC(=O)NCCOCCCCCCOC 7a_200000158885_100011998445 [0,1,0,0,0,0|3,0,0]=4 3373 B15R0.81 CCC(=O)OCCOCCCCCCCO 7a_200000031056_100000760002 [0,1,0,0,0,0|3,0,0]=4 3374 B15R0.81 CCC(=O)OCCOCCCCCCOC 7a_200000031056_100011998445 [0,1,0,0,0,0|3,0,0]=4 3375 B15R0.81 CCC/C=C/COCCCCCC(=O)OC 34a_100016278788_100009816466 [0,1,0,0,0,0|0,0,2]=3 3376 B15R0.81 CCC/C=C/COCCCCCC(=O)OC 7a_100016278788_100009816466 [0,1,0,0,0,0|0,0,2]=3 3377 B15R0.81 CCCC#CCCOCCCCC(=O)OC 34a_100000042726_100000204269 [0,1,0,0,0,0|0,0,2]=3 3378 B15R0.81 CCCC#CCCOCCCCC(=O)OC 7a_100000042726_100000204269 [0,1,0,0,0,0|0,0,2]=3 3379 B15R0.81 CCCC#CCCOCCOCC(=O)OC 34a_100000042726_100000090808 [0,1,0,0,0,0|1,0,2]=4 3380 B15R0.81 CCCC#CCCOCCOCC(=O)OC 7a_100000042726_100000090808 [0,1,0,0,0,0|1,0,2]=4 3381 B15R0.81 CCCC#CCOCCCCCC(=O)OC 34a_100000034806_100009816466 [0,1,0,0,0,0|0,0,2]=3 3382 B15R0.81 CCCC#CCOCCCCCC(=O)OC 7a_100000034806_100009816466 [0,1,0,0,0,0|0,0,2]=3 3383 B15R0.81 CCCC/C=C/CCCCOCC(=O)CC 7a_200020645093_100000747405 [0,1,0,0,0,0|1,0,2]=4 3384 B15R0.81 CCCC/C=C/CCCCOCC(=O)NC 34a_200020645093_100000183359 [0,1,0,0,0,0|1,0,2]=4 3385 B15R0.81 CCCC/C=C/CCCCOCC(=O)NC 7a_200020645093_100000183359 [0,1,0,0,0,0|1,0,2]=4 3386 B15R0.81 CCCC/C=C/CCCCOCC(=O)OC 34a_200020645093_100000747449 [0,1,0,0,0,0|0,0,2]=3 3387 B15R0.81 CCCC/C=C/CCCCOCC(=O)OC 7a_200020645093_100000747449 [0,1,0,0,0,0|0,0,2]=3 3388 B15R0.81 CCCC/C=C/COCCCCC(=O)OC 34a_200016272032_100000204269 [0,1,0,0,0,0|0,0,2]=3 3389 B15R0.81 CCCC/C=C/COCCCCC(=O)OC 7a_200016272032_100000204269 [0,1,0,0,0,0|0,0,2]=3 3390 B15R0.81 CCCC/C=C/COCCOCC(=O)OC 34a_200016272032_100000090808 [0,1,0,0,0,0|1,0,2]=4 3391 B15R0.81 CCCC/C=C/COCCOCC(=O)OC 7a_200016272032_100000090808 [0,1,0,0,0,0|1,0,2]=4 3392 B15R0.81 CCCC/C=C\CCOCCCC(=O)NC 34a_200016286491_100000741757 [0,1,0,0,0,0|1,0,2]=4 3393 B15R0.81 CCCC/C=C\CCOCCCC(=O)NC 7a_200016286491_100000741757 [0,1,0,0,0,0|1,0,2]=4 3394 B15R0.81 CCCC/C=C\CCOCCCC(=O)OC 34a_200016286491_100000742333 [0,1,0,0,0,0|0,0,2]=3 3395 B15R0.81 CCCC/C=C\CCOCCCC(=O)OC 7a_200016286491_100011218270 [0,1,0,0,0,0|0,0,2]=3 3396 B15R0.81 CCCCC#CCCCCCCC(=O)CC 1458a_100000210414_200000043322 [0,1,0,0,0,0|1,0,1]=3 3397 B15R0.81 CCCCC#CCCCCCCC(=O)CO 1458a_100000210174_200000043322 [0,1,0,0,0,0|2,0,1]=4 3398 B15R0.81 CCCCC#CCCCCOCC(=O)CC 7a_200000066234_100000747405 [0,1,0,0,0,0|1,0,2]=4 3399 B15R0.81 CCCCC#CCCCCOCC(=O)NC 34a_200000066234_100000183359 [0,1,0,0,0,0|1,0,2]=4 3400 B15R0.81 CCCCC#CCCCCOCC(=O)NC 7a_200000066234_100000183359 [0,1,0,0,0,0|1,0,2]=4 3401 B15R0.81 CCCCC#CCCCCOCC(=O)OC 34a_200000066234_100000747449 [0,1,0,0,0,0|0,0,2]=3 3402 B15R0.81 CCCCC#CCCCCOCC(=O)OC 7a_200000066234_100000747449 [0,1,0,0,0,0|0,0,2]=3 3403 B15R0.81 CCCCC#CCCCNCCC(=O)NC 2230a_100000738227_200000047210 [0,1,0,0,0,0|1,0,2]=4 3404 B15R0.81 CCCCC#CCCCNCCC(=O)NC 34a_100000738227_200000047210 [0,1,0,0,0,0|1,0,2]=4 3405 B15R0.81 CCCCC#CCCCOCCC(=O)NC 34a_100000754576_200000047210 [0,1,0,0,0,0|1,0,2]=4 3406 B15R0.81 CCCCC#CCCCSCCC(=O)NC 62a_100000737683_200000047210 [0,1,0,0,0,0|1,0,2]=4 3407 B15R0.81 CCCCC#CCCCSCCC(=O)NC 62a_200000047210_100000737683 [0,1,0,0,0,0|1,0,2]=4 3408 B15R0.81 CCCCC#CCCCSCCC(=O)OC 62a_100000204255_200000047210 [0,1,0,0,0,0|0,0,2]=3 3409 B15R0.81 CCCCC#CCCCSCCC(=O)OC 62a_200000047210_100000204255 [0,1,0,0,0,0|0,0,2]=3 3410 B15R0.81 CCCCC#CCCCSCOC(=O)OC 62a_200000047210_100000139417 [0,1,0,0,0,0|1,0,2]=4 3411 B15R0.81 CCCCC#CCCOCCCC(=O)NC 34a_100000037610_100000741757 [0,1,0,0,0,0|1,0,2]=4 3412 B15R0.81 CCCCC#CCCOCCCC(=O)NC 7a_100000037610_100000741757 [0,1,0,0,0,0|1,0,2]=4 3413 B15R0.81 CCCCC#CCCOCCCC(=O)OC 34a_100000037610_100000742333 [0,1,0,0,0,0|0,0,2]=3 3414 B15R0.81 CCCCC#CCCOCCCC(=O)OC 7a_100000037610_100011218270 [0,1,0,0,0,0|0,0,2]=3 3415 B15R0.81 CCCCC#CCOCCCCC(=O)OC 34a_200000034558_100000204269 [0,1,0,0,0,0|0,0,2]=3 3416 B15R0.81 CCCCC#CCOCCCCC(=O)OC 7a_200000034558_100000204269 [0,1,0,0,0,0|0,0,2]=3 3417 B15R0.81 CCCCC#CCOCCOCC(=O)OC 34a_200000034558_100000090808 [0,1,0,0,0,0|1,0,2]=4 3418 B15R0.81 CCCCC#CCOCCOCC(=O)OC 7a_200000034558_100000090808 [0,1,0,0,0,0|1,0,2]=4 3419 B15R0.81 CCCCC/C=C/COCCCC(=O)NC 34a_100016258190_100000741757 [0,1,0,0,0,0|1,0,2]=4 3420 B15R0.81 CCCCC/C=C/COCCCC(=O)NC 7a_100016258190_100000741757 [0,1,0,0,0,0|1,0,2]=4 3421 B15R0.81 CCCCC/C=C/COCCCC(=O)OC 34a_100016258190_100000742333 [0,1,0,0,0,0|0,0,2]=3 3422 B15R0.81 CCCCC/C=C/COCCCC(=O)OC 7a_100016258190_100011218270 [0,1,0,0,0,0|0,0,2]=3 3423 B15R0.81 CCCCC/C=C\CCCOCC(=O)CC 7a_100020655193_100000747405 [0,1,0,0,0,0|1,0,2]=4 3424 B15R0.81 CCCCC/C=C\CCCOCC(=O)NC 34a_100020655193_100000183359 [0,1,0,0,0,0|1,0,2]=4 3425 B15R0.81 CCCCC/C=C\CCCOCC(=O)NC 7a_100020655193_100000183359 [0,1,0,0,0,0|1,0,2]=4 3426 B15R0.81 CCCCC/C=C\CCCOCC(=O)OC 34a_100020655193_100000747449 [0,1,0,0,0,0|0,0,2]=3 3427 B15R0.81 CCCCC/C=C\CCCOCC(=O)OC 7a_100020655193_100000747449 [0,1,0,0,0,0|0,0,2]=3 3428 B15R0.81 CCCCC/C=C\CCOCCC(=O)NC 34a_100016277358_100012179268 [0,1,0,0,0,0|1,0,2]=4 3429 B15R0.81 CCCCC/C=C\CCOCCC(=O)NC 7a_100016277358_100000737683 [0,1,0,0,0,0|1,0,2]=4 3430 B15R0.81 CCCCC/C=C\CCOCCC(=O)OC 34a_100016277358_100000742370 [0,1,0,0,0,0|0,0,2]=3 3431 B15R0.81 CCCCC/C=C\CCOCCC(=O)OC 7a_100016277358_100000204255 [0,1,0,0,0,0|0,0,2]=3 3432 B15R0.81 CCCCCC#CCCOCCC(=O)NC 34a_200000042877_100012179268 [0,1,0,0,0,0|1,0,2]=4 3433 B15R0.81 CCCCCC#CCCOCCC(=O)NC 7a_200000042877_100000737683 [0,1,0,0,0,0|1,0,2]=4 3434 B15R0.81 CCCCCC#CCCOCCC(=O)OC 34a_200000042877_100000742370 [0,1,0,0,0,0|0,0,2]=3 3435 B15R0.81 CCCCCC#CCCOCCC(=O)OC 7a_200000042877_100000204255 [0,1,0,0,0,0|0,0,2]=3 3436 B15R0.81 CCCCCC#CCNCCCC(=O)NC 2230a_100000740002_100009816472 [0,1,0,0,0,0|1,0,2]=4 3437 B15R0.81 CCCCCC#CCNCCCC(=O)NC 34a_100000740002_100009816472 [0,1,0,0,0,0|1,0,2]=4 3438 B15R0.81 CCCCCC#CCOCCCC(=O)NC 34a_200000033628_100000741757 [0,1,0,0,0,0|1,0,2]=4 3439 B15R0.81 CCCCCC#CCOCCCC(=O)NC 7a_200000033628_100000741757 [0,1,0,0,0,0|1,0,2]=4 3440 B15R0.81 CCCCCC#CCOCCCC(=O)OC 34a_200000033628_100000742333 [0,1,0,0,0,0|0,0,2]=3 3441 B15R0.81 CCCCCC#CCOCCCC(=O)OC 7a_200000033628_100011218270 [0,1,0,0,0,0|0,0,2]=3 3442 B15R0.81 CCCCCC#CCOCCNC(=O)OC 34a_100000757965_100009816472 [0,1,0,0,0,0|1,0,2]=4 3443 B15R0.81 CCCCCC#CCOCCOC(=O)OC 34a_100010262106_100009816472 [0,1,0,0,0,0|1,0,2]=4 3444 B15R0.81 CCCCCC#CCSCCCC(=O)NC 62a_100000741757_100009816472 [0,1,0,0,0,0|1,0,2]=4 3445 B15R0.81 CCCCCC#CCSCCCC(=O)NC 62a_100009816472_100000741757 [0,1,0,0,0,0|1,0,2]=4 3446 B15R0.81 CCCCCC#CCSCCCC(=O)OC 62a_100009816472_100011218270 [0,1,0,0,0,0|0,0,2]=3 3447 B15R0.81 CCCCCC#CCSCCCC(=O)OC 62a_100011218270_100009816472 [0,1,0,0,0,0|0,0,2]=3 3448 B15R0.81 CCCCCC/C=C/COCCC(=O)NC 34a_200016276170_100012179268 [0,1,0,0,0,0|1,0,2]=4 3449 B15R0.81 CCCCCC/C=C/COCCC(=O)NC 7a_200016276170_100000737683 [0,1,0,0,0,0|1,0,2]=4 3450 B15R0.81 CCCCCC/C=C/COCCC(=O)OC 34a_200016276170_100000742370 [0,1,0,0,0,0|0,0,2]=3 3451 B15R0.81 CCCCCC/C=C/COCCC(=O)OC 7a_200016276170_100000204255 [0,1,0,0,0,0|0,0,2]=3 3452 B15R0.81 CCCCCCC#CCCOCC(=O)CC 7a_200000033163_100000747405 [0,1,0,0,0,0|1,0,2]=4 3453 B15R0.81 CCCCCCC#CCCOCC(=O)NC 34a_200000033163_100000183359 [0,1,0,0,0,0|1,0,2]=4 3454 B15R0.81 CCCCCCC#CCCOCC(=O)NC 7a_200000033163_100000183359 [0,1,0,0,0,0|1,0,2]=4 3455 B15R0.81 CCCCCCC#CCCOCC(=O)OC 34a_200000033163_100000747449 [0,1,0,0,0,0|0,0,2]=3 3456 B15R0.81 CCCCCCC#CCCOCC(=O)OC 7a_200000033163_100000747449 [0,1,0,0,0,0|0,0,2]=3 3457 B15R0.81 CCCCCCC#CCOCCC(=O)NC 34a_200000037284_100012179268 [0,1,0,0,0,0|1,0,2]=4 3458 B15R0.81 CCCCCCC#CCOCCC(=O)NC 7a_200000037284_100000737683 [0,1,0,0,0,0|1,0,2]=4 3459 B15R0.81 CCCCCCC#CCOCCC(=O)OC 34a_200000037284_100000742370 [0,1,0,0,0,0|0,0,2]=3 3460 B15R0.81 CCCCCCC#CCOCCC(=O)OC 7a_200000037284_100000204255 [0,1,0,0,0,0|0,0,2]=3 3461 B15R0.81 CCCCCCCC#CCOCC(=O)CC 7a_200000061759_100000747405 [0,1,0,0,0,0|1,0,2]=4 3462 B15R0.81 CCCCCCCC#CCOCC(=O)NC 34a_200000061759_100000183359 [0,1,0,0,0,0|1,0,2]=4 3463 B15R0.81 CCCCCCCC#CCOCC(=O)NC 7a_200000061759_100000183359 [0,1,0,0,0,0|1,0,2]=4 3464 B15R0.81 CCCCCCCC#CCOCC(=O)OC 34a_200000061759_100000747449 [0,1,0,0,0,0|0,0,2]=3 3465 B15R0.81 CCCCCCCC#CCOCC(=O)OC 7a_200000061759_100000747449 [0,1,0,0,0,0|0,0,2]=3 3466 B15R0.81 CCCCCCCCCC=NNC(=O)CC 4a_100000183195_100000210895 [0,1,0,0,0,0|2,0,1]=4 3467 B15R0.81 CCCCCCCCCCC=CC(=O)NC 11a_106832991635_100015291182 [0,1,0,0,0,0|1,0,1]=3 3468 B15R0.81 CCCCCCCCCCC=CC(=O)NC 1626a_100102657272_100015291182 [0,1,0,0,0,0|1,0,1]=3 3469 B15R0.81 CCCCCCCCCCC=CC(=O)NC 240690a_100102657272_100015291182 [0,1,0,0,0,0|1,0,1]=3 3470 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000759014 [0,1,0,0,0,0|1,0,0]=2 3471 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100011215791_100000210202 [0,1,0,0,0,0|1,0,0]=2 3472 B15R0.81 CCCCCCCCCCCCC(=O)CF 1458a_100011215791_100015361967 [0,1,0,0,0,0|2,0,0]=3 3473 B15R0.81 CCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000759014 [0,1,0,0,0,0|2,0,0]=3 3474 B15R0.81 CCCCCCCCCCCCC(=O)NC 11a_106832991635_100011215791 [0,1,0,0,0,0|1,0,0]=2 3475 B15R0.81 CCCCCCCCCCCCC(=O)NC 1626a_100102657272_100011215791 [0,1,0,0,0,0|1,0,0]=2 3476 B15R0.81 CCCCCCCCCCCCC(=O)NC 240690a_100102657272_100011215791 [0,1,0,0,0,0|1,0,0]=2 3477 B15R0.81 CCCCCCCCCCCCC(C)NC 2230a_106832991635_200011217028 [0,1,0,0,0,0|2,0,1]=4 3478 B15R0.81 CCCCCCCCCCCCC(C)NC 270004a_106832991635_100011219199 [0,1,0,0,0,0|2,0,1]=4 3479 B15R0.81 CCCCCCCCCCCCC(C)NC 34a_100102657272_200011217028 [0,1,0,0,0,0|2,0,1]=4 3480 B15R0.81 CCCCCCCCCCCCC(C)NC 7a_106832991635_200011217028 [0,1,0,0,0,0|2,0,1]=4 3481 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_100138415774_200011217028 [0,1,0,0,0,0|1,0,1]=3 3482 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_200011215752_200000210301 [0,1,0,0,0,0|1,0,1]=3 3483 B15R0.81 CCCCCCCCCCCCC(C)OC 7a_200011215752_200000210301 [0,1,0,0,0,0|1,0,1]=3 3484 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 34a_200011215752_200025704644 [0,1,0,0,0,0|1,0,1]=3 3485 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 7a_200011215752_200025704644 [0,1,0,0,0,0|1,0,1]=3 3486 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000225621_100011215052 [0,1,0,0,0,0|3,0,0]=4 3487 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000227908_100000210202 [0,1,0,0,0,0|3,0,0]=4 3488 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000225621_100000759014 [0,1,0,0,0,0|3,0,0]=4 3489 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000227908_100000204670 [0,1,0,0,0,0|3,0,0]=4 3490 B15R0.81 CCCCCCCCCCCNC(=O)CC 11a_200011215754_100000210414 [0,1,0,0,0,0|1,0,0]=2 3491 B15R0.81 CCCCCCCCCCCNC(=O)CC 1626a_200011215754_100000210414 [0,1,0,0,0,0|1,0,0]=2 3492 B15R0.81 CCCCCCCCCCCNC(=O)CC 240690a_200011215754_100000210414 [0,1,0,0,0,0|1,0,0]=2 3493 B15R0.81 CCCCCCCCCCCNC(=O)CC 527a_200011215754_100000210414 [0,1,0,0,0,0|1,0,0]=2 3494 B15R0.81 CCCCCCCCCCCNC(=O)CO 240690a_200011215754_100000210174 [0,1,0,0,0,0|2,0,0]=3 3495 B15R0.81 CCCCCCCCCCCNC(=O)CO 527a_200011215754_100000210174 [0,1,0,0,0,0|2,0,0]=3 3496 B15R0.81 CCCCCCCCCCCNC(=O)NC 2708a_100102657272_200011215754 [0,1,0,0,0,0|1,0,0]=2 3497 B15R0.81 CCCCCCCCCCCNC(=O)NC 2708a_200011215754_106832991635 [0,1,0,0,0,0|1,0,0]=2 3498 B15R0.81 CCCCCCCCCCCNC(=O)NC 273464a_100102657272_200011215754 [0,1,0,0,0,0|1,0,0]=2 3499 B15R0.81 CCCCCCCCCCCNC(=O)NC 273464a_200011215754_100102657272 [0,1,0,0,0,0|1,0,0]=2 3500 B15R0.81 CCCCCCCCCCCNC(=O)NC 512a_106832991638_200011215754 [0,1,0,0,0,0|1,0,0]=2 3501 B15R0.81 CCCCCCCCCCCNC(=O)NC 512a_200011215754_100102657272 [0,1,0,0,0,0|1,0,0]=2 3502 B15R0.81 CCCCCCCCCCCNC(C)CC 2230a_100000209981_100011215454 [0,1,0,0,0,0|2,0,1]=4 3503 B15R0.81 CCCCCCCCCCCNC(C)CC 2230a_200011215754_100000758301 [0,1,0,0,0,0|2,0,1]=4 3504 B15R0.81 CCCCCCCCCCCNC(C)CC 34a_200011215754_100011215416 [0,1,0,0,0,0|2,0,1]=4 3505 B15R0.81 CCCCCCCCCCCOC(C)CC 34a_100000210809_100011215416 [0,1,0,0,0,0|2,0,1]=4 3506 B15R0.81 CCCCCCCCCCCOC(C)CC 7a_100000210228_100011215454 [0,1,0,0,0,0|2,0,1]=4 3507 B15R0.81 CCCCCCCCCCCOC(C)CC 7a_100000210809_100000758301 [0,1,0,0,0,0|2,0,1]=4 3508 B15R0.81 CCCCCCCCCCCSC(C)OC 62a_100009879195_100011215454 [0,1,0,0,0,0|1,0,1]=3 3509 B15R0.81 CCCCCCCCCCNCC(=O)NC 2230a_100000684558_100000183359 [0,1,0,0,0,0|1,0,0]=2 3510 B15R0.81 CCCCCCCCCCNCC(=O)NC 2230a_100000693194_100000210320 [0,1,0,0,0,0|1,0,0]=2 3511 B15R0.81 CCCCCCCCCCNCC(=O)NC 34a_100000684558_100000183359 [0,1,0,0,0,0|1,0,0]=2 3512 B15R0.81 CCCCCCCCCCNCC(=O)OC 2230a_100000684558_100000747449 [0,1,0,0,0,0|0,0,0]=1 3513 B15R0.81 CCCCCCCCCCNCC(=O)OC 34a_100000684558_100000747449 [0,1,0,0,0,0|0,0,0]=1 3514 B15R0.81 CCCCCCCCCCNCC(C)CC 2230a_100000684558_100000748023 [0,1,0,0,0,0|2,0,1]=4 3515 B15R0.81 CCCCCCCCCCNCC(C)CC 2230a_100020588543_100000210320 [0,1,0,0,0,0|2,0,1]=4 3516 B15R0.81 CCCCCCCCCCNCC(C)CC 270004a_100000684558_100000243153 [0,1,0,0,0,0|2,0,1]=4 3517 B15R0.81 CCCCCCCCCCNCC(C)CC 34a_100000684558_100000748023 [0,1,0,0,0,0|2,0,1]=4 3518 B15R0.81 CCCCCCCCCCNCC(O)CC 2230a_100000684558_100011218378 [0,1,0,0,0,0|1,0,2]=4 3519 B15R0.81 CCCCCCCCCCNCC(O)CC 2230a_100011218483_100000210320 [0,1,0,0,0,0|1,0,2]=4 3520 B15R0.81 CCCCCCCCCCNCC(O)CC 34a_100000684558_100011218378 [0,1,0,0,0,0|1,0,2]=4 3521 B15R0.81 CCCCCCCCCCNC[C@@H](C)CC 2230a_100000684558_100009816398 [0,1,0,0,0,0|2,0,1]=4 3522 B15R0.81 CCCCCCCCCCNC[C@@H](C)CC 34a_100000684558_100009816398 [0,1,0,0,0,0|2,0,1]=4 3523 B15R0.81 CCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210320 [0,1,0,0,0,0|1,0,1]=3 3524 B15R0.81 CCCCCCCCCCOCC(=O)CC 34a_100000725409_100000210320 [0,1,0,0,0,0|1,0,0]=2 3525 B15R0.81 CCCCCCCCCCOCC(=O)CC 7a_100000210711_100000747405 [0,1,0,0,0,0|1,0,0]=2 3526 B15R0.81 CCCCCCCCCCOCC(=O)NC 34a_100000210711_100000183359 [0,1,0,0,0,0|1,0,0]=2 3527 B15R0.81 CCCCCCCCCCOCC(=O)NC 34a_100000750040_100000210320 [0,1,0,0,0,0|1,0,0]=2 3528 B15R0.81 CCCCCCCCCCOCC(=O)NC 7a_100000210711_100000183359 [0,1,0,0,0,0|1,0,0]=2 3529 B15R0.81 CCCCCCCCCCOCC(=O)OC 34a_100000210711_100000747449 [0,1,0,0,0,0|0,0,0]=1 3530 B15R0.81 CCCCCCCCCCOCC(=O)OC 7a_100000210711_100000747449 [0,1,0,0,0,0|0,0,0]=1 3531 B15R0.81 CCCCCCCCCCOCC(C)CC 34a_100000210711_100000748023 [0,1,0,0,0,0|2,0,1]=4 3532 B15R0.81 CCCCCCCCCCOCC(C)CC 7a_100000210711_100000748023 [0,1,0,0,0,0|2,0,1]=4 3533 B15R0.81 CCCCCCCCCCOCC(C)OC 34a_100000690652_100000210320 [0,1,0,0,0,0|1,0,1]=3 3534 B15R0.81 CCCCCCCCCCOCC(O)CC 34a_100000210711_100011218378 [0,1,0,0,0,0|1,0,2]=4 3535 B15R0.81 CCCCCCCCCCOCC(O)CC 7a_100000210711_100011218378 [0,1,0,0,0,0|1,0,2]=4 3536 B15R0.81 CCCCCCCCCCOC[C@@H](C)CC 34a_100000210711_100009816398 [0,1,0,0,0,0|2,0,1]=4 3537 B15R0.81 CCCCCCCCCCOC[C@@H](C)CC 7a_100000210711_100009816398 [0,1,0,0,0,0|2,0,1]=4 3538 B15R0.81 CCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210320 [0,1,0,0,0,0|2,0,1]=4 3539 B15R0.81 CCCCCCCCCCSCC(=O)CC 62a_100000747405_100000210320 [0,1,0,0,0,0|1,0,0]=2 3540 B15R0.81 CCCCCCCCCCSCC(=O)NC 62a_100000183359_100000210320 [0,1,0,0,0,0|1,0,0]=2 3541 B15R0.81 CCCCCCCCCCSCC(=O)OC 62a_100000747449_100000210320 [0,1,0,0,0,0|0,0,0]=1 3542 B15R0.81 CCCCCCCCCCSCC(C)CC 62a_100000748023_100000210320 [0,1,0,0,0,0|2,0,1]=4 3543 B15R0.81 CCCCCCCCCCSCC(O)CC 62a_100011218378_100000210320 [0,1,0,0,0,0|1,0,2]=4 3544 B15R0.81 CCCCCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210320 [0,1,0,0,0,0|2,0,1]=4 3545 B15R0.81 CCCCCCCCCNCCC(=O)NC 2230a_100000212291_100000737683 [0,1,0,0,0,0|1,0,0]=2 3546 B15R0.81 CCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011214924 [0,1,0,0,0,0|1,0,0]=2 3547 B15R0.81 CCCCCCCCCNCCC(=O)NC 34a_100000212291_100012179268 [0,1,0,0,0,0|1,0,0]=2 3548 B15R0.81 CCCCCCCCCNCCC(=O)NC 34a_100000738227_100011214924 [0,1,0,0,0,0|1,0,0]=2 3549 B15R0.81 CCCCCCCCCNCCC(=O)OC 2230a_100000212291_100000204255 [0,1,0,0,0,0|0,0,0]=1 3550 B15R0.81 CCCCCCCCCNCCC(=O)OC 34a_100000212291_100000742370 [0,1,0,0,0,0|0,0,0]=1 3551 B15R0.81 CCCCCCCCCNCCC(C)CC 2230a_100020591266_100011214924 [0,1,0,0,0,0|2,0,1]=4 3552 B15R0.81 CCCCCCCCCOCCC(=NO)N 34a_100000749954_100011214924 [0,1,0,0,0,0|3,0,0]=4 3553 B15R0.81 CCCCCCCCCOCCC(=O)NC 34a_100000210712_100012179268 [0,1,0,0,0,0|1,0,0]=2 3554 B15R0.81 CCCCCCCCCOCCC(=O)NC 34a_100000754576_100011214924 [0,1,0,0,0,0|1,0,0]=2 3555 B15R0.81 CCCCCCCCCOCCC(=O)NC 7a_100000210712_100000737683 [0,1,0,0,0,0|1,0,0]=2 3556 B15R0.81 CCCCCCCCCOCCC(=O)OC 34a_100000210712_100000742370 [0,1,0,0,0,0|0,0,0]=1 3557 B15R0.81 CCCCCCCCCOCCC(=O)OC 7a_100000210712_100000204255 [0,1,0,0,0,0|0,0,0]=1 3558 B15R0.81 CCCCCCCCCOCCC(C)CC 7a_100011215188_100000210328 [0,1,0,0,0,0|2,0,1]=4 3559 B15R0.81 CCCCCCCCCOCCC(C)OC 7a_100000764861_100000210328 [0,1,0,0,0,0|1,0,1]=3 3560 B15R0.81 CCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210670 [0,1,0,0,0,0|1,0,0]=2 3561 B15R0.81 CCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210670 [0,1,0,0,0,0|0,0,0]=1 3562 B15R0.81 CCCCCCCCNC/C=C/C(=O)OC 2230a_100000229939_100000742655 [0,1,0,0,0,0|0,0,2]=3 3563 B15R0.81 CCCCCCCCNC/C=C/C(=O)OC 34a_100000229939_100000742655 [0,1,0,0,0,0|0,0,2]=3 3564 B15R0.81 CCCCCCCCNCCCC(=O)NC 2230a_100000229939_100000741757 [0,1,0,0,0,0|1,0,0]=2 3565 B15R0.81 CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210759 [0,1,0,0,0,0|1,0,0]=2 3566 B15R0.81 CCCCCCCCNCCCC(=O)NC 34a_100000229939_100000741757 [0,1,0,0,0,0|1,0,0]=2 3567 B15R0.81 CCCCCCCCNCCCC(=O)NC 34a_100000740002_100000210759 [0,1,0,0,0,0|1,0,0]=2 3568 B15R0.81 CCCCCCCCNCCCC(=O)OC 2230a_100000229939_100011218270 [0,1,0,0,0,0|0,0,0]=1 3569 B15R0.81 CCCCCCCCNCCCC(=O)OC 34a_100000229939_100000742333 [0,1,0,0,0,0|0,0,0]=1 3570 B15R0.81 CCCCCCCCNCCCN(C)CC 2230a_100000229939_100015186262 [0,1,0,0,0,0|3,0,0]=4 3571 B15R0.81 CCCCCCCCNCCNC(=O)CC 34a_100132302217_100000210759 [0,1,0,0,0,0|2,0,0]=3 3572 B15R0.81 CCCCCCCCNCCNC(=O)NC 34a_100015205895_100000210759 [0,1,0,0,0,0|2,0,0]=3 3573 B15R0.81 CCCCCCCCNCCOC(=O)NC 34a_100000229939_200011997002 [0,1,0,0,0,0|2,0,0]=3 3574 B15R0.81 CCCCCCCCOC/C=C/C(=O)OC 34a_100000210232_100000742655 [0,1,0,0,0,0|0,0,2]=3 3575 B15R0.81 CCCCCCCCOC/C=C/C(=O)OC 7a_100000210232_100000742655 [0,1,0,0,0,0|0,0,2]=3 3576 B15R0.81 CCCCCCCCOCCCC(=O)NC 34a_100000210232_100000741757 [0,1,0,0,0,0|1,0,0]=2 3577 B15R0.81 CCCCCCCCOCCCC(=O)NC 7a_100000210232_100000741757 [0,1,0,0,0,0|1,0,0]=2 3578 B15R0.81 CCCCCCCCOCCCC(=O)NN 34a_100000211488_100000210759 [0,1,0,0,0,0|2,0,0]=3 3579 B15R0.81 CCCCCCCCOCCCC(=O)OC 34a_100000210232_100000742333 [0,1,0,0,0,0|0,0,0]=1 3580 B15R0.81 CCCCCCCCOCCCC(=O)OC 7a_100000210232_100011218270 [0,1,0,0,0,0|0,0,0]=1 3581 B15R0.81 CCCCCCCCOCCCC(C)CC 7a_100011216074_100000210759 [0,1,0,0,0,0|2,0,1]=4 3582 B15R0.81 CCCCCCCCOCCCN(C)CC 7a_100000210232_100015186262 [0,1,0,0,0,0|3,0,0]=4 3583 B15R0.81 CCCCCCCCOCCNC(=O)CC 34a_200000158885_100000210759 [0,1,0,0,0,0|2,0,0]=3 3584 B15R0.81 CCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210759 [0,1,0,0,0,0|2,0,0]=3 3585 B15R0.81 CCCCCCCCOCCNC(=O)OC 34a_100000757965_100000210759 [0,1,0,0,0,0|1,0,0]=2 3586 B15R0.81 CCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210759 [0,1,0,0,0,0|2,0,0]=3 3587 B15R0.81 CCCCCCCCOCCOC(=O)NC 34a_100000210232_200011997002 [0,1,0,0,0,0|2,0,0]=3 3588 B15R0.81 CCCCCCCCOCCOC(=O)NC 7a_100000210232_200011997002 [0,1,0,0,0,0|2,0,0]=3 3589 B15R0.81 CCCCCCCCOCCOC(=O)OC 34a_100010262106_100000210759 [0,1,0,0,0,0|1,0,0]=2 3590 B15R0.81 CCCCCCCCSC/C=C/C(=O)OC 62a_100000210759_100000742655 [0,1,0,0,0,0|0,0,2]=3 3591 B15R0.81 CCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210317 [0,1,0,0,0,0|0,0,2]=3 3592 B15R0.81 CCCCCCCCSCCCC(=O)NC 62a_100000210759_100000741757 [0,1,0,0,0,0|1,0,0]=2 3593 B15R0.81 CCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210317 [0,1,0,0,0,0|1,0,0]=2 3594 B15R0.81 CCCCCCCCSCCCC(=O)OC 62a_100000210759_100011218270 [0,1,0,0,0,0|0,0,0]=1 3595 B15R0.81 CCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210317 [0,1,0,0,0,0|0,0,0]=1 3596 B15R0.81 CCCCCCCCSCCCN(C)CC 62a_100000210759_100015186262 [0,1,0,0,0,0|3,0,0]=4 3597 B15R0.81 CCCCCCCCSCCOC(=O)NC 62a_100000210759_200011997002 [0,1,0,0,0,0|2,0,0]=3 3598 B15R0.81 CCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210317 [0,1,0,0,0,0|2,0,0]=3 3599 B15R0.81 CCCCCCCNCCCCC(=O)OC 2230a_100000229938_100000204269 [0,1,0,0,0,0|0,0,0]=1 3600 B15R0.81 CCCCCCCNCCOCC(=O)OC 2230a_100000229938_100000090808 [0,1,0,0,0,0|1,0,0]=2 3601 B15R0.81 CCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210614 [0,1,0,0,0,0|0,0,0]=1 3602 B15R0.81 CCCCCCCOCCCCC(=O)OC 34a_100000210272_100000204269 [0,1,0,0,0,0|0,0,0]=1 3603 B15R0.81 CCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210614 [0,1,0,0,0,0|0,0,0]=1 3604 B15R0.81 CCCCCCCOCCCCC(=O)OC 7a_100000210272_100000204269 [0,1,0,0,0,0|0,0,0]=1 3605 B15R0.81 CCCCCCCOCCOCC(=O)OC 34a_100000210272_100000090808 [0,1,0,0,0,0|1,0,0]=2 3606 B15R0.81 CCCCCCCOCCOCC(=O)OC 7a_100000210272_100000090808 [0,1,0,0,0,0|1,0,0]=2 3607 B15R0.81 CCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210316 [0,1,0,0,0,0|0,0,0]=1 3608 B15R0.81 CCCCCCCSCCCCC(=O)OC 62a_100000210614_100000204269 [0,1,0,0,0,0|0,0,0]=1 3609 B15R0.81 CCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210316 [0,1,0,0,0,0|1,0,0]=2 3610 B15R0.81 CCCCCCCSCCOCC(=O)OC 62a_100000210614_100000090808 [0,1,0,0,0,0|1,0,0]=2 3611 B15R0.81 CCCCCCNCCCCCC(=O)OC 2230a_100000210581_100009816466 [0,1,0,0,0,0|0,0,0]=1 3612 B15R0.81 CCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210314 [0,1,0,0,0,0|0,0,0]=1 3613 B15R0.81 CCCCCCOCCCCCC(=O)OC 34a_100000210259_100009816466 [0,1,0,0,0,0|0,0,0]=1 3614 B15R0.81 CCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210314 [0,1,0,0,0,0|0,0,0]=1 3615 B15R0.81 CCCCCCOCCCCCC(=O)OC 7a_100000210259_100009816466 [0,1,0,0,0,0|0,0,0]=1 3616 B15R0.81 CCCCCCOCCCCCC(C)CC 7a_200000035636_100000210314 [0,1,0,0,0,0|2,0,1]=4 3617 B15R0.81 CCCCCCOCCOCCC(=O)NC 34a_100000691444_100012179268 [0,1,0,0,0,0|2,0,0]=3 3618 B15R0.81 CCCCCCOCCOCCC(=O)NC 7a_100000691444_100000737683 [0,1,0,0,0,0|2,0,0]=3 3619 B15R0.81 CCCCCCOCCOCCC(=O)OC 34a_100000691444_100000742370 [0,1,0,0,0,0|1,0,0]=2 3620 B15R0.81 CCCCCCOCCOCCC(=O)OC 7a_100000691444_100000204255 [0,1,0,0,0,0|1,0,0]=2 3621 B15R0.81 CCCCCCSCCCCCC(=O)OC 62a_100000210314_100009816466 [0,1,0,0,0,0|0,0,0]=1 3622 B15R0.81 CCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210757 [0,1,0,0,0,0|0,0,0]=1 3623 B15R0.81 CCCCCNCCCCCCC(=O)OC 2230a_100000209983_100009815986 [0,1,0,0,0,0|0,0,0]=1 3624 B15R0.81 CCCCCNCCOC/C=C/C(=O)OC 34a_100000224656_100000742655 [0,1,0,0,0,0|1,0,2]=4 3625 B15R0.81 CCCCCNCCOCCCC(=O)NC 34a_100000224656_100000741757 [0,1,0,0,0,0|2,0,0]=3 3626 B15R0.81 CCCCCNCCOCCCC(=O)OC 34a_100000224656_100000742333 [0,1,0,0,0,0|1,0,0]=2 3627 B15R0.81 CCCCCNCCOCCOC(=O)NC 34a_100000224656_200011997002 [0,1,0,0,0,0|3,0,0]=4 3628 B15R0.81 CCCCCNN=CCCCCC(=O)OC 4a_100000694160_100000052768 [0,1,0,0,0,0|1,0,1]=3 3629 B15R0.81 CCCCCOCCCCCCC(=O)OC 34a_100000210253_100009815986 [0,1,0,0,0,0|0,0,0]=1 3630 B15R0.81 CCCCCOCCCCCCC(=O)OC 34a_100009863599_100000718602 [0,1,0,0,0,0|0,0,0]=1 3631 B15R0.81 CCCCCOCCCCCCC(=O)OC 7a_100000210253_100009815986 [0,1,0,0,0,0|0,0,0]=1 3632 B15R0.81 CCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210326 [0,1,0,0,0,0|0,0,0]=1 3633 B15R0.81 CCCCCOCCOC/C=C/C(=O)OC 34a_100011215259_100000742655 [0,1,0,0,0,0|1,0,2]=4 3634 B15R0.81 CCCCCOCCOC/C=C/C(=O)OC 7a_100011215259_100000742655 [0,1,0,0,0,0|1,0,2]=4 3635 B15R0.81 CCCCCOCCOCCCC(=O)NC 34a_100011215259_100000741757 [0,1,0,0,0,0|2,0,0]=3 3636 B15R0.81 CCCCCOCCOCCCC(=O)NC 7a_100011215259_100000741757 [0,1,0,0,0,0|2,0,0]=3 3637 B15R0.81 CCCCCOCCOCCCC(=O)OC 34a_100011215259_100000742333 [0,1,0,0,0,0|1,0,0]=2 3638 B15R0.81 CCCCCOCCOCCCC(=O)OC 7a_100011215259_100011218270 [0,1,0,0,0,0|1,0,0]=2 3639 B15R0.81 CCCCCOCCOCCOC(=O)NC 34a_100011215259_200011997002 [0,1,0,0,0,0|3,0,0]=4 3640 B15R0.81 CCCCCOCCOCCOC(=O)NC 7a_100011215259_200011997002 [0,1,0,0,0,0|3,0,0]=4 3641 B15R0.81 CCCCCSCCCCCCC(=O)OC 62a_100000210326_100009815986 [0,1,0,0,0,0|0,0,0]=1 3642 B15R0.81 CCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210326 [0,1,0,0,0,0|0,0,0]=1 3643 B15R0.81 CCCCNCCCCCCCC(=O)OC 2230a_100000102301_100010004213 [0,1,0,0,0,0|0,0,0]=1 3644 B15R0.81 CCCCNCCCCCCCC(=O)OC 7a_106832991798_100010004213 [0,1,0,0,0,0|0,0,0]=1 3645 B15R0.81 CCCCNCCCCOCCC(=O)NC 34a_200011216965_100012179268 [0,1,0,0,0,0|2,0,0]=3 3646 B15R0.81 CCCCNCCCCOCCC(=O)OC 34a_200011216965_100000742370 [0,1,0,0,0,0|1,0,0]=2 3647 B15R0.81 CCCCOCCCCCCCC(=O)OC 34a_100000210227_100010004213 [0,1,0,0,0,0|0,0,0]=1 3648 B15R0.81 CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000210210 [0,1,0,0,0,0|0,0,0]=1 3649 B15R0.81 CCCCOCCCCCCCC(=O)OC 7a_100000210227_100010004213 [0,1,0,0,0,0|0,0,0]=1 3650 B15R0.81 CCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210211 [0,1,0,0,0,0|0,0,0]=1 3651 B15R0.81 CCCCOCCCCOCCC(=O)NC 34a_200000760531_100012179268 [0,1,0,0,0,0|2,0,0]=3 3652 B15R0.81 CCCCOCCCCOCCC(=O)NC 7a_200000760531_100000737683 [0,1,0,0,0,0|2,0,0]=3 3653 B15R0.81 CCCCOCCCCOCCC(=O)OC 34a_200000760531_100000742370 [0,1,0,0,0,0|1,0,0]=2 3654 B15R0.81 CCCCOCCCCOCCC(=O)OC 7a_200000760531_100000204255 [0,1,0,0,0,0|1,0,0]=2 3655 B15R0.81 CCCCOCCCNC/C=C/C(=O)OC 2230a_200000211371_100000742655 [0,1,0,0,0,0|1,0,2]=4 3656 B15R0.81 CCCCOCCCNC/C=C/C(=O)OC 34a_200000211371_100000742655 [0,1,0,0,0,0|1,0,2]=4 3657 B15R0.81 CCCCOCCCNCCCC(=O)NC 2230a_200000211371_100000741757 [0,1,0,0,0,0|2,0,0]=3 3658 B15R0.81 CCCCOCCCNCCCC(=O)NC 34a_200000211371_100000741757 [0,1,0,0,0,0|2,0,0]=3 3659 B15R0.81 CCCCOCCCNCCCC(=O)OC 2230a_200000211371_100011218270 [0,1,0,0,0,0|1,0,0]=2 3660 B15R0.81 CCCCOCCCNCCCC(=O)OC 34a_200000211371_100000742333 [0,1,0,0,0,0|1,0,0]=2 3661 B15R0.81 CCCCOCCCNCCOC(=O)NC 34a_200000211371_200011997002 [0,1,0,0,0,0|3,0,0]=4 3662 B15R0.81 CCCCOCCCOC/C=C/C(=O)OC 34a_200011215613_100000742655 [0,1,0,0,0,0|1,0,2]=4 3663 B15R0.81 CCCCOCCCOC/C=C/C(=O)OC 7a_200011215613_100000742655 [0,1,0,0,0,0|1,0,2]=4 3664 B15R0.81 CCCCOCCCOCCCC(=O)NC 34a_200011215613_100000741757 [0,1,0,0,0,0|2,0,0]=3 3665 B15R0.81 CCCCOCCCOCCCC(=O)NC 7a_200011215613_100000741757 [0,1,0,0,0,0|2,0,0]=3 3666 B15R0.81 CCCCOCCCOCCCC(=O)OC 34a_200011215613_100000742333 [0,1,0,0,0,0|1,0,0]=2 3667 B15R0.81 CCCCOCCCOCCCC(=O)OC 7a_200011215613_100011218270 [0,1,0,0,0,0|1,0,0]=2 3668 B15R0.81 CCCCOCCCOCCOC(=O)NC 34a_200011215613_200011997002 [0,1,0,0,0,0|3,0,0]=4 3669 B15R0.81 CCCCOCCCOCCOC(=O)NC 7a_200011215613_200011997002 [0,1,0,0,0,0|3,0,0]=4 3670 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000059025_100000743108 [0,1,0,0,0,0|1,0,0]=2 3671 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000210238_100000204269 [0,1,0,0,0,0|1,0,0]=2 3672 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000059025_100000743108 [0,1,0,0,0,0|1,0,0]=2 3673 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000210238_100000204269 [0,1,0,0,0,0|1,0,0]=2 3674 B15R0.81 CCCCOCCOCCOCC(=O)CC 7a_100011215186_100000747405 [0,1,0,0,0,0|3,0,0]=4 3675 B15R0.81 CCCCOCCOCCOCC(=O)NC 34a_100011215186_100000183359 [0,1,0,0,0,0|3,0,0]=4 3676 B15R0.81 CCCCOCCOCCOCC(=O)NC 7a_100011215186_100000183359 [0,1,0,0,0,0|3,0,0]=4 3677 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100000210238_100000090808 [0,1,0,0,0,0|2,0,0]=3 3678 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100011023656_100000210210 [0,1,0,0,0,0|2,0,0]=3 3679 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100011215186_100000747449 [0,1,0,0,0,0|2,0,0]=3 3680 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100000210238_100000090808 [0,1,0,0,0,0|2,0,0]=3 3681 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210211 [0,1,0,0,0,0|2,0,0]=3 3682 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100011215186_100000747449 [0,1,0,0,0,0|2,0,0]=3 3683 B15R0.81 CCCCOCCSCCCCC(=O)OC 62a_100000204269_100000743108 [0,1,0,0,0,0|1,0,0]=2 3684 B15R0.81 CCCCOCCSCCCCC(=O)OC 62a_100000743108_100000204269 [0,1,0,0,0,0|1,0,0]=2 3685 B15R0.81 CCCCOCCSCCOCC(=O)OC 62a_100000090808_100000743108 [0,1,0,0,0,0|2,0,0]=3 3686 B15R0.81 CCCCOCCSCCOCC(=O)OC 62a_100000743108_100000090808 [0,1,0,0,0,0|2,0,0]=3 3687 B15R0.81 CCCCOCOCCCCCC(=O)OC 34a_100000074720_100011995733 [0,1,0,0,0,0|1,0,0]=2 3688 B15R0.81 CCCCOCSCCCCCC(=O)OC 62a_100009816466_100011995733 [0,1,0,0,0,0|1,0,0]=2 3689 B15R0.81 CCCCOCSCCCCCC(=O)OC 62a_100011995733_100009816466 [0,1,0,0,0,0|1,0,0]=2 3690 B15R0.81 CCCCSCCCCCCCC(=O)OC 62a_100000210211_100010004213 [0,1,0,0,0,0|0,0,0]=1 3691 B15R0.81 CCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210210 [0,1,0,0,0,0|0,0,0]=1 3692 B15R0.81 CCCCSCCNCCCCC(=O)OC 2230a_100025743550_100000204269 [0,1,0,0,0,0|1,0,0]=2 3693 B15R0.81 CCCCSCCNCCOCC(=O)OC 2230a_100025743550_100000090808 [0,1,0,0,0,0|2,0,0]=3 3694 B15R0.81 CCCCSCCOCCCCC(=O)OC 34a_200000230436_100000204269 [0,1,0,0,0,0|1,0,0]=2 3695 B15R0.81 CCCCSCCOCCCCC(=O)OC 7a_200000230436_100000204269 [0,1,0,0,0,0|1,0,0]=2 3696 B15R0.81 CCCCSCCOCCOCC(=O)OC 34a_200000230436_100000090808 [0,1,0,0,0,0|2,0,0]=3 3697 B15R0.81 CCCCSCCOCCOCC(=O)OC 7a_200000230436_100000090808 [0,1,0,0,0,0|2,0,0]=3 3698 B15R0.81 CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210303 [0,1,0,0,0,0|0,0,0]=1 3699 B15R0.81 CCCOCCCCCCCCC(=O)OC 34a_100000210258_100010282707 [0,1,0,0,0,0|0,0,0]=1 3700 B15R0.81 CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210303 [0,1,0,0,0,0|0,0,0]=1 3701 B15R0.81 CCCOCCCNCCCCC(=O)OC 2230a_100011217757_100000204269 [0,1,0,0,0,0|1,0,0]=2 3702 B15R0.81 CCCOCCCNCCCCC(=O)OC 34a_100011217757_100000204269 [0,1,0,0,0,0|1,0,0]=2 3703 B15R0.81 CCCOCCCNCCOCC(=O)OC 2230a_100011217757_100000090808 [0,1,0,0,0,0|2,0,0]=3 3704 B15R0.81 CCCOCCCNCCOCC(=O)OC 34a_100011217757_100000090808 [0,1,0,0,0,0|2,0,0]=3 3705 B15R0.81 CCCOCCNCCCCCC(=O)OC 2230a_100161115042_100009816466 [0,1,0,0,0,0|1,0,0]=2 3706 B15R0.81 CCCOCCNCCCCCC(=O)OC 34a_100161115042_100009816466 [0,1,0,0,0,0|1,0,0]=2 3707 B15R0.81 CCCOCCOCCCCCC(=O)OC 34a_100000074720_100011215938 [0,1,0,0,0,0|1,0,0]=2 3708 B15R0.81 CCCOCCOCCCCCC(=O)OC 34a_100000752267_100009816466 [0,1,0,0,0,0|1,0,0]=2 3709 B15R0.81 CCCOCCOCCCCCC(=O)OC 7a_100000074720_100011215938 [0,1,0,0,0,0|1,0,0]=2 3710 B15R0.81 CCCOCCOCCCCCC(=O)OC 7a_100000752267_100009816466 [0,1,0,0,0,0|1,0,0]=2 3711 B15R0.81 CCCOCCOCCNCCC(=O)NC 2230a_200011904461_100000737683 [0,1,0,0,0,0|3,0,0]=4 3712 B15R0.81 CCCOCCOCCNCCC(=O)NC 34a_200011904461_100012179268 [0,1,0,0,0,0|3,0,0]=4 3713 B15R0.81 CCCOCCOCCNCCC(=O)OC 2230a_200011904461_100000204255 [0,1,0,0,0,0|2,0,0]=3 3714 B15R0.81 CCCOCCOCCNCCC(=O)OC 34a_200011904461_100000742370 [0,1,0,0,0,0|2,0,0]=3 3715 B15R0.81 CCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210303 [0,1,0,0,0,0|2,0,0]=3 3716 B15R0.81 CCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210303 [0,1,0,0,0,0|2,0,0]=3 3717 B15R0.81 CCCOCCSCCCCCC(=O)OC 62a_100009816466_100011215938 [0,1,0,0,0,0|1,0,0]=2 3718 B15R0.81 CCCOCCSCCCCCC(=O)OC 62a_100011215938_100009816466 [0,1,0,0,0,0|1,0,0]=2 3719 B15R0.81 CCCSCCCCCCCCC(=O)OC 62a_100000210303_100010282707 [0,1,0,0,0,0|0,0,0]=1 3720 B15R0.81 CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210303 [0,1,0,0,0,0|0,0,0]=1 3721 B15R0.81 CCCSCCNCCCCCC(=O)OC 2230a_100020603323_100009816466 [0,1,0,0,0,0|1,0,0]=2 3722 B15R0.81 CCCSCCOCCCCCC(=O)OC 34a_200000230433_100009816466 [0,1,0,0,0,0|1,0,0]=2 3723 B15R0.81 CCCSCCOCCCCCC(=O)OC 7a_200000230433_100009816466 [0,1,0,0,0,0|1,0,0]=2 3724 B15R0.81 CCN(C)CCCCCCCCCCCO 2230a_100000225621_100009812471 [0,1,0,0,0,0|3,0,0]=4 3725 B15R0.81 CCN(C)CCCCCCCCCCCO 269982a_100000225621_100009812471 [0,1,0,0,0,0|3,0,0]=4 3726 B15R0.81 CCNCCCCCCCCCC(=O)OC 2230a_100015525214_100009813843 [0,1,0,0,0,0|0,0,0]=1 3727 B15R0.81 CCOCCCCCCCCCC(=O)OC 34a_100121572206_100009813843 [0,1,0,0,0,0|0,0,0]=1 3728 B15R0.81 CCOCCCNCCCCCC(=O)OC 2230a_100000210961_100009816466 [0,1,0,0,0,0|1,0,0]=2 3729 B15R0.81 CCOCCCNCCCCCC(=O)OC 34a_100000210961_100009816466 [0,1,0,0,0,0|1,0,0]=2 3730 B15R0.81 CCOCCCOCCCCCC(=O)OC 34a_100000074720_100012232248 [0,1,0,0,0,0|1,0,0]=2 3731 B15R0.81 CCOCCCOCCCCCC(=O)OC 34a_100000757476_100009816466 [0,1,0,0,0,0|1,0,0]=2 3732 B15R0.81 CCOCCCOCCCCCC(=O)OC 7a_100000074720_100012232248 [0,1,0,0,0,0|1,0,0]=2 3733 B15R0.81 CCOCCCOCCCCCC(=O)OC 7a_100000757476_100009816466 [0,1,0,0,0,0|1,0,0]=2 3734 B15R0.81 CCOCCCSCCCCCC(=O)OC 62a_100009816466_100012232248 [0,1,0,0,0,0|1,0,0]=2 3735 B15R0.81 CCOCCCSCCCCCC(=O)OC 62a_100012232248_100009816466 [0,1,0,0,0,0|1,0,0]=2 3736 B15R0.81 CCOCCNCCCCCCC(=O)OC 2230a_102516460346_100009815986 [0,1,0,0,0,0|1,0,0]=2 3737 B15R0.81 CCOCCNCCCCCCC(=O)OC 34a_102516460346_100009815986 [0,1,0,0,0,0|1,0,0]=2 3738 B15R0.81 CCOCCNN=CCCCCC(=O)OC 4a_100000732670_100000052768 [0,1,0,0,0,0|2,0,1]=4 3739 B15R0.81 CCOCCOCCCCCCC(=O)OC 34a_100000210136_100009815986 [0,1,0,0,0,0|1,0,0]=2 3740 B15R0.81 CCOCCOCCCCCCC(=O)OC 34a_100009863599_100000210147 [0,1,0,0,0,0|1,0,0]=2 3741 B15R0.81 CCOCCOCCCCCCC(=O)OC 7a_100000210136_100009815986 [0,1,0,0,0,0|1,0,0]=2 3742 B15R0.81 CCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215890 [0,1,0,0,0,0|1,0,0]=2 3743 B15R0.81 CCOCCOCCNCCCC(=O)NC 2230a_100000740002_100011211534 [0,1,0,0,0,0|3,0,0]=4 3744 B15R0.81 CCOCCOCCNCCCC(=O)NC 2230a_100102712874_100000741757 [0,1,0,0,0,0|3,0,0]=4 3745 B15R0.81 CCOCCOCCNCCCC(=O)NC 34a_100000740002_100011211534 [0,1,0,0,0,0|3,0,0]=4 3746 B15R0.81 CCOCCOCCNCCCC(=O)NC 34a_100102712874_100000741757 [0,1,0,0,0,0|3,0,0]=4 3747 B15R0.81 CCOCCOCCNCCCC(=O)OC 2230a_100102712874_100011218270 [0,1,0,0,0,0|2,0,0]=3 3748 B15R0.81 CCOCCOCCNCCCC(=O)OC 34a_100102712874_100000742333 [0,1,0,0,0,0|2,0,0]=3 3749 B15R0.81 CCOCCOCCOCCCC(=O)NC 34a_100000210240_100000741757 [0,1,0,0,0,0|3,0,0]=4 3750 B15R0.81 CCOCCOCCOCCCC(=O)NC 7a_100000210240_100000741757 [0,1,0,0,0,0|3,0,0]=4 3751 B15R0.81 CCOCCOCCOCCCC(=O)OC 34a_100000210240_100000742333 [0,1,0,0,0,0|2,0,0]=3 3752 B15R0.81 CCOCCOCCOCCCC(=O)OC 7a_100000210240_100011218270 [0,1,0,0,0,0|2,0,0]=3 3753 B15R0.81 CCOCCOCCOCCNC(=O)OC 34a_100000757965_100011211534 [0,1,0,0,0,0|3,0,0]=4 3754 B15R0.81 CCOCCOCCOCCOC(=O)OC 34a_100010262106_100011211534 [0,1,0,0,0,0|3,0,0]=4 3755 B15R0.81 CCOCCOCCSCCCC(=O)NC 62a_100000741757_100011211534 [0,1,0,0,0,0|3,0,0]=4 3756 B15R0.81 CCOCCOCCSCCCC(=O)NC 62a_100011211534_100000741757 [0,1,0,0,0,0|3,0,0]=4 3757 B15R0.81 CCOCCOCCSCCCC(=O)OC 62a_100011211534_100011218270 [0,1,0,0,0,0|2,0,0]=3 3758 B15R0.81 CCOCCOCCSCCCC(=O)OC 62a_100011218270_100011211534 [0,1,0,0,0,0|2,0,0]=3 3759 B15R0.81 CCOCCSCCCCCCC(=O)OC 62a_100000210147_100009815986 [0,1,0,0,0,0|1,0,0]=2 3760 B15R0.81 CCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215890 [0,1,0,0,0,0|1,0,0]=2 3761 B15R0.81 CCOCSCCCCCCCC(=O)OC 62a_100000739092_100010004213 [0,1,0,0,0,0|1,0,0]=2 3762 B15R0.81 CCOCSCCCCCCCC(=O)OC 62a_100010004213_100000739092 [0,1,0,0,0,0|1,0,0]=2 3763 B15R0.81 CCSCCCCCCCCCC(=O)OC 62a_100000210202_100009813843 [0,1,0,0,0,0|0,0,0]=1 3764 B15R0.81 CCSCCCOCCCCCC(=O)OC 34a_100011216438_100009816466 [0,1,0,0,0,0|1,0,0]=2 3765 B15R0.81 CCSCCCOCCCCCC(=O)OC 7a_100011216438_100009816466 [0,1,0,0,0,0|1,0,0]=2 3766 B15R0.81 CCSCCNCCCCCCC(=O)OC 2230a_100000106463_100009815986 [0,1,0,0,0,0|1,0,0]=2 3767 B15R0.81 CCSCCOCCCCCCC(=O)OC 34a_100000212035_100009815986 [0,1,0,0,0,0|1,0,0]=2 3768 B15R0.81 CCSCCOCCCCCCC(=O)OC 34a_100009863599_100000757381 [0,1,0,0,0,0|1,0,0]=2 3769 B15R0.81 CCSCCOCCCCCCC(=O)OC 7a_100000212035_100009815986 [0,1,0,0,0,0|1,0,0]=2 3770 B15R0.81 CCSCCOCCCCCCC(=O)OC 7a_100009863599_100000757381 [0,1,0,0,0,0|1,0,0]=2 3771 B15R0.81 CCSCCSCCCCCCC(=O)OC 62a_100000757381_100009815986 [0,1,0,0,0,0|1,0,0]=2 3772 B15R0.81 CCSCCSCCCCCCC(=O)OC 62a_100009815986_100000757381 [0,1,0,0,0,0|1,0,0]=2 3773 B15R0.81 CNC(=O)CCCCCCCCCCCO 240690a_100102657272_100000037981 [0,1,0,0,0,0|1,0,0]=2 3774 B15R0.81 CNC(=O)CCCNCCCCCCC#N 2230a_100000740002_100009813337 [0,1,0,0,0,0|2,0,1]=4 3775 B15R0.81 CNC(=O)CCCNCCCCCCCO 2230a_100000740002_100000760002 [0,1,0,0,0,0|2,0,0]=3 3776 B15R0.81 CNC(=O)CCCNCCCCCCCO 2230a_100011996573_100000741757 [0,1,0,0,0,0|2,0,0]=3 3777 B15R0.81 CNC(=O)CCCNCCCCCCCO 34a_100000740002_100000760002 [0,1,0,0,0,0|2,0,0]=3 3778 B15R0.81 CNC(=O)CCCNCCCCCCCO 34a_100011996573_100000741757 [0,1,0,0,0,0|2,0,0]=3 3779 B15R0.81 CNC(=O)CCCNCCCCCCOC 2230a_100000740002_100011998445 [0,1,0,0,0,0|2,0,0]=3 3780 B15R0.81 CNC(=O)CCCNCCCCCCOC 34a_100000740002_100011998445 [0,1,0,0,0,0|2,0,0]=3 3781 B15R0.81 CNC(=O)CCCNCCCOCCCO 2230a_100011310245_100000741757 [0,1,0,0,0,0|3,0,0]=4 3782 B15R0.81 CNC(=O)CCCNCCCOCCCO 34a_100011310245_100000741757 [0,1,0,0,0,0|3,0,0]=4 3783 B15R0.81 CNC(=O)CCCNCCCOCCOC 2230a_100000206027_100000741757 [0,1,0,0,0,0|3,0,0]=4 3784 B15R0.81 CNC(=O)CCCNCCCOCCOC 2230a_100000740002_100011216529 [0,1,0,0,0,0|3,0,0]=4 3785 B15R0.81 CNC(=O)CCCNCCCOCCOC 34a_100000206027_100000741757 [0,1,0,0,0,0|3,0,0]=4 3786 B15R0.81 CNC(=O)CCCNCCCOCCOC 34a_100000740002_100011216529 [0,1,0,0,0,0|3,0,0]=4 3787 B15R0.81 CNC(=O)CCCOCCCCCCCBr 34a_100000760002_100000741757 [0,1,0,0,0,0|2,0,0]=3 3788 B15R0.81 CNC(=O)CCCOCCCCCCCBr 7a_100000760002_100000741757 [0,1,0,0,0,0|2,0,0]=3 3789 B15R0.81 CNC(=O)CCCOCCCCCCCN 34a_100011996573_100000741757 [0,1,0,0,0,0|2,0,0]=3 3790 B15R0.81 CNC(=O)CCCOCCCCCCOC 34a_200012092642_100000741757 [0,1,0,0,0,0|2,0,0]=3 3791 B15R0.81 CNC(=O)CCCOCCCCCCOC 7a_200012092642_100000741757 [0,1,0,0,0,0|2,0,0]=3 3792 B15R0.81 CNC(=O)CCCOCCCOCCCN 34a_100011310245_100000741757 [0,1,0,0,0,0|3,0,0]=4 3793 B15R0.81 CNC(=O)CCCSCCCCCCC#N 62a_100000741757_100009813337 [0,1,0,0,0,0|2,0,1]=4 3794 B15R0.81 CNC(=O)CCCSCCCCCCC#N 62a_100009813337_100000741757 [0,1,0,0,0,0|2,0,1]=4 3795 B15R0.81 CNC(=O)CCCSCCCCCCCO 62a_100000741757_100000760002 [0,1,0,0,0,0|2,0,0]=3 3796 B15R0.81 CNC(=O)CCCSCCCCCCCO 62a_100000760002_100000741757 [0,1,0,0,0,0|2,0,0]=3 3797 B15R0.81 CNC(=O)CCCSCCCCCCOC 62a_100000741757_100011998445 [0,1,0,0,0,0|2,0,0]=3 3798 B15R0.81 CNC(=O)CCCSCCCCCCOC 62a_100011998445_100000741757 [0,1,0,0,0,0|2,0,0]=3 3799 B15R0.81 CNC(=O)CCCSCCCOCCOC 62a_100000741757_100011216529 [0,1,0,0,0,0|3,0,0]=4 3800 B15R0.81 CNC(=O)CCCSCCCOCCOC 62a_100011216529_100000741757 [0,1,0,0,0,0|3,0,0]=4 3801 B15R0.81 CNC(=O)CCNCCCCCCCCO 2230a_100000738227_100000033203 [0,1,0,0,0,0|2,0,0]=3 3802 B15R0.81 CNC(=O)CCNCCCCCCCCO 2230a_102515433106_100000737683 [0,1,0,0,0,0|2,0,0]=3 3803 B15R0.81 CNC(=O)CCNCCCCCCCCO 34a_100000738227_100000033203 [0,1,0,0,0,0|2,0,0]=3 3804 B15R0.81 CNC(=O)CCNCCCCCCCCO 34a_102515433106_100012179268 [0,1,0,0,0,0|2,0,0]=3 3805 B15R0.81 CNC(=O)CCOCCCCCCCCBr 34a_100009813846_100012179268 [0,1,0,0,0,0|2,0,0]=3 3806 B15R0.81 CNC(=O)CCOCCCCCCCCBr 7a_100009813846_100000737683 [0,1,0,0,0,0|2,0,0]=3 3807 B15R0.81 CNC(=O)CCOCCCCCCCCCl 34a_100000033203_100012179268 [0,1,0,0,0,0|2,0,0]=3 3808 B15R0.81 CNC(=O)CCOCCCCCCCCCl 7a_100000033203_100000737683 [0,1,0,0,0,0|2,0,0]=3 3809 B15R0.81 CNC(=O)CCOCCCCCCCCN 34a_102515433106_100012179268 [0,1,0,0,0,0|2,0,0]=3 3810 B15R0.81 CNC(=O)CCOCCCCCCCCO 34a_100000754576_100000033203 [0,1,0,0,0,0|2,0,0]=3 3811 B15R0.81 CNC(=O)CCOCCCCCNCCN 34a_103619048469_100012179268 [0,1,0,0,0,0|3,0,0]=4 3812 B15R0.81 CNC(=O)CCOCCCOCCCOC 34a_200011215475_100012179268 [0,1,0,0,0,0|3,0,0]=4 3813 B15R0.81 CNC(=O)CCOCCCOCCCOC 7a_200011215475_100000737683 [0,1,0,0,0,0|3,0,0]=4 3814 B15R0.81 CNC(=O)CCSCCCCCCCCO 62a_100000033203_100000737683 [0,1,0,0,0,0|2,0,0]=3 3815 B15R0.81 CNC(=O)CCSCCCCCCCCO 62a_100000737683_100000033203 [0,1,0,0,0,0|2,0,0]=3 3816 B15R0.81 CNC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183359 [0,1,0,0,0,0|2,0,0]=3 3817 B15R0.81 CNC(=O)CNCCCCCCCCCO 2230a_100000693194_100009813782 [0,1,0,0,0,0|2,0,0]=3 3818 B15R0.81 CNC(=O)CNCCCCCCCCCO 34a_100000078944_100000183359 [0,1,0,0,0,0|2,0,0]=3 3819 B15R0.81 CNC(=O)COCCCCCCCCCBr 34a_100009813782_100000183359 [0,1,0,0,0,0|2,0,0]=3 3820 B15R0.81 CNC(=O)COCCCCCCCCCBr 7a_100009813782_100000183359 [0,1,0,0,0,0|2,0,0]=3 3821 B15R0.81 CNC(=O)COCCCCCCCCCCl 34a_100009868337_100000183359 [0,1,0,0,0,0|2,0,0]=3 3822 B15R0.81 CNC(=O)COCCCCCCCCCCl 7a_100009868337_100000183359 [0,1,0,0,0,0|2,0,0]=3 3823 B15R0.81 CNC(=O)COCCCCCCCCCN 34a_100000078944_100000183359 [0,1,0,0,0,0|2,0,0]=3 3824 B15R0.81 CNC(=O)COCCCCCCCCCO 34a_100000750040_100009813782 [0,1,0,0,0,0|2,0,0]=3 3825 B15R0.81 CNC(=O)CSCCCCCCCCCO 62a_100000183359_100009813782 [0,1,0,0,0,0|2,0,0]=3 3826 B15R0.81 CNC(=O)CSCCCCCCCCCO 62a_100009813782_100000183359 [0,1,0,0,0,0|2,0,0]=3 3827 B15R0.81 CNC(=O)NCCCCCCCCCCO 2708a_100000066964_106832991635 [0,1,0,0,0,0|2,0,0]=3 3828 B15R0.81 CNC(=O)NCCCCCCCCCCO 2708a_100102657272_100000066964 [0,1,0,0,0,0|2,0,0]=3 3829 B15R0.81 CNC(=O)NCCCCCCCCCCO 273464a_100000066964_100102657272 [0,1,0,0,0,0|2,0,0]=3 3830 B15R0.81 CNC(=O)NCCCCCCCCCCO 273464a_100102657272_100000066964 [0,1,0,0,0,0|2,0,0]=3 3831 B15R0.81 CNC(=O)NCCCCCCCCCCO 512a_100000066964_100102657272 [0,1,0,0,0,0|2,0,0]=3 3832 B15R0.81 CNC(=O)NCCCCCCCCCCO 512a_106832991638_100000066964 [0,1,0,0,0,0|2,0,0]=3 3833 B15R0.81 CNC(=O)NCCNCCCCCCCO 34a_100015205895_100000760002 [0,1,0,0,0,0|3,0,0]=4 3834 B15R0.81 CNC(=O)NCCNCCCCCCOC 34a_100015205895_100011998445 [0,1,0,0,0,0|3,0,0]=4 3835 B15R0.81 CNC(=O)OCCNCCCCCCCO 34a_100011996573_200011997002 [0,1,0,0,0,0|3,0,0]=4 3836 B15R0.81 CNC(=O)OCCOCCCCCCCBr 34a_100000760002_200011997002 [0,1,0,0,0,0|3,0,0]=4 3837 B15R0.81 CNC(=O)OCCOCCCCCCCBr 7a_100000760002_200011997002 [0,1,0,0,0,0|3,0,0]=4 3838 B15R0.81 CNC(=O)OCCOCCCCCCCN 34a_100011996573_200011997002 [0,1,0,0,0,0|3,0,0]=4 3839 B15R0.81 CNC(=O)OCCOCCCCCCOC 34a_200012092642_200011997002 [0,1,0,0,0,0|3,0,0]=4 3840 B15R0.81 CNC(=O)OCCOCCCCCCOC 7a_200012092642_200011997002 [0,1,0,0,0,0|3,0,0]=4 3841 B15R0.81 CNC(=O)OCCSCCCCCCCO 62a_100000760002_200011997002 [0,1,0,0,0,0|3,0,0]=4 3842 B15R0.81 CNC(=O)OCCSCCCCCCCO 62a_200011997002_100000760002 [0,1,0,0,0,0|3,0,0]=4 3843 B15R0.81 CNC(=O)OCCSCCCCCCOC 62a_100011998445_200011997002 [0,1,0,0,0,0|3,0,0]=4 3844 B15R0.81 CNC(=O)OCCSCCCCCCOC 62a_200011997002_100011998445 [0,1,0,0,0,0|3,0,0]=4 3845 B15R0.81 CNCCCCCCCCCCC(=O)OC 2230a_106832991635_100009812566 [0,1,0,0,0,0|0,0,0]=1 3846 B15R0.81 CNCCCCCCCCCCC(=O)OC 34a_100102657272_100009812566 [0,1,0,0,0,0|0,0,0]=1 3847 B15R0.81 CNCCCCCCCCCCC(=O)OC 7a_106832991635_100009812566 [0,1,0,0,0,0|0,0,0]=1 3848 B15R0.81 CNCCCCCOCCCCC(=O)OC 34a_100000722520_100000204269 [0,1,0,0,0,0|1,0,0]=2 3849 B15R0.81 CNCCCCCOCCOCC(=O)OC 34a_100000722520_100000090808 [0,1,0,0,0,0|2,0,0]=3 3850 B15R0.81 CNCCCOCCCCCCC(=O)OC 34a_100000213112_100009815986 [0,1,0,0,0,0|1,0,0]=2 3851 B15R0.81 CNCCOCCOCCCCC(=O)OC 34a_100000228057_100000204269 [0,1,0,0,0,0|2,0,0]=3 3852 B15R0.81 CNCCOCCOCCOCC(=O)OC 34a_100000228057_100000090808 [0,1,0,0,0,0|3,0,0]=4 3853 B15R0.81 CNCCOCCOCCOCC(=O)OC 34a_200014138305_100000747449 [0,1,0,0,0,0|3,0,0]=4 3854 B15R0.81 COC(=O)/C=C/CNCCCCCCCO 2230a_100011996573_100000742655 [0,1,0,0,0,0|1,0,2]=4 3855 B15R0.81 COC(=O)/C=C/CNCCCCCCCO 34a_100011996573_100000742655 [0,1,0,0,0,0|1,0,2]=4 3856 B15R0.81 COC(=O)/C=C/COCCCCCCCBr 34a_100000760002_100000742655 [0,1,0,0,0,0|1,0,2]=4 3857 B15R0.81 COC(=O)/C=C/COCCCCCCCBr 7a_100000760002_100000742655 [0,1,0,0,0,0|1,0,2]=4 3858 B15R0.81 COC(=O)/C=C/COCCCCCCCN 34a_100011996573_100000742655 [0,1,0,0,0,0|1,0,2]=4 3859 B15R0.81 COC(=O)/C=C/CSCCCCCCCO 62a_100000742655_100000760002 [0,1,0,0,0,0|1,0,2]=4 3860 B15R0.81 COC(=O)/C=C/CSCCCCCCCO 62a_100000760002_100000742655 [0,1,0,0,0,0|1,0,2]=4 3861 B15R0.81 COC(=O)CCCCCCCCCCO[13CH3] 34a_100011003013_200025704644 [0,1,0,0,0,0|0,0,0]=1 3862 B15R0.81 COC(=O)CCCCCCCCCCO[13CH3] 7a_100011003013_200025704644 [0,1,0,0,0,0|0,0,0]=1 3863 B15R0.81 COC(=O)CCCCCCCCCCSC 62a_200000210301_100009812566 [0,1,0,0,0,0|0,0,0]=1 3864 B15R0.81 COC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009812566 [0,1,0,0,0,0|0,0,0]=1 3865 B15R0.81 COC(=O)CCCCCCCCCSCF 62a_100015361967_100009813843 [0,1,0,0,0,0|1,0,0]=2 3866 B15R0.81 COC(=O)CCCCCCCCNCCF 34a_100000724931_100010282707 [0,1,0,0,0,0|1,0,0]=2 3867 B15R0.81 COC(=O)CCCCCCCCNCCO 2230a_100016997473_100010282707 [0,1,0,0,0,0|1,0,0]=2 3868 B15R0.81 COC(=O)CCCCCCCCNCCO 34a_100016990907_100010282707 [0,1,0,0,0,0|1,0,0]=2 3869 B15R0.81 COC(=O)CCCCCCCCOCC#N 7a_100000035544_100011215382 [0,1,0,0,0,0|1,0,1]=3 3870 B15R0.81 COC(=O)CCCCCCCCOCC=O 34a_100000035544_200009817547 [0,1,0,0,0,0|1,0,1]=3 3871 B15R0.81 COC(=O)CCCCCCCCOCC=O 7a_100000035544_200015260668 [0,1,0,0,0,0|1,0,1]=3 3872 B15R0.81 COC(=O)CCCCCCCCOCCBr 34a_100000211926_100010282707 [0,1,0,0,0,0|1,0,0]=2 3873 B15R0.81 COC(=O)CCCCCCCCOCCF 34a_100000035544_100011217306 [0,1,0,0,0,0|1,0,0]=2 3874 B15R0.81 COC(=O)CCCCCCCCOCCF 7a_100000035544_100011217306 [0,1,0,0,0,0|1,0,0]=2 3875 B15R0.81 COC(=O)CCCCCCCCOCCN 34a_100000210304_100010282707 [0,1,0,0,0,0|1,0,0]=2 3876 B15R0.81 COC(=O)CCCCCCCCOCCO 34a_100000035544_100000211926 [0,1,0,0,0,0|1,0,0]=2 3877 B15R0.81 COC(=O)CCCCCCCCOCCO 7a_100000035544_100000211926 [0,1,0,0,0,0|1,0,0]=2 3878 B15R0.81 COC(=O)CCCCCCCCOCSC 34a_100000035544_100011218213 [0,1,0,0,0,0|1,0,0]=2 3879 B15R0.81 COC(=O)CCCCCCCCSCC#N 62a_100010282707_100011215382 [0,1,0,0,0,0|1,0,1]=3 3880 B15R0.81 COC(=O)CCCCCCCCSCC#N 62a_100011215382_100010282707 [0,1,0,0,0,0|1,0,1]=3 3881 B15R0.81 COC(=O)CCCCCCCCSCC=O 62a_100010282707_200015260668 [0,1,0,0,0,0|1,0,1]=3 3882 B15R0.81 COC(=O)CCCCCCCCSCC=O 62a_200015260668_100010282707 [0,1,0,0,0,0|1,0,1]=3 3883 B15R0.81 COC(=O)CCCCCCCCSCCF 62a_100010282707_100011217306 [0,1,0,0,0,0|1,0,0]=2 3884 B15R0.81 COC(=O)CCCCCCCCSCCF 62a_100011217306_100010282707 [0,1,0,0,0,0|1,0,0]=2 3885 B15R0.81 COC(=O)CCCCCCCCSCCO 62a_100000211926_100010282707 [0,1,0,0,0,0|1,0,0]=2 3886 B15R0.81 COC(=O)CCCCCCCCSCCO 62a_100010282707_100000211926 [0,1,0,0,0,0|1,0,0]=2 3887 B15R0.81 COC(=O)CCCCCCCCSCSC 62a_100010282707_100011218213 [0,1,0,0,0,0|1,0,0]=2 3888 B15R0.81 COC(=O)CCCCCCCCSCSC 62a_100011218213_100010282707 [0,1,0,0,0,0|1,0,0]=2 3889 B15R0.81 COC(=O)CCCCCCCNCCCF 2230a_100015189416_100010004213 [0,1,0,0,0,0|1,0,0]=2 3890 B15R0.81 COC(=O)CCCCCCCNCCCF 34a_100015189416_100010004213 [0,1,0,0,0,0|1,0,0]=2 3891 B15R0.81 COC(=O)CCCCCCCNCCSC 2230a_100020590264_100010004213 [0,1,0,0,0,0|1,0,0]=2 3892 B15R0.81 COC(=O)CCCCCCCOCCC#N 7a_100011022521_100000184422 [0,1,0,0,0,0|1,0,1]=3 3893 B15R0.81 COC(=O)CCCCCCCOCCCBr 34a_100011217188_100010004213 [0,1,0,0,0,0|1,0,0]=2 3894 B15R0.81 COC(=O)CCCCCCCOCCCCl 34a_100000230001_100010004213 [0,1,0,0,0,0|1,0,0]=2 3895 B15R0.81 COC(=O)CCCCCCCOCCCF 34a_100000759539_100010004213 [0,1,0,0,0,0|1,0,0]=2 3896 B15R0.81 COC(=O)CCCCCCCOCCCF 34a_100011022521_100011934791 [0,1,0,0,0,0|1,0,0]=2 3897 B15R0.81 COC(=O)CCCCCCCOCCCF 7a_100011022521_100011934791 [0,1,0,0,0,0|1,0,0]=2 3898 B15R0.81 COC(=O)CCCCCCCOCCCN 34a_100000182051_100010004213 [0,1,0,0,0,0|1,0,0]=2 3899 B15R0.81 COC(=O)CCCCCCCOCCCO 34a_100011022521_100000230001 [0,1,0,0,0,0|1,0,0]=2 3900 B15R0.81 COC(=O)CCCCCCCOCCCO 7a_100011022521_100011215043 [0,1,0,0,0,0|1,0,0]=2 3901 B15R0.81 COC(=O)CCCCCCCOCCON 34a_100000700252_100010004213 [0,1,0,0,0,0|2,0,0]=3 3902 B15R0.81 COC(=O)CCCCCCCOCCSC 34a_100000230434_100010004213 [0,1,0,0,0,0|1,0,0]=2 3903 B15R0.81 COC(=O)CCCCCCCOCCSC 34a_100011022521_100000212216 [0,1,0,0,0,0|1,0,0]=2 3904 B15R0.81 COC(=O)CCCCCCCOCCSC 7a_100000230434_100010004213 [0,1,0,0,0,0|1,0,0]=2 3905 B15R0.81 COC(=O)CCCCCCCOCCSC 7a_100011022521_100000212216 [0,1,0,0,0,0|1,0,0]=2 3906 B15R0.81 COC(=O)CCCCCCCSCCC#N 62a_100010004213_100011215226 [0,1,0,0,0,0|1,0,1]=3 3907 B15R0.81 COC(=O)CCCCCCCSCCC#N 62a_100011215226_100010004213 [0,1,0,0,0,0|1,0,1]=3 3908 B15R0.81 COC(=O)CCCCCCCSCCCF 62a_100010004213_100011934791 [0,1,0,0,0,0|1,0,0]=2 3909 B15R0.81 COC(=O)CCCCCCCSCCCF 62a_100011934791_100010004213 [0,1,0,0,0,0|1,0,0]=2 3910 B15R0.81 COC(=O)CCCCCCCSCCCO 62a_100010004213_100011215043 [0,1,0,0,0,0|1,0,0]=2 3911 B15R0.81 COC(=O)CCCCCCCSCCCO 62a_100011215043_100010004213 [0,1,0,0,0,0|1,0,0]=2 3912 B15R0.81 COC(=O)CCCCCCCSCCSC 62a_100000212216_100010004213 [0,1,0,0,0,0|1,0,0]=2 3913 B15R0.81 COC(=O)CCCCCCCSCCSC 62a_100010004213_100000751147 [0,1,0,0,0,0|1,0,0]=2 3914 B15R0.81 COC(=O)CCCCCCCSCSC#N 62a_100000211825_100010004213 [0,1,0,0,0,0|2,0,1]=4 3915 B15R0.81 COC(=O)CCCCCCCSCSC#N 62a_100010004213_100000211825 [0,1,0,0,0,0|2,0,1]=4 3916 B15R0.81 COC(=O)CCCCCCNCCCCO 2230a_100000750430_100009815986 [0,1,0,0,0,0|1,0,0]=2 3917 B15R0.81 COC(=O)CCCCCCNCCCCO 34a_100000750430_100009815986 [0,1,0,0,0,0|1,0,0]=2 3918 B15R0.81 COC(=O)CCCCCCNCCCSC 2230a_100000749238_100009815986 [0,1,0,0,0,0|1,0,0]=2 3919 B15R0.81 COC(=O)CCCCCCOCC#CCCl 34a_200000047223_100009815986 [0,1,0,0,0,0|1,0,2]=4 3920 B15R0.81 COC(=O)CCCCCCOCC#CCO 34a_100009863599_200000047223 [0,1,0,0,0,0|1,0,2]=4 3921 B15R0.81 COC(=O)CCCCCCOCC#CCO 7a_100009863599_200000047223 [0,1,0,0,0,0|1,0,2]=4 3922 B15R0.81 COC(=O)CCCCCCOCCCC#N 7a_100009863599_100000687738 [0,1,0,0,0,0|1,0,1]=3 3923 B15R0.81 COC(=O)CCCCCCOCCCC=O 7a_100009863599_200011292268 [0,1,0,0,0,0|1,0,1]=3 3924 B15R0.81 COC(=O)CCCCCCOCCCCBr 34a_100011216708_100009815986 [0,1,0,0,0,0|1,0,0]=2 3925 B15R0.81 COC(=O)CCCCCCOCCCCCl 34a_100000210776_100009815986 [0,1,0,0,0,0|1,0,0]=2 3926 B15R0.81 COC(=O)CCCCCCOCCCCCl 7a_100000210776_100009815986 [0,1,0,0,0,0|1,0,0]=2 3927 B15R0.81 COC(=O)CCCCCCOCCCCF 34a_100009863599_100000729493 [0,1,0,0,0,0|1,0,0]=2 3928 B15R0.81 COC(=O)CCCCCCOCCCCF 34a_100011995726_100009815986 [0,1,0,0,0,0|1,0,0]=2 3929 B15R0.81 COC(=O)CCCCCCOCCCCF 7a_100009863599_100000729493 [0,1,0,0,0,0|1,0,0]=2 3930 B15R0.81 COC(=O)CCCCCCOCCCCF 7a_100011995726_100009815986 [0,1,0,0,0,0|1,0,0]=2 3931 B15R0.81 COC(=O)CCCCCCOCCCCI 34a_200012148704_100009815986 [0,1,0,0,0,0|1,0,0]=2 3932 B15R0.81 COC(=O)CCCCCCOCCCCN 34a_100000750430_100009815986 [0,1,0,0,0,0|1,0,0]=2 3933 B15R0.81 COC(=O)CCCCCCOCCCCO 34a_100009863599_100011216708 [0,1,0,0,0,0|1,0,0]=2 3934 B15R0.81 COC(=O)CCCCCCOCCCCO 7a_100009863599_100000210776 [0,1,0,0,0,0|1,0,0]=2 3935 B15R0.81 COC(=O)CCCCCCOCCCSC 34a_100000690336_100009815986 [0,1,0,0,0,0|1,0,0]=2 3936 B15R0.81 COC(=O)CCCCCCOCCCSC 7a_100000690336_100009815986 [0,1,0,0,0,0|1,0,0]=2 3937 B15R0.81 COC(=O)CCCCCCSCC#CCO 62a_100009815986_200000047223 [0,1,0,0,0,0|1,0,2]=4 3938 B15R0.81 COC(=O)CCCCCCSCC#CCO 62a_200000047223_100009815986 [0,1,0,0,0,0|1,0,2]=4 3939 B15R0.81 COC(=O)CCCCCCSCCCC#N 62a_100000687738_100009815986 [0,1,0,0,0,0|1,0,1]=3 3940 B15R0.81 COC(=O)CCCCCCSCCCC#N 62a_100009815986_100000687738 [0,1,0,0,0,0|1,0,1]=3 3941 B15R0.81 COC(=O)CCCCCCSCCCC=O 62a_100009815986_200011292268 [0,1,0,0,0,0|1,0,1]=3 3942 B15R0.81 COC(=O)CCCCCCSCCCC=O 62a_200011292268_100009815986 [0,1,0,0,0,0|1,0,1]=3 3943 B15R0.81 COC(=O)CCCCCCSCCCCF 62a_100000729493_100009815986 [0,1,0,0,0,0|1,0,0]=2 3944 B15R0.81 COC(=O)CCCCCCSCCCCF 62a_100009815986_100000729493 [0,1,0,0,0,0|1,0,0]=2 3945 B15R0.81 COC(=O)CCCCCCSCCCCO 62a_100000210776_100009815986 [0,1,0,0,0,0|1,0,0]=2 3946 B15R0.81 COC(=O)CCCCCCSCCCCO 62a_100009815986_100000210776 [0,1,0,0,0,0|1,0,0]=2 3947 B15R0.81 COC(=O)CCCCCCSCCSC#N 62a_100000034367_100009815986 [0,1,0,0,0,0|2,0,1]=4 3948 B15R0.81 COC(=O)CCCCCCSCCSC#N 62a_100009815986_100000034367 [0,1,0,0,0,0|2,0,1]=4 3949 B15R0.81 COC(=O)CCCCCNCCCCCO 2230a_100000762737_100009816466 [0,1,0,0,0,0|1,0,0]=2 3950 B15R0.81 COC(=O)CCCCCNCCCCCO 34a_100000762737_100009816466 [0,1,0,0,0,0|1,0,0]=2 3951 B15R0.81 COC(=O)CCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100009816466 [0,1,0,0,0,0|3,0,0]=4 3952 B15R0.81 COC(=O)CCCCCNCCOCCO 2230a_100000211614_100009816466 [0,1,0,0,0,0|2,0,0]=3 3953 B15R0.81 COC(=O)CCCCCNCCOCCO 34a_100000211614_100009816466 [0,1,0,0,0,0|2,0,0]=3 3954 B15R0.81 COC(=O)CCCCCNCCSCCO 2230a_100011219999_100009816466 [0,1,0,0,0,0|2,0,0]=3 3955 B15R0.81 COC(=O)CCCCCOCCCCC#N 7a_100000074720_100000211819 [0,1,0,0,0,0|1,0,1]=3 3956 B15R0.81 COC(=O)CCCCCOCCCCC=O 7a_100000074720_100000139335 [0,1,0,0,0,0|1,0,1]=3 3957 B15R0.81 COC(=O)CCCCCOCCCCCBr 34a_100000746331_100009816466 [0,1,0,0,0,0|1,0,0]=2 3958 B15R0.81 COC(=O)CCCCCOCCCCCBr 7a_100000746331_100009816466 [0,1,0,0,0,0|1,0,0]=2 3959 B15R0.81 COC(=O)CCCCCOCCCCCCl 34a_100000746330_100009816466 [0,1,0,0,0,0|1,0,0]=2 3960 B15R0.81 COC(=O)CCCCCOCCCCCCl 7a_100000746330_100009816466 [0,1,0,0,0,0|1,0,0]=2 3961 B15R0.81 COC(=O)CCCCCOCCCCCF 34a_100000074720_100000729378 [0,1,0,0,0,0|1,0,0]=2 3962 B15R0.81 COC(=O)CCCCCOCCCCCF 7a_100000074720_100000729378 [0,1,0,0,0,0|1,0,0]=2 3963 B15R0.81 COC(=O)CCCCCOCCCCCI 34a_200012148887_100009816466 [0,1,0,0,0,0|1,0,0]=2 3964 B15R0.81 COC(=O)CCCCCOCCCCCI 7a_200012148887_100009816466 [0,1,0,0,0,0|1,0,0]=2 3965 B15R0.81 COC(=O)CCCCCOCCCCCN 34a_100000762737_100009816466 [0,1,0,0,0,0|1,0,0]=2 3966 B15R0.81 COC(=O)CCCCCOCCCCCO 34a_100000074720_100000746330 [0,1,0,0,0,0|1,0,0]=2 3967 B15R0.81 COC(=O)CCCCCOCCCCCO 7a_100000074720_100000746330 [0,1,0,0,0,0|1,0,0]=2 3968 B15R0.81 COC(=O)CCCCCOCCCCSC 34a_100011217163_100009816466 [0,1,0,0,0,0|1,0,0]=2 3969 B15R0.81 COC(=O)CCCCCOCCCCSC 7a_100011217163_100009816466 [0,1,0,0,0,0|1,0,0]=2 3970 B15R0.81 COC(=O)CCCCCOCCOCC#N 7a_100000074720_200000047693 [0,1,0,0,0,0|2,0,1]=4 3971 B15R0.81 COC(=O)CCCCCOCCOCCBr 34a_100000692535_100009816466 [0,1,0,0,0,0|2,0,0]=3 3972 B15R0.81 COC(=O)CCCCCOCCOCCBr 7a_100000692535_100009816466 [0,1,0,0,0,0|2,0,0]=3 3973 B15R0.81 COC(=O)CCCCCOCCOCCCl 34a_100011215305_100009816466 [0,1,0,0,0,0|2,0,0]=3 3974 B15R0.81 COC(=O)CCCCCOCCOCCCl 7a_100011215305_100009816466 [0,1,0,0,0,0|2,0,0]=3 3975 B15R0.81 COC(=O)CCCCCOCCOCCF 34a_200015357709_100009816466 [0,1,0,0,0,0|2,0,0]=3 3976 B15R0.81 COC(=O)CCCCCOCCOCCF 7a_200015357709_100009816466 [0,1,0,0,0,0|2,0,0]=3 3977 B15R0.81 COC(=O)CCCCCOCCOCCI 34a_100012149058_100009816466 [0,1,0,0,0,0|2,0,0]=3 3978 B15R0.81 COC(=O)CCCCCOCCOCCI 7a_100012149058_100009816466 [0,1,0,0,0,0|2,0,0]=3 3979 B15R0.81 COC(=O)CCCCCOCCOCCN 34a_100000211614_100009816466 [0,1,0,0,0,0|2,0,0]=3 3980 B15R0.81 COC(=O)CCCCCOCCOCCO 34a_100000074720_100000692535 [0,1,0,0,0,0|2,0,0]=3 3981 B15R0.81 COC(=O)CCCCCOCCOCCO 7a_100000074720_100011215305 [0,1,0,0,0,0|2,0,0]=3 3982 B15R0.81 COC(=O)CCCCCSCCCCC#N 62a_100009816466_100000211819 [0,1,0,0,0,0|1,0,1]=3 3983 B15R0.81 COC(=O)CCCCCSCCCCC#N 62a_100011219923_100009816466 [0,1,0,0,0,0|1,0,1]=3 3984 B15R0.81 COC(=O)CCCCCSCCCCC=O 62a_100000139335_100009816466 [0,1,0,0,0,0|1,0,1]=3 3985 B15R0.81 COC(=O)CCCCCSCCCCC=O 62a_100009816466_100000139335 [0,1,0,0,0,0|1,0,1]=3 3986 B15R0.81 COC(=O)CCCCCSCCCCCF 62a_100000729378_100009816466 [0,1,0,0,0,0|1,0,0]=2 3987 B15R0.81 COC(=O)CCCCCSCCCCCF 62a_100009816466_100000729378 [0,1,0,0,0,0|1,0,0]=2 3988 B15R0.81 COC(=O)CCCCCSCCCCCO 62a_100000746330_100009816466 [0,1,0,0,0,0|1,0,0]=2 3989 B15R0.81 COC(=O)CCCCCSCCCCCO 62a_100009816466_100000746330 [0,1,0,0,0,0|1,0,0]=2 3990 B15R0.81 COC(=O)CCCCCSCCOCC#N 62a_100009816466_200000047693 [0,1,0,0,0,0|2,0,1]=4 3991 B15R0.81 COC(=O)CCCCCSCCOCC#N 62a_200000047693_100009816466 [0,1,0,0,0,0|2,0,1]=4 3992 B15R0.81 COC(=O)CCCCCSCCOCCO 62a_100009816466_100011215305 [0,1,0,0,0,0|2,0,0]=3 3993 B15R0.81 COC(=O)CCCCCSCCOCCO 62a_100011215305_100009816466 [0,1,0,0,0,0|2,0,0]=3 3994 B15R0.81 COC(=O)CCCCNCCCCCCO 2230a_100000686447_100000204269 [0,1,0,0,0,0|1,0,0]=2 3995 B15R0.81 COC(=O)CCCCNCCCCCCO 34a_100000686447_100000204269 [0,1,0,0,0,0|1,0,0]=2 3996 B15R0.81 COC(=O)CCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000204269 [0,1,0,0,0,0|3,0,0]=4 3997 B15R0.81 COC(=O)CCCCOCCCCCC#N 7a_100000059025_100009813376 [0,1,0,0,0,0|1,0,1]=3 3998 B15R0.81 COC(=O)CCCCOCCCCCC=O 7a_100000059025_100000139337 [0,1,0,0,0,0|1,0,1]=3 3999 B15R0.81 COC(=O)CCCCOCCCCCCBr 34a_100011215345_100000204269 [0,1,0,0,0,0|1,0,0]=2 4000 B15R0.81 COC(=O)CCCCOCCCCCCBr 7a_100011215345_100000204269 [0,1,0,0,0,0|1,0,0]=2 4001 B15R0.81 COC(=O)CCCCOCCCCCCCl 34a_100000766143_100000204269 [0,1,0,0,0,0|1,0,0]=2 4002 B15R0.81 COC(=O)CCCCOCCCCCCCl 7a_100000766143_100000204269 [0,1,0,0,0,0|1,0,0]=2 4003 B15R0.81 COC(=O)CCCCOCCCCCCF 34a_100000059025_100015922095 [0,1,0,0,0,0|1,0,0]=2 4004 B15R0.81 COC(=O)CCCCOCCCCCCF 34a_100000732779_100000204269 [0,1,0,0,0,0|1,0,0]=2 4005 B15R0.81 COC(=O)CCCCOCCCCCCF 7a_100000059025_100015922095 [0,1,0,0,0,0|1,0,0]=2 4006 B15R0.81 COC(=O)CCCCOCCCCCCF 7a_100000732779_100000204269 [0,1,0,0,0,0|1,0,0]=2 4007 B15R0.81 COC(=O)CCCCOCCCCCCN 34a_100000686447_100000204269 [0,1,0,0,0,0|1,0,0]=2 4008 B15R0.81 COC(=O)CCCCOCCCCCCO 34a_100000059025_100000766143 [0,1,0,0,0,0|1,0,0]=2 4009 B15R0.81 COC(=O)CCCCOCCCCCCO 7a_100000059025_100000766143 [0,1,0,0,0,0|1,0,0]=2 4010 B15R0.81 COC(=O)CCCCSCCCCCC#N 62a_100000204269_100009813376 [0,1,0,0,0,0|1,0,1]=3 4011 B15R0.81 COC(=O)CCCCSCCCCCC#N 62a_100009813376_100000204269 [0,1,0,0,0,0|1,0,1]=3 4012 B15R0.81 COC(=O)CCCCSCCCCCC=O 62a_100000139337_100000204269 [0,1,0,0,0,0|1,0,1]=3 4013 B15R0.81 COC(=O)CCCCSCCCCCC=O 62a_100000204269_100000139337 [0,1,0,0,0,0|1,0,1]=3 4014 B15R0.81 COC(=O)CCCCSCCCCCCF 62a_100000204269_100015922095 [0,1,0,0,0,0|1,0,0]=2 4015 B15R0.81 COC(=O)CCCCSCCCCCCF 62a_100015922095_100000204269 [0,1,0,0,0,0|1,0,0]=2 4016 B15R0.81 COC(=O)CCCCSCCCCCCO 62a_100000204269_100000766143 [0,1,0,0,0,0|1,0,0]=2 4017 B15R0.81 COC(=O)CCCCSCCCCCCO 62a_100000766143_100000204269 [0,1,0,0,0,0|1,0,0]=2 4018 B15R0.81 COC(=O)CCCNCCCCCCCO 2230a_100011996573_100011218270 [0,1,0,0,0,0|1,0,0]=2 4019 B15R0.81 COC(=O)CCCNCCCCCCCO 34a_100011996573_100000742333 [0,1,0,0,0,0|1,0,0]=2 4020 B15R0.81 COC(=O)CCCNCCCOCCCO 2230a_100011310245_100011218270 [0,1,0,0,0,0|2,0,0]=3 4021 B15R0.81 COC(=O)CCCNCCCOCCCO 34a_100011310245_100000742333 [0,1,0,0,0,0|2,0,0]=3 4022 B15R0.81 COC(=O)CCCOCCCCCCCBr 34a_100000760002_100000742333 [0,1,0,0,0,0|1,0,0]=2 4023 B15R0.81 COC(=O)CCCOCCCCCCCBr 7a_100000760002_100011218270 [0,1,0,0,0,0|1,0,0]=2 4024 B15R0.81 COC(=O)CCCOCCCCCCCN 34a_100011996573_100000742333 [0,1,0,0,0,0|1,0,0]=2 4025 B15R0.81 COC(=O)CCCOCCCOCCCN 34a_100011310245_100000742333 [0,1,0,0,0,0|2,0,0]=3 4026 B15R0.81 COC(=O)CCCSCCCCCCC#N 62a_100009813337_100011218270 [0,1,0,0,0,0|1,0,1]=3 4027 B15R0.81 COC(=O)CCCSCCCCCCC#N 62a_100011218270_100009813337 [0,1,0,0,0,0|1,0,1]=3 4028 B15R0.81 COC(=O)CCCSCCCCCCCO 62a_100000760002_100011218270 [0,1,0,0,0,0|1,0,0]=2 4029 B15R0.81 COC(=O)CCCSCCCCCCCO 62a_100011218270_100000760002 [0,1,0,0,0,0|1,0,0]=2 4030 B15R0.81 COC(=O)CCNCCCCCCCCO 2230a_102515433106_100000204255 [0,1,0,0,0,0|1,0,0]=2 4031 B15R0.81 COC(=O)CCNCCCCCCCCO 34a_102515433106_100000742370 [0,1,0,0,0,0|1,0,0]=2 4032 B15R0.81 COC(=O)CCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000204255 [0,1,0,0,0,0|3,0,0]=4 4033 B15R0.81 COC(=O)CCNCCOCCOCCO 2230a_100011998139_100000204255 [0,1,0,0,0,0|3,0,0]=4 4034 B15R0.81 COC(=O)CCNCCOCCOCCO 34a_100011998139_100000742370 [0,1,0,0,0,0|3,0,0]=4 4035 B15R0.81 COC(=O)CCOCCCCCCCCBr 34a_100009813846_100000742370 [0,1,0,0,0,0|1,0,0]=2 4036 B15R0.81 COC(=O)CCOCCCCCCCCBr 7a_100009813846_100000204255 [0,1,0,0,0,0|1,0,0]=2 4037 B15R0.81 COC(=O)CCOCCCCCCCCCl 34a_100000033203_100000742370 [0,1,0,0,0,0|1,0,0]=2 4038 B15R0.81 COC(=O)CCOCCCCCCCCCl 7a_100000033203_100000204255 [0,1,0,0,0,0|1,0,0]=2 4039 B15R0.81 COC(=O)CCOCCCCCCCCN 34a_102515433106_100000742370 [0,1,0,0,0,0|1,0,0]=2 4040 B15R0.81 COC(=O)CCOCCCCCNCCN 34a_103619048469_100000742370 [0,1,0,0,0,0|2,0,0]=3 4041 B15R0.81 COC(=O)CCOCCOCCOCCBr 34a_100010132937_100000742370 [0,1,0,0,0,0|3,0,0]=4 4042 B15R0.81 COC(=O)CCOCCOCCOCCBr 7a_100010132937_100000204255 [0,1,0,0,0,0|3,0,0]=4 4043 B15R0.81 COC(=O)CCOCCOCCOCCCl 34a_100000032323_100000742370 [0,1,0,0,0,0|3,0,0]=4 4044 B15R0.81 COC(=O)CCOCCOCCOCCCl 7a_100000032323_100000204255 [0,1,0,0,0,0|3,0,0]=4 4045 B15R0.81 COC(=O)CCOCCOCCOCCF 34a_100010982084_100011217306 [0,1,0,0,0,0|3,0,0]=4 4046 B15R0.81 COC(=O)CCOCCOCCOCCF 7a_100010982084_100011217306 [0,1,0,0,0,0|3,0,0]=4 4047 B15R0.81 COC(=O)CCOCCOCCOCCN 34a_100011998139_100000742370 [0,1,0,0,0,0|3,0,0]=4 4048 B15R0.81 COC(=O)CCOCCOCCOCCO 34a_100010982084_100000211926 [0,1,0,0,0,0|3,0,0]=4 4049 B15R0.81 COC(=O)CCOCCOCCOCCO 7a_100010982084_100000211926 [0,1,0,0,0,0|3,0,0]=4 4050 B15R0.81 COC(=O)CCOCCOCCOCSC 34a_100010982084_100011218213 [0,1,0,0,0,0|3,0,0]=4 4051 B15R0.81 COC(=O)CCSCCCCCCCCO 62a_100000033203_100000204255 [0,1,0,0,0,0|1,0,0]=2 4052 B15R0.81 COC(=O)CCSCCCCCCCCO 62a_100000204255_100000033203 [0,1,0,0,0,0|1,0,0]=2 4053 B15R0.81 COC(=O)CCSCCOCCOCCO 62a_100000032323_100000204255 [0,1,0,0,0,0|3,0,0]=4 4054 B15R0.81 COC(=O)CCSCCOCCOCCO 62a_100000204255_100000032323 [0,1,0,0,0,0|3,0,0]=4 4055 B15R0.81 COC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747449 [0,1,0,0,0,0|1,0,0]=2 4056 B15R0.81 COC(=O)CNCCCCCCCCCO 34a_100000078944_100000747449 [0,1,0,0,0,0|1,0,0]=2 4057 B15R0.81 COC(=O)CNCCCOCCOCCO 2230a_100011996194_100000747449 [0,1,0,0,0,0|3,0,0]=4 4058 B15R0.81 COC(=O)CNCCCOCCOCCO 34a_100011996194_100000747449 [0,1,0,0,0,0|3,0,0]=4 4059 B15R0.81 COC(=O)COCCCCCCCCCBr 34a_100009813782_100000747449 [0,1,0,0,0,0|1,0,0]=2 4060 B15R0.81 COC(=O)COCCCCCCCCCBr 7a_100009813782_100000747449 [0,1,0,0,0,0|1,0,0]=2 4061 B15R0.81 COC(=O)COCCCCCCCCCCl 34a_100009868337_100000747449 [0,1,0,0,0,0|1,0,0]=2 4062 B15R0.81 COC(=O)COCCCCCCCCCCl 7a_100009868337_100000747449 [0,1,0,0,0,0|1,0,0]=2 4063 B15R0.81 COC(=O)COCCCCCCCCCN 34a_100000078944_100000747449 [0,1,0,0,0,0|1,0,0]=2 4064 B15R0.81 COC(=O)COCCNCCCCCCO 2230a_100000686447_100000090808 [0,1,0,0,0,0|2,0,0]=3 4065 B15R0.81 COC(=O)COCCNCCCCCCO 34a_100000686447_100000090808 [0,1,0,0,0,0|2,0,0]=3 4066 B15R0.81 COC(=O)COCCOCCCCCCBr 34a_100011215345_100000090808 [0,1,0,0,0,0|2,0,0]=3 4067 B15R0.81 COC(=O)COCCOCCCCCCBr 7a_100011215345_100000090808 [0,1,0,0,0,0|2,0,0]=3 4068 B15R0.81 COC(=O)COCCOCCCCCCCl 34a_100000766143_100000090808 [0,1,0,0,0,0|2,0,0]=3 4069 B15R0.81 COC(=O)COCCOCCCCCCCl 7a_100000766143_100000090808 [0,1,0,0,0,0|2,0,0]=3 4070 B15R0.81 COC(=O)COCCOCCCCCCF 34a_100000732779_100000090808 [0,1,0,0,0,0|2,0,0]=3 4071 B15R0.81 COC(=O)COCCOCCCCCCF 7a_100000732779_100000090808 [0,1,0,0,0,0|2,0,0]=3 4072 B15R0.81 COC(=O)COCCOCCCCCCN 34a_100000686447_100000090808 [0,1,0,0,0,0|2,0,0]=3 4073 B15R0.81 COC(=O)COCCOCCOCCCF 34a_100011023656_100011934791 [0,1,0,0,0,0|3,0,0]=4 4074 B15R0.81 COC(=O)COCCOCCOCCCF 7a_100011023656_100011934791 [0,1,0,0,0,0|3,0,0]=4 4075 B15R0.81 COC(=O)COCCOCCOCCCN 34a_100011996194_100000747449 [0,1,0,0,0,0|3,0,0]=4 4076 B15R0.81 COC(=O)COCCOCCOCCCO 34a_100011023656_100000230001 [0,1,0,0,0,0|3,0,0]=4 4077 B15R0.81 COC(=O)COCCOCCOCCCO 7a_100011023656_100011215043 [0,1,0,0,0,0|3,0,0]=4 4078 B15R0.81 COC(=O)COCCOCCOCCSC 34a_100011023656_100000212216 [0,1,0,0,0,0|3,0,0]=4 4079 B15R0.81 COC(=O)COCCOCCOCCSC 7a_100011023656_100000212216 [0,1,0,0,0,0|3,0,0]=4 4080 B15R0.81 COC(=O)COCCSCCCCCC#N 62a_100000090808_100009813376 [0,1,0,0,0,0|2,0,1]=4 4081 B15R0.81 COC(=O)COCCSCCCCCC#N 62a_100009813376_100000090808 [0,1,0,0,0,0|2,0,1]=4 4082 B15R0.81 COC(=O)COCCSCCCCCC=O 62a_100000090808_100000139337 [0,1,0,0,0,0|2,0,1]=4 4083 B15R0.81 COC(=O)COCCSCCCCCC=O 62a_100000139337_100000090808 [0,1,0,0,0,0|2,0,1]=4 4084 B15R0.81 COC(=O)COCCSCCCCCCF 62a_100000090808_100015922095 [0,1,0,0,0,0|2,0,0]=3 4085 B15R0.81 COC(=O)COCCSCCCCCCF 62a_100015922095_100000090808 [0,1,0,0,0,0|2,0,0]=3 4086 B15R0.81 COC(=O)COCCSCCCCCCO 62a_100000090808_100000766143 [0,1,0,0,0,0|2,0,0]=3 4087 B15R0.81 COC(=O)COCCSCCCCCCO 62a_100000766143_100000090808 [0,1,0,0,0,0|2,0,0]=3 4088 B15R0.81 COC(=O)CSCCCCCCCCCO 62a_100000747449_100009813782 [0,1,0,0,0,0|1,0,0]=2 4089 B15R0.81 COC(=O)CSCCCCCCCCCO 62a_100009813782_100000747449 [0,1,0,0,0,0|1,0,0]=2 4090 B15R0.81 COC(=O)NCCOCCCCCCCO 34a_100000757965_100000760002 [0,1,0,0,0,0|2,0,0]=3 4091 B15R0.81 COC(=O)OCCOCCCCCCCO 34a_100010262106_100000760002 [0,1,0,0,0,0|2,0,0]=3 4092 B15R0.81 COC(=O)OCSCCCCCCCCO 62a_100000033203_100000139417 [0,1,0,0,0,0|2,0,0]=3 4093 B15R0.81 COC(C)CCOCCCCCCCCO 7a_100000764861_100000033203 [0,1,0,0,0,0|2,0,1]=4 4094 B15R0.81 COC(C)COCCCCCCCCCO 34a_100000690652_100009813782 [0,1,0,0,0,0|2,0,1]=4 4095 B15R0.81 COC(C)SCCCCCCCCCCO 62a_100009813290_100009879195 [0,1,0,0,0,0|2,0,1]=4 4096 B15R0.81 COC(C)SCCCCCCCCCCO 62a_100009879195_200000033068 [0,1,0,0,0,0|2,0,1]=4 4097 B15R0.81 COCCCCCCCCCCC(=O)OC 34a_100011003013_200000210301 [0,1,0,0,0,0|0,0,0]=1 4098 B15R0.81 COCCCCCCCCCCC(=O)OC 34a_100138415774_100009812566 [0,1,0,0,0,0|0,0,0]=1 4099 B15R0.81 COCCCCCCCCCCC(=O)OC 7a_100011003013_200000210301 [0,1,0,0,0,0|0,0,0]=1 4100 B15R0.81 COCCCCCCOC/C=C/C(=O)OC 34a_200012092642_100000742655 [0,1,0,0,0,0|1,0,2]=4 4101 B15R0.81 COCCCCCCOC/C=C/C(=O)OC 7a_200012092642_100000742655 [0,1,0,0,0,0|1,0,2]=4 4102 B15R0.81 COCCCCCCOCCCC(=O)NN 34a_100000211488_100011998445 [0,1,0,0,0,0|3,0,0]=4 4103 B15R0.81 COCCCCCCOCCCC(=O)OC 34a_200012092642_100000742333 [0,1,0,0,0,0|1,0,0]=2 4104 B15R0.81 COCCCCCCOCCCC(=O)OC 7a_200012092642_100011218270 [0,1,0,0,0,0|1,0,0]=2 4105 B15R0.81 COCCCCCCOCCNC(=O)OC 34a_100000757965_100011998445 [0,1,0,0,0,0|2,0,0]=3 4106 B15R0.81 COCCCCCCOCCOC(=O)OC 34a_100010262106_100011998445 [0,1,0,0,0,0|2,0,0]=3 4107 B15R0.81 COCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100011998445 [0,1,0,0,0,0|1,0,2]=4 4108 B15R0.81 COCCCCCCSC/C=C/C(=O)OC 62a_100011998445_100000742655 [0,1,0,0,0,0|1,0,2]=4 4109 B15R0.81 COCCCCCCSCCCC(=O)OC 62a_100011218270_100011998445 [0,1,0,0,0,0|1,0,0]=2 4110 B15R0.81 COCCCCCCSCCCC(=O)OC 62a_100011998445_100011218270 [0,1,0,0,0,0|1,0,0]=2 4111 B15R0.81 COCCCCCNCCCCC(=O)OC 2230a_100000747528_100000204269 [0,1,0,0,0,0|1,0,0]=2 4112 B15R0.81 COCCCCCNCCCCC(=O)OC 34a_100000747528_100000204269 [0,1,0,0,0,0|1,0,0]=2 4113 B15R0.81 COCCCCCNCCOCC(=O)OC 2230a_100000747528_100000090808 [0,1,0,0,0,0|2,0,0]=3 4114 B15R0.81 COCCCCCNCCOCC(=O)OC 34a_100000747528_100000090808 [0,1,0,0,0,0|2,0,0]=3 4115 B15R0.81 COCCCCOCCCCCC(=O)OC 34a_100000074720_100000755781 [0,1,0,0,0,0|1,0,0]=2 4116 B15R0.81 COCCCCOCCCCCC(=O)OC 34a_100000740925_100009816466 [0,1,0,0,0,0|1,0,0]=2 4117 B15R0.81 COCCCCOCCCCCC(=O)OC 7a_100000074720_100000730899 [0,1,0,0,0,0|1,0,0]=2 4118 B15R0.81 COCCCCSCCCCCC(=O)OC 62a_100000730899_100009816466 [0,1,0,0,0,0|1,0,0]=2 4119 B15R0.81 COCCCCSCCCCCC(=O)OC 62a_100009816466_100000730899 [0,1,0,0,0,0|1,0,0]=2 4120 B15R0.81 COCCCNCCCCCCC(=O)OC 34a_100150723488_100009815986 [0,1,0,0,0,0|1,0,0]=2 4121 B15R0.81 COCCCOCCCCCCC(=O)OC 34a_100000740835_100009815986 [0,1,0,0,0,0|1,0,0]=2 4122 B15R0.81 COCCCOCCCCCCC(=O)OC 34a_100009863599_100000740836 [0,1,0,0,0,0|1,0,0]=2 4123 B15R0.81 COCCCOCCCCCCC(=O)OC 7a_100009863599_100000740836 [0,1,0,0,0,0|1,0,0]=2 4124 B15R0.81 COCCCOCCCOCCC(=O)OC 34a_200011215475_100000742370 [0,1,0,0,0,0|2,0,0]=3 4125 B15R0.81 COCCCOCCCOCCC(=O)OC 7a_200011215475_100000204255 [0,1,0,0,0,0|2,0,0]=3 4126 B15R0.81 COCCCSCCCCCCC(=O)OC 62a_100000709357_100009815986 [0,1,0,0,0,0|1,0,0]=2 4127 B15R0.81 COCCCSCCCCCCC(=O)OC 62a_100009815986_100000709357 [0,1,0,0,0,0|1,0,0]=2 4128 B15R0.81 COCCNCCCCCCCC(=O)OC 2230a_100000209980_100010004213 [0,1,0,0,0,0|1,0,0]=2 4129 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100000210237_100010004213 [0,1,0,0,0,0|1,0,0]=2 4130 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100011022521_100011201679 [0,1,0,0,0,0|1,0,0]=2 4131 B15R0.81 COCCOCCCCCCCC(=O)OC 7a_100011022521_100000233755 [0,1,0,0,0,0|1,0,0]=2 4132 B15R0.81 COCCOCCCNCCCC(=O)OC 2230a_100000206027_100011218270 [0,1,0,0,0,0|2,0,0]=3 4133 B15R0.81 COCCOCCCNCCCC(=O)OC 34a_100000206027_100000742333 [0,1,0,0,0,0|2,0,0]=3 4134 B15R0.81 COCCOCCCOCCNC(=O)OC 34a_100000757965_100011216529 [0,1,0,0,0,0|3,0,0]=4 4135 B15R0.81 COCCOCCCOCCOC(=O)OC 34a_100010262106_100011216529 [0,1,0,0,0,0|3,0,0]=4 4136 B15R0.81 COCCOCCCSCCCC(=O)OC 62a_100011216529_100011218270 [0,1,0,0,0,0|2,0,0]=3 4137 B15R0.81 COCCOCCCSCCCC(=O)OC 62a_100011218270_100011216529 [0,1,0,0,0,0|2,0,0]=3 4138 B15R0.81 COCCOCCNCCCCC(=O)OC 2230a_100000745349_100000204269 [0,1,0,0,0,0|2,0,0]=3 4139 B15R0.81 COCCOCCNCCCCC(=O)OC 34a_100000745349_100000204269 [0,1,0,0,0,0|2,0,0]=3 4140 B15R0.81 COCCOCCNCCOCC(=O)OC 2230a_100000745349_100000090808 [0,1,0,0,0,0|3,0,0]=4 4141 B15R0.81 COCCOCCNCCOCC(=O)OC 34a_100000745349_100000090808 [0,1,0,0,0,0|3,0,0]=4 4142 B15R0.81 COCCOCCOCCCCC(=O)OC 34a_100000059025_100000695917 [0,1,0,0,0,0|2,0,0]=3 4143 B15R0.81 COCCOCCOCCCCC(=O)OC 34a_100011215163_100000204269 [0,1,0,0,0,0|2,0,0]=3 4144 B15R0.81 COCCOCCOCCCCC(=O)OC 7a_100000059025_100000695917 [0,1,0,0,0,0|2,0,0]=3 4145 B15R0.81 COCCOCCOCCCCC(=O)OC 7a_100011215163_100000204269 [0,1,0,0,0,0|2,0,0]=3 4146 B15R0.81 COCCOCCOCCNCC(=O)OC 2230a_100012028300_100000747449 [0,1,0,0,0,0|3,0,0]=4 4147 B15R0.81 COCCOCCOCCNCC(=O)OC 34a_100012028300_100000747449 [0,1,0,0,0,0|3,0,0]=4 4148 B15R0.81 COCCOCCOCCOCC(=O)OC 34a_100000688194_100000747449 [0,1,0,0,0,0|3,0,0]=4 4149 B15R0.81 COCCOCCOCCOCC(=O)OC 34a_100011023656_100011201679 [0,1,0,0,0,0|3,0,0]=4 4150 B15R0.81 COCCOCCOCCOCC(=O)OC 34a_100011215163_100000090808 [0,1,0,0,0,0|3,0,0]=4 4151 B15R0.81 COCCOCCOCCOCC(=O)OC 7a_100000688194_100000747449 [0,1,0,0,0,0|3,0,0]=4 4152 B15R0.81 COCCOCCOCCOCC(=O)OC 7a_100011023656_100000233755 [0,1,0,0,0,0|3,0,0]=4 4153 B15R0.81 COCCOCCOCCOCC(=O)OC 7a_100011215163_100000090808 [0,1,0,0,0,0|3,0,0]=4 4154 B15R0.81 COCCOCCOCCSCC(=O)OC 62a_100000747449_100013367474 [0,1,0,0,0,0|3,0,0]=4 4155 B15R0.81 COCCOCCOCCSCC(=O)OC 62a_100013367474_100000747449 [0,1,0,0,0,0|3,0,0]=4 4156 B15R0.81 COCCOCCSCCCCC(=O)OC 62a_100000204269_100000695917 [0,1,0,0,0,0|2,0,0]=3 4157 B15R0.81 COCCOCCSCCCCC(=O)OC 62a_100000695917_100000204269 [0,1,0,0,0,0|2,0,0]=3 4158 B15R0.81 COCCOCCSCCOCC(=O)OC 62a_100000090808_100000695917 [0,1,0,0,0,0|3,0,0]=4 4159 B15R0.81 COCCOCCSCCOCC(=O)OC 62a_100000695917_100000090808 [0,1,0,0,0,0|3,0,0]=4 4160 B15R0.81 COCCOCSCCCCCC(=O)OC 62a_100000231047_100009816466 [0,1,0,0,0,0|2,0,0]=3 4161 B15R0.81 COCCOCSCCCCCC(=O)OC 62a_100009816466_100000231047 [0,1,0,0,0,0|2,0,0]=3 4162 B15R0.81 COCCSCCCCCCCC(=O)OC 62a_100000233755_100010004213 [0,1,0,0,0,0|1,0,0]=2 4163 B15R0.81 COCCSCCCCCCCC(=O)OC 62a_100010004213_100000233755 [0,1,0,0,0,0|1,0,0]=2 4164 B15R0.81 COCSCCCCCCCCC(=O)OC 62a_100000766300_100010282707 [0,1,0,0,0,0|1,0,0]=2 4165 B15R0.81 COCSCCCCCCCCC(=O)OC 62a_100010282707_100000766300 [0,1,0,0,0,0|1,0,0]=2 4166 B15R0.81 CO[C@H](C)CNCCCCCCCCCO 2230a_100020591295_100009813782 [0,1,0,0,0,0|2,0,1]=4 4167 B15R0.81 NNC(=O)CCCOCCCCCCCO 34a_100000211488_100000760002 [0,1,0,0,0,0|3,0,0]=4 4168 B15R0.81 O=C(CO)CCCCCCCCCCCO 1458a_100000210174_100009812471 [0,1,0,0,0,0|2,0,0]=3 4169 B15R0.81 O=C(CO)NCCCCCCCCCCO 240690a_100000066964_100000210174 [0,1,0,0,0,0|3,0,0]=4 4170 B15R0.84 C=C(Br)C(=O)NCCCCCCCCCC 11a_100000684558_100009813364 [0,1,0,0,0,0|2,0,1]=4 4171 B15R0.84 C=C(Br)C(=O)NCCCCCCCCCC 1626a_100000684558_100009813364 [0,1,0,0,0,0|2,0,1]=4 4172 B15R0.84 C=C(C)C(=O)CCCCCCCCCCC 1458a_100000185857_100011215454 [0,1,0,0,0,0|1,0,0]=2 4173 B15R0.84 C=C(C)C(=O)CCCCCCCCCCO 1458a_100000185857_100009813290 [0,1,0,0,0,0|2,0,0]=3 4174 B15R0.84 C=C(C)C(=O)NCCCCCCCCCC 11a_100000684558_100000185857 [0,1,0,0,0,0|2,0,0]=3 4175 B15R0.84 C=C(C)C(=O)NCCCCCCCCCC 1626a_100000684558_100000185857 [0,1,0,0,0,0|2,0,0]=3 4176 B15R0.84 C=C(C)C(=O)NCCCNCCCCCC 2230a_100016987756_100000210314 [0,1,0,0,0,0|3,0,0]=4 4177 B15R0.84 C=C(C)C(=O)NCCNCCCCCCC 2230a_100102636416_100000210681 [0,1,0,0,0,0|3,0,0]=4 4178 B15R0.84 C=C(C)C(=O)OCCCCCCOCCC 34a_100000210258_200010402237 [0,1,0,0,0,0|3,0,0]=4 4179 B15R0.84 C=C(C)C(=O)OCCCCCCSCCC 62a_100000210303_200010402237 [0,1,0,0,0,0|3,0,0]=4 4180 B15R0.84 C=C(C)C(=O)OCCCCCCSCCC 62a_200010402237_100000210303 [0,1,0,0,0,0|3,0,0]=4 4181 B15R0.84 C=C(C)C(=O)OCCCCOCCCCC 7a_100000065474_100000210326 [0,1,0,0,0,0|3,0,0]=4 4182 B15R0.84 C=C(C)C(=O)OCCCOCCCCCC 7a_100000032641_100000210314 [0,1,0,0,0,0|3,0,0]=4 4183 B15R0.84 C=C(C)C(=O)OCCNCCCCCCC 2230a_100000229938_100009816335 [0,1,0,0,0,0|3,0,0]=4 4184 B15R0.84 C=C(C)C(=O)OCCOCCCCCCC 34a_100000210272_100009816335 [0,1,0,0,0,0|3,0,0]=4 4185 B15R0.84 C=C(C)C(=O)OCCOCCCCCCC 7a_100000210272_100009816335 [0,1,0,0,0,0|3,0,0]=4 4186 B15R0.84 C=C(C)C(=O)OCCSCCCCCCC 62a_100000210614_100009816335 [0,1,0,0,0,0|3,0,0]=4 4187 B15R0.84 C=C(C)C(=O)OCCSCCCCCCC 62a_100009816335_100000210316 [0,1,0,0,0,0|3,0,0]=4 4188 B15R0.84 C=C(Cl)C(=O)NCCCCCCCCCC 11a_100000684558_100000039160 [0,1,0,0,0,0|2,0,1]=4 4189 B15R0.84 C=C(Cl)C(=O)NCCCCCCCCCC 1626a_100000684558_100000039160 [0,1,0,0,0,0|2,0,1]=4 4190 B15R0.84 C=C(F)C(=O)NCCCCCCCCCC 11a_100000684558_100000036797 [0,1,0,0,0,0|2,0,1]=4 4191 B15R0.84 C=C(F)C(=O)NCCCCCCCCCC 1626a_100000684558_100000036797 [0,1,0,0,0,0|2,0,1]=4 4192 B15R0.84 C=CCCCCCCCCCC(=O)C(=C)C 1458a_100000185857_100009814027 [0,1,0,0,0,0|1,0,2]=4 4193 B15R0.84 C=CCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100009814027 [0,1,0,0,0,0|1,0,2]=4 4194 B15R0.84 C=CCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100009814027 [0,1,0,0,0,0|1,0,2]=4 4195 B15R0.84 C=CCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100009814027 [0,1,0,0,0,0|1,0,2]=4 4196 B15R0.84 C=CCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100009814027 [0,1,0,0,0,0|1,0,2]=4 4197 B15R0.84 CC(=O)C(=O)CNCCCCCCCCO 34a_102515433106_100011261029 [0,1,0,0,0,0|3,0,0]=4 4198 B15R0.84 CC(=O)C(=O)COCCCCCCCCBr 34a_100009813846_100011261029 [0,1,0,0,0,0|3,0,0]=4 4199 B15R0.84 CC(=O)C(=O)COCCCCCCCCCl 34a_100000033203_100011261029 [0,1,0,0,0,0|3,0,0]=4 4200 B15R0.84 CC(=O)C(=O)COCCCCCCCCN 34a_102515433106_100011261029 [0,1,0,0,0,0|3,0,0]=4 4201 B15R0.84 CC(=O)C(=O)CSCCCCCCCCO 62a_100000033203_100011261029 [0,1,0,0,0,0|3,0,0]=4 4202 B15R0.84 CC(=O)C(=O)CSCCCCCCCCO 62a_100011261029_100000033203 [0,1,0,0,0,0|3,0,0]=4 4203 B15R0.84 CC(C)C(=O)CCCCCCCCCCO 1458a_100000210198_100009813290 [0,1,0,0,0,0|2,0,0]=3 4204 B15R0.84 CC(C)C(=O)CNCCCCCCCCO 2230a_102515433106_100000753385 [0,1,0,0,0,0|3,0,0]=4 4205 B15R0.84 CC(C)C(=O)CNCCCCCCCCO 34a_102515433106_100000753385 [0,1,0,0,0,0|3,0,0]=4 4206 B15R0.84 CC(C)C(=O)COCCCCCCCCBr 34a_100009813846_100000753385 [0,1,0,0,0,0|3,0,0]=4 4207 B15R0.84 CC(C)C(=O)COCCCCCCCCBr 7a_100009813846_100000753385 [0,1,0,0,0,0|3,0,0]=4 4208 B15R0.84 CC(C)C(=O)COCCCCCCCCCl 34a_100000033203_100000753385 [0,1,0,0,0,0|3,0,0]=4 4209 B15R0.84 CC(C)C(=O)COCCCCCCCCCl 7a_100000033203_100000753385 [0,1,0,0,0,0|3,0,0]=4 4210 B15R0.84 CC(C)C(=O)COCCCCCCCCN 34a_102515433106_100000753385 [0,1,0,0,0,0|3,0,0]=4 4211 B15R0.84 CC(C)C(=O)CSCCCCCCCCO 62a_100000033203_100000753385 [0,1,0,0,0,0|3,0,0]=4 4212 B15R0.84 CC(C)C(=O)CSCCCCCCCCO 62a_100000753385_100000033203 [0,1,0,0,0,0|3,0,0]=4 4213 B15R0.84 CC(C)C(=O)NCCCCCCCCCO 240690a_100000078944_100000210198 [0,1,0,0,0,0|3,0,0]=4 4214 B15R0.84 CC(F)C(=O)CCCCCCCCCCO 1458a_100000062450_100009813290 [0,1,0,0,0,0|2,0,0]=3 4215 B15R0.84 CC(F)C(=O)NCCCCCCCCCO 240690a_100000078944_100000062450 [0,1,0,0,0,0|3,0,0]=4 4216 B15R0.84 CCCCCCCCCC=CC(=O)C(C)C 1458a_200015352897_100000210206 [0,1,0,0,0,0|1,0,2]=4 4217 B15R0.84 CCCCCCCCCC=CC(=O)N(C)C 11a_100102631434_200015352897 [0,1,0,0,0,0|1,0,2]=4 4218 B15R0.84 CCCCCCCCCC=CC(=O)N(C)C 1626a_100102631434_200015352897 [0,1,0,0,0,0|1,0,2]=4 4219 B15R0.84 CCCCCCCCCC=CC(=O)N(C)C 240690a_100102631434_200015352897 [0,1,0,0,0,0|1,0,2]=4 4220 B15R0.84 CCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100011215454 [0,1,0,0,0,0|1,0,0]=2 4221 B15R0.84 CCCCCCCCCCCC(=O)C(C)C 1458a_100000210736_100000210206 [0,1,0,0,0,0|1,0,0]=2 4222 B15R0.84 CCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100011215454 [0,1,0,0,0,0|1,0,0]=2 4223 B15R0.84 CCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100011215454 [0,1,0,0,0,0|2,0,0]=3 4224 B15R0.84 CCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100000210736 [0,1,0,0,0,0|1,0,0]=2 4225 B15R0.84 CCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100000210736 [0,1,0,0,0,0|1,0,0]=2 4226 B15R0.84 CCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100000210736 [0,1,0,0,0,0|1,0,0]=2 4227 B15R0.84 CCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100011215454 [0,1,0,0,0,0|1,0,0]=2 4228 B15R0.84 CCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100011215454 [0,1,0,0,0,0|1,0,0]=2 4229 B15R0.84 CCCCCCCCCCCC(C)N(C)C 270004a_100102631434_100011216755 [0,1,0,0,0,0|2,0,1]=4 4230 B15R0.84 CCCCCCCCCCCN(C)C(C)C 269982a_200000211004_100011215454 [0,1,0,0,0,0|3,0,0]=4 4231 B15R0.84 CCCCCCCCCCNC(=O)C(=O)N 240690a_100000684558_100011215815 [0,1,0,0,0,0|3,0,0]=4 4232 B15R0.84 CCCCCCCCCCNC(=O)C(C)C 11a_100000684558_100000210198 [0,1,0,0,0,0|2,0,0]=3 4233 B15R0.84 CCCCCCCCCCNC(=O)C(C)C 1626a_100000684558_100000210198 [0,1,0,0,0,0|2,0,0]=3 4234 B15R0.84 CCCCCCCCCCNC(=O)C(C)C 240690a_100000684558_100000210198 [0,1,0,0,0,0|2,0,0]=3 4235 B15R0.84 CCCCCCCCCCNC(=O)C(C)C 527a_100000684558_100000210198 [0,1,0,0,0,0|2,0,0]=3 4236 B15R0.84 CCCCCCCCCCNC(=O)C(C)F 11a_100000684558_100000062450 [0,1,0,0,0,0|2,0,0]=3 4237 B15R0.84 CCCCCCCCCCNC(=O)C(C)F 1626a_100000684558_100000062450 [0,1,0,0,0,0|2,0,0]=3 4238 B15R0.84 CCCCCCCCCCNC(=O)C(C)F 240690a_100000684558_100000062450 [0,1,0,0,0,0|2,0,0]=3 4239 B15R0.84 CCCCCCCCCCNC(=O)C(C)F 527a_100000684558_100000062450 [0,1,0,0,0,0|2,0,0]=3 4240 B15R0.84 CCCCCCCCCCNC(=O)C(F)F 11a_100000684558_100000210393 [0,1,0,0,0,0|3,0,0]=4 4241 B15R0.84 CCCCCCCCCCNC(=O)C(F)F 1626a_100000684558_100000210393 [0,1,0,0,0,0|3,0,0]=4 4242 B15R0.84 CCCCCCCCCCNC(=O)C(F)F 240690a_100000684558_100000210393 [0,1,0,0,0,0|3,0,0]=4 4243 B15R0.84 CCCCCCCCCCNC(=O)C(F)F 527a_100000684558_100000210393 [0,1,0,0,0,0|3,0,0]=4 4244 B15R0.84 CCCCCCCCCCNC(=O)C(O)O 240690a_100000684558_100000233687 [0,1,0,0,0,0|3,0,0]=4 4245 B15R0.84 CCCCCCCCCCNC(=O)N(C)C 2708a_100000684558_100102631434 [0,1,0,0,0,0|2,0,0]=3 4246 B15R0.84 CCCCCCCCCCNC(=O)[C@@H](C)O 240690a_100000684558_100000717761 [0,1,0,0,0,0|2,0,0]=3 4247 B15R0.84 CCCCCCCCCCNC(=O)[C@H](C)O 1626a_100000684558_217856618621 [0,1,0,0,0,0|2,0,0]=3 4248 B15R0.84 CCCCCCCCCCNC(=O)[C@H](C)O 240690a_100000684558_217856618621 [0,1,0,0,0,0|2,0,0]=3 4249 B15R0.84 CCCCCCCCCNCC(=O)C(=O)C 34a_100000212291_100011261029 [0,1,0,0,0,0|2,0,0]=3 4250 B15R0.84 CCCCCCCCCNCC(=O)C(C)C 2230a_100000212291_100000753385 [0,1,0,0,0,0|2,0,0]=3 4251 B15R0.84 CCCCCCCCCNCC(=O)C(C)C 34a_100000212291_100000753385 [0,1,0,0,0,0|2,0,0]=3 4252 B15R0.84 CCCCCCCCCNCC(=O)N(C)C 2230a_100000212291_100000185267 [0,1,0,0,0,0|2,0,0]=3 4253 B15R0.84 CCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100011214924 [0,1,0,0,0,0|2,0,0]=3 4254 B15R0.84 CCCCCCCCCNCC(=O)N(C)C 34a_100000212291_100000692301 [0,1,0,0,0,0|2,0,0]=3 4255 B15R0.84 CCCCCCCCCOCC(=O)C(=O)C 34a_100000210712_100011261029 [0,1,0,0,0,0|2,0,0]=3 4256 B15R0.84 CCCCCCCCCOCC(=O)C(C)C 34a_100000210712_100000753385 [0,1,0,0,0,0|2,0,0]=3 4257 B15R0.84 CCCCCCCCCOCC(=O)C(C)C 7a_100000210712_100000753385 [0,1,0,0,0,0|2,0,0]=3 4258 B15R0.84 CCCCCCCCCOCC(=O)N(C)C 34a_100000210712_100000692301 [0,1,0,0,0,0|2,0,0]=3 4259 B15R0.84 CCCCCCCCCOCC(=O)N(C)C 7a_100000210712_100000692301 [0,1,0,0,0,0|2,0,0]=3 4260 B15R0.84 CCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210670 [0,1,0,0,0,0|2,0,0]=3 4261 B15R0.84 CCCCCCCCCSCC(=O)C(C)C 62a_100000753385_100000210670 [0,1,0,0,0,0|2,0,0]=3 4262 B15R0.84 CCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100000210670 [0,1,0,0,0,0|2,0,0]=3 4263 B15R0.84 CCCCCCCCNCCC(=O)N(C)C 2230a_100000229939_100000737620 [0,1,0,0,0,0|2,0,0]=3 4264 B15R0.84 CCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100000210759 [0,1,0,0,0,0|2,0,0]=3 4265 B15R0.84 CCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100000210759 [0,1,0,0,0,0|2,0,0]=3 4266 B15R0.84 CCCCCCCCOCCC(=O)N(C)C 7a_100000210232_100000737620 [0,1,0,0,0,0|2,0,0]=3 4267 B15R0.84 CCCCCCCCSCCC(=O)N(C)C 62a_100000210759_100000737620 [0,1,0,0,0,0|2,0,0]=3 4268 B15R0.84 CCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210317 [0,1,0,0,0,0|2,0,0]=3 4269 B15R0.84 CCCCCCCCSCOC(=O)C(C)C 62a_100000139345_100000210317 [0,1,0,0,0,0|3,0,0]=4 4270 B15R0.84 CCCCCCCCSCOC(=O)C(C)C 62a_100000210759_100000139345 [0,1,0,0,0,0|3,0,0]=4 4271 B15R0.84 CCCCCCCNCCCC(=O)N(C)C 2230a_100000229938_100000737642 [0,1,0,0,0,0|2,0,0]=3 4272 B15R0.84 CCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210681 [0,1,0,0,0,0|2,0,0]=3 4273 B15R0.84 CCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100000210681 [0,1,0,0,0,0|3,0,0]=4 4274 B15R0.84 CCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100000210614 [0,1,0,0,0,0|3,0,0]=4 4275 B15R0.84 CCCCCCCOCCCC(=O)N(C)C 7a_100000210272_100000737642 [0,1,0,0,0,0|2,0,0]=3 4276 B15R0.84 CCCCCCCSCCCC(=O)N(C)C 62a_100000210614_100000737642 [0,1,0,0,0,0|2,0,0]=3 4277 B15R0.84 CCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210316 [0,1,0,0,0,0|2,0,0]=3 4278 B15R0.84 CCCCCCOCCCCC(=O)N(C)C 34a_100000210259_100000752486 [0,1,0,0,0,0|2,0,0]=3 4279 B15R0.84 CCCCCCOCCCCC(=O)N(C)C 7a_100000210259_100000752486 [0,1,0,0,0,0|2,0,0]=3 4280 B15R0.84 CCCCCCOCCOCC(=O)C(=O)C 34a_100000691444_100011261029 [0,1,0,0,0,0|3,0,0]=4 4281 B15R0.84 CCCCCCOCCOCC(=O)C(C)C 34a_100000691444_100000753385 [0,1,0,0,0,0|3,0,0]=4 4282 B15R0.84 CCCCCCOCCOCC(=O)C(C)C 7a_100000691444_100000753385 [0,1,0,0,0,0|3,0,0]=4 4283 B15R0.84 CCCCCCOCCOCC(=O)N(C)C 34a_100000691444_100000692301 [0,1,0,0,0,0|3,0,0]=4 4284 B15R0.84 CCCCCCOCCOCC(=O)N(C)C 7a_100000691444_100000692301 [0,1,0,0,0,0|3,0,0]=4 4285 B15R0.84 CCCCCCSCCCCC(=O)N(C)C 62a_100000210314_100000752486 [0,1,0,0,0,0|2,0,0]=3 4286 B15R0.84 CCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210757 [0,1,0,0,0,0|2,0,0]=3 4287 B15R0.84 CCCCCOCCOCCC(=O)N(C)C 7a_100011215259_100000737620 [0,1,0,0,0,0|3,0,0]=4 4288 B15R0.84 CCCCNCCCCOCC(=O)C(=O)C 34a_200011216965_100011261029 [0,1,0,0,0,0|3,0,0]=4 4289 B15R0.84 CCCCNCCCCOCC(=O)C(C)C 34a_200011216965_100000753385 [0,1,0,0,0,0|3,0,0]=4 4290 B15R0.84 CCCCNCCCCOCC(=O)N(C)C 34a_200011216965_100000692301 [0,1,0,0,0,0|3,0,0]=4 4291 B15R0.84 CCCCOCCCCOCC(=O)C(=O)C 34a_200000760531_100011261029 [0,1,0,0,0,0|3,0,0]=4 4292 B15R0.84 CCCCOCCCCOCC(=O)C(C)C 34a_200000760531_100000753385 [0,1,0,0,0,0|3,0,0]=4 4293 B15R0.84 CCCCOCCCCOCC(=O)C(C)C 7a_200000760531_100000753385 [0,1,0,0,0,0|3,0,0]=4 4294 B15R0.84 CCCCOCCCCOCC(=O)N(C)C 34a_200000760531_100000692301 [0,1,0,0,0,0|3,0,0]=4 4295 B15R0.84 CCCCOCCCCOCC(=O)N(C)C 7a_200000760531_100000692301 [0,1,0,0,0,0|3,0,0]=4 4296 B15R0.84 CCCCOCCCNCCC(=O)N(C)C 2230a_200000211371_100000737620 [0,1,0,0,0,0|3,0,0]=4 4297 B15R0.84 CCCCOCCCOCCC(=O)N(C)C 7a_200011215613_100000737620 [0,1,0,0,0,0|3,0,0]=4 4298 B15R0.84 CCCCOCCNCCCC(=O)N(C)C 2230a_200000744827_100000743108 [0,1,0,0,0,0|3,0,0]=4 4299 B15R0.84 CCCCOCCOCCCC(=O)N(C)C 7a_100000210238_100000737642 [0,1,0,0,0,0|3,0,0]=4 4300 B15R0.84 CCCCOCCSCCCC(=O)N(C)C 62a_100000737642_100000743108 [0,1,0,0,0,0|3,0,0]=4 4301 B15R0.84 CCCCOCCSCCCC(=O)N(C)C 62a_100000743108_100000737642 [0,1,0,0,0,0|3,0,0]=4 4302 B15R0.84 CCCCOCSCCCCC(=O)N(C)C 62a_100000752486_100011995733 [0,1,0,0,0,0|3,0,0]=4 4303 B15R0.84 CCCCOCSCCCCC(=O)N(C)C 62a_100011995733_100000752486 [0,1,0,0,0,0|3,0,0]=4 4304 B15R0.84 CCCCSCCNCCCC(=O)N(C)C 2230a_100025743550_100000737642 [0,1,0,0,0,0|3,0,0]=4 4305 B15R0.84 CCCCSCCOCCCC(=O)N(C)C 7a_200000230436_100000737642 [0,1,0,0,0,0|3,0,0]=4 4306 B15R0.84 CCCOCCCNCCCC(=O)N(C)C 2230a_100011217757_100000737642 [0,1,0,0,0,0|3,0,0]=4 4307 B15R0.84 CCCOCCNCCCCC(=O)N(C)C 34a_100161115042_100000752486 [0,1,0,0,0,0|3,0,0]=4 4308 B15R0.84 CCCOCCOCCCCC(=O)N(C)C 34a_100000752267_100000752486 [0,1,0,0,0,0|3,0,0]=4 4309 B15R0.84 CCCOCCOCCCCC(=O)N(C)C 7a_100000752267_100000752486 [0,1,0,0,0,0|3,0,0]=4 4310 B15R0.84 CCCOCCSCCCCC(=O)N(C)C 62a_100000752486_100011215938 [0,1,0,0,0,0|3,0,0]=4 4311 B15R0.84 CCCOCCSCCCCC(=O)N(C)C 62a_100011215938_100000752486 [0,1,0,0,0,0|3,0,0]=4 4312 B15R0.84 CCCSCCOCCCCC(=O)N(C)C 34a_200000230433_100000752486 [0,1,0,0,0,0|3,0,0]=4 4313 B15R0.84 CCCSCCOCCCCC(=O)N(C)C 7a_200000230433_100000752486 [0,1,0,0,0,0|3,0,0]=4 4314 B15R0.84 CCOCCCNCCCCC(=O)N(C)C 34a_100000210961_100000752486 [0,1,0,0,0,0|3,0,0]=4 4315 B15R0.84 CCOCCCOCCCCC(=O)N(C)C 34a_100000757476_100000752486 [0,1,0,0,0,0|3,0,0]=4 4316 B15R0.84 CCOCCCOCCCCC(=O)N(C)C 7a_100000757476_100000752486 [0,1,0,0,0,0|3,0,0]=4 4317 B15R0.84 CCOCCCSCCCCC(=O)N(C)C 62a_100000752486_100012232248 [0,1,0,0,0,0|3,0,0]=4 4318 B15R0.84 CCOCCCSCCCCC(=O)N(C)C 62a_100012232248_100000752486 [0,1,0,0,0,0|3,0,0]=4 4319 B15R0.84 CCSCCCOCCCCC(=O)N(C)C 34a_100011216438_100000752486 [0,1,0,0,0,0|3,0,0]=4 4320 B15R0.84 CCSCCCOCCCCC(=O)N(C)C 7a_100011216438_100000752486 [0,1,0,0,0,0|3,0,0]=4 4321 B15R0.84 CN(C)C(=O)CCCCCCCCCCO 240690a_100102631434_200000016029 [0,1,0,0,0,0|2,0,0]=3 4322 B15R0.84 CN(C)C(=O)CCCCNCCCCCO 34a_100000762737_100000752486 [0,1,0,0,0,0|3,0,0]=4 4323 B15R0.84 CN(C)C(=O)CCCCOCCCCCBr 34a_100000746331_100000752486 [0,1,0,0,0,0|3,0,0]=4 4324 B15R0.84 CN(C)C(=O)CCCCOCCCCCBr 7a_100000746331_100000752486 [0,1,0,0,0,0|3,0,0]=4 4325 B15R0.84 CN(C)C(=O)CCCCOCCCCCCl 34a_100000746330_100000752486 [0,1,0,0,0,0|3,0,0]=4 4326 B15R0.84 CN(C)C(=O)CCCCOCCCCCCl 7a_100000746330_100000752486 [0,1,0,0,0,0|3,0,0]=4 4327 B15R0.84 CN(C)C(=O)CCCCOCCCCCI 34a_200012148887_100000752486 [0,1,0,0,0,0|3,0,0]=4 4328 B15R0.84 CN(C)C(=O)CCCCOCCCCCI 7a_200012148887_100000752486 [0,1,0,0,0,0|3,0,0]=4 4329 B15R0.84 CN(C)C(=O)CCCCOCCCCCN 34a_100000762737_100000752486 [0,1,0,0,0,0|3,0,0]=4 4330 B15R0.84 CN(C)C(=O)CCCCSCCCCCF 62a_100000729378_100000752486 [0,1,0,0,0,0|3,0,0]=4 4331 B15R0.84 CN(C)C(=O)CCCCSCCCCCF 62a_100000752486_100000729378 [0,1,0,0,0,0|3,0,0]=4 4332 B15R0.84 CN(C)C(=O)CCCCSCCCCCO 62a_100000746330_100000752486 [0,1,0,0,0,0|3,0,0]=4 4333 B15R0.84 CN(C)C(=O)CCCCSCCCCCO 62a_100000752486_100000746330 [0,1,0,0,0,0|3,0,0]=4 4334 B15R0.84 CN(C)C(=O)CCCNCCCCCCF 2230a_200000744827_100015922095 [0,1,0,0,0,0|3,0,0]=4 4335 B15R0.84 CN(C)C(=O)CCCNCCCCCCO 2230a_100000686447_100000737642 [0,1,0,0,0,0|3,0,0]=4 4336 B15R0.84 CN(C)C(=O)CCCNCCCCCCO 2230a_200000744827_100000766143 [0,1,0,0,0,0|3,0,0]=4 4337 B15R0.84 CN(C)C(=O)CCCOCCCCCCBr 7a_100011215345_100000737642 [0,1,0,0,0,0|3,0,0]=4 4338 B15R0.84 CN(C)C(=O)CCCOCCCCCCCl 7a_100000766143_100000737642 [0,1,0,0,0,0|3,0,0]=4 4339 B15R0.84 CN(C)C(=O)CCCOCCCCCCF 7a_100000732779_100000737642 [0,1,0,0,0,0|3,0,0]=4 4340 B15R0.84 CN(C)C(=O)CCCSCCCCCCF 62a_100000737642_100015922095 [0,1,0,0,0,0|3,0,0]=4 4341 B15R0.84 CN(C)C(=O)CCCSCCCCCCF 62a_100015922095_100000737642 [0,1,0,0,0,0|3,0,0]=4 4342 B15R0.84 CN(C)C(=O)CCCSCCCCCCO 62a_100000737642_100000766143 [0,1,0,0,0,0|3,0,0]=4 4343 B15R0.84 CN(C)C(=O)CCCSCCCCCCO 62a_100000766143_100000737642 [0,1,0,0,0,0|3,0,0]=4 4344 B15R0.84 CN(C)C(=O)CCNCCCCCCCO 2230a_100000738053_100000760002 [0,1,0,0,0,0|3,0,0]=4 4345 B15R0.84 CN(C)C(=O)CCNCCCCCCCO 2230a_100011996573_100000737620 [0,1,0,0,0,0|3,0,0]=4 4346 B15R0.84 CN(C)C(=O)CCOCCCCCCCBr 7a_100000760002_100000737620 [0,1,0,0,0,0|3,0,0]=4 4347 B15R0.84 CN(C)C(=O)CCOCCCCCCCO 34a_200000747469_100000760002 [0,1,0,0,0,0|3,0,0]=4 4348 B15R0.84 CN(C)C(=O)CCSCCCCCCCO 62a_100000737620_100000760002 [0,1,0,0,0,0|3,0,0]=4 4349 B15R0.84 CN(C)C(=O)CCSCCCCCCCO 62a_100000760002_100000737620 [0,1,0,0,0,0|3,0,0]=4 4350 B15R0.84 CN(C)C(=O)CNCCCCCCCCO 2230a_100015183351_100000033203 [0,1,0,0,0,0|3,0,0]=4 4351 B15R0.84 CN(C)C(=O)CNCCCCCCCCO 2230a_102515433106_100000185267 [0,1,0,0,0,0|3,0,0]=4 4352 B15R0.84 CN(C)C(=O)CNCCCCCCCCO 34a_102515433106_100000692301 [0,1,0,0,0,0|3,0,0]=4 4353 B15R0.84 CN(C)C(=O)COCCCCCCCCBr 34a_100009813846_100000692301 [0,1,0,0,0,0|3,0,0]=4 4354 B15R0.84 CN(C)C(=O)COCCCCCCCCBr 7a_100009813846_100000692301 [0,1,0,0,0,0|3,0,0]=4 4355 B15R0.84 CN(C)C(=O)COCCCCCCCCCl 34a_100000033203_100000692301 [0,1,0,0,0,0|3,0,0]=4 4356 B15R0.84 CN(C)C(=O)COCCCCCCCCCl 7a_100000033203_100000692301 [0,1,0,0,0,0|3,0,0]=4 4357 B15R0.84 CN(C)C(=O)COCCCCCCCCN 34a_102515433106_100000692301 [0,1,0,0,0,0|3,0,0]=4 4358 B15R0.84 CN(C)C(=O)CSCCCCCCCCO 62a_100000033203_100000692301 [0,1,0,0,0,0|3,0,0]=4 4359 B15R0.84 CN(C)C(=O)CSCCCCCCCCO 62a_100000692301_100000033203 [0,1,0,0,0,0|3,0,0]=4 4360 B15R0.84 CN(C)C(=O)NCCCCCCCCCO 2708a_100000078944_100102631434 [0,1,0,0,0,0|3,0,0]=4 4361 B15R0.84 COCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100011998445 [0,1,0,0,0,0|3,0,0]=4 4362 B15R0.84 COCCCCCCOCCC(=O)N(C)C 34a_200000747469_100011998445 [0,1,0,0,0,0|3,0,0]=4 4363 B15R0.84 COCCCCCCOCCC(=O)N(C)C 7a_200012092642_100000737620 [0,1,0,0,0,0|3,0,0]=4 4364 B15R0.84 COCCCCCCSCCC(=O)N(C)C 62a_100000737620_100011998445 [0,1,0,0,0,0|3,0,0]=4 4365 B15R0.84 COCCCCCCSCCC(=O)N(C)C 62a_100011998445_100000737620 [0,1,0,0,0,0|3,0,0]=4 4366 B15R0.84 COCCCCCNCCCC(=O)N(C)C 2230a_100000747528_100000737642 [0,1,0,0,0,0|3,0,0]=4 4367 B15R0.84 COCCCCOCCCCC(=O)N(C)C 34a_100000740925_100000752486 [0,1,0,0,0,0|3,0,0]=4 4368 B15R0.84 COCCCCSCCCCC(=O)N(C)C 62a_100000730899_100000752486 [0,1,0,0,0,0|3,0,0]=4 4369 B15R0.84 COCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000730899 [0,1,0,0,0,0|3,0,0]=4 4370 B15R0.84 CSCCCCOCCCCC(=O)N(C)C 34a_100011217163_100000752486 [0,1,0,0,0,0|3,0,0]=4 4371 B15R0.84 CSCCCCOCCCCC(=O)N(C)C 7a_100011217163_100000752486 [0,1,0,0,0,0|3,0,0]=4 4372 B15R0.84 C[C@@H](O)C(=O)CCCCCCCCCCO 1458a_100000717761_100009813290 [0,1,0,0,0,0|2,0,0]=3 4373 B15R0.84 C[C@@H](O)C(=O)NCCCCCCCCCO 240690a_100000078944_100000717761 [0,1,0,0,0,0|3,0,0]=4 4374 B15R0.84 C[C@H](O)C(=O)CCCCCCCCCCO 1458a_217856618621_100009813290 [0,1,0,0,0,0|2,0,0]=3 4375 B15R0.84 C[C@H](O)C(=O)NCCCCCCCCCO 240690a_100000078944_217856618621 [0,1,0,0,0,0|3,0,0]=4 4376 B15R0.84 O=C(CCCCCCCCCCO)C(O)O 1458a_100000233687_100009813290 [0,1,0,0,0,0|3,0,0]=4 4377 B15R0.137 C#CCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100012094781 [0,1,0,0,0,0|0,0,3]=4 4378 B15R0.137 C#CCCCCCC(=O)CCCC(=O)OC 1458a_100000694772_100011218270 [0,1,0,0,0,0|0,0,3]=4 4379 B15R0.137 C#CCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100012094781 [0,1,0,0,0,0|1,0,2]=4 4380 B15R0.137 C=CCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000700193 [0,1,0,0,0,0|0,0,3]=4 4381 B15R0.137 C=CCCCCCC(=O)CCCC(=O)OC 1458a_100011934241_100011218270 [0,1,0,0,0,0|0,0,3]=4 4382 B15R0.137 C=CCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000700193 [0,1,0,0,0,0|1,0,2]=4 4383 B15R0.137 CCCC/C=C/CC(=O)CCCC(=O)OC 1458a_200016282684_100011218270 [0,1,0,0,0,0|0,0,3]=4 4384 B15R0.137 CCCCCC#CC(=O)CCCC(=O)OC 1458a_100011215388_100011218270 [0,1,0,0,0,0|0,0,3]=4 4385 B15R0.137 CCCCCC=CC(=O)CCCC(=O)OC 1458a_100016263427_100011218270 [0,1,0,0,0,0|0,0,3]=4 4386 B15R0.137 CCCCCCCC(=O)CCCC(=O)NC 1458a_100000211969_100000741757 [0,1,0,0,0,0|1,0,1]=3 4387 B15R0.137 CCCCCCCC(=O)CCCC(=O)OC 1458a_100000211969_100011218270 [0,1,0,0,0,0|0,0,1]=2 4388 B15R0.137 CCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210614 [0,1,0,0,0,0|0,0,1]=2 4389 B15R0.137 CCCCCCCC(=O)CCOC(=O)NC 1458a_100000211969_200011997002 [0,1,0,0,0,0|2,0,1]=4 4390 B15R0.137 CCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210614 [0,1,0,0,0,0|1,0,1]=3 4391 B15R0.137 CCCCCCCC(=O)NCCC(=O)NC 11a_100000738227_100000211969 [0,1,0,0,0,0|2,0,1]=4 4392 B15R0.137 CCCCCCCC(=O)NCCC(=O)NC 240690a_100000738227_100000211969 [0,1,0,0,0,0|2,0,1]=4 4393 B15R0.137 CCCCCCCC(=O)NCCC(=O)NC 527a_100000738227_100000211969 [0,1,0,0,0,0|2,0,1]=4 4394 B15R0.137 CCCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000211969 [0,1,0,0,0,0|1,0,1]=3 4395 B15R0.137 CCCCCCCC(C)NCCC(=O)NC 2230a_100000738227_200011218727 [0,1,0,0,0,0|2,0,0]=3 4396 B15R0.137 CCCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100000210596 [0,1,0,0,0,0|2,0,0]=3 4397 B15R0.137 CCCCCCCC(C)NCCC(=O)NC 34a_100000738227_200011218727 [0,1,0,0,0,0|2,0,0]=3 4398 B15R0.137 CCCCCCCC(C)OCCC(=O)NC 34a_100000754576_200011218727 [0,1,0,0,0,0|2,0,0]=3 4399 B15R0.137 CCCCCCCC(C)OCCC(=O)NC 34a_200011215852_100012179268 [0,1,0,0,0,0|2,0,0]=3 4400 B15R0.137 CCCCCCCC(C)OCCC(=O)NC 7a_200011215852_100000737683 [0,1,0,0,0,0|2,0,0]=3 4401 B15R0.137 CCCCCCCC(C)OCCC(=O)OC 34a_200011215852_100000742370 [0,1,0,0,0,0|1,0,0]=2 4402 B15R0.137 CCCCCCCC(C)OCCC(=O)OC 7a_200011215852_100000204255 [0,1,0,0,0,0|1,0,0]=2 4403 B15R0.137 CCCCCCCC(C)OCCC(C)OC 7a_100000764861_200011218727 [0,1,0,0,0,0|2,0,1]=4 4404 B15R0.137 CCCCCCCC(C)SCCC(=O)NC 62a_100000737683_200011218727 [0,1,0,0,0,0|2,0,0]=3 4405 B15R0.137 CCCCCCCC(C)SCCC(=O)NC 62a_200011218727_100000737683 [0,1,0,0,0,0|2,0,0]=3 4406 B15R0.137 CCCCCCCC(C)SCCC(=O)OC 62a_100000204255_200011218727 [0,1,0,0,0,0|1,0,0]=2 4407 B15R0.137 CCCCCCCC(C)SCCC(=O)OC 62a_200011218727_100000204255 [0,1,0,0,0,0|1,0,0]=2 4408 B15R0.137 CCCCCCCC(C)SCOC(=O)OC 62a_200011218727_100000139417 [0,1,0,0,0,0|2,0,0]=3 4409 B15R0.137 CCCCCCCN(C)C/C=C/C(=O)OC 2230a_100000228206_100000742655 [0,1,0,0,0,0|1,0,2]=4 4410 B15R0.137 CCCCCCCN(C)C/C=C/C(=O)OC 269982a_100000228206_100000742655 [0,1,0,0,0,0|1,0,2]=4 4411 B15R0.137 CCCCCCCN(C)CCCC(=O)NC 2230a_100000228206_100000741757 [0,1,0,0,0,0|2,0,0]=3 4412 B15R0.137 CCCCCCCN(C)CCCC(=O)NC 269982a_100000228206_100000741757 [0,1,0,0,0,0|2,0,0]=3 4413 B15R0.137 CCCCCCCN(C)CCCC(=O)OC 2230a_100000228206_100011218270 [0,1,0,0,0,0|1,0,0]=2 4414 B15R0.137 CCCCCCCN(C)CCCC(=O)OC 269982a_100000228206_100011218270 [0,1,0,0,0,0|1,0,0]=2 4415 B15R0.137 CCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210681 [0,1,0,0,0,0|1,0,0]=2 4416 B15R0.137 CCCCCCCN(C)CCOC(=O)NC 269982a_100000228206_200011997002 [0,1,0,0,0,0|3,0,0]=4 4417 B15R0.137 CCCCCCNC(=O)CCCC(=O)OC 11a_100000210581_100000239890 [0,1,0,0,0,0|1,0,1]=3 4418 B15R0.137 CCCCCCNC(=O)CCCC(=O)OC 1626a_100000210581_100000239890 [0,1,0,0,0,0|1,0,1]=3 4419 B15R0.137 CCCCCCNC(=O)CCCC(=O)OC 240690a_100000210581_100000239890 [0,1,0,0,0,0|1,0,1]=3 4420 B15R0.137 CCCCCCNC(=O)CCCC(=O)OC 527a_100000210581_100000239890 [0,1,0,0,0,0|1,0,1]=3 4421 B15R0.137 CCCCCCNC(=O)CSCC(=O)OC 11a_100000210581_100000191316 [0,1,0,0,0,0|2,0,1]=4 4422 B15R0.137 CCCCCCNC(=O)CSCC(=O)OC 1626a_100000210581_100000191316 [0,1,0,0,0,0|2,0,1]=4 4423 B15R0.137 CCCCCCNC(=O)CSCC(=O)OC 240690a_100000210581_100000191316 [0,1,0,0,0,0|2,0,1]=4 4424 B15R0.137 CCCCCCNC(=O)CSCC(=O)OC 62a_100000230325_100000747449 [0,1,0,0,0,0|2,0,1]=4 4425 B15R0.137 CCCCCNCC(=O)NCCC(=O)OC 2230a_100000209983_100000230212 [0,1,0,0,0,0|2,0,1]=4 4426 B15R0.137 CCCCCNN=C(C)CCCC(=O)OC 4a_100000694160_100000015542 [0,1,0,0,0,0|2,0,1]=4 4427 B15R0.137 CCCCCNNC(=O)CCCC(=O)OC 22a_100000694160_100000239890 [0,1,0,0,0,0|2,0,1]=4 4428 B15R0.137 CCCCCOCC(=O)NCCC(=O)OC 34a_100000210253_100000230212 [0,1,0,0,0,0|2,0,1]=4 4429 B15R0.137 CCCCCOCC(=O)NCCC(=O)OC 7a_100000210253_100000230212 [0,1,0,0,0,0|2,0,1]=4 4430 B15R0.137 CCCCCSCC(=O)NCCC(=O)OC 62a_100000210326_100000230212 [0,1,0,0,0,0|2,0,1]=4 4431 B15R0.137 CCCCCSCC(=O)NCCC(=O)OC 62a_100000230212_100000210326 [0,1,0,0,0,0|2,0,1]=4 4432 B15R0.137 CCCCOCCC(=O)CCCC(=O)OC 1458a_100000239890_100000743108 [0,1,0,0,0,0|1,0,1]=3 4433 B15R0.137 CCCCOCCC(=O)CSCC(=O)OC 1458a_100000191316_100000743108 [0,1,0,0,0,0|2,0,1]=4 4434 B15R0.137 CCCCOCCN(C)CCCC(=O)OC 269982a_100000739225_100000743108 [0,1,0,0,0,0|2,0,0]=3 4435 B15R0.137 CCCOCCNC(=O)CCCC(=O)OC 1626a_100161115042_100000239890 [0,1,0,0,0,0|2,0,1]=4 4436 B15R0.137 CCCOCCNC(=O)CCCC(=O)OC 240690a_100161115042_100000239890 [0,1,0,0,0,0|2,0,1]=4 4437 B15R0.137 CCCOCCNC(=O)CCCC(=O)OC 527a_100161115042_100000239890 [0,1,0,0,0,0|2,0,1]=4 4438 B15R0.137 CCCSCCNC(=O)CCCC(=O)OC 11a_100020603323_100000239890 [0,1,0,0,0,0|2,0,1]=4 4439 B15R0.137 CCCSCCNC(=O)CCCC(=O)OC 240690a_100020603323_100000239890 [0,1,0,0,0,0|2,0,1]=4 4440 B15R0.137 CCCSCCNC(=O)CCCC(=O)OC 527a_100020603323_100000239890 [0,1,0,0,0,0|2,0,1]=4 4441 B15R0.137 CCOCCCNC(=O)CCCC(=O)OC 11a_100000210961_100000239890 [0,1,0,0,0,0|2,0,1]=4 4442 B15R0.137 CCOCCCNC(=O)CCCC(=O)OC 1626a_100000210961_100000239890 [0,1,0,0,0,0|2,0,1]=4 4443 B15R0.137 CCOCCCNC(=O)CCCC(=O)OC 240690a_100000210961_100000239890 [0,1,0,0,0,0|2,0,1]=4 4444 B15R0.137 CCOCCCNC(=O)CCCC(=O)OC 527a_100000210961_100000239890 [0,1,0,0,0,0|2,0,1]=4 4445 B15R0.137 CNC(=O)CCCC(=O)CCCCCCO 1458a_100011996774_100000741757 [0,1,0,0,0,0|2,0,1]=4 4446 B15R0.137 CNC(=O)CCCC(=O)CCCCCOC 1458a_100011935119_100000741757 [0,1,0,0,0,0|2,0,1]=4 4447 B15R0.137 COC(=O)CCCC(=O)CCCCCC#N 1458a_100000239890_100009813376 [0,1,0,0,0,0|1,0,2]=4 4448 B15R0.137 COC(=O)CCCC(=O)CCCCCCF 1458a_100000239890_100015922095 [0,1,0,0,0,0|1,0,1]=3 4449 B15R0.137 COC(=O)CCCC(=O)CCCCCCO 1458a_100000239890_100000766143 [0,1,0,0,0,0|1,0,1]=3 4450 B15R0.137 COC(=O)CCCC(=O)CCCCCCO 1458a_100011996774_100011218270 [0,1,0,0,0,0|1,0,1]=3 4451 B15R0.137 COC(=O)CCCC(=O)NCCCCCO 240690a_100000762737_100000239890 [0,1,0,0,0,0|2,0,1]=4 4452 B15R0.137 COC(=O)CCCN(C)CCCCCC#N 269982a_100000739225_100009813376 [0,1,0,0,0,0|2,0,1]=4 4453 B15R0.137 COC(=O)CCCN(C)CCCCCC=O 269982a_100000739225_100000139337 [0,1,0,0,0,0|2,0,1]=4 4454 B15R0.137 COC(=O)CCCN(C)CCCCCCF 269982a_100000739225_100015922095 [0,1,0,0,0,0|2,0,0]=3 4455 B15R0.137 COC(=O)CCCN(C)CCCCCCO 269982a_100000739225_100000766143 [0,1,0,0,0,0|2,0,0]=3 4456 B15R0.137 COC(=O)CCNC(=O)CCCCCCO 188690a_100000683876_100011996774 [0,1,0,0,0,0|2,0,1]=4 4457 B15R0.137 COC(=O)CSCC(=O)CCCCCCF 1458a_100000191316_100015922095 [0,1,0,0,0,0|2,0,1]=4 4458 B15R0.137 COC(=O)CSCC(=O)CCCCCCO 1458a_100000191316_100000766143 [0,1,0,0,0,0|2,0,1]=4 4459 B15R0.137 COCCCCCC(=O)CCCC(=O)OC 1458a_100011935119_100011218270 [0,1,0,0,0,0|1,0,1]=3 4460 B15R0.137 COCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100011935119 [0,1,0,0,0,0|2,0,1]=4 4461 B15R0.137 COCCOCCC(=O)CCCC(=O)OC 1458a_100000239890_100000695917 [0,1,0,0,0,0|2,0,1]=4 4462 B15R0.137 COCCOCCC(=O)CCCC(=O)OC 1458a_100000745395_100011218270 [0,1,0,0,0,0|2,0,1]=4 4463 B15R0.137 COCCOCCN(C)CCCC(=O)OC 269982a_100000739225_100000695917 [0,1,0,0,0,0|3,0,0]=4 4464 B15R0.172 C#CC(=O)CCCCCCCCC(=O)OC 1458a_100000211873_100010282707 [0,1,0,0,0,0|0,0,3]=4 4465 B15R0.172 C#CC(C)NCCCCCCCC(=O)OC 2230a_100000707721_100010004213 [0,1,0,0,0,0|1,0,2]=4 4466 B15R0.172 C#CC(C)NCCCCCCCC(=O)OC 34a_100000707721_100010004213 [0,1,0,0,0,0|1,0,2]=4 4467 B15R0.172 C#CC(C)OCCCCCCCC(=O)OC 34a_100011022521_200000035995 [0,1,0,0,0,0|1,0,2]=4 4468 B15R0.172 C#CC(C)SCCCCCCCC(=O)OC 62a_200000035995_100010004213 [0,1,0,0,0,0|1,0,2]=4 4469 B15R0.172 C#CC(O)CCCCCSCCC(=O)OC 62a_100000204255_200010408556 [0,1,0,0,0,0|1,0,2]=4 4470 B15R0.172 C#CC(O)CCCCCSCCC(=O)OC 62a_200010408556_100000204255 [0,1,0,0,0,0|1,0,2]=4 4471 B15R0.172 C#C[C@@H](C)OCCCCCCCC(=O)OC 34a_100009815206_100010004213 [0,1,0,0,0,0|1,0,2]=4 4472 B15R0.172 C#C[C@@H](C)OCCCCCCCC(=O)OC 7a_100009815206_100010004213 [0,1,0,0,0,0|1,0,2]=4 4473 B15R0.172 C=CC(=O)CCCCCCCCC(=O)OC 1458a_100000185746_100010282707 [0,1,0,0,0,0|0,0,3]=4 4474 B15R0.172 C=CC(C)COCCCCCCC(=O)OC 34a_100011215527_100009815986 [0,1,0,0,0,0|1,0,2]=4 4475 B15R0.172 C=CC(C)COCCCCCCC(=O)OC 7a_100011215527_100009815986 [0,1,0,0,0,0|1,0,2]=4 4476 B15R0.172 C=CC(C)OCCCCCCCC(=O)OC 34a_100000695699_100010004213 [0,1,0,0,0,0|1,0,2]=4 4477 B15R0.172 C=CC(C)SCCCCCCCC(=O)OC 62a_100011215867_100010004213 [0,1,0,0,0,0|1,0,2]=4 4478 B15R0.172 C=CC(O)COCCCCCCC(=O)OC 34a_100009863599_100000730141 [0,1,0,0,0,0|1,0,2]=4 4479 B15R0.172 C=CC(O)COCCCCCCC(=O)OC 7a_100009863599_100000730141 [0,1,0,0,0,0|1,0,2]=4 4480 B15R0.172 C=CC(O)CSCCCCCCC(=O)OC 62a_100000730141_100009815986 [0,1,0,0,0,0|1,0,2]=4 4481 B15R0.172 C=CC(O)CSCCCCCCC(=O)OC 62a_100009815986_100000730141 [0,1,0,0,0,0|1,0,2]=4 4482 B15R0.172 C=C[C@H](N)COCCCCCCC(=O)OC 34a_100016989147_100009815986 [0,1,0,0,0,0|1,0,2]=4 4483 B15R0.172 CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210202 [0,1,0,0,0,0|0,0,1]=2 4484 B15R0.172 CCC(=O)CCCCCCCCC(=O)OC 1458a_100000210414_100010282707 [0,1,0,0,0,0|0,0,1]=2 4485 B15R0.172 CCC(=O)CCOCCOCCC(=O)OC 1458a_200020673210_100000210202 [0,1,0,0,0,0|2,0,1]=4 4486 B15R0.172 CCC(=O)COCCCCCCC(=O)OC 34a_100000725409_100009815986 [0,1,0,0,0,0|1,0,1]=3 4487 B15R0.172 CCC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000747405 [0,1,0,0,0,0|1,0,1]=3 4488 B15R0.172 CCC(=O)CSCCCCCCC(=O)OC 62a_100000747405_100009815986 [0,1,0,0,0,0|1,0,1]=3 4489 B15R0.172 CCC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000747405 [0,1,0,0,0,0|1,0,1]=3 4490 B15R0.172 CCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000210414 [0,1,0,0,0,0|1,0,1]=3 4491 B15R0.172 CCC(=O)NCCNCCCCC(=O)OC 34a_100132302217_100000204269 [0,1,0,0,0,0|2,0,1]=4 4492 B15R0.172 CCC(=O)NCCOCCCCC(=O)OC 34a_200000158885_100000204269 [0,1,0,0,0,0|2,0,1]=4 4493 B15R0.172 CCC(=O)NCCOCCCCC(=O)OC 7a_200000158885_100000204269 [0,1,0,0,0,0|2,0,1]=4 4494 B15R0.172 CCC(=O)OCCOCCCCC(=O)OC 7a_200000031056_100000204269 [0,1,0,0,0,0|2,0,1]=4 4495 B15R0.172 CCC(C)CCCCCOCCC(=O)NC 7a_200000035636_100000737683 [0,1,0,0,0,0|2,0,0]=3 4496 B15R0.172 CCC(C)CCCCCOCCC(=O)OC 7a_200000035636_100000204255 [0,1,0,0,0,0|1,0,0]=2 4497 B15R0.172 CCC(C)CCCOCCCCC(=O)OC 7a_100011216074_100000204269 [0,1,0,0,0,0|1,0,0]=2 4498 B15R0.172 CCC(C)CCCOCCOCC(=O)OC 7a_100011216074_100000090808 [0,1,0,0,0,0|2,0,0]=3 4499 B15R0.172 CCC(C)CCNCCCCCC(=O)OC 2230a_100020591266_100009816466 [0,1,0,0,0,0|1,0,0]=2 4500 B15R0.172 CCC(C)CCOCCCCCC(=O)OC 7a_100011215188_100009816466 [0,1,0,0,0,0|1,0,0]=2 4501 B15R0.172 CCC(C)CNCCCCCCC(=O)OC 2230a_100020588543_100009815986 [0,1,0,0,0,0|1,0,0]=2 4502 B15R0.172 CCC(C)COCCCCCCC(=O)OC 34a_100009863599_100000748023 [0,1,0,0,0,0|1,0,0]=2 4503 B15R0.172 CCC(C)COCCCCCCC(=O)OC 7a_100009863599_100000748023 [0,1,0,0,0,0|1,0,0]=2 4504 B15R0.172 CCC(C)CSCCCCCCC(=O)OC 62a_100000748023_100009815986 [0,1,0,0,0,0|1,0,0]=2 4505 B15R0.172 CCC(C)CSCCCCCCC(=O)OC 62a_100009815986_100000748023 [0,1,0,0,0,0|1,0,0]=2 4506 B15R0.172 CCC(C)NCCCCCCCC(=O)OC 2230a_100000209981_100010004213 [0,1,0,0,0,0|1,0,0]=2 4507 B15R0.172 CCC(C)OCCCCCCCC(=O)OC 34a_100011022521_100011215416 [0,1,0,0,0,0|1,0,0]=2 4508 B15R0.172 CCC(C)OCCCCCCCC(=O)OC 7a_100000210228_100010004213 [0,1,0,0,0,0|1,0,0]=2 4509 B15R0.172 CCC(C)OCCCCCCCC(=O)OC 7a_100011022521_100000758301 [0,1,0,0,0,0|1,0,0]=2 4510 B15R0.172 CCC(C)OCCOCCOCC(=O)OC 34a_100011023656_100011215416 [0,1,0,0,0,0|3,0,0]=4 4511 B15R0.172 CCC(C)OCCOCCOCC(=O)OC 7a_100011023656_100000758301 [0,1,0,0,0,0|3,0,0]=4 4512 B15R0.172 CCC(C)SCCCCCCCC(=O)OC 62a_100000758301_100010004213 [0,1,0,0,0,0|1,0,0]=2 4513 B15R0.172 CCC(C)SCCCCCCCC(=O)OC 62a_100010004213_100000758301 [0,1,0,0,0,0|1,0,0]=2 4514 B15R0.172 CCC(O)CNCCCCCCC(=O)OC 2230a_100011218483_100009815986 [0,1,0,0,0,0|1,0,0]=2 4515 B15R0.172 CCC(O)CNN=CCCCCC(=O)OC 4a_100015206393_100000052768 [0,1,0,0,0,0|2,0,1]=4 4516 B15R0.172 CCC(O)COCCCCCCC(=O)OC 34a_100009863599_100011218378 [0,1,0,0,0,0|1,0,0]=2 4517 B15R0.172 CCC(O)COCCCCCCC(=O)OC 7a_100009863599_100011218378 [0,1,0,0,0,0|1,0,0]=2 4518 B15R0.172 CCC(O)CSCCCCCCC(=O)OC 62a_100009815986_100011218378 [0,1,0,0,0,0|1,0,0]=2 4519 B15R0.172 CCC(O)CSCCCCCCC(=O)OC 62a_100011218378_100009815986 [0,1,0,0,0,0|1,0,0]=2 4520 B15R0.172 CCN(C)CCCCCCCCC(=O)OC 2230a_100000225621_100010282707 [0,1,0,0,0,0|1,0,0]=2 4521 B15R0.172 CCN(C)CCCCCCCCC(=O)OC 269982a_100000225621_100010282707 [0,1,0,0,0,0|1,0,0]=2 4522 B15R0.172 CCN(C)CCCOCCCCC(=O)OC 7a_100000059025_100015186262 [0,1,0,0,0,0|2,0,0]=3 4523 B15R0.172 CCN(C)CCCSCCCCC(=O)OC 62a_100000204269_100015186262 [0,1,0,0,0,0|2,0,0]=3 4524 B15R0.172 CCN(C)CCCSCCOCC(=O)OC 62a_100000090808_100015186262 [0,1,0,0,0,0|3,0,0]=4 4525 B15R0.172 CC[C@H](C)COCCCCCCC(=O)OC 34a_100009863599_100009816398 [0,1,0,0,0,0|1,0,0]=2 4526 B15R0.172 CC[C@H](C)COCCCCCCC(=O)OC 7a_100009816381_100009815986 [0,1,0,0,0,0|1,0,0]=2 4527 B15R0.172 CC[C@H](C)COCCCCCCC(=O)OC 7a_100009863599_100009816398 [0,1,0,0,0,0|1,0,0]=2 4528 B15R0.172 CC[C@H](C)CSCCCCCCC(=O)OC 62a_100009815986_100009816398 [0,1,0,0,0,0|1,0,0]=2 4529 B15R0.172 CC[C@H](C)CSCCCCCCC(=O)OC 62a_100009816398_100009815986 [0,1,0,0,0,0|1,0,0]=2 4530 B15R0.172 CNC(=O)CCCCCCCCC(=O)OC 11a_106832991635_100000036616 [0,1,0,0,0,0|1,0,1]=3 4531 B15R0.172 CNC(=O)CCCCCCCCC(=O)OC 1626a_100102657272_100000036616 [0,1,0,0,0,0|1,0,1]=3 4532 B15R0.172 CNC(=O)CCCCCCCCC(=O)OC 240690a_100102657272_100000036616 [0,1,0,0,0,0|1,0,1]=3 4533 B15R0.172 CNC(=O)CCCNCCCCC(=O)OC 2230a_100000740002_100000204269 [0,1,0,0,0,0|2,0,1]=4 4534 B15R0.172 CNC(=O)CCCNCCCCC(=O)OC 34a_100000740002_100000204269 [0,1,0,0,0,0|2,0,1]=4 4535 B15R0.172 CNC(=O)CCCOCCCCC(=O)OC 34a_100000059025_100000741757 [0,1,0,0,0,0|2,0,1]=4 4536 B15R0.172 CNC(=O)CCCOCCCCC(=O)OC 7a_100000059025_100000741757 [0,1,0,0,0,0|2,0,1]=4 4537 B15R0.172 CNC(=O)CCCSCCCCC(=O)OC 62a_100000204269_100000741757 [0,1,0,0,0,0|2,0,1]=4 4538 B15R0.172 CNC(=O)CCCSCCCCC(=O)OC 62a_100000741757_100000204269 [0,1,0,0,0,0|2,0,1]=4 4539 B15R0.172 CNC(=O)CCNCCCCCC(=O)OC 2230a_100000738227_100009816466 [0,1,0,0,0,0|2,0,1]=4 4540 B15R0.172 CNC(=O)CCNCCCCCC(=O)OC 34a_100000738227_100009816466 [0,1,0,0,0,0|2,0,1]=4 4541 B15R0.172 CNC(=O)CCOCCCCCC(=O)OC 34a_100000074720_100012179268 [0,1,0,0,0,0|2,0,1]=4 4542 B15R0.172 CNC(=O)CCOCCCCCC(=O)OC 34a_100000754576_100009816466 [0,1,0,0,0,0|2,0,1]=4 4543 B15R0.172 CNC(=O)CCOCCCCCC(=O)OC 7a_100000074720_100000737683 [0,1,0,0,0,0|2,0,1]=4 4544 B15R0.172 CNC(=O)CCSCCCCCC(=O)OC 62a_100000737683_100009816466 [0,1,0,0,0,0|2,0,1]=4 4545 B15R0.172 CNC(=O)CCSCCCCCC(=O)OC 62a_100009816466_100000737683 [0,1,0,0,0,0|2,0,1]=4 4546 B15R0.172 CNC(=O)CNCCCCCCC(=O)OC 2230a_100000693194_100009815986 [0,1,0,0,0,0|2,0,1]=4 4547 B15R0.172 CNC(=O)COCCCCCCC(=O)OC 34a_100000750040_100009815986 [0,1,0,0,0,0|2,0,1]=4 4548 B15R0.172 CNC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000183359 [0,1,0,0,0,0|2,0,1]=4 4549 B15R0.172 CNC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000183359 [0,1,0,0,0,0|2,0,1]=4 4550 B15R0.172 CNC(=O)CSCCCCCCC(=O)OC 62a_100000183359_100009815986 [0,1,0,0,0,0|2,0,1]=4 4551 B15R0.172 CNC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000183359 [0,1,0,0,0,0|2,0,1]=4 4552 B15R0.172 COC(=O)CCCCCCCCC(=O)CF 1458a_100000036616_100015361967 [0,1,0,0,0,0|1,0,1]=3 4553 B15R0.172 COC(=O)CCCCCCCCC(=O)CO 1458a_100000210174_100010282707 [0,1,0,0,0,0|1,0,1]=3 4554 B15R0.172 COC(=O)CCCCCCCNC(=O)CO 188690a_100000687944_100000210174 [0,1,0,0,0,0|2,0,1]=4 4555 B15R0.172 COC(=O)CCCCCCCNC(C)C#N 2230a_100000737613_100010004213 [0,1,0,0,0,0|2,0,1]=4 4556 B15R0.172 COC(=O)CCCCCCCN[C@H](C)CO 2230a_100000737577_100010004213 [0,1,0,0,0,0|2,0,0]=3 4557 B15R0.172 COC(=O)CCCCCCCOC(C)C#N 34a_100011218135_100010004213 [0,1,0,0,0,0|2,0,1]=4 4558 B15R0.172 COC(=O)CCCCCCCOC(C)C#N 7a_100011022521_100000703298 [0,1,0,0,0,0|2,0,1]=4 4559 B15R0.172 COC(=O)CCCCCCCOC(C)CF 34a_100016041109_100010004213 [0,1,0,0,0,0|2,0,0]=3 4560 B15R0.172 COC(=O)CCCCCCCOC(C)CF 7a_100016041109_100010004213 [0,1,0,0,0,0|2,0,0]=3 4561 B15R0.172 COC(=O)CCCCCCCOC(C)CN 34a_100000210904_100010004213 [0,1,0,0,0,0|2,0,0]=3 4562 B15R0.172 COC(=O)CCCCCCCOC(C)CO 34a_100011022521_100012180447 [0,1,0,0,0,0|2,0,0]=3 4563 B15R0.172 COC(=O)CCCCCCCOC(C)CO 7a_100011022521_100012180447 [0,1,0,0,0,0|2,0,0]=3 4564 B15R0.172 COC(=O)CCCCCCCSC(C)C#N 62a_100000703298_100010004213 [0,1,0,0,0,0|2,0,1]=4 4565 B15R0.172 COC(=O)CCCCCCCSC(C)C#N 62a_100010004213_100000703298 [0,1,0,0,0,0|2,0,1]=4 4566 B15R0.172 COC(=O)CCCCCCCSC(C)CO 62a_100012180447_100010004213 [0,1,0,0,0,0|2,0,0]=3 4567 B15R0.172 COC(=O)CCCCCCCSC(C)OC 62a_100009879195_100010004213 [0,1,0,0,0,0|2,0,0]=3 4568 B15R0.172 COC(=O)CCCCCCCSC(C)OC 62a_100010004213_100009879195 [0,1,0,0,0,0|2,0,0]=3 4569 B15R0.172 COC(=O)CCCCCCCSC(F)C#N 62a_100010004213_200000117898 [0,1,0,0,0,0|2,0,1]=4 4570 B15R0.172 COC(=O)CCCCCCCSC(F)C#N 62a_200000117898_100010004213 [0,1,0,0,0,0|2,0,1]=4 4571 B15R0.172 COC(=O)CCCCCCCS[C@H](C)CO 62a_100010004213_100016084084 [0,1,0,0,0,0|2,0,0]=3 4572 B15R0.172 COC(=O)CCCCCCCS[C@H](C)CO 62a_100016084084_100010004213 [0,1,0,0,0,0|2,0,0]=3 4573 B15R0.172 COC(=O)CCCCCCNCC(C)CO 34a_100000744482_100009815986 [0,1,0,0,0,0|2,0,0]=3 4574 B15R0.172 COC(=O)CCCCCCNC[C@@H](C)OC 2230a_100020591295_100009815986 [0,1,0,0,0,0|2,0,0]=3 4575 B15R0.172 COC(=O)CCCCCCNC[C@@H](F)CO 34a_100015665980_100009815986 [0,1,0,0,0,0|2,0,0]=3 4576 B15R0.172 COC(=O)CCCCCCNC[C@H](O)CO 2230a_100020644852_100009815986 [0,1,0,0,0,0|2,0,0]=3 4577 B15R0.172 COC(=O)CCCCCCOCC(=O)OC 34a_100009863599_100000747449 [0,1,0,0,0,0|2,0,1]=4 4578 B15R0.172 COC(=O)CCCCCCOCC(=O)OC 7a_100009863599_100000747449 [0,1,0,0,0,0|2,0,1]=4 4579 B15R0.172 COC(=O)CCCCCCOCC(C)CN 34a_100000744482_100009815986 [0,1,0,0,0,0|2,0,0]=3 4580 B15R0.172 COC(=O)CCCCCCOCC(C)OC 34a_100000690652_100009815986 [0,1,0,0,0,0|2,0,0]=3 4581 B15R0.172 COC(=O)CCCCCCOCC(Cl)CCl 34a_100000033668_100009815986 [0,1,0,0,0,0|2,0,0]=3 4582 B15R0.172 COC(=O)CCCCCCOCC(O)CO 34a_100009863599_100011219619 [0,1,0,0,0,0|2,0,0]=3 4583 B15R0.172 COC(=O)CCCCCCOCC(O)CO 7a_100009863599_100011219619 [0,1,0,0,0,0|2,0,0]=3 4584 B15R0.172 COC(=O)CCCCCCOC[C@@H](C)CO 34a_100009863599_100000059175 [0,1,0,0,0,0|2,0,0]=3 4585 B15R0.172 COC(=O)CCCCCCOC[C@@H](C)CO 7a_100009863599_100000059175 [0,1,0,0,0,0|2,0,0]=3 4586 B15R0.172 COC(=O)CCCCCCOC[C@@H](O)CF 34a_100009863599_100015614560 [0,1,0,0,0,0|2,0,0]=3 4587 B15R0.172 COC(=O)CCCCCCOC[C@@H](O)CF 7a_100009863599_100015614560 [0,1,0,0,0,0|2,0,0]=3 4588 B15R0.172 COC(=O)CCCCCCOC[C@@H](O)CO 34a_100009863599_100009815848 [0,1,0,0,0,0|2,0,0]=3 4589 B15R0.172 COC(=O)CCCCCCOC[C@@H](O)CO 7a_100009863599_100009815848 [0,1,0,0,0,0|2,0,0]=3 4590 B15R0.172 COC(=O)CCCCCCOC[C@H](F)CN 34a_100015665980_100009815986 [0,1,0,0,0,0|2,0,0]=3 4591 B15R0.172 COC(=O)CCCCCCSCC(=O)OC 62a_100000747449_100009815986 [0,1,0,0,0,0|2,0,1]=4 4592 B15R0.172 COC(=O)CCCCCCSCC(=O)OC 62a_100009815986_100000747449 [0,1,0,0,0,0|2,0,1]=4 4593 B15R0.172 COC(=O)CCCCCCSCC(O)CO 62a_100009815986_100011219619 [0,1,0,0,0,0|2,0,0]=3 4594 B15R0.172 COC(=O)CCCCCCSCC(O)CO 62a_100011219619_100009815986 [0,1,0,0,0,0|2,0,0]=3 4595 B15R0.172 COC(=O)CCCCCCSC[C@@H](C)CO 62a_100000059175_100009815986 [0,1,0,0,0,0|2,0,0]=3 4596 B15R0.172 COC(=O)CCCCCCSC[C@@H](C)CO 62a_100009815986_100000059175 [0,1,0,0,0,0|2,0,0]=3 4597 B15R0.172 COC(=O)CCCCCCSC[C@@H](O)CF 62a_100009815986_100015614560 [0,1,0,0,0,0|2,0,0]=3 4598 B15R0.172 COC(=O)CCCCCCSC[C@@H](O)CF 62a_100015614560_100009815986 [0,1,0,0,0,0|2,0,0]=3 4599 B15R0.172 COC(=O)CCCCCCSC[C@@H](O)CO 62a_100009815848_100009815986 [0,1,0,0,0,0|2,0,0]=3 4600 B15R0.172 COC(=O)CCCCCCSC[C@@H](O)CO 62a_100009815986_100009815848 [0,1,0,0,0,0|2,0,0]=3 4601 B15R0.172 COC(=O)CCCCCNCCC(C)CO 2230a_106354213184_100009816466 [0,1,0,0,0,0|2,0,0]=3 4602 B15R0.172 COC(=O)CCCCCNCCC(C)CO 34a_106354213184_100009816466 [0,1,0,0,0,0|2,0,0]=3 4603 B15R0.172 COC(=O)CCCCCOCCC(=O)OC 34a_100000074720_100000742370 [0,1,0,0,0,0|2,0,1]=4 4604 B15R0.172 COC(=O)CCCCCOCCC(=O)OC 7a_100000074720_100000204255 [0,1,0,0,0,0|2,0,1]=4 4605 B15R0.172 COC(=O)CCCCCOCCC(C)OC 7a_100000764861_100009816466 [0,1,0,0,0,0|2,0,0]=3 4606 B15R0.172 COC(=O)CCCCCSCCC(=O)OC 62a_100000204255_100009816466 [0,1,0,0,0,0|2,0,1]=4 4607 B15R0.172 COC(=O)CCCCCSCCC(=O)OC 62a_100009816466_100000204255 [0,1,0,0,0,0|2,0,1]=4 4608 B15R0.172 COC(=O)CCCCOCCCC(=O)OC 34a_100000059025_100000742333 [0,1,0,0,0,0|2,0,1]=4 4609 B15R0.172 COC(=O)CCCCOCCCC(=O)OC 7a_100000059025_100011218270 [0,1,0,0,0,0|2,0,1]=4 4610 B15R0.172 COC(=O)CCCCOCCC[C@@H](C)CN 34a_100160569302_100000204269 [0,1,0,0,0,0|2,0,0]=3 4611 B15R0.172 COC(=O)CCCCSCCCC(=O)OC 62a_100000204269_100011218270 [0,1,0,0,0,0|2,0,1]=4 4612 B15R0.172 COC(=O)CCCCSCCCC(=O)OC 62a_100011218270_100000204269 [0,1,0,0,0,0|2,0,1]=4 4613 B15R0.172 COC(=O)COCCOCCC[C@@H](C)CN 34a_100160569302_100000090808 [0,1,0,0,0,0|3,0,0]=4 4614 B15R0.189 C#CCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100010269958 [0,1,0,0,0,0|0,0,3]=4 4615 B15R0.189 C#CCCCCC(=O)CCCCC(=O)OC 1458a_100000696528_100000204269 [0,1,0,0,0,0|0,0,3]=4 4616 B15R0.189 C=CCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011215482 [0,1,0,0,0,0|0,0,3]=4 4617 B15R0.189 C=CCCCCC(=O)CCCCC(=O)OC 1458a_100011215552_100000204269 [0,1,0,0,0,0|0,0,3]=4 4618 B15R0.189 C=CCCCCN(C)CCCCC(=O)OC 2230a_100012000471_100000204269 [0,1,0,0,0,0|1,0,2]=4 4619 B15R0.189 C=CCCCCN(C)CCCCC(=O)OC 269982a_100012000471_100000204269 [0,1,0,0,0,0|1,0,2]=4 4620 B15R0.189 CC/C=C\CCC(=O)CCCCC(=O)OC 1458a_100000695723_100015370543 [0,1,0,0,0,0|0,0,3]=4 4621 B15R0.189 CCC/C=C/CC(=O)CCCCC(=O)OC 1458a_200016266809_100000204269 [0,1,0,0,0,0|0,0,3]=4 4622 B15R0.189 CCCCC=CC(=O)CCCCC(=O)OC 1458a_100016266645_100000204269 [0,1,0,0,0,0|0,0,3]=4 4623 B15R0.189 CCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210757 [0,1,0,0,0,0|0,0,1]=2 4624 B15R0.189 CCCCCCC(=O)CCCCC(=O)OC 1458a_100102632555_100000204269 [0,1,0,0,0,0|0,0,1]=2 4625 B15R0.189 CCCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210757 [0,1,0,0,0,0|1,0,1]=3 4626 B15R0.189 CCCCCCC(=O)CCOCC(=O)OC 1458a_100102632555_100000090808 [0,1,0,0,0,0|1,0,1]=3 4627 B15R0.189 CCCCCCC(=O)NCCCC(=O)NC 11a_100000740002_100102632555 [0,1,0,0,0,0|2,0,1]=4 4628 B15R0.189 CCCCCCC(=O)NCCCC(=O)NC 240690a_100000740002_100102632555 [0,1,0,0,0,0|2,0,1]=4 4629 B15R0.189 CCCCCCC(=O)NCCCC(=O)NC 527a_100000740002_100102632555 [0,1,0,0,0,0|2,0,1]=4 4630 B15R0.189 CCCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100102632555 [0,1,0,0,0,0|1,0,1]=3 4631 B15R0.189 CCCCCCC(C)CCOCC(=O)CC 7a_200011024964_100000747405 [0,1,0,0,0,0|2,0,0]=3 4632 B15R0.189 CCCCCCC(C)CCOCC(=O)NC 34a_200011024964_100000183359 [0,1,0,0,0,0|2,0,0]=3 4633 B15R0.189 CCCCCCC(C)CCOCC(=O)NC 7a_200011024964_100000183359 [0,1,0,0,0,0|2,0,0]=3 4634 B15R0.189 CCCCCCC(C)CCOCC(=O)OC 34a_200011024964_100000747449 [0,1,0,0,0,0|1,0,0]=2 4635 B15R0.189 CCCCCCC(C)CCOCC(=O)OC 7a_200011024964_100000747449 [0,1,0,0,0,0|1,0,0]=2 4636 B15R0.189 CCCCCCC(C)NC/C=C/C(=O)OC 2230a_100000210919_100000742655 [0,1,0,0,0,0|1,0,2]=4 4637 B15R0.189 CCCCCCC(C)NC/C=C/C(=O)OC 34a_100000210919_100000742655 [0,1,0,0,0,0|1,0,2]=4 4638 B15R0.189 CCCCCCC(C)NCCCC(=O)NC 2230a_100000210919_100000741757 [0,1,0,0,0,0|2,0,0]=3 4639 B15R0.189 CCCCCCC(C)NCCCC(=O)NC 2230a_100000740002_100011215978 [0,1,0,0,0,0|2,0,0]=3 4640 B15R0.189 CCCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100000210826 [0,1,0,0,0,0|2,0,0]=3 4641 B15R0.189 CCCCCCC(C)NCCCC(=O)NC 34a_100000210919_100000741757 [0,1,0,0,0,0|2,0,0]=3 4642 B15R0.189 CCCCCCC(C)NCCCC(=O)NC 34a_100000740002_100011215978 [0,1,0,0,0,0|2,0,0]=3 4643 B15R0.189 CCCCCCC(C)NCCCC(=O)OC 2230a_100000210919_100011218270 [0,1,0,0,0,0|1,0,0]=2 4644 B15R0.189 CCCCCCC(C)NCCCC(=O)OC 34a_100000210919_100000742333 [0,1,0,0,0,0|1,0,0]=2 4645 B15R0.189 CCCCCCC(C)NCCNC(=O)CC 270004a_100132302217_100000210826 [0,1,0,0,0,0|3,0,0]=4 4646 B15R0.189 CCCCCCC(C)NCCNC(=O)CC 34a_100132302217_100011215978 [0,1,0,0,0,0|3,0,0]=4 4647 B15R0.189 CCCCCCC(C)NCCNC(=O)NC 34a_100015205895_100011215978 [0,1,0,0,0,0|3,0,0]=4 4648 B15R0.189 CCCCCCC(C)NCCOC(=O)NC 34a_100000210919_200011997002 [0,1,0,0,0,0|3,0,0]=4 4649 B15R0.189 CCCCCCC(C)OC/C=C/C(=O)OC 34a_100000210265_100000742655 [0,1,0,0,0,0|1,0,2]=4 4650 B15R0.189 CCCCCCC(C)OC/C=C/C(=O)OC 7a_100000210265_100000742655 [0,1,0,0,0,0|1,0,2]=4 4651 B15R0.189 CCCCCCC(C)OCCCC(=O)NC 34a_100000210265_100000741757 [0,1,0,0,0,0|2,0,0]=3 4652 B15R0.189 CCCCCCC(C)OCCCC(=O)NC 7a_100000210265_100000741757 [0,1,0,0,0,0|2,0,0]=3 4653 B15R0.189 CCCCCCC(C)OCCCC(=O)NN 34a_100000211488_100011215978 [0,1,0,0,0,0|3,0,0]=4 4654 B15R0.189 CCCCCCC(C)OCCCC(=O)OC 34a_100000210265_100000742333 [0,1,0,0,0,0|1,0,0]=2 4655 B15R0.189 CCCCCCC(C)OCCCC(=O)OC 7a_100000210265_100011218270 [0,1,0,0,0,0|1,0,0]=2 4656 B15R0.189 CCCCCCC(C)OCCNC(=O)CC 34a_200000158885_100011215978 [0,1,0,0,0,0|3,0,0]=4 4657 B15R0.189 CCCCCCC(C)OCCNC(=O)CC 7a_200000158885_100011215978 [0,1,0,0,0,0|3,0,0]=4 4658 B15R0.189 CCCCCCC(C)OCCNC(=O)OC 34a_100000757965_100011215978 [0,1,0,0,0,0|2,0,0]=3 4659 B15R0.189 CCCCCCC(C)OCCOC(=O)CC 7a_200000031056_100011215978 [0,1,0,0,0,0|3,0,0]=4 4660 B15R0.189 CCCCCCC(C)OCCOC(=O)NC 34a_100000210265_200011997002 [0,1,0,0,0,0|3,0,0]=4 4661 B15R0.189 CCCCCCC(C)OCCOC(=O)NC 7a_100000210265_200011997002 [0,1,0,0,0,0|3,0,0]=4 4662 B15R0.189 CCCCCCC(C)OCCOC(=O)OC 34a_100010262106_100011215978 [0,1,0,0,0,0|2,0,0]=3 4663 B15R0.189 CCCCCCC(C)SC/C=C/C(=O)OC 62a_100000742655_100011215978 [0,1,0,0,0,0|1,0,2]=4 4664 B15R0.189 CCCCCCC(C)SC/C=C/C(=O)OC 62a_100011215978_100000742655 [0,1,0,0,0,0|1,0,2]=4 4665 B15R0.189 CCCCCCC(C)SCCCC(=O)NC 62a_100000741757_100011215978 [0,1,0,0,0,0|2,0,0]=3 4666 B15R0.189 CCCCCCC(C)SCCCC(=O)NC 62a_100011215978_100000741757 [0,1,0,0,0,0|2,0,0]=3 4667 B15R0.189 CCCCCCC(C)SCCCC(=O)OC 62a_100011215978_100011218270 [0,1,0,0,0,0|1,0,0]=2 4668 B15R0.189 CCCCCCC(C)SCCCC(=O)OC 62a_100011218270_100011215978 [0,1,0,0,0,0|1,0,0]=2 4669 B15R0.189 CCCCCCC(C)SCCOC(=O)NC 62a_100011215978_200011997002 [0,1,0,0,0,0|3,0,0]=4 4670 B15R0.189 CCCCCCC(C)SCCOC(=O)NC 62a_200011997002_100011215978 [0,1,0,0,0,0|3,0,0]=4 4671 B15R0.189 CCCCCCN(C)CCCCC(=O)OC 2230a_106256046315_100000204269 [0,1,0,0,0,0|1,0,0]=2 4672 B15R0.189 CCCCCCN(C)CCCCC(=O)OC 269982a_106256046315_100000204269 [0,1,0,0,0,0|1,0,0]=2 4673 B15R0.189 CCCCCCN(C)CCOCC(=O)OC 2230a_106256046315_100000090808 [0,1,0,0,0,0|2,0,0]=3 4674 B15R0.189 CCCCCNC(=O)CCCCC(=O)OC 11a_100000209983_100000695723 [0,1,0,0,0,0|1,0,1]=3 4675 B15R0.189 CCCCCNC(=O)CCCCC(=O)OC 1626a_100000209983_100000695723 [0,1,0,0,0,0|1,0,1]=3 4676 B15R0.189 CCCCCNC(=O)CCCCC(=O)OC 240690a_100000209983_100000695723 [0,1,0,0,0,0|1,0,1]=3 4677 B15R0.189 CCCCCNC(=O)CCCCC(=O)OC 527a_100000209983_100000695723 [0,1,0,0,0,0|1,0,1]=3 4678 B15R0.189 CCCCCNC(=O)CCCNC(=O)OC 11a_100000209983_100000753017 [0,1,0,0,0,0|2,0,1]=4 4679 B15R0.189 CCCCCNC(=O)CCCNC(=O)OC 1626a_100000209983_100000753017 [0,1,0,0,0,0|2,0,1]=4 4680 B15R0.189 CCCCCNC(=O)CCCNC(=O)OC 240690a_100000209983_100000753017 [0,1,0,0,0,0|2,0,1]=4 4681 B15R0.189 CCCCCNC(=O)CCCNC(=O)OC 527a_100000209983_100000753017 [0,1,0,0,0,0|2,0,1]=4 4682 B15R0.189 CCCCCNC(=O)CSCCC(=O)OC 62a_100000204255_100000230301 [0,1,0,0,0,0|2,0,1]=4 4683 B15R0.189 CCCCCNC(=O)CSCCC(=O)OC 62a_100000230301_100000204255 [0,1,0,0,0,0|2,0,1]=4 4684 B15R0.189 CCCCNCC(=O)NCCCC(=O)OC 2230a_100000102301_100000230218 [0,1,0,0,0,0|2,0,1]=4 4685 B15R0.189 CCCCNCC(=O)NCCCC(=O)OC 7a_106832991798_100000230218 [0,1,0,0,0,0|2,0,1]=4 4686 B15R0.189 CCCCNN=C(C)CCCCC(=O)OC 4a_100025702795_100010369326 [0,1,0,0,0,0|2,0,1]=4 4687 B15R0.189 CCCCNNC(=O)CCCCC(=O)OC 22a_100025702795_100000695723 [0,1,0,0,0,0|2,0,1]=4 4688 B15R0.189 CCCCOCC(=O)CCCCC(=O)OC 1458a_100000695723_100011995733 [0,1,0,0,0,0|1,0,1]=3 4689 B15R0.189 CCCCOCC(=O)CCCCC(=O)OC 1458a_100000757543_100000204269 [0,1,0,0,0,0|1,0,1]=3 4690 B15R0.189 CCCCOCC(=O)CCCNC(=O)OC 1458a_100000753017_100011995733 [0,1,0,0,0,0|2,0,1]=4 4691 B15R0.189 CCCCOCC(=O)CCOCC(=O)OC 1458a_100000757543_100000090808 [0,1,0,0,0,0|2,0,1]=4 4692 B15R0.189 CCCCOCC(=O)NCCCC(=O)OC 188690a_100000184769_100000757543 [0,1,0,0,0,0|2,0,1]=4 4693 B15R0.189 CCCCOCC(=O)NCCCC(=O)OC 34a_100000210227_100000230218 [0,1,0,0,0,0|2,0,1]=4 4694 B15R0.189 CCCCOCC(=O)NCCCC(=O)OC 7a_100000210227_100000230218 [0,1,0,0,0,0|2,0,1]=4 4695 B15R0.189 CCCCOCC(C)OCCCC(=O)NC 34a_100011217071_100000741757 [0,1,0,0,0,0|3,0,0]=4 4696 B15R0.189 CCCCOCC(C)OCCCC(=O)NC 7a_100011217071_100000741757 [0,1,0,0,0,0|3,0,0]=4 4697 B15R0.189 CCCCOCC(C)OCCCC(=O)OC 34a_100011217071_100000742333 [0,1,0,0,0,0|2,0,0]=3 4698 B15R0.189 CCCCOCC(C)OCCCC(=O)OC 7a_100011217071_100011218270 [0,1,0,0,0,0|2,0,0]=3 4699 B15R0.189 CCCCSCC(=O)CCCCC(=O)OC 1458a_100000191162_100000204269 [0,1,0,0,0,0|1,0,1]=3 4700 B15R0.189 CCCCSCC(=O)CCOCC(=O)OC 1458a_100000191162_100000090808 [0,1,0,0,0,0|2,0,1]=4 4701 B15R0.189 CCCCSCC(=O)NCCCC(=O)OC 188690a_100000184769_100000191162 [0,1,0,0,0,0|2,0,1]=4 4702 B15R0.189 CCCCSCC(=O)NCCCC(=O)OC 62a_100000210211_100000230218 [0,1,0,0,0,0|2,0,1]=4 4703 B15R0.189 CCCCSCC(=O)NCCCC(=O)OC 62a_100000230218_100000210210 [0,1,0,0,0,0|2,0,1]=4 4704 B15R0.189 CCCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011215938 [0,1,0,0,0,0|1,0,1]=3 4705 B15R0.189 CCCOCCC(=O)CCCNC(=O)OC 1458a_100000753017_100011215938 [0,1,0,0,0,0|2,0,1]=4 4706 B15R0.189 CCOCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100012232248 [0,1,0,0,0,0|1,0,1]=3 4707 B15R0.189 CCOCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100012232248 [0,1,0,0,0,0|2,0,1]=4 4708 B15R0.189 CCOCCNC(=O)CCCCC(=O)OC 11a_100011200944_100000695723 [0,1,0,0,0,0|2,0,1]=4 4709 B15R0.189 CCOCCNC(=O)CCCCC(=O)OC 1626a_102516460346_100000695723 [0,1,0,0,0,0|2,0,1]=4 4710 B15R0.189 CCOCCNC(=O)CCCCC(=O)OC 240690a_100011200944_100000695723 [0,1,0,0,0,0|2,0,1]=4 4711 B15R0.189 CCOCCNC(=O)CCCCC(=O)OC 527a_100011200944_100000695723 [0,1,0,0,0,0|2,0,1]=4 4712 B15R0.189 CCSCCNC(=O)CCCCC(=O)OC 11a_100000106463_100000695723 [0,1,0,0,0,0|2,0,1]=4 4713 B15R0.189 CCSCCNC(=O)CCCCC(=O)OC 1626a_100000106463_100000695723 [0,1,0,0,0,0|2,0,1]=4 4714 B15R0.189 CCSCCNC(=O)CCCCC(=O)OC 240690a_100000106463_100000695723 [0,1,0,0,0,0|2,0,1]=4 4715 B15R0.189 CCSCCNC(=O)CCCCC(=O)OC 527a_100000106463_100000695723 [0,1,0,0,0,0|2,0,1]=4 4716 B15R0.189 COC(=O)CCCCC(=O)CCCCC#N 1458a_100000695723_100000211819 [0,1,0,0,0,0|1,0,2]=4 4717 B15R0.189 COC(=O)CCCCC(=O)CCCCCF 1458a_100000695723_100000729378 [0,1,0,0,0,0|1,0,1]=3 4718 B15R0.189 COC(=O)CCCCC(=O)CCCCCO 1458a_100000695723_100000746330 [0,1,0,0,0,0|1,0,1]=3 4719 B15R0.189 COC(=O)CCCCC(=O)CCCCCO 1458a_100102619762_100000204269 [0,1,0,0,0,0|1,0,1]=3 4720 B15R0.189 COC(=O)CCCCC(=O)CCOCCO 1458a_100000695723_100011215305 [0,1,0,0,0,0|2,0,1]=4 4721 B15R0.189 COC(=O)CCCCC(=O)CCOCCO 1458a_100011229844_100000204269 [0,1,0,0,0,0|2,0,1]=4 4722 B15R0.189 COC(=O)CCCCC(=O)NCCCCO 240690a_100000750430_100000695723 [0,1,0,0,0,0|2,0,1]=4 4723 B15R0.189 COC(=O)CCCCC(=O)NCCCCO 527a_100000750430_100000695723 [0,1,0,0,0,0|2,0,1]=4 4724 B15R0.189 COC(=O)CCCCC(=O)NCCCSC 11a_100000749238_100000695723 [0,1,0,0,0,0|2,0,1]=4 4725 B15R0.189 COC(=O)CCCCC(=O)NCCCSC 1626a_100000749238_100000695723 [0,1,0,0,0,0|2,0,1]=4 4726 B15R0.189 COC(=O)CCCCC(=O)NCCCSC 240690a_100000749238_100000695723 [0,1,0,0,0,0|2,0,1]=4 4727 B15R0.189 COC(=O)CCCCC(=O)NCCCSC 527a_100000749238_100000695723 [0,1,0,0,0,0|2,0,1]=4 4728 B15R0.189 COC(=O)CCCCN(C)CCCCCO 2230a_100000722520_100000204269 [0,1,0,0,0,0|2,0,0]=3 4729 B15R0.189 COC(=O)CCCCN(C)CCCCCO 269982a_100000722520_100000204269 [0,1,0,0,0,0|2,0,0]=3 4730 B15R0.189 COC(=O)CCCCN(C)CCOCCO 2230a_100000228057_100000204269 [0,1,0,0,0,0|3,0,0]=4 4731 B15R0.189 COC(=O)CCCCN(C)CCOCCO 269982a_100000228057_100000204269 [0,1,0,0,0,0|3,0,0]=4 4732 B15R0.189 COC(=O)CCCNC(=O)CCCCCO 188690a_100000184769_100102619762 [0,1,0,0,0,0|2,0,1]=4 4733 B15R0.189 COC(=O)COCCC(=O)CCCCCO 1458a_100102619762_100000090808 [0,1,0,0,0,0|2,0,1]=4 4734 B15R0.189 COC(=O)COCCN(C)CCCCCO 2230a_100000722520_100000090808 [0,1,0,0,0,0|3,0,0]=4 4735 B15R0.189 COC(=O)NCCCC(=O)CCCCCF 1458a_100000753017_100000729378 [0,1,0,0,0,0|2,0,1]=4 4736 B15R0.189 COC(=O)NCCCC(=O)CCCCCO 1458a_100000753017_100000746330 [0,1,0,0,0,0|2,0,1]=4 4737 B15R0.189 COCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000755781 [0,1,0,0,0,0|1,0,1]=3 4738 B15R0.189 COCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000755781 [0,1,0,0,0,0|2,0,1]=4 4739 B15R0.189 COCCCNC(=O)CCCCC(=O)OC 1626a_100150723488_100000695723 [0,1,0,0,0,0|2,0,1]=4 4740 B15R0.189 COCCCNC(=O)CCCCC(=O)OC 240690a_100150723488_100000695723 [0,1,0,0,0,0|2,0,1]=4 4741 B15R0.189 COCCCNC(=O)CCCCC(=O)OC 527a_100150723488_100000695723 [0,1,0,0,0,0|2,0,1]=4 4742 B15R0.189 COCCOCC(=O)CCCCC(=O)OC 1458a_100000211095_100000204269 [0,1,0,0,0,0|2,0,1]=4 4743 B15R0.209 C#CCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000753159 [0,1,0,0,0,0|0,0,3]=4 4744 B15R0.209 C#CCCC(=O)CCCCCCC(=O)OC 1458a_100000692101_100009815986 [0,1,0,0,0,0|0,0,3]=4 4745 B15R0.209 C/C=C/CC(=O)CCCCCCC(=O)OC 1458a_100000036694_100102629194 [0,1,0,0,0,0|0,0,3]=4 4746 B15R0.209 C=CCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000754431 [0,1,0,0,0,0|0,0,3]=4 4747 B15R0.209 C=CCCC(=O)CCCCCCC(=O)OC 1458a_100000749702_100009815986 [0,1,0,0,0,0|0,0,3]=4 4748 B15R0.209 C=CCCC(C)OCCCCCC(=O)OC 34a_100000765329_100009816466 [0,1,0,0,0,0|1,0,2]=4 4749 B15R0.209 C=CCCC(C)OCCCCCC(=O)OC 7a_100000765329_100009816466 [0,1,0,0,0,0|1,0,2]=4 4750 B15R0.209 C=CCCN(C)CCCCCCC(=O)OC 2230a_100020639649_100009815986 [0,1,0,0,0,0|1,0,2]=4 4751 B15R0.209 C=CCCN(C)CCCCCCC(=O)OC 269982a_100020639649_100009815986 [0,1,0,0,0,0|1,0,2]=4 4752 B15R0.209 CC#CCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000748600 [0,1,0,0,0,0|0,0,3]=4 4753 B15R0.209 CC=CCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000070051 [0,1,0,0,0,0|0,0,3]=4 4754 B15R0.209 CC=CCC(=O)CCCCCCC(=O)OC 1458a_100121576822_100009815986 [0,1,0,0,0,0|0,0,3]=4 4755 B15R0.209 CCC#CC(=O)CCCCCCC(=O)OC 1458a_100011827653_100009815986 [0,1,0,0,0,0|0,0,3]=4 4756 B15R0.209 CCC#CC(C)OCCCCCC(=O)OC 34a_100000033903_100009816466 [0,1,0,0,0,0|1,0,2]=4 4757 B15R0.209 CCC#CC(C)OCCCCCC(=O)OC 7a_100000033903_100009816466 [0,1,0,0,0,0|1,0,2]=4 4758 B15R0.209 CCC=CC(=O)CCCCCCC(=O)OC 1458a_100000212282_100009815986 [0,1,0,0,0,0|0,0,3]=4 4759 B15R0.209 CCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210211 [0,1,0,0,0,0|0,0,1]=2 4760 B15R0.209 CCCCC(=O)CCCCCCC(=O)OC 1458a_100000210183_100009815986 [0,1,0,0,0,0|0,0,1]=2 4761 B15R0.209 CCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000210183 [0,1,0,0,0,0|1,0,1]=3 4762 B15R0.209 CCCCC(=O)NCCOCCC(=O)OC 188690a_100102954618_100000210183 [0,1,0,0,0,0|2,0,1]=4 4763 B15R0.209 CCCCC(C)CCCCOCC(=O)CC 7a_200011021034_100000747405 [0,1,0,0,0,0|2,0,0]=3 4764 B15R0.209 CCCCC(C)CCCCOCC(=O)NC 34a_200011021034_100000183359 [0,1,0,0,0,0|2,0,0]=3 4765 B15R0.209 CCCCC(C)CCCCOCC(=O)NC 7a_200011021034_100000183359 [0,1,0,0,0,0|2,0,0]=3 4766 B15R0.209 CCCCC(C)CCCCOCC(=O)OC 34a_200011021034_100000747449 [0,1,0,0,0,0|1,0,0]=2 4767 B15R0.209 CCCCC(C)CCCCOCC(=O)OC 7a_200011021034_100000747449 [0,1,0,0,0,0|1,0,0]=2 4768 B15R0.209 CCCCC(C)COCCCCC(=O)OC 34a_100011995851_100000204269 [0,1,0,0,0,0|1,0,0]=2 4769 B15R0.209 CCCCC(C)COCCCCC(=O)OC 7a_100011995851_100000204269 [0,1,0,0,0,0|1,0,0]=2 4770 B15R0.209 CCCCC(C)COCCOCC(=O)OC 34a_100011995851_100000090808 [0,1,0,0,0,0|2,0,0]=3 4771 B15R0.209 CCCCC(C)COCCOCC(=O)OC 7a_100011995851_100000090808 [0,1,0,0,0,0|2,0,0]=3 4772 B15R0.209 CCCCC(C)NCCCCCC(=O)OC 2230a_100000126638_100009816466 [0,1,0,0,0,0|1,0,0]=2 4773 B15R0.209 CCCCC(C)OCCCCCC(=O)OC 34a_100000074720_200011215066 [0,1,0,0,0,0|1,0,0]=2 4774 B15R0.209 CCCCC(C)OCCCCCC(=O)OC 34a_100000687866_100009816466 [0,1,0,0,0,0|1,0,0]=2 4775 B15R0.209 CCCCC(C)OCCCCCC(=O)OC 7a_100000074720_200011215066 [0,1,0,0,0,0|1,0,0]=2 4776 B15R0.209 CCCCC(C)OCCCCCC(=O)OC 7a_100000687866_100009816466 [0,1,0,0,0,0|1,0,0]=2 4777 B15R0.209 CCCCC(C)SCCCCCC(=O)OC 62a_100009816466_200011215066 [0,1,0,0,0,0|1,0,0]=2 4778 B15R0.209 CCCCC(C)SCCCCCC(=O)OC 62a_200011215066_100009816466 [0,1,0,0,0,0|1,0,0]=2 4779 B15R0.209 CCCCN(C)CCCCCCC(=O)OC 2230a_100000207549_100009815986 [0,1,0,0,0,0|1,0,0]=2 4780 B15R0.209 CCCCN(C)CCCCCCC(=O)OC 269982a_100000207549_100009815986 [0,1,0,0,0,0|1,0,0]=2 4781 B15R0.209 CCCC[C@H](N)COCCCCC(=O)OC 34a_100011934283_100000204269 [0,1,0,0,0,0|1,0,0]=2 4782 B15R0.209 CCCC[C@H](N)COCCOCC(=O)OC 34a_100011934283_100000090808 [0,1,0,0,0,0|2,0,0]=3 4783 B15R0.209 CCCNC(=O)CCCCCCC(=O)OC 11a_100020643023_100000036694 [0,1,0,0,0,0|1,0,1]=3 4784 B15R0.209 CCCNC(=O)CCCCCCC(=O)OC 1626a_100020643023_100000036694 [0,1,0,0,0,0|1,0,1]=3 4785 B15R0.209 CCCNC(=O)CCCCCCC(=O)OC 240690a_100020643023_100000036694 [0,1,0,0,0,0|1,0,1]=3 4786 B15R0.209 CCCNC(=O)CCCSCCC(=O)OC 62a_100000204255_100011194427 [0,1,0,0,0,0|2,0,1]=4 4787 B15R0.209 CCCNC(=O)CCCSCCC(=O)OC 62a_100011194427_100000204255 [0,1,0,0,0,0|2,0,1]=4 4788 B15R0.209 CCCNC(=O)CNCCCCC(=O)OC 2230a_100000174927_100000204269 [0,1,0,0,0,0|2,0,1]=4 4789 B15R0.209 CCCNC(=O)COCCCCC(=O)OC 34a_100000059025_100000183358 [0,1,0,0,0,0|2,0,1]=4 4790 B15R0.209 CCCNC(=O)COCCCCC(=O)OC 7a_100000059025_100000183358 [0,1,0,0,0,0|2,0,1]=4 4791 B15R0.209 CCCNC(=O)CSCCCCC(=O)OC 62a_100000183358_100000204269 [0,1,0,0,0,0|2,0,1]=4 4792 B15R0.209 CCCNC(=O)CSCCCCC(=O)OC 62a_100000204269_100000183358 [0,1,0,0,0,0|2,0,1]=4 4793 B15R0.209 CCCOC(=O)COCCCCC(=O)OC 34a_100000059025_200011215008 [0,1,0,0,0,0|2,0,1]=4 4794 B15R0.209 CCCOC(=O)COCCCCC(=O)OC 7a_100000059025_200011215008 [0,1,0,0,0,0|2,0,1]=4 4795 B15R0.209 CCCOC(=O)CSCCCCC(=O)OC 62a_100000204269_200011215008 [0,1,0,0,0,0|2,0,1]=4 4796 B15R0.209 CCCOC(=O)CSCCCCC(=O)OC 62a_200011215008_100000204269 [0,1,0,0,0,0|2,0,1]=4 4797 B15R0.209 CCCOC(C)CNCCCCC(=O)OC 2230a_100015185124_100000204269 [0,1,0,0,0,0|2,0,0]=3 4798 B15R0.209 CCCOC(C)CNCCCCC(=O)OC 34a_100015185124_100000204269 [0,1,0,0,0,0|2,0,0]=3 4799 B15R0.209 CCCOC(C)CNCCOCC(=O)OC 2230a_100015185124_100000090808 [0,1,0,0,0,0|3,0,0]=4 4800 B15R0.209 CCCOC(C)CNCCOCC(=O)OC 34a_100015185124_100000090808 [0,1,0,0,0,0|3,0,0]=4 4801 B15R0.209 CCNNC(=O)CCCCCCC(=O)OC 22a_100000756455_100000036694 [0,1,0,0,0,0|2,0,1]=4 4802 B15R0.209 CCOCC(=O)CCCCCCC(=O)OC 1458a_100000211967_100009815986 [0,1,0,0,0,0|1,0,1]=3 4803 B15R0.209 CCOCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000211967 [0,1,0,0,0,0|2,0,1]=4 4804 B15R0.209 CCOCC(C)OCCCCCC(=O)OC 34a_100000718985_100009816466 [0,1,0,0,0,0|2,0,0]=3 4805 B15R0.209 CCOCC(C)OCCCCCC(=O)OC 7a_100000718985_100009816466 [0,1,0,0,0,0|2,0,0]=3 4806 B15R0.209 CCOCC(O)CNCCCCC(=O)OC 2230a_102515437182_100000204269 [0,1,0,0,0,0|2,0,0]=3 4807 B15R0.209 CCOCC(O)CNCCCCC(=O)OC 34a_102515437182_100000204269 [0,1,0,0,0,0|2,0,0]=3 4808 B15R0.209 CCOCC(O)CNCCOCC(=O)OC 2230a_102515437182_100000090808 [0,1,0,0,0,0|3,0,0]=4 4809 B15R0.209 CCOCC(O)CNCCOCC(=O)OC 34a_102515437182_100000090808 [0,1,0,0,0,0|3,0,0]=4 4810 B15R0.209 CCSCC(=O)CCCCCCC(=O)OC 1458a_100000230394_100009815986 [0,1,0,0,0,0|1,0,1]=3 4811 B15R0.209 CCSCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000230394 [0,1,0,0,0,0|2,0,1]=4 4812 B15R0.209 COC(=O)CCCCCCC(=O)CCC#N 1458a_100000036694_100011215226 [0,1,0,0,0,0|1,0,2]=4 4813 B15R0.209 COC(=O)CCCCCCC(=O)CCC#N 1458a_100011934036_100009815986 [0,1,0,0,0,0|1,0,2]=4 4814 B15R0.209 COC(=O)CCCCCCC(=O)CCCF 1458a_100000036694_100011934791 [0,1,0,0,0,0|1,0,1]=3 4815 B15R0.209 COC(=O)CCCCCCC(=O)CCCO 1458a_100000036694_100011215043 [0,1,0,0,0,0|1,0,1]=3 4816 B15R0.209 COC(=O)CCCCCCC(=O)CCSC 1458a_100000036694_100000751147 [0,1,0,0,0,0|1,0,1]=3 4817 B15R0.209 COC(=O)CCCCCCC(=O)CCSC 1458a_100000174002_100009815986 [0,1,0,0,0,0|1,0,1]=3 4818 B15R0.209 COC(=O)CCCCCCC(=O)NCCF 11a_100000724931_100000036694 [0,1,0,0,0,0|2,0,1]=4 4819 B15R0.209 COC(=O)CCCCCCC(=O)NCCF 1626a_100000724931_100000036694 [0,1,0,0,0,0|2,0,1]=4 4820 B15R0.209 COC(=O)CCCCCCC(=O)NCCF 240690a_100000724931_100000036694 [0,1,0,0,0,0|2,0,1]=4 4821 B15R0.209 COC(=O)CCCCCCC(=O)NCCO 240690a_100000210304_100000036694 [0,1,0,0,0,0|2,0,1]=4 4822 B15R0.209 COC(=O)CCCCCCN(C)CCC#N 2230a_100000184479_100009815986 [0,1,0,0,0,0|2,0,1]=4 4823 B15R0.209 COC(=O)CCCCCCN(C)CCCO 2230a_100000213112_100009815986 [0,1,0,0,0,0|2,0,0]=3 4824 B15R0.209 COC(=O)CCCCCCN(C)CCCO 269982a_100000213112_100009815986 [0,1,0,0,0,0|2,0,0]=3 4825 B15R0.209 COC(=O)CCCCCCN(C)CCSC 2230a_100000686725_100009815986 [0,1,0,0,0,0|2,0,0]=3 4826 B15R0.209 COC(=O)CCCCCCN(C)CCSC 269982a_100000686725_100009815986 [0,1,0,0,0,0|2,0,0]=3 4827 B15R0.209 COC(=O)CCCCCNC(=O)CCSC 188690a_100000184999_100000174002 [0,1,0,0,0,0|2,0,1]=4 4828 B15R0.209 COC(=O)CCCCCOC(C)CCCCl 34a_200000718107_100009816466 [0,1,0,0,0,0|2,0,0]=3 4829 B15R0.209 COC(=O)CCCCCOC(C)CCCCl 7a_200000718107_100009816466 [0,1,0,0,0,0|2,0,0]=3 4830 B15R0.209 COC(=O)CCCCNC[C@H](C)CCCO 2230a_100160569302_100000204269 [0,1,0,0,0,0|2,0,0]=3 4831 B15R0.209 COC(=O)CCCCNC[C@H](C)CCCO 34a_100160569302_100000204269 [0,1,0,0,0,0|2,0,0]=3 4832 B15R0.209 COC(=O)CCCCOC[C@@H](N)CCSC 34a_100011827619_100000204269 [0,1,0,0,0,0|2,0,0]=3 4833 B15R0.209 COC(=O)COCCNC[C@H](C)CCCO 2230a_100160569302_100000090808 [0,1,0,0,0,0|3,0,0]=4 4834 B15R0.209 COC(=O)COCCNC[C@H](C)CCCO 34a_100160569302_100000090808 [0,1,0,0,0,0|3,0,0]=4 4835 B15R0.209 COC(=O)COCCOC[C@@H](N)CCSC 34a_100011827619_100000090808 [0,1,0,0,0,0|3,0,0]=4 4836 B15R0.209 COCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000233755 [0,1,0,0,0,0|1,0,1]=3 4837 B15R0.209 COCCC(=O)CCCCCCC(=O)OC 1458a_100000749529_100009815986 [0,1,0,0,0,0|1,0,1]=3 4838 B15R0.209 COCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000749529 [0,1,0,0,0,0|2,0,1]=4 4839 B15R0.209 COCCN(C)CCCCCCC(=O)OC 2230a_100000743101_100009815986 [0,1,0,0,0,0|2,0,0]=3 4840 B15R0.209 COCCN(C)CCCCCCC(=O)OC 269982a_100000743101_100009815986 [0,1,0,0,0,0|2,0,0]=3 4841 B15R0.209 COCO[C@H](C)COCCCCC(=O)OC 34a_100016172286_100000204269 [0,1,0,0,0,0|3,0,0]=4 4842 B15R0.209 COCO[C@H](C)COCCCCC(=O)OC 7a_100016172286_100000204269 [0,1,0,0,0,0|3,0,0]=4 4843 B15R0.233 C#CCCCC(=O)CCCCCC(=O)OC 1458a_100000690238_100009816466 [0,1,0,0,0,0|0,0,3]=4 4844 B15R0.233 C#CCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000731252 [0,1,0,0,0,0|0,0,3]=4 4845 B15R0.233 C=CCCCC(=O)CCCCCC(=O)OC 1458a_100000766728_100009816466 [0,1,0,0,0,0|0,0,3]=4 4846 B15R0.233 C=CCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000757094 [0,1,0,0,0,0|0,0,3]=4 4847 B15R0.233 CC/C=C/CC(=O)CCCCCC(=O)OC 1458a_100016274230_100009816466 [0,1,0,0,0,0|0,0,3]=4 4848 B15R0.233 CC/C=C\CC(=O)CCCCCC(=O)OC 1458a_100009848860_100103147603 [0,1,0,0,0,0|0,0,3]=4 4849 B15R0.233 CCC#CCC(=O)CCCCCC(=O)OC 1458a_100009848860_100009813939 [0,1,0,0,0,0|0,0,3]=4 4850 B15R0.233 CCC#CCC(C)OCCCCC(=O)OC 34a_200000035118_100000204269 [0,1,0,0,0,0|1,0,2]=4 4851 B15R0.233 CCC#CCC(C)OCCCCC(=O)OC 7a_200000035118_100000204269 [0,1,0,0,0,0|1,0,2]=4 4852 B15R0.233 CCCC#CC(=O)CCCCCC(=O)OC 1458a_200011218047_100009816466 [0,1,0,0,0,0|0,0,3]=4 4853 B15R0.233 CCCC=CC(=O)CCCCCC(=O)OC 1458a_100000212230_100009816466 [0,1,0,0,0,0|0,0,3]=4 4854 B15R0.233 CCCCCC(=O)CCCCCC(=O)OC 1458a_100000212188_100009816466 [0,1,0,0,0,0|0,0,1]=2 4855 B15R0.233 CCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210326 [0,1,0,0,0,0|0,0,1]=2 4856 B15R0.233 CCCCCC(=O)CNCCCC(=O)NC 2230a_100000740002_200012276598 [0,1,0,0,0,0|2,0,1]=4 4857 B15R0.233 CCCCCC(=O)CNCCCC(=O)NC 34a_100000740002_200012276598 [0,1,0,0,0,0|2,0,1]=4 4858 B15R0.233 CCCCCC(=O)COCCNC(=O)OC 34a_100000757965_200012276598 [0,1,0,0,0,0|2,0,1]=4 4859 B15R0.233 CCCCCC(=O)COCCOC(=O)OC 34a_100010262106_200012276598 [0,1,0,0,0,0|2,0,1]=4 4860 B15R0.233 CCCCCC(=O)CSCCCC(=O)NC 62a_100000741757_200012276598 [0,1,0,0,0,0|2,0,1]=4 4861 B15R0.233 CCCCCC(=O)CSCCCC(=O)NC 62a_200012276598_100000741757 [0,1,0,0,0,0|2,0,1]=4 4862 B15R0.233 CCCCCC(=O)CSCCCC(=O)OC 62a_100011218270_200012276598 [0,1,0,0,0,0|1,0,1]=3 4863 B15R0.233 CCCCCC(=O)CSCCCC(=O)OC 62a_200012276598_100011218270 [0,1,0,0,0,0|1,0,1]=3 4864 B15R0.233 CCCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000212188 [0,1,0,0,0,0|1,0,1]=3 4865 B15R0.233 CCCCCC(C)NCCCCC(=O)OC 2230a_100000211957_100000204269 [0,1,0,0,0,0|1,0,0]=2 4866 B15R0.233 CCCCCC(C)NCCOCC(=O)OC 2230a_100000211957_100000090808 [0,1,0,0,0,0|2,0,0]=3 4867 B15R0.233 CCCCCC(C)OCCCCC(=O)OC 34a_100000059025_200011218191 [0,1,0,0,0,0|1,0,0]=2 4868 B15R0.233 CCCCCC(C)OCCCCC(=O)OC 34a_100011215632_100000204269 [0,1,0,0,0,0|1,0,0]=2 4869 B15R0.233 CCCCCC(C)OCCCCC(=O)OC 7a_100000059025_200011218191 [0,1,0,0,0,0|1,0,0]=2 4870 B15R0.233 CCCCCC(C)OCCCCC(=O)OC 7a_100011215632_100000204269 [0,1,0,0,0,0|1,0,0]=2 4871 B15R0.233 CCCCCC(C)OCCOCC(=O)OC 34a_100011215632_100000090808 [0,1,0,0,0,0|2,0,0]=3 4872 B15R0.233 CCCCCC(C)OCCOCC(=O)OC 7a_100011215632_100000090808 [0,1,0,0,0,0|2,0,0]=3 4873 B15R0.233 CCCCCC(C)SCCCCC(=O)OC 62a_100000204269_200011218191 [0,1,0,0,0,0|1,0,0]=2 4874 B15R0.233 CCCCCC(C)SCCCCC(=O)OC 62a_200011218191_100000204269 [0,1,0,0,0,0|1,0,0]=2 4875 B15R0.233 CCCCCC(C)SCCOCC(=O)OC 62a_100000090808_200011218191 [0,1,0,0,0,0|2,0,0]=3 4876 B15R0.233 CCCCCC(C)SCCOCC(=O)OC 62a_200011218191_100000090808 [0,1,0,0,0,0|2,0,0]=3 4877 B15R0.233 CCCCCN(C)CCCCCC(=O)OC 2230a_100000223495_100009816466 [0,1,0,0,0,0|1,0,0]=2 4878 B15R0.233 CCCCCN(C)CCCCCC(=O)OC 269982a_100000223495_100009816466 [0,1,0,0,0,0|1,0,0]=2 4879 B15R0.233 CCCCNC(=O)CCCCCC(=O)OC 11a_100000102301_100009848860 [0,1,0,0,0,0|1,0,1]=3 4880 B15R0.233 CCCCNC(=O)CCCCCC(=O)OC 1626a_100000102301_100009848860 [0,1,0,0,0,0|1,0,1]=3 4881 B15R0.233 CCCCNC(=O)CCCCCC(=O)OC 240690a_100000102301_100009848860 [0,1,0,0,0,0|1,0,1]=3 4882 B15R0.233 CCCCNC(=O)CSCCCC(=O)OC 62a_100000182744_100011218270 [0,1,0,0,0,0|2,0,1]=4 4883 B15R0.233 CCCCNC(=O)CSCCCC(=O)OC 62a_100011218270_100000182744 [0,1,0,0,0,0|2,0,1]=4 4884 B15R0.233 CCCCOC(=O)CSCCCC(=O)OC 62a_100000211628_100011218270 [0,1,0,0,0,0|2,0,1]=4 4885 B15R0.233 CCCCOC(=O)CSCCCC(=O)OC 62a_100011218270_100000211628 [0,1,0,0,0,0|2,0,1]=4 4886 B15R0.233 CCCNNC(=O)CCCCCC(=O)OC 22a_100000740057_100009848860 [0,1,0,0,0,0|2,0,1]=4 4887 B15R0.233 CCCOCC(=O)CCCCCC(=O)OC 1458a_100000745993_100009816466 [0,1,0,0,0,0|1,0,1]=3 4888 B15R0.233 CCCOCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000745993 [0,1,0,0,0,0|2,0,1]=4 4889 B15R0.233 CCCSCC(=O)CCCCCC(=O)OC 1458a_100000217233_100009816466 [0,1,0,0,0,0|1,0,1]=3 4890 B15R0.233 CCCSCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000217233 [0,1,0,0,0,0|2,0,1]=4 4891 B15R0.233 CCOCCC(=O)CCCCCC(=O)OC 1458a_100000749530_100009816466 [0,1,0,0,0,0|1,0,1]=3 4892 B15R0.233 CCOCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011215890 [0,1,0,0,0,0|1,0,1]=3 4893 B15R0.233 CCOCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000749530 [0,1,0,0,0,0|2,0,1]=4 4894 B15R0.233 CCSCCC(=O)CCCCCC(=O)OC 1458a_100000230768_100009816466 [0,1,0,0,0,0|1,0,1]=3 4895 B15R0.233 CCSCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000757381 [0,1,0,0,0,0|1,0,1]=3 4896 B15R0.233 CCSCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000230768 [0,1,0,0,0,0|2,0,1]=4 4897 B15R0.233 CNC(=O)CCCOC[C@@H](N)CCCCN 34a_100016993712_100000741757 [0,1,0,0,0,0|3,0,0]=4 4898 B15R0.233 COC(=O)CCCCCC(=O)CCCC#N 1458a_100000075515_100009816466 [0,1,0,0,0,0|1,0,2]=4 4899 B15R0.233 COC(=O)CCCCCC(=O)CCCC#N 1458a_100009848860_100000211468 [0,1,0,0,0,0|1,0,2]=4 4900 B15R0.233 COC(=O)CCCCCC(=O)CCCCF 1458a_100009848860_100000729493 [0,1,0,0,0,0|1,0,1]=3 4901 B15R0.233 COC(=O)CCCCCC(=O)CCCCO 1458a_100000695505_100009816466 [0,1,0,0,0,0|1,0,1]=3 4902 B15R0.233 COC(=O)CCCCCC(=O)CCCCO 1458a_100009848860_100000210776 [0,1,0,0,0,0|1,0,1]=3 4903 B15R0.233 COC(=O)CCCCCC(=O)CCCSC 1458a_100000173376_100009816466 [0,1,0,0,0,0|1,0,1]=3 4904 B15R0.233 COC(=O)CCCCCC(=O)COCCO 1458a_100000708028_100009816466 [0,1,0,0,0,0|2,0,1]=4 4905 B15R0.233 COC(=O)CCCCCC(=O)NCCCF 11a_100015189416_100009848860 [0,1,0,0,0,0|2,0,1]=4 4906 B15R0.233 COC(=O)CCCCCC(=O)NCCCF 1626a_100015189416_100009848860 [0,1,0,0,0,0|2,0,1]=4 4907 B15R0.233 COC(=O)CCCCCC(=O)NCCCF 240690a_100015189416_100009848860 [0,1,0,0,0,0|2,0,1]=4 4908 B15R0.233 COC(=O)CCCCCC(=O)NCCCO 240690a_100000182051_100009848860 [0,1,0,0,0,0|2,0,1]=4 4909 B15R0.233 COC(=O)CCCCCC(=O)NCCSC 11a_100020590264_100009848860 [0,1,0,0,0,0|2,0,1]=4 4910 B15R0.233 COC(=O)CCCCCC(=O)NCCSC 1626a_100020590264_100009848860 [0,1,0,0,0,0|2,0,1]=4 4911 B15R0.233 COC(=O)CCCCCC(=O)NCCSC 240690a_100020590264_100009848860 [0,1,0,0,0,0|2,0,1]=4 4912 B15R0.233 COC(=O)CCCCCN(C)CCCCO 2230a_100000717598_100009816466 [0,1,0,0,0,0|2,0,0]=3 4913 B15R0.233 COC(=O)CCCCCN(C)CCCCO 269982a_100000717598_100009816466 [0,1,0,0,0,0|2,0,0]=3 4914 B15R0.233 COC(=O)CCCCNC(=O)CCCCO 188690a_100000746077_100000695505 [0,1,0,0,0,0|2,0,1]=4 4915 B15R0.233 COC(=O)CCCCNC(=O)CCCSC 188690a_100000746077_100000173376 [0,1,0,0,0,0|2,0,1]=4 4916 B15R0.233 COC(=O)CCCOC[C@@H](N)CCCCN 34a_100016993712_100000742333 [0,1,0,0,0,0|2,0,0]=3 4917 B15R0.233 COCCCC(=O)CCCCCC(=O)OC 1458a_100000741012_100009816466 [0,1,0,0,0,0|1,0,1]=3 4918 B15R0.233 COCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000740836 [0,1,0,0,0,0|1,0,1]=3 4919 B15R0.233 COCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000741012 [0,1,0,0,0,0|2,0,1]=4 4920 B15R0.233 COCCCC(C)OCCCCC(=O)OC 34a_200011539412_100000204269 [0,1,0,0,0,0|2,0,0]=3 4921 B15R0.233 COCCCC(C)OCCCCC(=O)OC 7a_200011539412_100000204269 [0,1,0,0,0,0|2,0,0]=3 4922 B15R0.233 COCCCC(C)OCCOCC(=O)OC 34a_200011539412_100000090808 [0,1,0,0,0,0|3,0,0]=4 4923 B15R0.233 COCCCC(C)OCCOCC(=O)OC 7a_200011539412_100000090808 [0,1,0,0,0,0|3,0,0]=4 4924 B15R0.233 COCCCN(C)CCCCCC(=O)OC 2230a_100000224831_100009816466 [0,1,0,0,0,0|2,0,0]=3 4925 B15R0.233 COCCCN(C)CCCCCC(=O)OC 269982a_100000224831_100009816466 [0,1,0,0,0,0|2,0,0]=3 4926 B15R0.233 COCCNC(=O)CCCCCC(=O)OC 1626a_100000209980_100009848860 [0,1,0,0,0,0|2,0,1]=4 4927 B15R0.233 COCCNC(=O)CCCCCC(=O)OC 240690a_100000209980_100009848860 [0,1,0,0,0,0|2,0,1]=4 4928 B15R0.247 C=C(Br)CCOCCCCCCC(=O)OC 34a_100009813270_100009815986 [0,1,0,0,0,0|1,0,2]=4 4929 B15R0.247 C=C(C)CCOCCCCCCC(=O)OC 34a_100000764851_100009815986 [0,1,0,0,0,0|1,0,1]=3 4930 B15R0.247 C=C(C)CCOCCCCCCC(=O)OC 34a_100009863599_100000730704 [0,1,0,0,0,0|1,0,1]=3 4931 B15R0.247 C=C(C)CCOCCCCCCC(=O)OC 7a_100009863599_100000730704 [0,1,0,0,0,0|1,0,1]=3 4932 B15R0.247 C=C(C)CCSCCCCCCC(=O)OC 62a_100000730704_100009815986 [0,1,0,0,0,0|1,0,1]=3 4933 B15R0.247 C=C(C)CCSCCCCCCC(=O)OC 62a_100009815986_100000730704 [0,1,0,0,0,0|1,0,1]=3 4934 B15R0.247 C=C(C)COCCCCCCCC(=O)OC 34a_100000210245_100010004213 [0,1,0,0,0,0|1,0,1]=3 4935 B15R0.247 C=C(C)COCCCCCCCC(=O)OC 34a_100011022521_100000748629 [0,1,0,0,0,0|1,0,1]=3 4936 B15R0.247 C=C(C)COCCCCCCCC(=O)OC 7a_100011022521_100000748629 [0,1,0,0,0,0|1,0,1]=3 4937 B15R0.247 C=C(C)CSCCCCCCCC(=O)OC 62a_100000748629_100010004213 [0,1,0,0,0,0|1,0,1]=3 4938 B15R0.247 C=C(C)CSCCCCCCCC(=O)OC 62a_100010004213_100000211660 [0,1,0,0,0,0|1,0,1]=3 4939 B15R0.247 C=C(F)COCCCCCCCC(=O)OC 34a_100011022521_100009893438 [0,1,0,0,0,0|1,0,2]=4 4940 B15R0.247 C=C(F)COCCCCCCCC(=O)OC 34a_200010262243_100010004213 [0,1,0,0,0,0|1,0,2]=4 4941 B15R0.247 C=C(F)COCCCCCCCC(=O)OC 7a_100011022521_100000042424 [0,1,0,0,0,0|1,0,2]=4 4942 B15R0.247 C=C(F)CSCCCCCCCC(=O)OC 62a_100000042424_100010004213 [0,1,0,0,0,0|1,0,2]=4 4943 B15R0.247 C=C(F)CSCCCCCCCC(=O)OC 62a_100010004213_100000042424 [0,1,0,0,0,0|1,0,2]=4 4944 B15R0.247 CC(C)CCCCCOCCCC(=O)NN 34a_100000211488_100000210682 [0,1,0,0,0,0|3,0,0]=4 4945 B15R0.247 CCC(=O)COCCCCCCCC(C)C 7a_200000210741_100000747405 [0,1,0,0,0,0|2,0,0]=3 4946 B15R0.247 CCC(=O)NCCNCCCCCC(C)C 34a_100132302217_100000210682 [0,1,0,0,0,0|3,0,0]=4 4947 B15R0.247 CCC(=O)NCCOCCCCCC(C)C 34a_200000158885_100000210682 [0,1,0,0,0,0|3,0,0]=4 4948 B15R0.247 CCC(=O)NCCOCCCCCC(C)C 7a_200000158885_100000210682 [0,1,0,0,0,0|3,0,0]=4 4949 B15R0.247 CCC(=O)OCCOCCCCCC(C)C 7a_200000031056_100000210682 [0,1,0,0,0,0|3,0,0]=4 4950 B15R0.247 CNC(=O)CCCNCCCCCC(C)C 2230a_100000740002_100000210682 [0,1,0,0,0,0|2,0,0]=3 4951 B15R0.247 CNC(=O)CCCNCCCCCC(C)C 2230a_100011290863_100000741757 [0,1,0,0,0,0|2,0,0]=3 4952 B15R0.247 CNC(=O)CCCNCCCCCC(C)C 34a_100000740002_100000210682 [0,1,0,0,0,0|2,0,0]=3 4953 B15R0.247 CNC(=O)CCCNCCCCCC(C)C 34a_100011290863_100000741757 [0,1,0,0,0,0|2,0,0]=3 4954 B15R0.247 CNC(=O)CCCNCCCOCC(C)C 2230a_100000205972_100000741757 [0,1,0,0,0,0|3,0,0]=4 4955 B15R0.247 CNC(=O)CCCNCCCOCC(C)C 34a_100000205972_100000741757 [0,1,0,0,0,0|3,0,0]=4 4956 B15R0.247 CNC(=O)CCCOCCCCCC(C)C 34a_100011995859_100000741757 [0,1,0,0,0,0|2,0,0]=3 4957 B15R0.247 CNC(=O)CCCOCCCCCC(C)C 7a_100011995859_100000741757 [0,1,0,0,0,0|2,0,0]=3 4958 B15R0.247 CNC(=O)CCCOCCCCNC(C)C 34a_100011521146_100000741757 [0,1,0,0,0,0|3,0,0]=4 4959 B15R0.247 CNC(=O)CCCSCCCCCC(C)C 62a_100000210682_100000741757 [0,1,0,0,0,0|2,0,0]=3 4960 B15R0.247 CNC(=O)CCCSCCCCCC(C)C 62a_100000741757_100000210682 [0,1,0,0,0,0|2,0,0]=3 4961 B15R0.247 CNC(=O)CCNCCCCCCC(C)C 2230a_100000211014_100000737683 [0,1,0,0,0,0|2,0,0]=3 4962 B15R0.247 CNC(=O)CCNCCCCCCC(C)C 34a_100000211014_100012179268 [0,1,0,0,0,0|2,0,0]=3 4963 B15R0.247 CNC(=O)CCOCCCCCNC(C)C 34a_100011629493_100012179268 [0,1,0,0,0,0|3,0,0]=4 4964 B15R0.247 CNC(=O)COCCCCCCCC(C)C 34a_200000210741_100000183359 [0,1,0,0,0,0|2,0,0]=3 4965 B15R0.247 CNC(=O)COCCCCCCCC(C)C 7a_200000210741_100000183359 [0,1,0,0,0,0|2,0,0]=3 4966 B15R0.247 CNC(=O)NCCNCCCCCC(C)C 34a_100015205895_100000210682 [0,1,0,0,0,0|3,0,0]=4 4967 B15R0.247 CNC(=O)OCCNCCCCCC(C)C 34a_100011290863_200011997002 [0,1,0,0,0,0|3,0,0]=4 4968 B15R0.247 CNC(=O)OCCOCCCCCC(C)C 34a_100011995859_200011997002 [0,1,0,0,0,0|3,0,0]=4 4969 B15R0.247 CNC(=O)OCCOCCCCCC(C)C 7a_100011995859_200011997002 [0,1,0,0,0,0|3,0,0]=4 4970 B15R0.247 CNC(=O)OCCSCCCCCC(C)C 62a_100000210682_200011997002 [0,1,0,0,0,0|3,0,0]=4 4971 B15R0.247 CNC(=O)OCCSCCCCCC(C)C 62a_200011997002_100000210682 [0,1,0,0,0,0|3,0,0]=4 4972 B15R0.247 COC(=O)/C=C/CNCCCCCC(C)C 2230a_100011290863_100000742655 [0,1,0,0,0,0|1,0,2]=4 4973 B15R0.247 COC(=O)/C=C/CNCCCCCC(C)C 34a_100011290863_100000742655 [0,1,0,0,0,0|1,0,2]=4 4974 B15R0.247 COC(=O)/C=C/COCCCCCC(C)C 34a_100011995859_100000742655 [0,1,0,0,0,0|1,0,2]=4 4975 B15R0.247 COC(=O)/C=C/COCCCCCC(C)C 7a_100011995859_100000742655 [0,1,0,0,0,0|1,0,2]=4 4976 B15R0.247 COC(=O)/C=C/CSCCCCCC(C)C 62a_100000210682_100000742655 [0,1,0,0,0,0|1,0,2]=4 4977 B15R0.247 COC(=O)/C=C/CSCCCCCC(C)C 62a_100000742655_100000210682 [0,1,0,0,0,0|1,0,2]=4 4978 B15R0.247 COC(=O)CCCCCCCCCC(=O)C 1458a_100000070787_100009813843 [0,1,0,0,0,0|0,0,1]=2 4979 B15R0.247 COC(=O)CCCCCCCCCC(=O)C 1458a_100009997464_200000210301 [0,1,0,0,0,0|0,0,1]=2 4980 B15R0.247 COC(=O)CCCCCCCCCC(=O)[13CH3] 1458a_100009997464_200025704644 [0,1,0,0,0,0|0,0,1]=2 4981 B15R0.247 COC(=O)CCCCCCCCCN(C)C 2230a_100102631434_100009813843 [0,1,0,0,0,0|1,0,0]=2 4982 B15R0.247 COC(=O)CCCCCCCCCN(C)C 269982a_100102631434_100009813843 [0,1,0,0,0,0|1,0,0]=2 4983 B15R0.247 COC(=O)CCCCCCCCNC(C)C 2230a_100138425928_100010282707 [0,1,0,0,0,0|1,0,0]=2 4984 B15R0.247 COC(=O)CCCCCCCCNC(C)C 34a_100138425928_100010282707 [0,1,0,0,0,0|1,0,0]=2 4985 B15R0.247 COC(=O)CCCCCCCCOC(C)C 34a_100000035544_100000210206 [0,1,0,0,0,0|1,0,0]=2 4986 B15R0.247 COC(=O)CCCCCCCCOC(C)C 34a_100000212225_100010282707 [0,1,0,0,0,0|1,0,0]=2 4987 B15R0.247 COC(=O)CCCCCCCCOC(C)C 7a_100000035544_100000210206 [0,1,0,0,0,0|1,0,0]=2 4988 B15R0.247 COC(=O)CCCCCCCCSC(C)C 62a_100000210206_100010282707 [0,1,0,0,0,0|1,0,0]=2 4989 B15R0.247 COC(=O)CCCCCCCCSC(C)C 62a_100010282707_100000210206 [0,1,0,0,0,0|1,0,0]=2 4990 B15R0.247 COC(=O)CCCCCCCNCC(=O)N 2230a_100000711301_100010004213 [0,1,0,0,0,0|2,0,1]=4 4991 B15R0.247 COC(=O)CCCCCCCNCC(=O)O 269956a_100016091260_100010004213 [0,1,0,0,0,0|2,0,1]=4 4992 B15R0.247 COC(=O)CCCCCCCNCC(C)C 2230a_100000210953_100010004213 [0,1,0,0,0,0|1,0,0]=2 4993 B15R0.247 COC(=O)CCCCCCCNCC(C)C 34a_100000210953_100010004213 [0,1,0,0,0,0|1,0,0]=2 4994 B15R0.247 COC(=O)CCCCCCCNCC(C)O 2230a_100000210904_100010004213 [0,1,0,0,0,0|1,0,0]=2 4995 B15R0.247 COC(=O)CCCCCCCNCC(C)O 34a_100000210904_100010004213 [0,1,0,0,0,0|1,0,0]=2 4996 B15R0.247 COC(=O)CCCCCCCNCC(F)F 34a_100000765723_100010004213 [0,1,0,0,0,0|2,0,0]=3 4997 B15R0.247 COC(=O)CCCCCCCOCC(=O)C 34a_100000211253_100010004213 [0,1,0,0,0,0|1,0,1]=3 4998 B15R0.247 COC(=O)CCCCCCCOCC(=O)N 34a_100011022521_100000187820 [0,1,0,0,0,0|2,0,1]=4 4999 B15R0.247 COC(=O)CCCCCCCOCC(=O)N 7a_100011022521_100000187820 [0,1,0,0,0,0|2,0,1]=4 5000 B15R0.247 COC(=O)CCCCCCCOCC(=O)[O-] 34a_100011022521_100020667443 [0,1,0,0,0,0|2,0,1]=4 5001 B15R0.247 COC(=O)CCCCCCCOCC(C)Br 34a_100012180447_100010004213 [0,1,0,0,0,0|1,0,0]=2 5002 B15R0.247 COC(=O)CCCCCCCOCC(C)C 34a_100000210257_100010004213 [0,1,0,0,0,0|1,0,0]=2 5003 B15R0.247 COC(=O)CCCCCCCOCC(C)C 34a_100011022521_100000210624 [0,1,0,0,0,0|1,0,0]=2 5004 B15R0.247 COC(=O)CCCCCCCOCC(C)C 7a_100011022521_100000210760 [0,1,0,0,0,0|1,0,0]=2 5005 B15R0.247 COC(=O)CCCCCCCOCC(C)F 34a_100015925927_100010004213 [0,1,0,0,0,0|1,0,0]=2 5006 B15R0.247 COC(=O)CCCCCCCOCC(C)O 34a_100011022521_100011218427 [0,1,0,0,0,0|1,0,0]=2 5007 B15R0.247 COC(=O)CCCCCCCOCC(C)O 7a_100011022521_100011218427 [0,1,0,0,0,0|1,0,0]=2 5008 B15R0.247 COC(=O)CCCCCCCOCC(F)F 34a_100000743014_100010004213 [0,1,0,0,0,0|2,0,0]=3 5009 B15R0.247 COC(=O)CCCCCCCOCC(F)F 34a_100011022521_100011934356 [0,1,0,0,0,0|2,0,0]=3 5010 B15R0.247 COC(=O)CCCCCCCOCC(F)F 7a_100011022521_100011934356 [0,1,0,0,0,0|2,0,0]=3 5011 B15R0.247 COC(=O)CCCCCCCOC[C@@H](C)Cl 34a_100016084084_100010004213 [0,1,0,0,0,0|1,0,0]=2 5012 B15R0.247 COC(=O)CCCCCCCOC[C@@H](C)N 34a_100000737577_100010004213 [0,1,0,0,0,0|1,0,0]=2 5013 B15R0.247 COC(=O)CCCCCCCOC[C@@H](C)O 34a_100011022521_100009817552 [0,1,0,0,0,0|1,0,0]=2 5014 B15R0.247 COC(=O)CCCCCCCOC[C@@H](C)O 7a_100011022521_100009817552 [0,1,0,0,0,0|1,0,0]=2 5015 B15R0.247 COC(=O)CCCCCCCOC[N+](=O)[O-] 34a_100011022521_100000761209 [0,1,0,0,0,0|3,0,0]=4 5016 B15R0.247 COC(=O)CCCCCCCSCC(=O)N 62a_100000747473_100010004213 [0,1,0,0,0,0|2,0,1]=4 5017 B15R0.247 COC(=O)CCCCCCCSCC(=O)N 62a_100010004213_100000747473 [0,1,0,0,0,0|2,0,1]=4 5018 B15R0.247 COC(=O)CCCCCCCSCC(=O)[O-] 62a_100010004213_100020667443 [0,1,0,0,0,0|2,0,1]=4 5019 B15R0.247 COC(=O)CCCCCCCSCC(=O)[O-] 62a_100020667443_100010004213 [0,1,0,0,0,0|2,0,1]=4 5020 B15R0.247 COC(=O)CCCCCCCSCC(C)C 62a_100000210624_100010004213 [0,1,0,0,0,0|1,0,0]=2 5021 B15R0.247 COC(=O)CCCCCCCSCC(C)C 62a_100010004213_100000210760 [0,1,0,0,0,0|1,0,0]=2 5022 B15R0.247 COC(=O)CCCCCCCSCC(C)O 62a_100010004213_100011218427 [0,1,0,0,0,0|1,0,0]=2 5023 B15R0.247 COC(=O)CCCCCCCSCC(C)O 62a_100011218427_100010004213 [0,1,0,0,0,0|1,0,0]=2 5024 B15R0.247 COC(=O)CCCCCCCSCC(F)F 62a_100010004213_100011934356 [0,1,0,0,0,0|2,0,0]=3 5025 B15R0.247 COC(=O)CCCCCCCSCC(F)F 62a_100011934356_100010004213 [0,1,0,0,0,0|2,0,0]=3 5026 B15R0.247 COC(=O)CCCCCCCSC[C@@H](C)O 62a_100009817552_100010004213 [0,1,0,0,0,0|1,0,0]=2 5027 B15R0.247 COC(=O)CCCCCCCSC[C@@H](C)O 62a_100010004213_100009817552 [0,1,0,0,0,0|1,0,0]=2 5028 B15R0.247 COC(=O)CCCCCCCSC[N+](=O)[O-] 62a_100010004213_100000761209 [0,1,0,0,0,0|3,0,0]=4 5029 B15R0.247 COC(=O)CCCCCCNCC=C(C)C 34a_100000718196_100009815986 [0,1,0,0,0,0|1,0,2]=4 5030 B15R0.247 COC(=O)CCCCCCNCCC(C)O 2230a_200000755665_100009815986 [0,1,0,0,0,0|1,0,0]=2 5031 B15R0.247 COC(=O)CCCCCCOCC=C(C)C 34a_100000753907_100009815986 [0,1,0,0,0,0|1,0,2]=4 5032 B15R0.247 COC(=O)CCCCCCOCC=C(C)C 34a_100009863599_100000761012 [0,1,0,0,0,0|1,0,2]=4 5033 B15R0.247 COC(=O)CCCCCCOCC=C(C)C 7a_100009863599_100000761012 [0,1,0,0,0,0|1,0,2]=4 5034 B15R0.247 COC(=O)CCCCCCOCCC(=O)C 34a_100000759926_100009815986 [0,1,0,0,0,0|1,0,1]=3 5035 B15R0.247 COC(=O)CCCCCCOCCC(=O)C 7a_100000759926_100009815986 [0,1,0,0,0,0|1,0,1]=3 5036 B15R0.247 COC(=O)CCCCCCOCCC(=O)C 7a_100009863599_100000053229 [0,1,0,0,0,0|1,0,1]=3 5037 B15R0.247 COC(=O)CCCCCCOCCC(=O)N 34a_100000757172_100009815986 [0,1,0,0,0,0|2,0,1]=4 5038 B15R0.247 COC(=O)CCCCCCOCCC(=O)N 34a_100009863599_100000731001 [0,1,0,0,0,0|2,0,1]=4 5039 B15R0.247 COC(=O)CCCCCCOCCC(=O)N 7a_100000757172_100009815986 [0,1,0,0,0,0|2,0,1]=4 5040 B15R0.247 COC(=O)CCCCCCOCCC(=O)N 7a_100009863599_100000744528 [0,1,0,0,0,0|2,0,1]=4 5041 B15R0.247 COC(=O)CCCCCCOCCC(C)Br 34a_100009893172_100009815986 [0,1,0,0,0,0|1,0,0]=2 5042 B15R0.247 COC(=O)CCCCCCOCCC(C)C 34a_100000210254_100009815986 [0,1,0,0,0,0|1,0,0]=2 5043 B15R0.247 COC(=O)CCCCCCOCCC(C)C 34a_100009863599_100000210312 [0,1,0,0,0,0|1,0,0]=2 5044 B15R0.247 COC(=O)CCCCCCOCCC(C)C 7a_100000210254_100009815986 [0,1,0,0,0,0|1,0,0]=2 5045 B15R0.247 COC(=O)CCCCCCOCCC(C)C 7a_100009863599_100000210626 [0,1,0,0,0,0|1,0,0]=2 5046 B15R0.247 COC(=O)CCCCCCOCCC(C)O 34a_100009863599_100012276601 [0,1,0,0,0,0|1,0,0]=2 5047 B15R0.247 COC(=O)CCCCCCOCCC(C)O 7a_100009863599_100012276601 [0,1,0,0,0,0|1,0,0]=2 5048 B15R0.247 COC(=O)CCCCCCOCCC(F)F 34a_100103093639_100009815986 [0,1,0,0,0,0|2,0,0]=3 5049 B15R0.247 COC(=O)CCCCCCOCCN(C)C 7a_100009863599_100000755713 [0,1,0,0,0,0|2,0,0]=3 5050 B15R0.247 COC(=O)CCCCCCOCC[C@@H](C)N 34a_100000706166_100009815986 [0,1,0,0,0,0|1,0,0]=2 5051 B15R0.247 COC(=O)CCCCCCOCOC(=O)C 34a_100009863599_100009813279 [0,1,0,0,0,0|2,0,1]=4 5052 B15R0.247 COC(=O)CCCCCCOCOC(C)C 34a_100009863599_100000709892 [0,1,0,0,0,0|2,0,0]=3 5053 B15R0.247 COC(=O)CCCCCCSCC=C(C)C 62a_100000761012_100009815986 [0,1,0,0,0,0|1,0,2]=4 5054 B15R0.247 COC(=O)CCCCCCSCC=C(C)C 62a_100009815986_100000761012 [0,1,0,0,0,0|1,0,2]=4 5055 B15R0.247 COC(=O)CCCCCCSCCC(=O)C 62a_100000053229_100009815986 [0,1,0,0,0,0|1,0,1]=3 5056 B15R0.247 COC(=O)CCCCCCSCCC(=O)C 62a_100009815986_100000053229 [0,1,0,0,0,0|1,0,1]=3 5057 B15R0.247 COC(=O)CCCCCCSCCC(=O)N 62a_100000744528_100009815986 [0,1,0,0,0,0|2,0,1]=4 5058 B15R0.247 COC(=O)CCCCCCSCCC(=O)N 62a_100009815986_100000744528 [0,1,0,0,0,0|2,0,1]=4 5059 B15R0.247 COC(=O)CCCCCCSCCC(C)C 62a_100000210312_100009815986 [0,1,0,0,0,0|1,0,0]=2 5060 B15R0.247 COC(=O)CCCCCCSCCC(C)C 62a_100009815986_100000210312 [0,1,0,0,0,0|1,0,0]=2 5061 B15R0.247 COC(=O)CCCCCCSCCC(C)O 62a_100009815986_100012276601 [0,1,0,0,0,0|1,0,0]=2 5062 B15R0.247 COC(=O)CCCCCCSCCC(C)O 62a_100012276601_100009815986 [0,1,0,0,0,0|1,0,0]=2 5063 B15R0.247 COC(=O)CCCCCCSCCN(C)C 62a_100009815986_100000755713 [0,1,0,0,0,0|2,0,0]=3 5064 B15R0.247 COC(=O)CCCCCCSCOC(=O)C 62a_100000076356_100009815986 [0,1,0,0,0,0|2,0,1]=4 5065 B15R0.247 COC(=O)CCCCCCSCOC(=O)C 62a_100009815986_100000076356 [0,1,0,0,0,0|2,0,1]=4 5066 B15R0.247 COC(=O)CCCCCCSCOC(C)C 62a_100000709892_100009815986 [0,1,0,0,0,0|2,0,0]=3 5067 B15R0.247 COC(=O)CCCCCCSCOC(C)C 62a_100009815986_100000709892 [0,1,0,0,0,0|2,0,0]=3 5068 B15R0.247 COC(=O)CCCCCNCCCC(=O)N 34a_100000739312_100009816466 [0,1,0,0,0,0|2,0,1]=4 5069 B15R0.247 COC(=O)CCCCCNCCCC(C)C 2230a_200000737386_100009816466 [0,1,0,0,0,0|1,0,0]=2 5070 B15R0.247 COC(=O)CCCCCNCCCC(C)C 34a_200000737386_100009816466 [0,1,0,0,0,0|1,0,0]=2 5071 B15R0.247 COC(=O)CCCCCNCCCS(=O)C 2230a_200000753449_100009816466 [0,1,0,0,0,0|2,0,0]=3 5072 B15R0.247 COC(=O)CCCCCNCCNC(=O)C 2230a_100000209853_100009816466 [0,1,0,0,0,0|2,0,1]=4 5073 B15R0.247 COC(=O)CCCCCNCCOC(C)C 2230a_100000701111_100009816466 [0,1,0,0,0,0|2,0,0]=3 5074 B15R0.247 COC(=O)CCCCCNCCOC(C)C 34a_100000701111_100009816466 [0,1,0,0,0,0|2,0,0]=3 5075 B15R0.247 COC(=O)CCCCCNCCSC(C)C 2230a_100000731138_100009816466 [0,1,0,0,0,0|2,0,0]=3 5076 B15R0.247 COC(=O)CCCCCNCCSC(C)C 34a_100000731138_100009816466 [0,1,0,0,0,0|2,0,0]=3 5077 B15R0.247 COC(=O)CCCCCOCCC=C(C)C 34a_100000074720_100011217483 [0,1,0,0,0,0|1,0,2]=4 5078 B15R0.247 COC(=O)CCCCCOCCC=C(C)C 7a_100000074720_100011217483 [0,1,0,0,0,0|1,0,2]=4 5079 B15R0.247 COC(=O)CCCCCOCCCC(=O)C 34a_100000074720_100000685027 [0,1,0,0,0,0|1,0,1]=3 5080 B15R0.247 COC(=O)CCCCCOCCCC(=O)C 34a_100000759063_100009816466 [0,1,0,0,0,0|1,0,1]=3 5081 B15R0.247 COC(=O)CCCCCOCCCC(=O)C 7a_100000074720_100011215641 [0,1,0,0,0,0|1,0,1]=3 5082 B15R0.247 COC(=O)CCCCCOCCCC(=O)C 7a_100000759063_100009816466 [0,1,0,0,0,0|1,0,1]=3 5083 B15R0.247 COC(=O)CCCCCOCCCC(=O)N 34a_100000074720_100102525003 [0,1,0,0,0,0|2,0,1]=4 5084 B15R0.247 COC(=O)CCCCCOCCCC(=O)N 7a_100000074720_100102525003 [0,1,0,0,0,0|2,0,1]=4 5085 B15R0.247 COC(=O)CCCCCOCCCC(C)C 34a_100000074720_100011214892 [0,1,0,0,0,0|1,0,0]=2 5086 B15R0.247 COC(=O)CCCCCOCCCC(C)C 34a_100000210774_100009816466 [0,1,0,0,0,0|1,0,0]=2 5087 B15R0.247 COC(=O)CCCCCOCCCC(C)C 7a_100000074720_100011214892 [0,1,0,0,0,0|1,0,0]=2 5088 B15R0.247 COC(=O)CCCCCOCCCC(C)C 7a_100000210774_100009816466 [0,1,0,0,0,0|1,0,0]=2 5089 B15R0.247 COC(=O)CCCCCOCCCC(C)O 34a_100000074720_200000718107 [0,1,0,0,0,0|1,0,0]=2 5090 B15R0.247 COC(=O)CCCCCOCCCC(C)O 7a_100000074720_200000718107 [0,1,0,0,0,0|1,0,0]=2 5091 B15R0.247 COC(=O)CCCCCOCCCN(C)C 7a_100000074720_100000757444 [0,1,0,0,0,0|2,0,0]=3 5092 B15R0.247 COC(=O)CCCCCOCCC[N+](=O)[O-] 34a_200000037920_100009816466 [0,1,0,0,0,0|3,0,0]=4 5093 B15R0.247 COC(=O)CCCCCOCCNC(=O)C 34a_100000158858_100009816466 [0,1,0,0,0,0|2,0,1]=4 5094 B15R0.247 COC(=O)CCCCCOCCNC(=O)C 7a_100000074720_100000189650 [0,1,0,0,0,0|2,0,1]=4 5095 B15R0.247 COC(=O)CCCCCOCCNC(C)C 34a_100000224655_100009816466 [0,1,0,0,0,0|2,0,0]=3 5096 B15R0.247 COC(=O)CCCCCOCCOC(=O)C 34a_100000074720_100009814007 [0,1,0,0,0,0|2,0,1]=4 5097 B15R0.247 COC(=O)CCCCCOCCOC(=O)C 7a_100000074720_100009814007 [0,1,0,0,0,0|2,0,1]=4 5098 B15R0.247 COC(=O)CCCCCOCCOC(C)C 34a_100000074720_100000211751 [0,1,0,0,0,0|2,0,0]=3 5099 B15R0.247 COC(=O)CCCCCOCCOC(C)C 34a_100000211219_100009816466 [0,1,0,0,0,0|2,0,0]=3 5100 B15R0.247 COC(=O)CCCCCOCCOC(C)C 7a_100000074720_100000211751 [0,1,0,0,0,0|2,0,0]=3 5101 B15R0.247 COC(=O)CCCCCOCCOC(C)C 7a_100000211219_100009816466 [0,1,0,0,0,0|2,0,0]=3 5102 B15R0.247 COC(=O)CCCCCOCCSC(C)C 34a_100000074720_100000730970 [0,1,0,0,0,0|2,0,0]=3 5103 B15R0.247 COC(=O)CCCCCOCCSC(C)C 34a_200011212901_100009816466 [0,1,0,0,0,0|2,0,0]=3 5104 B15R0.247 COC(=O)CCCCCOCCSC(C)C 7a_100000074720_100000730970 [0,1,0,0,0,0|2,0,0]=3 5105 B15R0.247 COC(=O)CCCCCOCCSC(C)C 7a_200011212901_100009816466 [0,1,0,0,0,0|2,0,0]=3 5106 B15R0.247 COC(=O)CCCCCSCCC=C(C)C 62a_100009816466_100011217483 [0,1,0,0,0,0|1,0,2]=4 5107 B15R0.247 COC(=O)CCCCCSCCC=C(C)C 62a_100011217483_100009816466 [0,1,0,0,0,0|1,0,2]=4 5108 B15R0.247 COC(=O)CCCCCSCCCC(=O)C 62a_100009816466_100011215641 [0,1,0,0,0,0|1,0,1]=3 5109 B15R0.247 COC(=O)CCCCCSCCCC(=O)C 62a_100011215641_100009816466 [0,1,0,0,0,0|1,0,1]=3 5110 B15R0.247 COC(=O)CCCCCSCCCC(=O)N 62a_100009816466_100102525003 [0,1,0,0,0,0|2,0,1]=4 5111 B15R0.247 COC(=O)CCCCCSCCCC(=O)N 62a_100102525003_100009816466 [0,1,0,0,0,0|2,0,1]=4 5112 B15R0.247 COC(=O)CCCCCSCCCC(C)C 62a_100009816466_100011214892 [0,1,0,0,0,0|1,0,0]=2 5113 B15R0.247 COC(=O)CCCCCSCCCC(C)C 62a_100011214892_100009816466 [0,1,0,0,0,0|1,0,0]=2 5114 B15R0.247 COC(=O)CCCCCSCCCC(C)O 62a_100009816466_200000718107 [0,1,0,0,0,0|1,0,0]=2 5115 B15R0.247 COC(=O)CCCCCSCCCC(C)O 62a_200000718107_100009816466 [0,1,0,0,0,0|1,0,0]=2 5116 B15R0.247 COC(=O)CCCCCSCCCN(C)C 62a_100009816466_100000757444 [0,1,0,0,0,0|2,0,0]=3 5117 B15R0.247 COC(=O)CCCCCSCCNC(=O)C 62a_100000189650_100009816466 [0,1,0,0,0,0|2,0,1]=4 5118 B15R0.247 COC(=O)CCCCCSCCNC(=O)C 62a_100009816466_100000189650 [0,1,0,0,0,0|2,0,1]=4 5119 B15R0.247 COC(=O)CCCCCSCCOC(=O)C 62a_100009814007_100009816466 [0,1,0,0,0,0|2,0,1]=4 5120 B15R0.247 COC(=O)CCCCCSCCOC(=O)C 62a_100009816466_100009814007 [0,1,0,0,0,0|2,0,1]=4 5121 B15R0.247 COC(=O)CCCCCSCCOC(C)C 62a_100000211751_100009816466 [0,1,0,0,0,0|2,0,0]=3 5122 B15R0.247 COC(=O)CCCCCSCCOC(C)C 62a_100009816466_100000211751 [0,1,0,0,0,0|2,0,0]=3 5123 B15R0.247 COC(=O)CCCCCSCCSC(C)C 62a_100000730970_100009816466 [0,1,0,0,0,0|2,0,0]=3 5124 B15R0.247 COC(=O)CCCCCSCCSC(C)C 62a_100009816466_100000730970 [0,1,0,0,0,0|2,0,0]=3 5125 B15R0.247 COC(=O)CCCCNCCCCC(=O)N 34a_100000696515_100000204269 [0,1,0,0,0,0|2,0,1]=4 5126 B15R0.247 COC(=O)CCCCNCCCNC(=O)C 34a_100000736810_100000204269 [0,1,0,0,0,0|2,0,1]=4 5127 B15R0.247 COC(=O)CCCCNCCCOC(C)C 2230a_100000737246_100000204269 [0,1,0,0,0,0|2,0,0]=3 5128 B15R0.247 COC(=O)CCCCNCCCOC(C)C 34a_100000737246_100000204269 [0,1,0,0,0,0|2,0,0]=3 5129 B15R0.247 COC(=O)CCCCOCCCCB(O)O 34a_100000059025_200009817182 [0,1,0,0,0,0|3,0,0]=4 5130 B15R0.247 COC(=O)CCCCOCCCCB(O)O 7a_100000059025_200009817182 [0,1,0,0,0,0|3,0,0]=4 5131 B15R0.247 COC(=O)CCCCOCCCCC(=O)C 34a_100000059025_100009817362 [0,1,0,0,0,0|1,0,1]=3 5132 B15R0.247 COC(=O)CCCCOCCCCC(=O)C 7a_100000059025_100000735457 [0,1,0,0,0,0|1,0,1]=3 5133 B15R0.247 COC(=O)CCCCOCCCCC(=O)N 34a_100012022536_100000204269 [0,1,0,0,0,0|2,0,1]=4 5134 B15R0.247 COC(=O)CCCCOCCCCC(=O)N 7a_100012022536_100000204269 [0,1,0,0,0,0|2,0,1]=4 5135 B15R0.247 COC(=O)CCCCOCCCCC(C)C 34a_100000059025_100011216152 [0,1,0,0,0,0|1,0,0]=2 5136 B15R0.247 COC(=O)CCCCOCCCCC(C)C 34a_100011214890_100000204269 [0,1,0,0,0,0|1,0,0]=2 5137 B15R0.247 COC(=O)CCCCOCCCCC(C)C 7a_100000059025_100011216152 [0,1,0,0,0,0|1,0,0]=2 5138 B15R0.247 COC(=O)CCCCOCCCCC(C)C 7a_100011214890_100000204269 [0,1,0,0,0,0|1,0,0]=2 5139 B15R0.247 COC(=O)CCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000204269 [0,1,0,0,0,0|3,0,0]=4 5140 B15R0.247 COC(=O)CCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000204269 [0,1,0,0,0,0|3,0,0]=4 5141 B15R0.247 COC(=O)CCCCOCCCNC(=O)C 34a_100000752032_100000204269 [0,1,0,0,0,0|2,0,1]=4 5142 B15R0.247 COC(=O)CCCCOCCCNC(C)C 34a_100000182298_100000204269 [0,1,0,0,0,0|2,0,0]=3 5143 B15R0.247 COC(=O)CCCCOCCCOC(=O)C 34a_100000059025_100000042594 [0,1,0,0,0,0|2,0,1]=4 5144 B15R0.247 COC(=O)CCCCOCCCOC(=O)C 7a_100000059025_100000042594 [0,1,0,0,0,0|2,0,1]=4 5145 B15R0.247 COC(=O)CCCCOCCCOC(=S)C 34a_100000059025_200135323944 [0,1,0,0,0,0|2,0,1]=4 5146 B15R0.247 COC(=O)CCCCOCCCOC(=S)C 7a_100000059025_200135323944 [0,1,0,0,0,0|2,0,1]=4 5147 B15R0.247 COC(=O)CCCCOCCCSC(=O)C 34a_100000059025_100000038929 [0,1,0,0,0,0|2,0,1]=4 5148 B15R0.247 COC(=O)CCCCOCCCSC(=O)C 7a_100000059025_100000038929 [0,1,0,0,0,0|2,0,1]=4 5149 B15R0.247 COC(=O)CCCCOCCNCC(C)C 34a_100015185251_100000204269 [0,1,0,0,0,0|2,0,0]=3 5150 B15R0.247 COC(=O)CCCCOCCOCC(C)C 34a_100000703358_100000204269 [0,1,0,0,0,0|2,0,0]=3 5151 B15R0.247 COC(=O)CCCCOCCOCC(C)C 7a_100000703358_100000204269 [0,1,0,0,0,0|2,0,0]=3 5152 B15R0.247 COC(=O)CCCCOCCOCC(F)F 34a_100000059025_200012177212 [0,1,0,0,0,0|3,0,0]=4 5153 B15R0.247 COC(=O)CCCCOCCOCC(F)F 34a_100000704375_100000204269 [0,1,0,0,0,0|3,0,0]=4 5154 B15R0.247 COC(=O)CCCCOCCOCC(F)F 7a_100000059025_200012177212 [0,1,0,0,0,0|3,0,0]=4 5155 B15R0.247 COC(=O)CCCCOCCOCC(F)F 7a_100000704375_100000204269 [0,1,0,0,0,0|3,0,0]=4 5156 B15R0.247 COC(=O)CCCCOCCSCC(C)C 34a_200000230437_100000204269 [0,1,0,0,0,0|2,0,0]=3 5157 B15R0.247 COC(=O)CCCCOCCSCC(C)C 7a_200000230437_100000204269 [0,1,0,0,0,0|2,0,0]=3 5158 B15R0.247 COC(=O)CCCCSCCCCB(O)O 62a_100000204269_200009817182 [0,1,0,0,0,0|3,0,0]=4 5159 B15R0.247 COC(=O)CCCCSCCCCB(O)O 62a_200009817182_100000204269 [0,1,0,0,0,0|3,0,0]=4 5160 B15R0.247 COC(=O)CCCCSCCCCC(=O)C 62a_100000204269_100000735457 [0,1,0,0,0,0|1,0,1]=3 5161 B15R0.247 COC(=O)CCCCSCCCCC(=O)C 62a_100000735457_100000204269 [0,1,0,0,0,0|1,0,1]=3 5162 B15R0.247 COC(=O)CCCCSCCCCC(C)C 62a_100000204269_100011216152 [0,1,0,0,0,0|1,0,0]=2 5163 B15R0.247 COC(=O)CCCCSCCCCC(C)C 62a_100011216152_100000204269 [0,1,0,0,0,0|1,0,0]=2 5164 B15R0.247 COC(=O)CCCCSCCCCN(C)C 62a_100000204269_100000690147 [0,1,0,0,0,0|2,0,0]=3 5165 B15R0.247 COC(=O)CCCCSCCCOC(=O)C 62a_100000042594_100000204269 [0,1,0,0,0,0|2,0,1]=4 5166 B15R0.247 COC(=O)CCCCSCCCOC(=O)C 62a_100000204269_100000042594 [0,1,0,0,0,0|2,0,1]=4 5167 B15R0.247 COC(=O)CCCCSCCCOC(=S)C 62a_100000204269_200135323944 [0,1,0,0,0,0|2,0,1]=4 5168 B15R0.247 COC(=O)CCCCSCCCOC(=S)C 62a_200135323944_100000204269 [0,1,0,0,0,0|2,0,1]=4 5169 B15R0.247 COC(=O)CCCCSCCCSC(=O)C 62a_100000038929_100000204269 [0,1,0,0,0,0|2,0,1]=4 5170 B15R0.247 COC(=O)CCCCSCCCSC(=O)C 62a_100000204269_100000038929 [0,1,0,0,0,0|2,0,1]=4 5171 B15R0.247 COC(=O)CCCCSCCOCC(F)F 62a_100000204269_200012177212 [0,1,0,0,0,0|3,0,0]=4 5172 B15R0.247 COC(=O)CCCCSCCOCC(F)F 62a_200012177212_100000204269 [0,1,0,0,0,0|3,0,0]=4 5173 B15R0.247 COC(=O)CCCNCCCCCC(C)C 2230a_100011290863_100011218270 [0,1,0,0,0,0|1,0,0]=2 5174 B15R0.247 COC(=O)CCCNCCCCCC(C)C 34a_100011290863_100000742333 [0,1,0,0,0,0|1,0,0]=2 5175 B15R0.247 COC(=O)CCCNCCCCNC(=O)C 2230a_200011368371_100011218270 [0,1,0,0,0,0|2,0,1]=4 5176 B15R0.247 COC(=O)CCCNCCCCNC(=O)C 34a_200011368371_100000742333 [0,1,0,0,0,0|2,0,1]=4 5177 B15R0.247 COC(=O)CCCNCCCOCC(C)C 2230a_100000205972_100011218270 [0,1,0,0,0,0|2,0,0]=3 5178 B15R0.247 COC(=O)CCCNCCCOCC(C)C 34a_100000205972_100000742333 [0,1,0,0,0,0|2,0,0]=3 5179 B15R0.247 COC(=O)CCCOCCCCCC(=O)N 34a_100000123541_100000742333 [0,1,0,0,0,0|2,0,1]=4 5180 B15R0.247 COC(=O)CCCOCCCCCC(=O)N 7a_100000123541_100011218270 [0,1,0,0,0,0|2,0,1]=4 5181 B15R0.247 COC(=O)CCCOCCCCCC(=O)[O-] 7a_100102619762_100011218270 [0,1,0,0,0,0|2,0,1]=4 5182 B15R0.247 COC(=O)CCCOCCCCCC(C)C 34a_100011995859_100000742333 [0,1,0,0,0,0|1,0,0]=2 5183 B15R0.247 COC(=O)CCCOCCCCCC(C)C 7a_100011995859_100011218270 [0,1,0,0,0,0|1,0,0]=2 5184 B15R0.247 COC(=O)CCCOCCCCNC(C)C 34a_100011521146_100000742333 [0,1,0,0,0,0|2,0,0]=3 5185 B15R0.247 COC(=O)CCCOCCCCOC(=O)C 34a_100000073216_100000742333 [0,1,0,0,0,0|2,0,1]=4 5186 B15R0.247 COC(=O)CCCOCCCCOC(=O)C 7a_100000073216_100011218270 [0,1,0,0,0,0|2,0,1]=4 5187 B15R0.247 COC(=O)CCCSCCCCCB(O)O 62a_100011218270_200009817188 [0,1,0,0,0,0|3,0,0]=4 5188 B15R0.247 COC(=O)CCCSCCCCCB(O)O 62a_200009817188_100011218270 [0,1,0,0,0,0|3,0,0]=4 5189 B15R0.247 COC(=O)CCCSCCCCCC(=O)N 62a_100009817443_100011218270 [0,1,0,0,0,0|2,0,1]=4 5190 B15R0.247 COC(=O)CCCSCCCCCC(=O)N 62a_100011218270_100009817443 [0,1,0,0,0,0|2,0,1]=4 5191 B15R0.247 COC(=O)CCCSCCCCCC(C)C 62a_100000210682_100011218270 [0,1,0,0,0,0|1,0,0]=2 5192 B15R0.247 COC(=O)CCCSCCCCCC(C)C 62a_100011218270_100000210682 [0,1,0,0,0,0|1,0,0]=2 5193 B15R0.247 COC(=O)CCCSCCCCOC(=O)C 62a_100000033659_100011218270 [0,1,0,0,0,0|2,0,1]=4 5194 B15R0.247 COC(=O)CCCSCCCCOC(=O)C 62a_100011218270_100000033659 [0,1,0,0,0,0|2,0,1]=4 5195 B15R0.247 COC(=O)CCCSCCCCSC(=O)C 62a_100011218270_200010402107 [0,1,0,0,0,0|2,0,1]=4 5196 B15R0.247 COC(=O)CCCSCCCCSC(=O)C 62a_200010402107_100011218270 [0,1,0,0,0,0|2,0,1]=4 5197 B15R0.247 COC(=O)CCNCCCCCCC(C)C 2230a_100000211014_100000204255 [0,1,0,0,0,0|1,0,0]=2 5198 B15R0.247 COC(=O)CCNCCCCCCC(C)C 34a_100000211014_100000742370 [0,1,0,0,0,0|1,0,0]=2 5199 B15R0.247 COC(=O)CCNCCCCCNC(=O)C 2230a_200012022750_100000204255 [0,1,0,0,0,0|2,0,1]=4 5200 B15R0.247 COC(=O)CCNCCCCCNC(=O)C 34a_200012022750_100000742370 [0,1,0,0,0,0|2,0,1]=4 5201 B15R0.247 COC(=O)CCOCCCCCNC(C)C 34a_100011629493_100000742370 [0,1,0,0,0,0|2,0,0]=3 5202 B15R0.247 COC(=O)CCOCCOCCOC(C)C 34a_100010982084_100000210206 [0,1,0,0,0,0|3,0,0]=4 5203 B15R0.247 COC(=O)CCOCCOCCOC(C)C 7a_100010982084_100000210206 [0,1,0,0,0,0|3,0,0]=4 5204 B15R0.247 COC(=O)CCSCCCCCCB(O)O 62a_100000204255_100009817187 [0,1,0,0,0,0|3,0,0]=4 5205 B15R0.247 COC(=O)CCSCCCCCCB(O)O 62a_100009817187_100000204255 [0,1,0,0,0,0|3,0,0]=4 5206 B15R0.247 COC(=O)CCSCCCCCOC(=O)C 62a_100000033007_100000204255 [0,1,0,0,0,0|2,0,1]=4 5207 B15R0.247 COC(=O)CCSCCCCCOC(=O)C 62a_100000204255_100000033007 [0,1,0,0,0,0|2,0,1]=4 5208 B15R0.247 COC(=O)CNCCCCCCNC(=O)C 2230a_200011996284_100000747449 [0,1,0,0,0,0|2,0,1]=4 5209 B15R0.247 COC(=O)CNCCCCCCNC(=O)C 34a_200011996284_100000747449 [0,1,0,0,0,0|2,0,1]=4 5210 B15R0.247 COC(=O)COCCCCCCCC(C)C 34a_200000210741_100000747449 [0,1,0,0,0,0|1,0,0]=2 5211 B15R0.247 COC(=O)COCCCCCCCC(C)C 7a_200000210741_100000747449 [0,1,0,0,0,0|1,0,0]=2 5212 B15R0.247 COC(=O)COCCNCCCOC(C)C 2230a_100000737246_100000090808 [0,1,0,0,0,0|3,0,0]=4 5213 B15R0.247 COC(=O)COCCNCCCOC(C)C 34a_100000737246_100000090808 [0,1,0,0,0,0|3,0,0]=4 5214 B15R0.247 COC(=O)COCCOCCCCC(C)C 34a_100011214890_100000090808 [0,1,0,0,0,0|2,0,0]=3 5215 B15R0.247 COC(=O)COCCOCCCCC(C)C 7a_100011214890_100000090808 [0,1,0,0,0,0|2,0,0]=3 5216 B15R0.247 COC(=O)COCCOCCCNC(C)C 34a_100000182298_100000090808 [0,1,0,0,0,0|3,0,0]=4 5217 B15R0.247 COC(=O)COCCOCCNCC(C)C 34a_100015185251_100000090808 [0,1,0,0,0,0|3,0,0]=4 5218 B15R0.247 COC(=O)COCCOCCOCC(C)C 34a_100000703358_100000090808 [0,1,0,0,0,0|3,0,0]=4 5219 B15R0.247 COC(=O)COCCOCCOCC(C)C 34a_100011023656_100000210624 [0,1,0,0,0,0|3,0,0]=4 5220 B15R0.247 COC(=O)COCCOCCOCC(C)C 7a_100000703358_100000090808 [0,1,0,0,0,0|3,0,0]=4 5221 B15R0.247 COC(=O)COCCOCCOCC(C)C 7a_100011023656_100000210760 [0,1,0,0,0,0|3,0,0]=4 5222 B15R0.247 COC(=O)COCCOCCOCC(C)O 34a_100011023656_100011218427 [0,1,0,0,0,0|3,0,0]=4 5223 B15R0.247 COC(=O)COCCOCCOCC(C)O 7a_100011023656_100011218427 [0,1,0,0,0,0|3,0,0]=4 5224 B15R0.247 COC(=O)COCCOCCOC[C@@H](C)O 34a_100011023656_100009817552 [0,1,0,0,0,0|3,0,0]=4 5225 B15R0.247 COC(=O)COCCOCCOC[C@@H](C)O 7a_100011023656_100009817552 [0,1,0,0,0,0|3,0,0]=4 5226 B15R0.247 COC(=O)COCCOCCSCC(C)C 34a_200000230437_100000090808 [0,1,0,0,0,0|3,0,0]=4 5227 B15R0.247 COC(=O)COCCOCCSCC(C)C 7a_200000230437_100000090808 [0,1,0,0,0,0|3,0,0]=4 5228 B15R0.247 COC(=O)COCCSCCCCC(=O)C 62a_100000090808_100000735457 [0,1,0,0,0,0|2,0,1]=4 5229 B15R0.247 COC(=O)COCCSCCCCC(=O)C 62a_100000735457_100000090808 [0,1,0,0,0,0|2,0,1]=4 5230 B15R0.247 COC(=O)COCCSCCCCC(C)C 62a_100000090808_100011216152 [0,1,0,0,0,0|2,0,0]=3 5231 B15R0.247 COC(=O)COCCSCCCCC(C)C 62a_100011216152_100000090808 [0,1,0,0,0,0|2,0,0]=3 5232 B15R0.247 COC(=O)COCCSCCCCN(C)C 62a_100000090808_100000690147 [0,1,0,0,0,0|3,0,0]=4 5233 B15R0.247 COC(=O)NCCOCCCCCC(C)C 34a_100000757965_100000210682 [0,1,0,0,0,0|2,0,0]=3 5234 B15R0.247 COC(=O)OCCOCCCCCC(C)C 34a_100010262106_100000210682 [0,1,0,0,0,0|2,0,0]=3 5235 B15R0.253 CCCCCCCCCCCC(CC)NC 270004a_106832991635_100011216094 [0,1,0,0,0,0|2,0,1]=4 5236 B15R0.253 CCCCCCCCCCCN(CC)CC 2230a_100000724800_100011215454 [0,1,0,0,0,0|3,0,0]=4 5237 B15R0.253 CCCCCCCCCCCN(CC)CC 269956a_100000042499_100011215454 [0,1,0,0,0,0|3,0,0]=4 5238 B15R0.253 CCCCCCCCCCCN(CC)CC 269982a_100000724800_100011215454 [0,1,0,0,0,0|3,0,0]=4 5239 B15R0.253 CCCCCCCCCNCC(OC)OC 2230a_100000212291_100000751394 [0,1,0,0,0,0|1,0,2]=4 5240 B15R0.253 CCCCCCCCCNCC(OC)OC 270004a_100000212291_100000752162 [0,1,0,0,0,0|1,0,2]=4 5241 B15R0.253 CCCCCCCCCNCC(OC)OC 34a_100000212291_100000211822 [0,1,0,0,0,0|1,0,2]=4 5242 B15R0.253 CCCCCCCCCOCC(CC)OC 34a_100011934954_100011214924 [0,1,0,0,0,0|2,0,1]=4 5243 B15R0.253 CCCCCCCCCOCC(CC)OC 7a_100011934954_100000210328 [0,1,0,0,0,0|2,0,1]=4 5244 B15R0.253 CCCCCCCCCOCC(OC)OC 34a_100000210712_100000211822 [0,1,0,0,0,0|1,0,2]=4 5245 B15R0.253 CCCCCCCCCOCC(OC)OC 34a_100011216393_100011214924 [0,1,0,0,0,0|1,0,2]=4 5246 B15R0.253 CCCCCCCCCOCC(OC)OC 7a_100000210712_100000751394 [0,1,0,0,0,0|1,0,2]=4 5247 B15R0.253 CCCCCCCCCSCC(OC)OC 62a_100000751394_100000210670 [0,1,0,0,0,0|1,0,2]=4 5248 B15R0.253 CCCCCCCCNCCC(OC)OC 2230a_100000229939_100009813347 [0,1,0,0,0,0|1,0,2]=4 5249 B15R0.253 CCCCCCCCNCCC(OC)OC 34a_100000229939_100000139399 [0,1,0,0,0,0|1,0,2]=4 5250 B15R0.253 CCCCCCCCOCCC(OC)OC 34a_100000210232_100000139399 [0,1,0,0,0,0|1,0,2]=4 5251 B15R0.253 CCCCCCCCOCCC(OC)OC 7a_100000210232_100009813347 [0,1,0,0,0,0|1,0,2]=4 5252 B15R0.253 CCCCCCCCSCCC(OC)OC 62a_100000139399_100000210317 [0,1,0,0,0,0|1,0,2]=4 5253 B15R0.253 CCCCCCCCSCCC(OC)OC 62a_100000210759_100000139399 [0,1,0,0,0,0|1,0,2]=4 5254 B15R0.253 CCCCCCCNCCCC(OC)OC 2230a_100000229938_100000069011 [0,1,0,0,0,0|1,0,2]=4 5255 B15R0.253 CCCCCCCOCCCC(OC)OC 34a_100000210272_100000069011 [0,1,0,0,0,0|1,0,2]=4 5256 B15R0.253 CCCCCCCOCCCC(OC)OC 7a_100000210272_100000069011 [0,1,0,0,0,0|1,0,2]=4 5257 B15R0.253 CCCCCCCSCCCC(OC)OC 62a_100000069011_100000210316 [0,1,0,0,0,0|1,0,2]=4 5258 B15R0.253 CCCCCCCSCCCC(OC)OC 62a_100000210614_100000069011 [0,1,0,0,0,0|1,0,2]=4 5259 B15R0.253 CCCCCCOCCCCN(CC)N=O 34a_200000035056_100000210314 [0,1,0,0,0,0|3,0,0]=4 5260 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC 270084a_100000684558_100000211323 [0,1,0,0,0,0|3,0,0]=4 5261 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC 274078a_100000684558_100000211323 [0,1,0,0,0,0|3,0,0]=4 5262 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC 40a_100000684558_100000053943 [0,1,0,0,0,0|3,0,0]=4 5263 B15R0.254 CCCCCCCCCNCC(C)(C)OC 2230a_100000763424_100011214924 [0,1,0,0,0,0|2,0,1]=4 5264 B15R0.254 CCCCCCCCCNCC(C)(C)OC 34a_100000212291_100000701081 [0,1,0,0,0,0|2,0,1]=4 5265 B15R0.254 CCCCCCCCCOCC(C)(C)OC 34a_100000210712_100000701081 [0,1,0,0,0,0|2,0,1]=4 5266 B15R0.254 CCCCCCCCCSCC(C)(C)OC 62a_100000701081_100000210670 [0,1,0,0,0,0|2,0,1]=4 5267 B15R0.254 CCCCCCCCNCCS(=O)(=O)CC 2230a_100000229939_100000756660 [0,1,0,0,0,0|3,0,0]=4 5268 B15R0.254 CCCCCCCCNCCS(=O)(=O)CC 2230a_100000751051_100000210759 [0,1,0,0,0,0|3,0,0]=4 5269 B15R0.254 CCCCCCCCNCCS(=O)(=O)CC 34a_100000229939_100000756660 [0,1,0,0,0,0|3,0,0]=4 5270 B15R0.254 CCCCCCCCNCCS(=O)(=O)CC 34a_100000751051_100000210759 [0,1,0,0,0,0|3,0,0]=4 5271 B15R0.254 CCCCCCCCNCCS(=O)(=O)NC 2230a_100000710037_100000210759 [0,1,0,0,0,0|3,0,0]=4 5272 B15R0.254 CCCCCCCCNCCS(=O)(=O)NC 34a_100000710037_100000210759 [0,1,0,0,0,0|3,0,0]=4 5273 B15R0.254 CCCCCCCCOCCC(C)(C)OC 7a_100000699976_100000210759 [0,1,0,0,0,0|2,0,1]=4 5274 B15R0.254 CCCCCCCCOCCS(=O)(=O)CC 34a_100000210232_100000756660 [0,1,0,0,0,0|3,0,0]=4 5275 B15R0.254 CCCCCCCCOCCS(=O)(=O)CC 34a_200011216379_100000210759 [0,1,0,0,0,0|3,0,0]=4 5276 B15R0.254 CCCCCCCCOCCS(=O)(=O)CC 7a_100000210232_100000756660 [0,1,0,0,0,0|3,0,0]=4 5277 B15R0.254 CCCCCCCCOCCS(=O)(=O)CC 7a_200011216379_100000210759 [0,1,0,0,0,0|3,0,0]=4 5278 B15R0.254 CCCCCCCCSCCS(=O)(=O)CC 62a_100000210759_100000756660 [0,1,0,0,0,0|3,0,0]=4 5279 B15R0.254 CCCCCCCCSCCS(=O)(=O)CC 62a_100000756660_100000210317 [0,1,0,0,0,0|3,0,0]=4 5280 B15R0.324 C#CCCCCCCCOC(C)C(=O)OC 34a_100000054614_100000211248 [0,1,0,0,0,0|1,0,2]=4 5281 B15R0.324 C#CCCCCCCCOC(C)C(=O)OC 34a_100011215400_100153394163 [0,1,0,0,0,0|1,0,2]=4 5282 B15R0.324 C#CCCCCCCCOC(C)C(=O)OC 7a_100000054614_100000211248 [0,1,0,0,0,0|1,0,2]=4 5283 B15R0.324 C#CCCCCCCCSC(C)C(=O)OC 62a_100000211248_100153394163 [0,1,0,0,0,0|1,0,2]=4 5284 B15R0.324 C#CCCCCCCCSC(C)C(=O)OC 62a_100153394163_100000211248 [0,1,0,0,0,0|1,0,2]=4 5285 B15R0.324 C#CCCCCCCOCC(C)C(=O)OC 34a_100000749362_100012276617 [0,1,0,0,0,0|1,0,2]=4 5286 B15R0.324 C#CCCCCCCOCC(C)C(=O)OC 34a_100011217361_100000698445 [0,1,0,0,0,0|1,0,2]=4 5287 B15R0.324 C#CCCCCCCOCC(C)C(=O)OC 7a_100000749362_100012276617 [0,1,0,0,0,0|1,0,2]=4 5288 B15R0.324 C#CCCCCCCOCC(F)C(=O)OC 34a_200009849844_100012276617 [0,1,0,0,0,0|1,0,2]=4 5289 B15R0.324 C#CCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100012276617 [0,1,0,0,0,0|1,0,2]=4 5290 B15R0.324 C#CCCCCCCSCC(C)C(=O)OC 62a_100000698445_100012276617 [0,1,0,0,0,0|1,0,2]=4 5291 B15R0.324 C#CCCCCCCSCC(C)C(=O)OC 62a_100012276617_100000698445 [0,1,0,0,0,0|1,0,2]=4 5292 B15R0.324 C#CCCCCCOCCC(C)C(=O)OC 34a_100000766912_100000034942 [0,1,0,0,0,0|1,0,2]=4 5293 B15R0.324 C#CCCCCCOCCC(C)C(=O)OC 7a_100000766912_100000034942 [0,1,0,0,0,0|1,0,2]=4 5294 B15R0.324 C#CCCCCCSCCC(C)C(=O)OC 62a_100000034942_100012094781 [0,1,0,0,0,0|1,0,2]=4 5295 B15R0.324 C#CCCCCCSCCC(C)C(=O)OC 62a_100012094781_100000034942 [0,1,0,0,0,0|1,0,2]=4 5296 B15R0.324 C/C=C(\C)/C(=O)CCCCCCCCCC 1458a_100020587367_100000210319 [0,1,0,0,0,0|2,0,1]=4 5297 B15R0.324 C/C=C(\C)/C(C)NCCCCCCCCC 269862a_100000212291_100020675665 [0,1,0,0,0,0|3,0,0]=4 5298 B15R0.324 C=C(CNCCCCCCCC)C(=O)OC 34a_100000229939_100009813391 [0,1,0,0,0,0|1,0,1]=3 5299 B15R0.324 C=C(CNCCCCCCCO)C(=O)OC 34a_100011996573_100009813391 [0,1,0,0,0,0|2,0,1]=4 5300 B15R0.324 C=C(CNCCCOCCCC)C(=O)OC 34a_200000211371_100009813391 [0,1,0,0,0,0|2,0,1]=4 5301 B15R0.324 C=C(COCCCCCCCBr)C(=O)OC 34a_100000760002_100009813391 [0,1,0,0,0,0|2,0,1]=4 5302 B15R0.324 C=C(COCCCCCCCC)C(=O)OC 34a_100000210232_100009813391 [0,1,0,0,0,0|1,0,1]=3 5303 B15R0.324 C=C(COCCCCCCCN)C(=O)OC 34a_100011996573_100009813391 [0,1,0,0,0,0|2,0,1]=4 5304 B15R0.324 C=C(COCCCCCCOC)C(=O)OC 34a_200012092642_100009813391 [0,1,0,0,0,0|2,0,1]=4 5305 B15R0.324 C=C(COCCCOCCCC)C(=O)OC 34a_200011215613_100009813391 [0,1,0,0,0,0|2,0,1]=4 5306 B15R0.324 C=C(COCCNCCCCC)C(=O)OC 34a_100000224656_100009813391 [0,1,0,0,0,0|2,0,1]=4 5307 B15R0.324 C=C(COCCOCCCCC)C(=O)OC 34a_100011215259_100009813391 [0,1,0,0,0,0|2,0,1]=4 5308 B15R0.324 C=C(CSCCCCCCCC)C(=O)OC 62a_100000210759_100009813391 [0,1,0,0,0,0|1,0,1]=3 5309 B15R0.324 C=C(CSCCCCCCCC)C(=O)OC 62a_100009813391_100000210317 [0,1,0,0,0,0|1,0,1]=3 5310 B15R0.324 C=C(CSCCCCCCCO)C(=O)OC 62a_100000760002_100009813391 [0,1,0,0,0,0|2,0,1]=4 5311 B15R0.324 C=C(CSCCCCCCCO)C(=O)OC 62a_100009813391_100000760002 [0,1,0,0,0,0|2,0,1]=4 5312 B15R0.324 C=C(CSCCCCCCOC)C(=O)OC 62a_100009813391_100011998445 [0,1,0,0,0,0|2,0,1]=4 5313 B15R0.324 C=C(CSCCCCCCOC)C(=O)OC 62a_100011998445_100009813391 [0,1,0,0,0,0|2,0,1]=4 5314 B15R0.324 C=CC(=O)N(C)CCCCCCCCCC 1626a_100000207566_100000185746 [0,1,0,0,0,0|2,0,1]=4 5315 B15R0.324 C=CC(=O)N(C)CCCCCCCCCC 240690a_100000207566_200121576911 [0,1,0,0,0,0|2,0,1]=4 5316 B15R0.324 C=CCCCCCCCOC(C)C(=O)OC 34a_100000730831_100000211248 [0,1,0,0,0,0|1,0,2]=4 5317 B15R0.324 C=CCCCCCCCOC(C)C(=O)OC 34a_100011215400_100012355270 [0,1,0,0,0,0|1,0,2]=4 5318 B15R0.324 C=CCCCCCCCOC(C)C(=O)OC 7a_100000730831_100000211248 [0,1,0,0,0,0|1,0,2]=4 5319 B15R0.324 C=CCCCCCCCSC(C)C(=O)OC 62a_100000211248_100012355270 [0,1,0,0,0,0|1,0,2]=4 5320 B15R0.324 C=CCCCCCCCSC(C)C(=O)OC 62a_100012355270_100000211248 [0,1,0,0,0,0|1,0,2]=4 5321 B15R0.324 C=CCCCCCCOCC(C)C(=O)OC 34a_100000749362_100011215473 [0,1,0,0,0,0|1,0,2]=4 5322 B15R0.324 C=CCCCCCCOCC(C)C(=O)OC 34a_200011216477_100000698445 [0,1,0,0,0,0|1,0,2]=4 5323 B15R0.324 C=CCCCCCCOCC(C)C(=O)OC 7a_100000749362_100011215473 [0,1,0,0,0,0|1,0,2]=4 5324 B15R0.324 C=CCCCCCCOCC(F)C(=O)OC 34a_200009849844_100011215473 [0,1,0,0,0,0|1,0,2]=4 5325 B15R0.324 C=CCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011215473 [0,1,0,0,0,0|1,0,2]=4 5326 B15R0.324 C=CCCCCCCSCC(C)C(=O)OC 62a_100000698445_100011215473 [0,1,0,0,0,0|1,0,2]=4 5327 B15R0.324 C=CCCCCCCSCC(C)C(=O)OC 62a_100011215473_100000698445 [0,1,0,0,0,0|1,0,2]=4 5328 B15R0.324 C=CCCCCCOCCC(C)C(=O)OC 34a_100011216702_100000034942 [0,1,0,0,0,0|1,0,2]=4 5329 B15R0.324 C=CCCCCCOCCC(C)C(=O)OC 7a_100011216702_100000034942 [0,1,0,0,0,0|1,0,2]=4 5330 B15R0.324 C=CCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000700193 [0,1,0,0,0,0|1,0,2]=4 5331 B15R0.324 C=CCCCCCSCCC(C)C(=O)OC 62a_100000700193_100000034942 [0,1,0,0,0,0|1,0,2]=4 5332 B15R0.324 CC/C=C/CCCOCCC(C)C(=O)OC 34a_100016287902_100000034942 [0,1,0,0,0,0|1,0,2]=4 5333 B15R0.324 CC/C=C/CCCOCCC(C)C(=O)OC 7a_100016287902_100000034942 [0,1,0,0,0,0|1,0,2]=4 5334 B15R0.324 CC/C=C\CCCCCOC(C)C(=O)OC 34a_100016268722_100000211248 [0,1,0,0,0,0|1,0,2]=4 5335 B15R0.324 CC/C=C\CCCCCOC(C)C(=O)OC 7a_100016268722_100000211248 [0,1,0,0,0,0|1,0,2]=4 5336 B15R0.324 CC/C=C\CCCCOCC(C)C(=O)OC 34a_100016287862_100000698445 [0,1,0,0,0,0|1,0,2]=4 5337 B15R0.324 CCC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100000742827 [0,1,0,0,0,0|3,0,0]=4 5338 B15R0.324 CCC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100000742827 [0,1,0,0,0,0|3,0,0]=4 5339 B15R0.324 CCC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100000742827 [0,1,0,0,0,0|3,0,0]=4 5340 B15R0.324 CCC(=O)C(C)SCCCCCCCCO 62a_100000033203_100000742827 [0,1,0,0,0,0|3,0,0]=4 5341 B15R0.324 CCC(=O)C(C)SCCCCCCCCO 62a_100000742827_100000033203 [0,1,0,0,0,0|3,0,0]=4 5342 B15R0.324 CCCC#CCCOCCC(C)C(=O)OC 34a_100000042726_100000034942 [0,1,0,0,0,0|1,0,2]=4 5343 B15R0.324 CCCC#CCCOCCC(C)C(=O)OC 7a_100000042726_100000034942 [0,1,0,0,0,0|1,0,2]=4 5344 B15R0.324 CCCC/C=C/COCCC(C)C(=O)OC 34a_200016272032_100000034942 [0,1,0,0,0,0|1,0,2]=4 5345 B15R0.324 CCCC/C=C/COCCC(C)C(=O)OC 7a_200016272032_100000034942 [0,1,0,0,0,0|1,0,2]=4 5346 B15R0.324 CCCC/C=C\CCOCC(C)C(=O)OC 34a_200016286491_100000698445 [0,1,0,0,0,0|1,0,2]=4 5347 B15R0.324 CCCCC#CCCCOC(C)C(=O)OC 34a_100011215400_200000047210 [0,1,0,0,0,0|1,0,2]=4 5348 B15R0.324 CCCCC#CCCCSC(C)C(=O)OC 62a_100000211248_200000047210 [0,1,0,0,0,0|1,0,2]=4 5349 B15R0.324 CCCCC#CCCCSC(C)C(=O)OC 62a_200000047210_100000211248 [0,1,0,0,0,0|1,0,2]=4 5350 B15R0.324 CCCCC#CCCOCC(C)C(=O)OC 34a_100000037610_100000698445 [0,1,0,0,0,0|1,0,2]=4 5351 B15R0.324 CCCCC#CCOCCC(C)C(=O)OC 34a_200000034558_100000034942 [0,1,0,0,0,0|1,0,2]=4 5352 B15R0.324 CCCCC#CCOCCC(C)C(=O)OC 7a_200000034558_100000034942 [0,1,0,0,0,0|1,0,2]=4 5353 B15R0.324 CCCCC/C=C/COCC(C)C(=O)OC 34a_100016258190_100000698445 [0,1,0,0,0,0|1,0,2]=4 5354 B15R0.324 CCCCC/C=C\CCOC(C)C(=O)OC 34a_100016277358_100000211248 [0,1,0,0,0,0|1,0,2]=4 5355 B15R0.324 CCCCC/C=C\CCOC(C)C(=O)OC 7a_100016277358_100000211248 [0,1,0,0,0,0|1,0,2]=4 5356 B15R0.324 CCCCCC#CCCOC(C)C(=O)OC 34a_200000042877_100000211248 [0,1,0,0,0,0|1,0,2]=4 5357 B15R0.324 CCCCCC#CCCOC(C)C(=O)OC 7a_200000042877_100000211248 [0,1,0,0,0,0|1,0,2]=4 5358 B15R0.324 CCCCCC#CCOCC(C)C(=O)OC 34a_100000749362_100009816472 [0,1,0,0,0,0|1,0,2]=4 5359 B15R0.324 CCCCCC#CCOCC(C)C(=O)OC 34a_200000033628_100000698445 [0,1,0,0,0,0|1,0,2]=4 5360 B15R0.324 CCCCCC#CCOCC(C)C(=O)OC 7a_100000749362_100009816472 [0,1,0,0,0,0|1,0,2]=4 5361 B15R0.324 CCCCCC#CCOCC(F)C(=O)OC 34a_200009849844_100009816472 [0,1,0,0,0,0|1,0,2]=4 5362 B15R0.324 CCCCCC#CCOC[C@@H](N)C(=O)OC 34a_100000003586_100009816472 [0,1,0,0,0,0|1,0,2]=4 5363 B15R0.324 CCCCCC#CCSCC(C)C(=O)OC 62a_100000698445_100009816472 [0,1,0,0,0,0|1,0,2]=4 5364 B15R0.324 CCCCCC#CCSCC(C)C(=O)OC 62a_100009816472_100000698445 [0,1,0,0,0,0|1,0,2]=4 5365 B15R0.324 CCCCCC/C=C/COC(C)C(=O)OC 34a_200016276170_100000211248 [0,1,0,0,0,0|1,0,2]=4 5366 B15R0.324 CCCCCC/C=C/COC(C)C(=O)OC 7a_200016276170_100000211248 [0,1,0,0,0,0|1,0,2]=4 5367 B15R0.324 CCCCCCC#CCOC(C)C(=O)OC 34a_200000037284_100000211248 [0,1,0,0,0,0|1,0,2]=4 5368 B15R0.324 CCCCCCC#CCOC(C)C(=O)OC 7a_200000037284_100000211248 [0,1,0,0,0,0|1,0,2]=4 5369 B15R0.324 CCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210319 [0,1,0,0,0,0|1,0,1]=3 5370 B15R0.324 CCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000210319 [0,1,0,0,0,0|1,0,2]=4 5371 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 11a_100000207566_100000210414 [0,1,0,0,0,0|2,0,0]=3 5372 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 1626a_100000207566_100000210414 [0,1,0,0,0,0|2,0,0]=3 5373 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 240690a_100000207566_100000210414 [0,1,0,0,0,0|2,0,0]=3 5374 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 527a_100000207566_100000210414 [0,1,0,0,0,0|2,0,0]=3 5375 B15R0.324 CCCCCCCCCCN(C)C(=O)CO 240690a_100000207566_100000210174 [0,1,0,0,0,0|3,0,0]=4 5376 B15R0.324 CCCCCCCCCCN(C)C(=O)CO 527a_100000207566_100000210174 [0,1,0,0,0,0|3,0,0]=4 5377 B15R0.324 CCCCCCCCCCN(C)C(=O)NC 2708a_100102657272_100000207566 [0,1,0,0,0,0|2,0,0]=3 5378 B15R0.324 CCCCCCCCCCN(C)C(=O)NC 273464a_100102657272_100000207566 [0,1,0,0,0,0|2,0,0]=3 5379 B15R0.324 CCCCCCCCCCN(C)C(C)OC 269982a_100000207566_100009879195 [0,1,0,0,0,0|2,0,1]=4 5380 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC 1626a_100000212291_100011218921 [0,1,0,0,0,0|2,0,1]=4 5381 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC 240690a_100000212291_100011218921 [0,1,0,0,0,0|2,0,1]=4 5382 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC 527a_100000212291_100011218921 [0,1,0,0,0,0|2,0,1]=4 5383 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 11a_100000212291_100000024059 [0,1,0,0,0,0|1,0,1]=3 5384 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 1626a_100000212291_100000024059 [0,1,0,0,0,0|1,0,1]=3 5385 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 240690a_100000212291_100000024059 [0,1,0,0,0,0|1,0,1]=3 5386 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 527a_100000212291_100000024059 [0,1,0,0,0,0|1,0,1]=3 5387 B15R0.324 CCCCCCCCCNC(C)C(=O)CC 2230a_100000212291_100000742827 [0,1,0,0,0,0|2,0,0]=3 5388 B15R0.324 CCCCCCCCCNC(C)C(=O)NC 2230a_100000212291_100000731044 [0,1,0,0,0,0|2,0,0]=3 5389 B15R0.324 CCCCCCCCCNC(C)C(=O)NC 34a_100000212291_100000731044 [0,1,0,0,0,0|2,0,0]=3 5390 B15R0.324 CCCCCCCCCNC(C)C(=O)OC 2230a_100000212291_100000211248 [0,1,0,0,0,0|1,0,0]=2 5391 B15R0.324 CCCCCCCCCNC(C)C(=O)OC 34a_100000212291_100000211248 [0,1,0,0,0,0|1,0,0]=2 5392 B15R0.324 CCCCCCCCCNC(F)C(=O)NC 2230a_100000212291_100009813575 [0,1,0,0,0,0|2,0,0]=3 5393 B15R0.324 CCCCCCCCCNC(F)C(=O)NC 34a_100000212291_100009813575 [0,1,0,0,0,0|2,0,0]=3 5394 B15R0.324 CCCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100011214924 [0,1,0,0,0,0|2,0,0]=3 5395 B15R0.324 CCCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100011214924 [0,1,0,0,0,0|2,0,0]=3 5396 B15R0.324 CCCCCCCCCOC(C)C(=O)CC 7a_100000210712_100000742827 [0,1,0,0,0,0|2,0,0]=3 5397 B15R0.324 CCCCCCCCCOC(C)C(=O)NC 34a_100000210712_100000731044 [0,1,0,0,0,0|2,0,0]=3 5398 B15R0.324 CCCCCCCCCOC(C)C(=O)NC 7a_100000210712_100000209862 [0,1,0,0,0,0|2,0,0]=3 5399 B15R0.324 CCCCCCCCCOC(C)C(=O)NN 34a_100000725659_100011214924 [0,1,0,0,0,0|3,0,0]=4 5400 B15R0.324 CCCCCCCCCOC(C)C(=O)OC 34a_100000210712_100000211248 [0,1,0,0,0,0|1,0,0]=2 5401 B15R0.324 CCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100011214924 [0,1,0,0,0,0|1,0,0]=2 5402 B15R0.324 CCCCCCCCCOC(C)C(=O)OC 7a_100000210712_100000211248 [0,1,0,0,0,0|1,0,0]=2 5403 B15R0.324 CCCCCCCCCOC(F)C(=O)NC 34a_100000210712_100009813575 [0,1,0,0,0,0|2,0,0]=3 5404 B15R0.324 CCCCCCCCCOC(F)C(=O)NC 7a_100000210712_100009813575 [0,1,0,0,0,0|2,0,0]=3 5405 B15R0.324 CCCCCCCCCSC(C)C(=O)CC 62a_100000742827_100000210670 [0,1,0,0,0,0|2,0,0]=3 5406 B15R0.324 CCCCCCCCCSC(C)C(=O)NC 62a_100000209862_100000210670 [0,1,0,0,0,0|2,0,0]=3 5407 B15R0.324 CCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100000210670 [0,1,0,0,0,0|1,0,0]=2 5408 B15R0.324 CCCCCCCCCSC(F)C(=O)NC 62a_100009813575_100000210670 [0,1,0,0,0,0|2,0,0]=3 5409 B15R0.324 CCCCCCCCNCC(=O)C(=O)OC 34a_100000229939_100011610305 [0,1,0,0,0,0|1,0,1]=3 5410 B15R0.324 CCCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100000210759 [0,1,0,0,0,0|2,0,0]=3 5411 B15R0.324 CCCCCCCCNCC(C)C(=O)NC 34a_100015187722_100000210759 [0,1,0,0,0,0|2,0,0]=3 5412 B15R0.324 CCCCCCCCNCC(C)C(=O)OC 34a_100000229939_100000698445 [0,1,0,0,0,0|1,0,0]=2 5413 B15R0.324 CCCCCCCCOCC(=O)C(=O)OC 34a_100000210232_100011610305 [0,1,0,0,0,0|1,0,1]=3 5414 B15R0.324 CCCCCCCCOCC(C)C(=O)OC 34a_100000210232_100000698445 [0,1,0,0,0,0|1,0,0]=2 5415 B15R0.324 CCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100000210759 [0,1,0,0,0,0|1,0,0]=2 5416 B15R0.324 CCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210759 [0,1,0,0,0,0|1,0,0]=2 5417 B15R0.324 CCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100000210759 [0,1,0,0,0,0|1,0,0]=2 5418 B15R0.324 CCCCCCCCOCC(N)C(=O)NN 34a_100016989258_100000210759 [0,1,0,0,0,0|3,0,0]=4 5419 B15R0.324 CCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210759 [0,1,0,0,0,0|1,0,0]=2 5420 B15R0.324 CCCCCCCCSCC(=O)C(=O)OC 62a_100000210759_100011610305 [0,1,0,0,0,0|1,0,1]=3 5421 B15R0.324 CCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210317 [0,1,0,0,0,0|1,0,1]=3 5422 B15R0.324 CCCCCCCCSCC(C)C(=O)OC 62a_100000210759_100000698445 [0,1,0,0,0,0|1,0,0]=2 5423 B15R0.324 CCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210317 [0,1,0,0,0,0|1,0,0]=2 5424 B15R0.324 CCCCCCCNCCC(C)C(=O)OC 2230a_100000229938_100000034942 [0,1,0,0,0,0|1,0,0]=2 5425 B15R0.324 CCCCCCCOCCC(C)C(=O)OC 34a_100000210272_100000034942 [0,1,0,0,0,0|1,0,0]=2 5426 B15R0.324 CCCCCCCOCCC(C)C(=O)OC 7a_100000210272_100000034942 [0,1,0,0,0,0|1,0,0]=2 5427 B15R0.324 CCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210316 [0,1,0,0,0,0|1,0,0]=2 5428 B15R0.324 CCCCCCCSCCC(C)C(=O)OC 62a_100000210614_100000034942 [0,1,0,0,0,0|1,0,0]=2 5429 B15R0.324 CCCCCCOCCOC(C)C(=O)CC 7a_100000691444_100000742827 [0,1,0,0,0,0|3,0,0]=4 5430 B15R0.324 CCCCCCOCCOC(C)C(=O)NC 34a_100000691444_100000731044 [0,1,0,0,0,0|3,0,0]=4 5431 B15R0.324 CCCCCCOCCOC(C)C(=O)NC 7a_100000691444_100000209862 [0,1,0,0,0,0|3,0,0]=4 5432 B15R0.324 CCCCCCOCCOC(C)C(=O)OC 34a_100000691444_100000211248 [0,1,0,0,0,0|2,0,0]=3 5433 B15R0.324 CCCCCCOCCOC(C)C(=O)OC 7a_100000691444_100000211248 [0,1,0,0,0,0|2,0,0]=3 5434 B15R0.324 CCCCCCOCCOC(F)C(=O)NC 34a_100000691444_100009813575 [0,1,0,0,0,0|3,0,0]=4 5435 B15R0.324 CCCCCCOCCOC(F)C(=O)NC 7a_100000691444_100009813575 [0,1,0,0,0,0|3,0,0]=4 5436 B15R0.324 CCCCCNCCOCC(=O)C(=O)OC 34a_100000224656_100011610305 [0,1,0,0,0,0|2,0,1]=4 5437 B15R0.324 CCCCCNCCOCC(C)C(=O)OC 34a_100000224656_100000698445 [0,1,0,0,0,0|2,0,0]=3 5438 B15R0.324 CCCCCOCCOCC(=O)C(=O)OC 34a_100011215259_100011610305 [0,1,0,0,0,0|2,0,1]=4 5439 B15R0.324 CCCCCOCCOCC(C)C(=O)OC 34a_100011215259_100000698445 [0,1,0,0,0,0|2,0,0]=3 5440 B15R0.324 CCCCNCCCCOC(C)C(=O)NC 34a_200011216965_100000731044 [0,1,0,0,0,0|3,0,0]=4 5441 B15R0.324 CCCCNCCCCOC(C)C(=O)OC 34a_200011216965_100000211248 [0,1,0,0,0,0|2,0,0]=3 5442 B15R0.324 CCCCNCCCCOC(F)C(=O)NC 34a_200011216965_100009813575 [0,1,0,0,0,0|3,0,0]=4 5443 B15R0.324 CCCCOCCCCOC(C)C(=O)CC 7a_200000760531_100000742827 [0,1,0,0,0,0|3,0,0]=4 5444 B15R0.324 CCCCOCCCCOC(C)C(=O)NC 34a_200000760531_100000731044 [0,1,0,0,0,0|3,0,0]=4 5445 B15R0.324 CCCCOCCCCOC(C)C(=O)NC 7a_200000760531_100000209862 [0,1,0,0,0,0|3,0,0]=4 5446 B15R0.324 CCCCOCCCCOC(C)C(=O)OC 34a_200000760531_100000211248 [0,1,0,0,0,0|2,0,0]=3 5447 B15R0.324 CCCCOCCCCOC(C)C(=O)OC 7a_200000760531_100000211248 [0,1,0,0,0,0|2,0,0]=3 5448 B15R0.324 CCCCOCCCCOC(F)C(=O)NC 34a_200000760531_100009813575 [0,1,0,0,0,0|3,0,0]=4 5449 B15R0.324 CCCCOCCCCOC(F)C(=O)NC 7a_200000760531_100009813575 [0,1,0,0,0,0|3,0,0]=4 5450 B15R0.324 CCCCOCCCNCC(=O)C(=O)OC 34a_200000211371_100011610305 [0,1,0,0,0,0|2,0,1]=4 5451 B15R0.324 CCCCOCCCNCC(C)C(=O)OC 34a_200000211371_100000698445 [0,1,0,0,0,0|2,0,0]=3 5452 B15R0.324 CCCCOCCCOCC(=O)C(=O)OC 34a_200011215613_100011610305 [0,1,0,0,0,0|2,0,1]=4 5453 B15R0.324 CCCCOCCCOCC(C)C(=O)OC 34a_200011215613_100000698445 [0,1,0,0,0,0|2,0,0]=3 5454 B15R0.324 CCCCOCCOCCC(C)C(=O)OC 34a_100000210238_100000034942 [0,1,0,0,0,0|2,0,0]=3 5455 B15R0.324 CCCCOCCOCCC(C)C(=O)OC 7a_100000210238_100000034942 [0,1,0,0,0,0|2,0,0]=3 5456 B15R0.324 CCCCOCCSCCC(C)C(=O)OC 62a_100000034942_100000743108 [0,1,0,0,0,0|2,0,0]=3 5457 B15R0.324 CCCCOCCSCCC(C)C(=O)OC 62a_100000743108_100000034942 [0,1,0,0,0,0|2,0,0]=3 5458 B15R0.324 CCCCSCCNCCC(C)C(=O)OC 2230a_100025743550_100000034942 [0,1,0,0,0,0|2,0,0]=3 5459 B15R0.324 CCCCSCCOCCC(C)C(=O)OC 34a_200000230436_100000034942 [0,1,0,0,0,0|2,0,0]=3 5460 B15R0.324 CCCCSCCOCCC(C)C(=O)OC 7a_200000230436_100000034942 [0,1,0,0,0,0|2,0,0]=3 5461 B15R0.324 CCCOCCCNCCC(C)C(=O)OC 2230a_100011217757_100000034942 [0,1,0,0,0,0|2,0,0]=3 5462 B15R0.324 CCCOCCCNCCC(C)C(=O)OC 34a_100011217757_100000034942 [0,1,0,0,0,0|2,0,0]=3 5463 B15R0.324 CCCOCCOCCNC(C)C(=O)OC 2230a_200011904461_100000211248 [0,1,0,0,0,0|3,0,0]=4 5464 B15R0.324 CCCOCCOCCNC(C)C(=O)OC 34a_200011904461_100000211248 [0,1,0,0,0,0|3,0,0]=4 5465 B15R0.324 CCOCCOCCNCC(C)C(=O)OC 34a_100102712874_100000698445 [0,1,0,0,0,0|3,0,0]=4 5466 B15R0.324 CCOCCOCCOCC(C)C(=O)OC 34a_100000210240_100000698445 [0,1,0,0,0,0|3,0,0]=4 5467 B15R0.324 CCOCCOCCOCC(C)C(=O)OC 34a_100000749362_100011211534 [0,1,0,0,0,0|3,0,0]=4 5468 B15R0.324 CCOCCOCCOCC(C)C(=O)OC 7a_100000749362_100011211534 [0,1,0,0,0,0|3,0,0]=4 5469 B15R0.324 CCOCCOCCOCC(F)C(=O)OC 34a_200009849844_100011211534 [0,1,0,0,0,0|3,0,0]=4 5470 B15R0.324 CCOCCOCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011211534 [0,1,0,0,0,0|3,0,0]=4 5471 B15R0.324 CCOCCOCCSCC(C)C(=O)OC 62a_100000698445_100011211534 [0,1,0,0,0,0|3,0,0]=4 5472 B15R0.324 CCOCCOCCSCC(C)C(=O)OC 62a_100011211534_100000698445 [0,1,0,0,0,0|3,0,0]=4 5473 B15R0.324 CNC(=O)C(=O)CCCCCCCCCO 1458a_100011218921_100009813782 [0,1,0,0,0,0|2,0,1]=4 5474 B15R0.324 CNC(=O)C(C)CNCCCCCCCO 2230a_100015187722_100000760002 [0,1,0,0,0,0|3,0,0]=4 5475 B15R0.324 CNC(=O)C(C)CNCCCCCCCO 34a_100015187722_100000760002 [0,1,0,0,0,0|3,0,0]=4 5476 B15R0.324 CNC(=O)C(C)CNCCCCCCOC 2230a_100015187722_100011998445 [0,1,0,0,0,0|3,0,0]=4 5477 B15R0.324 CNC(=O)C(C)CNCCCCCCOC 34a_100015187722_100011998445 [0,1,0,0,0,0|3,0,0]=4 5478 B15R0.324 CNC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100000731044 [0,1,0,0,0,0|3,0,0]=4 5479 B15R0.324 CNC(=O)C(C)NCCCCCCCCO 34a_102515433106_100000731044 [0,1,0,0,0,0|3,0,0]=4 5480 B15R0.324 CNC(=O)C(C)OCCCCCCCCBr 34a_100009813846_100000731044 [0,1,0,0,0,0|3,0,0]=4 5481 B15R0.324 CNC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100000209862 [0,1,0,0,0,0|3,0,0]=4 5482 B15R0.324 CNC(=O)C(C)OCCCCCCCCCl 34a_100000033203_100000731044 [0,1,0,0,0,0|3,0,0]=4 5483 B15R0.324 CNC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100000209862 [0,1,0,0,0,0|3,0,0]=4 5484 B15R0.324 CNC(=O)C(C)OCCCCCCCCN 34a_102515433106_100000731044 [0,1,0,0,0,0|3,0,0]=4 5485 B15R0.324 CNC(=O)C(C)SCCCCCCCCO 62a_100000033203_100000731044 [0,1,0,0,0,0|3,0,0]=4 5486 B15R0.324 CNC(=O)C(C)SCCCCCCCCO 62a_100000209862_100000033203 [0,1,0,0,0,0|3,0,0]=4 5487 B15R0.324 CNC(=O)C(F)NCCCCCCCCO 2230a_102515433106_100009813575 [0,1,0,0,0,0|3,0,0]=4 5488 B15R0.324 CNC(=O)C(F)NCCCCCCCCO 34a_102515433106_100009813575 [0,1,0,0,0,0|3,0,0]=4 5489 B15R0.324 CNC(=O)C(F)OCCCCCCCCBr 34a_100009813846_100009813575 [0,1,0,0,0,0|3,0,0]=4 5490 B15R0.324 CNC(=O)C(F)OCCCCCCCCBr 7a_100009813846_100009813575 [0,1,0,0,0,0|3,0,0]=4 5491 B15R0.324 CNC(=O)C(F)OCCCCCCCCCl 34a_100000033203_100009813575 [0,1,0,0,0,0|3,0,0]=4 5492 B15R0.324 CNC(=O)C(F)OCCCCCCCCCl 7a_100000033203_100009813575 [0,1,0,0,0,0|3,0,0]=4 5493 B15R0.324 CNC(=O)C(F)OCCCCCCCCN 34a_102515433106_100009813575 [0,1,0,0,0,0|3,0,0]=4 5494 B15R0.324 CNC(=O)C(F)SCCCCCCCCO 62a_100000033203_100009813575 [0,1,0,0,0,0|3,0,0]=4 5495 B15R0.324 CNC(=O)C(F)SCCCCCCCCO 62a_100009813575_100000033203 [0,1,0,0,0,0|3,0,0]=4 5496 B15R0.324 CNC(=O)[C@@H](C)NCCCCCCCCO 2230a_100000684985_100000033203 [0,1,0,0,0,0|3,0,0]=4 5497 B15R0.324 CNC(=O)[C@@H](C)NCCCCCCCCO 34a_100000684985_100000033203 [0,1,0,0,0,0|3,0,0]=4 5498 B15R0.324 CNCCCCCOCCC(C)C(=O)OC 34a_100000722520_100000034942 [0,1,0,0,0,0|2,0,0]=3 5499 B15R0.324 CNCCOCCOCCC(C)C(=O)OC 34a_100000228057_100000034942 [0,1,0,0,0,0|3,0,0]=4 5500 B15R0.324 COC(=O)C(=O)CNCCCCCCCO 34a_100011996573_100011610305 [0,1,0,0,0,0|2,0,1]=4 5501 B15R0.324 COC(=O)C(=O)COCCCCCCCBr 34a_100000760002_100011610305 [0,1,0,0,0,0|2,0,1]=4 5502 B15R0.324 COC(=O)C(=O)COCCCCCCCN 34a_100011996573_100011610305 [0,1,0,0,0,0|2,0,1]=4 5503 B15R0.324 COC(=O)C(=O)CSCCCCCCCO 62a_100000760002_100011610305 [0,1,0,0,0,0|2,0,1]=4 5504 B15R0.324 COC(=O)C(=O)CSCCCCCCCO 62a_100011610305_100000760002 [0,1,0,0,0,0|2,0,1]=4 5505 B15R0.324 COC(=O)C(=O)NCCCCCCCCO 240690a_102515433106_100000024059 [0,1,0,0,0,0|2,0,1]=4 5506 B15R0.324 COC(=O)C(C)CCNCCCCCCO 2230a_100000686447_100000034942 [0,1,0,0,0,0|2,0,0]=3 5507 B15R0.324 COC(=O)C(C)CCNCCCCCCO 34a_100000686447_100000034942 [0,1,0,0,0,0|2,0,0]=3 5508 B15R0.324 COC(=O)C(C)CCOCCCCCCBr 34a_100011215345_100000034942 [0,1,0,0,0,0|2,0,0]=3 5509 B15R0.324 COC(=O)C(C)CCOCCCCCCBr 7a_100011215345_100000034942 [0,1,0,0,0,0|2,0,0]=3 5510 B15R0.324 COC(=O)C(C)CCOCCCCCCCl 34a_100000766143_100000034942 [0,1,0,0,0,0|2,0,0]=3 5511 B15R0.324 COC(=O)C(C)CCOCCCCCCCl 7a_100000766143_100000034942 [0,1,0,0,0,0|2,0,0]=3 5512 B15R0.324 COC(=O)C(C)CCOCCCCCCF 34a_100000732779_100000034942 [0,1,0,0,0,0|2,0,0]=3 5513 B15R0.324 COC(=O)C(C)CCOCCCCCCF 7a_100000732779_100000034942 [0,1,0,0,0,0|2,0,0]=3 5514 B15R0.324 COC(=O)C(C)CCOCCCCCCN 34a_100000686447_100000034942 [0,1,0,0,0,0|2,0,0]=3 5515 B15R0.324 COC(=O)C(C)CCSCCCCCC#N 62a_100000034942_100009813376 [0,1,0,0,0,0|2,0,1]=4 5516 B15R0.324 COC(=O)C(C)CCSCCCCCC#N 62a_100009813376_100000034942 [0,1,0,0,0,0|2,0,1]=4 5517 B15R0.324 COC(=O)C(C)CCSCCCCCC=O 62a_100000034942_100000139337 [0,1,0,0,0,0|2,0,1]=4 5518 B15R0.324 COC(=O)C(C)CCSCCCCCC=O 62a_100000139337_100000034942 [0,1,0,0,0,0|2,0,1]=4 5519 B15R0.324 COC(=O)C(C)CCSCCCCCCF 62a_100000034942_100015922095 [0,1,0,0,0,0|2,0,0]=3 5520 B15R0.324 COC(=O)C(C)CCSCCCCCCF 62a_100015922095_100000034942 [0,1,0,0,0,0|2,0,0]=3 5521 B15R0.324 COC(=O)C(C)CCSCCCCCCO 62a_100000034942_100000766143 [0,1,0,0,0,0|2,0,0]=3 5522 B15R0.324 COC(=O)C(C)CCSCCCCCCO 62a_100000766143_100000034942 [0,1,0,0,0,0|2,0,0]=3 5523 B15R0.324 COC(=O)C(C)CNCCCCCCCO 34a_100011996573_100000698445 [0,1,0,0,0,0|2,0,0]=3 5524 B15R0.324 COC(=O)C(C)CNCCCOCCCO 34a_100011310245_100000698445 [0,1,0,0,0,0|3,0,0]=4 5525 B15R0.324 COC(=O)C(C)COCCCCCCC#N 7a_100000749362_100009813337 [0,1,0,0,0,0|2,0,1]=4 5526 B15R0.324 COC(=O)C(C)COCCCCCCCBr 34a_100000760002_100000698445 [0,1,0,0,0,0|2,0,0]=3 5527 B15R0.324 COC(=O)C(C)COCCCCCCCN 34a_100011996573_100000698445 [0,1,0,0,0,0|2,0,0]=3 5528 B15R0.324 COC(=O)C(C)COCCCCCCCO 34a_100000749362_100000760002 [0,1,0,0,0,0|2,0,0]=3 5529 B15R0.324 COC(=O)C(C)COCCCCCCCO 7a_100000749362_100000760002 [0,1,0,0,0,0|2,0,0]=3 5530 B15R0.324 COC(=O)C(C)COCCCOCCCN 34a_100011310245_100000698445 [0,1,0,0,0,0|3,0,0]=4 5531 B15R0.324 COC(=O)C(C)CSCCCCCCC#N 62a_100000698445_100009813337 [0,1,0,0,0,0|2,0,1]=4 5532 B15R0.324 COC(=O)C(C)CSCCCCCCC#N 62a_100009813337_100000698445 [0,1,0,0,0,0|2,0,1]=4 5533 B15R0.324 COC(=O)C(C)CSCCCCCCCO 62a_100000698445_100000760002 [0,1,0,0,0,0|2,0,0]=3 5534 B15R0.324 COC(=O)C(C)CSCCCCCCCO 62a_100000760002_100000698445 [0,1,0,0,0,0|2,0,0]=3 5535 B15R0.324 COC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100000211248 [0,1,0,0,0,0|2,0,0]=3 5536 B15R0.324 COC(=O)C(C)NCCCCCCCCO 34a_102515433106_100000211248 [0,1,0,0,0,0|2,0,0]=3 5537 B15R0.324 COC(=O)C(C)OCCCCCCCCBr 34a_100009813846_100000211248 [0,1,0,0,0,0|2,0,0]=3 5538 B15R0.324 COC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100000211248 [0,1,0,0,0,0|2,0,0]=3 5539 B15R0.324 COC(=O)C(C)OCCCCCCCCCl 34a_100000033203_100000211248 [0,1,0,0,0,0|2,0,0]=3 5540 B15R0.324 COC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100000211248 [0,1,0,0,0,0|2,0,0]=3 5541 B15R0.324 COC(=O)C(C)OCCCCCCCCN 34a_102515433106_100000211248 [0,1,0,0,0,0|2,0,0]=3 5542 B15R0.324 COC(=O)C(C)OCCCCCCCCO 34a_100011215400_100000033203 [0,1,0,0,0,0|2,0,0]=3 5543 B15R0.324 COC(=O)C(C)OCCCCCNCCN 34a_103619048469_100000211248 [0,1,0,0,0,0|3,0,0]=4 5544 B15R0.324 COC(=O)C(C)SCCCCCCCCO 62a_100000033203_100000211248 [0,1,0,0,0,0|2,0,0]=3 5545 B15R0.324 COC(=O)C(C)SCCCCCCCCO 62a_100000211248_100000033203 [0,1,0,0,0,0|2,0,0]=3 5546 B15R0.324 COC(=O)C(F)COCCCCCCCO 34a_200009849844_100000760002 [0,1,0,0,0,0|2,0,0]=3 5547 B15R0.324 COC(=O)[C@H](N)COCCCCCCCO 34a_100000003586_100000760002 [0,1,0,0,0,0|2,0,0]=3 5548 B15R0.324 COCCCCCCOCC(=O)C(=O)OC 34a_200012092642_100011610305 [0,1,0,0,0,0|2,0,1]=4 5549 B15R0.324 COCCCCCCOCC(C)C(=O)OC 34a_100000749362_100011998445 [0,1,0,0,0,0|2,0,0]=3 5550 B15R0.324 COCCCCCCOCC(C)C(=O)OC 34a_200012092642_100000698445 [0,1,0,0,0,0|2,0,0]=3 5551 B15R0.324 COCCCCCCOCC(C)C(=O)OC 7a_100000749362_100011998445 [0,1,0,0,0,0|2,0,0]=3 5552 B15R0.324 COCCCCCCOCC(F)C(=O)OC 34a_200009849844_100011998445 [0,1,0,0,0,0|2,0,0]=3 5553 B15R0.324 COCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011998445 [0,1,0,0,0,0|2,0,0]=3 5554 B15R0.324 COCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100011998445 [0,1,0,0,0,0|2,0,1]=4 5555 B15R0.324 COCCCCCCSCC(=O)C(=O)OC 62a_100011998445_100011610305 [0,1,0,0,0,0|2,0,1]=4 5556 B15R0.324 COCCCCCCSCC(C)C(=O)OC 62a_100000698445_100011998445 [0,1,0,0,0,0|2,0,0]=3 5557 B15R0.324 COCCCCCCSCC(C)C(=O)OC 62a_100011998445_100000698445 [0,1,0,0,0,0|2,0,0]=3 5558 B15R0.324 COCCCCCNCCC(C)C(=O)OC 2230a_100000747528_100000034942 [0,1,0,0,0,0|2,0,0]=3 5559 B15R0.324 COCCCCCNCCC(C)C(=O)OC 34a_100000747528_100000034942 [0,1,0,0,0,0|2,0,0]=3 5560 B15R0.324 COCCCOCCCOC(C)C(=O)OC 34a_200011215475_100000211248 [0,1,0,0,0,0|3,0,0]=4 5561 B15R0.324 COCCCOCCCOC(C)C(=O)OC 7a_200011215475_100000211248 [0,1,0,0,0,0|3,0,0]=4 5562 B15R0.324 COCCOCCCNCC(C)C(=O)OC 34a_100000206027_100000698445 [0,1,0,0,0,0|3,0,0]=4 5563 B15R0.324 COCCOCCCOCC(C)C(=O)OC 34a_100000749362_100011216529 [0,1,0,0,0,0|3,0,0]=4 5564 B15R0.324 COCCOCCCOCC(C)C(=O)OC 7a_100000749362_100011216529 [0,1,0,0,0,0|3,0,0]=4 5565 B15R0.324 COCCOCCCOCC(F)C(=O)OC 34a_200009849844_100011216529 [0,1,0,0,0,0|3,0,0]=4 5566 B15R0.324 COCCOCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011216529 [0,1,0,0,0,0|3,0,0]=4 5567 B15R0.324 COCCOCCCSCC(C)C(=O)OC 62a_100000698445_100011216529 [0,1,0,0,0,0|3,0,0]=4 5568 B15R0.324 COCCOCCCSCC(C)C(=O)OC 62a_100011216529_100000698445 [0,1,0,0,0,0|3,0,0]=4 5569 B15R0.324 COCCOCCNCCC(C)C(=O)OC 2230a_100000745349_100000034942 [0,1,0,0,0,0|3,0,0]=4 5570 B15R0.324 COCCOCCNCCC(C)C(=O)OC 34a_100000745349_100000034942 [0,1,0,0,0,0|3,0,0]=4 5571 B15R0.324 COCCOCCOCCC(C)C(=O)OC 34a_100011215163_100000034942 [0,1,0,0,0,0|3,0,0]=4 5572 B15R0.324 COCCOCCOCCC(C)C(=O)OC 7a_100011215163_100000034942 [0,1,0,0,0,0|3,0,0]=4 5573 B15R0.324 COCCOCCSCCC(C)C(=O)OC 62a_100000034942_100000695917 [0,1,0,0,0,0|3,0,0]=4 5574 B15R0.324 COCCOCCSCCC(C)C(=O)OC 62a_100000695917_100000034942 [0,1,0,0,0,0|3,0,0]=4 5575 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000184674 [0,1,0,0,0,0|1,0,1]=3 5576 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100011220946_100011215454 [0,1,0,0,0,0|1,0,1]=3 5577 B15R0.366 C#CCC(=O)CCCCCCCCCCO 1458a_100011220946_100009813290 [0,1,0,0,0,0|2,0,1]=4 5578 B15R0.366 C#CCC(=O)NCCCCCCCCCC 1626a_100000684558_100011220946 [0,1,0,0,0,0|2,0,1]=4 5579 B15R0.366 C#CCC(=O)NCCCCCCCCCC 527a_100000684558_100011220946 [0,1,0,0,0,0|2,0,1]=4 5580 B15R0.366 C#CCCCCCCCOCC(=O)OCC 34a_100000054614_100000188475 [0,1,0,0,0,0|1,0,2]=4 5581 B15R0.366 C#CCCCCCCCOCC(=O)OCC 7a_100000054614_100000188475 [0,1,0,0,0,0|1,0,2]=4 5582 B15R0.366 C#CCCCCCCCSCC(=O)OCC 62a_100000188475_100153394163 [0,1,0,0,0,0|1,0,2]=4 5583 B15R0.366 C#CCCCCCCCSCC(=O)OCC 62a_100153394163_100000188475 [0,1,0,0,0,0|1,0,2]=4 5584 B15R0.366 C#CCCCCCCOCCC(=O)OCC 34a_100011217361_100000765890 [0,1,0,0,0,0|1,0,2]=4 5585 B15R0.366 C#CCCCCCCOCCC(=O)OCC 7a_100011217361_100011206558 [0,1,0,0,0,0|1,0,2]=4 5586 B15R0.366 C#CCCCCCCSCCC(=O)OCC 62a_100000765890_100012276617 [0,1,0,0,0,0|1,0,2]=4 5587 B15R0.366 C#CCCCCCCSCCC(=O)OCC 62a_100012276617_100000765890 [0,1,0,0,0,0|1,0,2]=4 5588 B15R0.366 C#CCCCCCOCCCC(=O)OCC 34a_100000766912_100009991533 [0,1,0,0,0,0|1,0,2]=4 5589 B15R0.366 C#CCCCCCOCCCC(=O)OCC 7a_100000766912_100011215271 [0,1,0,0,0,0|1,0,2]=4 5590 B15R0.366 C#CCCCCCOCCCC(=O)OCC 7a_100012001163_100012094781 [0,1,0,0,0,0|1,0,2]=4 5591 B15R0.366 C#CCCCCCSCCCC(=O)OCC 62a_100009991533_100012094781 [0,1,0,0,0,0|1,0,2]=4 5592 B15R0.366 C#CCCCCCSCCCC(=O)OCC 62a_100012094781_100009991533 [0,1,0,0,0,0|1,0,2]=4 5593 B15R0.366 C#CCCCCNCCCCC(=O)OCC 2230a_100000706060_100000750268 [0,1,0,0,0,0|1,0,2]=4 5594 B15R0.366 C#CCCCCNCCCCC(=O)OCC 34a_100000706060_100000750268 [0,1,0,0,0,0|1,0,2]=4 5595 B15R0.366 C#CCCCCOCCCCC(=O)OCC 34a_100000766709_100000750268 [0,1,0,0,0,0|1,0,2]=4 5596 B15R0.366 C#CCCCCOCCCCC(=O)OCC 7a_100000766709_100000750268 [0,1,0,0,0,0|1,0,2]=4 5597 B15R0.366 C#CCCCCSCCCCC(=O)OCC 62a_100000750268_100010269958 [0,1,0,0,0,0|1,0,2]=4 5598 B15R0.366 C#CCCCCSCCCCC(=O)OCC 62a_100010269958_100000750268 [0,1,0,0,0,0|1,0,2]=4 5599 B15R0.366 C#CCCCNCCCCCC(=O)OCC 34a_100000718082_100000755133 [0,1,0,0,0,0|1,0,2]=4 5600 B15R0.366 C#CCCCOCCCCCC(=O)OCC 34a_100000215630_100000755133 [0,1,0,0,0,0|1,0,2]=4 5601 B15R0.366 C#CCCCOCCCCCC(=O)OCC 7a_100000215630_100000755133 [0,1,0,0,0,0|1,0,2]=4 5602 B15R0.366 C#CCCCOCCCCCC(=O)OCC 7a_100011214988_100011215417 [0,1,0,0,0,0|1,0,2]=4 5603 B15R0.366 C#CCCCSCCCCCC(=O)OCC 62a_100000755133_100011215417 [0,1,0,0,0,0|1,0,2]=4 5604 B15R0.366 C#CCCCSCCCCCC(=O)OCC 62a_100011215417_100000755133 [0,1,0,0,0,0|1,0,2]=4 5605 B15R0.366 C#CCCNCCCCCCC(=O)OCC 34a_100000755551_100009814379 [0,1,0,0,0,0|1,0,2]=4 5606 B15R0.366 C#CCCOCCCCCCC(=O)OCC 34a_100011215631_100009814379 [0,1,0,0,0,0|1,0,2]=4 5607 B15R0.366 C#CCCSCCCCCCC(=O)OCC 62a_100000688953_100009814379 [0,1,0,0,0,0|1,0,2]=4 5608 B15R0.366 C#CCNCCCCCCCC(=O)OCC 34a_100000212058_100009991516 [0,1,0,0,0,0|1,0,2]=4 5609 B15R0.366 C#CCOCCCCCCCC(=O)OCC 34a_100000210247_100009991516 [0,1,0,0,0,0|1,0,2]=4 5610 B15R0.366 C#CCSCCCCCCCC(=O)OCC 62a_100000038162_100009991516 [0,1,0,0,0,0|1,0,2]=4 5611 B15R0.366 C/C=C/CCOCCCCCC(=O)OCC 34a_100016278192_100000755133 [0,1,0,0,0,0|1,0,2]=4 5612 B15R0.366 C/C=C/COCCCCCCC(=O)OCC 34a_100016270725_100009814379 [0,1,0,0,0,0|1,0,2]=4 5613 B15R0.366 C/C=C/CSCCCCCCC(=O)OCC 62a_100102629194_100009814379 [0,1,0,0,0,0|1,0,2]=4 5614 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210193_100011215454 [0,1,0,0,0,0|1,0,1]=3 5615 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000210623 [0,1,0,0,0,0|1,0,1]=3 5616 B15R0.366 C=CCC(=O)CCCCCCCCCCO 1458a_100000210193_100009813290 [0,1,0,0,0,0|2,0,1]=4 5617 B15R0.366 C=CCC(=O)NCCCCCCCCCC 11a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 5618 B15R0.366 C=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 5619 B15R0.366 C=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 5620 B15R0.366 C=CCC(=O)NCCCCCCCCCC 527a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 5621 B15R0.366 C=CCCCCCCCCCC(=O)C#CC 1458a_100000763181_100009814027 [0,1,0,0,0,0|1,0,2]=4 5622 B15R0.366 C=CCCCCCCCCCC(=O)C=CC 1458a_100000210699_100009814027 [0,1,0,0,0,0|1,0,2]=4 5623 B15R0.366 C=CCCCCCCCCCC(=O)CCC 1458a_100000211992_100009814027 [0,1,0,0,0,0|1,0,2]=4 5624 B15R0.366 C=CCCCCCCCCCC(=O)CCO 1458a_100011216618_100009814027 [0,1,0,0,0,0|1,0,2]=4 5625 B15R0.366 C=CCCCCCCCCCC(=O)COC 1458a_100000210968_100009814027 [0,1,0,0,0,0|0,0,2]=3 5626 B15R0.366 C=CCCCCCCCCCC(=O)CSC 1458a_100000184570_100009814027 [0,1,0,0,0,0|0,1,2]=4 5627 B15R0.366 C=CCCCCCCCOCC(=O)OCC 34a_100000730831_100000188475 [0,1,0,0,0,0|1,0,2]=4 5628 B15R0.366 C=CCCCCCCCOCC(=O)OCC 7a_100000730831_100000188475 [0,1,0,0,0,0|1,0,2]=4 5629 B15R0.366 C=CCCCCCCCSCC(=O)OCC 62a_100000188475_100012355270 [0,1,0,0,0,0|1,0,2]=4 5630 B15R0.366 C=CCCCCCCCSCC(=O)OCC 62a_100012355270_100000188475 [0,1,0,0,0,0|1,0,2]=4 5631 B15R0.366 C=CCCCCCCOCCC(=O)OCC 34a_200011216477_100000765890 [0,1,0,0,0,0|1,0,2]=4 5632 B15R0.366 C=CCCCCCCOCCC(=O)OCC 7a_200011216477_100011206558 [0,1,0,0,0,0|1,0,2]=4 5633 B15R0.366 C=CCCCCCCSCCC(=O)OCC 62a_100000765890_100011215473 [0,1,0,0,0,0|1,0,2]=4 5634 B15R0.366 C=CCCCCCCSCCC(=O)OCC 62a_100011215473_100000765890 [0,1,0,0,0,0|1,0,2]=4 5635 B15R0.366 C=CCCCCCOCCCC(=O)OCC 34a_100011216702_100009991533 [0,1,0,0,0,0|1,0,2]=4 5636 B15R0.366 C=CCCCCCOCCCC(=O)OCC 7a_100011216702_100011215271 [0,1,0,0,0,0|1,0,2]=4 5637 B15R0.366 C=CCCCCCOCCCC(=O)OCC 7a_100012001163_100000700193 [0,1,0,0,0,0|1,0,2]=4 5638 B15R0.366 C=CCCCCCSCCCC(=O)OCC 62a_100000700193_100009991533 [0,1,0,0,0,0|1,0,2]=4 5639 B15R0.366 C=CCCCCCSCCCC(=O)OCC 62a_100009991533_100000700193 [0,1,0,0,0,0|1,0,2]=4 5640 B15R0.366 C=CCCCCNCCCCC(=O)OCC 2230a_100000703577_100000750268 [0,1,0,0,0,0|1,0,2]=4 5641 B15R0.366 C=CCCCCNCCCCC(=O)OCC 34a_100000703577_100000750268 [0,1,0,0,0,0|1,0,2]=4 5642 B15R0.366 C=CCCCCOCCCCC(=O)OCC 34a_100000766645_100000750268 [0,1,0,0,0,0|1,0,2]=4 5643 B15R0.366 C=CCCCCOCCCCC(=O)OCC 7a_100000766645_100000750268 [0,1,0,0,0,0|1,0,2]=4 5644 B15R0.366 C=CCCCCSCCCCC(=O)OCC 62a_100000750268_100011215482 [0,1,0,0,0,0|1,0,2]=4 5645 B15R0.366 C=CCCCCSCCCCC(=O)OCC 62a_100011215482_100000750268 [0,1,0,0,0,0|1,0,2]=4 5646 B15R0.366 C=CCCCNCCCCCC(=O)OCC 2230a_100000700776_100000755133 [0,1,0,0,0,0|1,0,2]=4 5647 B15R0.366 C=CCCCNCCCCCC(=O)OCC 34a_100000700776_100000755133 [0,1,0,0,0,0|1,0,2]=4 5648 B15R0.366 C=CCCCOCCCCCC(=O)OCC 34a_100000758997_100000755133 [0,1,0,0,0,0|1,0,2]=4 5649 B15R0.366 C=CCCCOCCCCCC(=O)OCC 7a_100000758997_100000755133 [0,1,0,0,0,0|1,0,2]=4 5650 B15R0.366 C=CCCCOCCCCCC(=O)OCC 7a_100011214988_100000757094 [0,1,0,0,0,0|1,0,2]=4 5651 B15R0.366 C=CCCCSCCCCCC(=O)OCC 62a_100000755133_100000757094 [0,1,0,0,0,0|1,0,2]=4 5652 B15R0.366 C=CCCCSCCCCCC(=O)OCC 62a_100011713584_100000755133 [0,1,0,0,0,0|1,0,2]=4 5653 B15R0.366 C=CCCNCCCCCCC(=O)OCC 2230a_100015191253_100009814379 [0,1,0,0,0,0|1,0,2]=4 5654 B15R0.366 C=CCCOCCCCCCC(=O)OCC 34a_100011205117_100009814379 [0,1,0,0,0,0|1,0,2]=4 5655 B15R0.366 C=CCCSCCCCCCC(=O)OCC 62a_100000754431_100009814379 [0,1,0,0,0,0|1,0,2]=4 5656 B15R0.366 C=CCNCCCCCCCC(=O)OCC 2230a_100020586998_100009991516 [0,1,0,0,0,0|1,0,2]=4 5657 B15R0.366 C=CCOCCCCCCCC(=O)OCC 34a_200000210373_100009991516 [0,1,0,0,0,0|1,0,2]=4 5658 B15R0.366 C=CCSCCCCCCCC(=O)OCC 62a_100000210623_100009991516 [0,1,0,0,0,0|1,0,2]=4 5659 B15R0.366 C=COC(=O)CNCCCCCCCCC 2230a_100000212291_100000036128 [0,1,0,0,0,0|1,0,1]=3 5660 B15R0.366 C=COC(=O)CNCCCCCCCCC 34a_100000212291_100000036128 [0,1,0,0,0,0|1,0,1]=3 5661 B15R0.366 C=COC(=O)CNCCCCCCCCO 2230a_102515433106_100000036128 [0,1,0,0,0,0|2,0,1]=4 5662 B15R0.366 C=COC(=O)CNCCCCCCCCO 34a_102515433106_100000036128 [0,1,0,0,0,0|2,0,1]=4 5663 B15R0.366 C=COC(=O)COCCCCCCCCBr 34a_100009813846_100000036128 [0,1,0,0,0,0|2,0,1]=4 5664 B15R0.366 C=COC(=O)COCCCCCCCCC 34a_100000210712_100000036128 [0,1,0,0,0,0|1,0,1]=3 5665 B15R0.366 C=COC(=O)COCCCCCCCCCl 34a_100000033203_100000036128 [0,1,0,0,0,0|2,0,1]=4 5666 B15R0.366 C=COC(=O)COCCCCCCCCN 34a_102515433106_100000036128 [0,1,0,0,0,0|2,0,1]=4 5667 B15R0.366 C=COC(=O)COCCCCNCCCC 34a_200011216965_100000036128 [0,1,0,0,0,0|2,0,1]=4 5668 B15R0.366 C=COC(=O)COCCCCOCCCC 34a_200000760531_100000036128 [0,1,0,0,0,0|2,0,1]=4 5669 B15R0.366 C=COC(=O)COCCOCCCCCC 34a_100000691444_100000036128 [0,1,0,0,0,0|2,0,1]=4 5670 B15R0.366 C=COC(=O)CSCCCCCCCCC 62a_100000036128_100000210670 [0,1,0,0,0,0|1,0,1]=3 5671 B15R0.366 C=COC(=O)CSCCCCCCCCO 62a_100000033203_100000036128 [0,1,0,0,0,0|2,0,1]=4 5672 B15R0.366 C=COC(=O)CSCCCCCCCCO 62a_100000036128_100000033203 [0,1,0,0,0,0|2,0,1]=4 5673 B15R0.366 CC#CC(=O)CCCCCCCCCCC 1458a_100000763181_100011215454 [0,1,0,0,0,0|1,0,0]=2 5674 B15R0.366 CC#CC(=O)CCCCCCCCCCO 1458a_100000763181_100009813290 [0,1,0,0,0,0|2,0,0]=3 5675 B15R0.366 CC#CCCOCCCCCC(=O)OCC 34a_100000750427_100000755133 [0,1,0,0,0,0|1,0,2]=4 5676 B15R0.366 CC#CCNCCCCCCC(=O)OCC 2230a_100000685387_100009814379 [0,1,0,0,0,0|1,0,2]=4 5677 B15R0.366 CC#CCNCCCCCCC(=O)OCC 34a_100000685387_100009814379 [0,1,0,0,0,0|1,0,2]=4 5678 B15R0.366 CC#CCOCCCCCCC(=O)OCC 34a_100000761923_100009814379 [0,1,0,0,0,0|1,0,2]=4 5679 B15R0.366 CC#CCSCCCCCCC(=O)OCC 62a_100000748600_100009814379 [0,1,0,0,0,0|1,0,2]=4 5680 B15R0.366 CC/C=C/CCCOCCCC(=O)OCC 34a_100016287902_100009991533 [0,1,0,0,0,0|1,0,2]=4 5681 B15R0.366 CC/C=C/CCCOCCCC(=O)OCC 7a_100016287902_100011215271 [0,1,0,0,0,0|1,0,2]=4 5682 B15R0.366 CC/C=C\CCCCCOCC(=O)OCC 34a_100016268722_100000188475 [0,1,0,0,0,0|1,0,2]=4 5683 B15R0.366 CC/C=C\CCCCCOCC(=O)OCC 7a_100016268722_100000188475 [0,1,0,0,0,0|1,0,2]=4 5684 B15R0.366 CC/C=C\CCCCOCCC(=O)OCC 34a_100016287862_100000765890 [0,1,0,0,0,0|1,0,2]=4 5685 B15R0.366 CC/C=C\CCCCOCCC(=O)OCC 7a_100016287862_100011206558 [0,1,0,0,0,0|1,0,2]=4 5686 B15R0.366 CC/C=C\CCOCCCCC(=O)OCC 34a_100016288707_100000750268 [0,1,0,0,0,0|1,0,2]=4 5687 B15R0.366 CC/C=C\CCOCCCCC(=O)OCC 7a_100016288707_100000750268 [0,1,0,0,0,0|1,0,2]=4 5688 B15R0.366 CC/C=C\CCSCCCCC(=O)OCC 62a_100000750268_100015370543 [0,1,0,0,0,0|1,0,2]=4 5689 B15R0.366 CC/C=C\CCSCCCCC(=O)OCC 62a_100015370543_100000750268 [0,1,0,0,0,0|1,0,2]=4 5690 B15R0.366 CC/C=C\COCCCCCC(=O)OCC 34a_100016268518_100000755133 [0,1,0,0,0,0|1,0,2]=4 5691 B15R0.366 CC/C=C\COCCCCCC(=O)OCC 7a_100011214988_100103147603 [0,1,0,0,0,0|1,0,2]=4 5692 B15R0.366 CC/C=C\CSCCCCCC(=O)OCC 62a_100000755133_100103147603 [0,1,0,0,0,0|1,0,2]=4 5693 B15R0.366 CC/C=C\CSCCCCCC(=O)OCC 62a_100103147603_100000755133 [0,1,0,0,0,0|1,0,2]=4 5694 B15R0.366 CC=CC(=O)CCCCCCCCCCC 1458a_100000210699_100011215454 [0,1,0,0,0,0|1,0,0]=2 5695 B15R0.366 CC=CC(=O)CCCCCCCCCCO 1458a_100000210699_100009813290 [0,1,0,0,0,0|2,0,0]=3 5696 B15R0.366 CC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000210699 [0,1,0,0,0,0|2,0,0]=3 5697 B15R0.366 CC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000210699 [0,1,0,0,0,0|2,0,0]=3 5698 B15R0.366 CC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000210699 [0,1,0,0,0,0|2,0,0]=3 5699 B15R0.366 CC=CC(=O)NCCCCCCCCCO 240690a_100000078944_100000210699 [0,1,0,0,0,0|3,0,0]=4 5700 B15R0.366 CC=CCCCOCCCCC(=O)OCC 34a_100020645299_100000750268 [0,1,0,0,0,0|1,0,2]=4 5701 B15R0.366 CC=CCSCCCCCCC(=O)OCC 62a_100000070051_100009814379 [0,1,0,0,0,0|1,0,2]=4 5702 B15R0.366 CCC#CCCOCCCCC(=O)OCC 34a_100000036655_100000750268 [0,1,0,0,0,0|1,0,2]=4 5703 B15R0.366 CCC#CCCOCCCCC(=O)OCC 7a_100000036655_100000750268 [0,1,0,0,0,0|1,0,2]=4 5704 B15R0.366 CCC#CCOCCCCCC(=O)OCC 34a_100000032950_100000755133 [0,1,0,0,0,0|1,0,2]=4 5705 B15R0.366 CCC#CCOCCCCCC(=O)OCC 7a_100011214988_100009813939 [0,1,0,0,0,0|1,0,2]=4 5706 B15R0.366 CCC#CCSCCCCCC(=O)OCC 62a_100000755133_100009813939 [0,1,0,0,0,0|1,0,2]=4 5707 B15R0.366 CCC#CCSCCCCCC(=O)OCC 62a_100009813939_100000755133 [0,1,0,0,0,0|1,0,2]=4 5708 B15R0.366 CCC/C=C/COCCCCC(=O)OCC 34a_100016278788_100000750268 [0,1,0,0,0,0|1,0,2]=4 5709 B15R0.366 CCC/C=C/COCCCCC(=O)OCC 7a_100016278788_100000750268 [0,1,0,0,0,0|1,0,2]=4 5710 B15R0.366 CCCC#CCCOCCCC(=O)OCC 34a_100000042726_100009991533 [0,1,0,0,0,0|1,0,2]=4 5711 B15R0.366 CCCC#CCCOCCCC(=O)OCC 7a_100000042726_100011215271 [0,1,0,0,0,0|1,0,2]=4 5712 B15R0.366 CCCC#CCOCCCCC(=O)OCC 34a_100000034806_100000750268 [0,1,0,0,0,0|1,0,2]=4 5713 B15R0.366 CCCC#CCOCCCCC(=O)OCC 7a_100000034806_100000750268 [0,1,0,0,0,0|1,0,2]=4 5714 B15R0.366 CCCC(=O)CCCCCCCCCCO 1458a_100000211992_100009813290 [0,1,0,0,0,0|2,0,0]=3 5715 B15R0.366 CCCC(=O)CNCCCCCCCCO 2230a_102515433106_100000747444 [0,1,0,0,0,0|3,0,0]=4 5716 B15R0.366 CCCC(=O)COCCCCCCCCBr 7a_100009813846_100000747444 [0,1,0,0,0,0|3,0,0]=4 5717 B15R0.366 CCCC(=O)COCCCCCCCCCl 7a_100000033203_100000747444 [0,1,0,0,0,0|3,0,0]=4 5718 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000033203_100000747444 [0,1,0,0,0,0|3,0,0]=4 5719 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000747444_100000033203 [0,1,0,0,0,0|3,0,0]=4 5720 B15R0.366 CCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211992 [0,1,0,0,0,0|3,0,0]=4 5721 B15R0.366 CCCC/C=C/COCCCC(=O)OCC 34a_200016272032_100009991533 [0,1,0,0,0,0|1,0,2]=4 5722 B15R0.366 CCCC/C=C/COCCCC(=O)OCC 7a_200016272032_100011215271 [0,1,0,0,0,0|1,0,2]=4 5723 B15R0.366 CCCC/C=C\CCOCCC(=O)OCC 34a_200016286491_100000765890 [0,1,0,0,0,0|1,0,2]=4 5724 B15R0.366 CCCC/C=C\CCOCCC(=O)OCC 7a_200016286491_100011206558 [0,1,0,0,0,0|1,0,2]=4 5725 B15R0.366 CCCCC#CCCCSCC(=O)OCC 62a_100000188475_200000047210 [0,1,0,0,0,0|1,0,2]=4 5726 B15R0.366 CCCCC#CCCCSCC(=O)OCC 62a_200000047210_100000188475 [0,1,0,0,0,0|1,0,2]=4 5727 B15R0.366 CCCCC#CCCOCCC(=O)OCC 34a_100000037610_100000765890 [0,1,0,0,0,0|1,0,2]=4 5728 B15R0.366 CCCCC#CCCOCCC(=O)OCC 7a_100000037610_100011206558 [0,1,0,0,0,0|1,0,2]=4 5729 B15R0.366 CCCCC#CCOCCCC(=O)OCC 34a_200000034558_100009991533 [0,1,0,0,0,0|1,0,2]=4 5730 B15R0.366 CCCCC#CCOCCCC(=O)OCC 7a_200000034558_100011215271 [0,1,0,0,0,0|1,0,2]=4 5731 B15R0.366 CCCCC/C=C/COCCC(=O)OCC 34a_100016258190_100000765890 [0,1,0,0,0,0|1,0,2]=4 5732 B15R0.366 CCCCC/C=C/COCCC(=O)OCC 7a_100016258190_100011206558 [0,1,0,0,0,0|1,0,2]=4 5733 B15R0.366 CCCCC/C=C\CCOCC(=O)OCC 34a_100016277358_100000188475 [0,1,0,0,0,0|1,0,2]=4 5734 B15R0.366 CCCCC/C=C\CCOCC(=O)OCC 7a_100016277358_100000188475 [0,1,0,0,0,0|1,0,2]=4 5735 B15R0.366 CCCCCC#CCCOCC(=O)OCC 34a_200000042877_100000188475 [0,1,0,0,0,0|1,0,2]=4 5736 B15R0.366 CCCCCC#CCCOCC(=O)OCC 7a_200000042877_100000188475 [0,1,0,0,0,0|1,0,2]=4 5737 B15R0.366 CCCCCC#CCOCCC(=O)OCC 34a_200000033628_100000765890 [0,1,0,0,0,0|1,0,2]=4 5738 B15R0.366 CCCCCC#CCOCCC(=O)OCC 7a_200000033628_100011206558 [0,1,0,0,0,0|1,0,2]=4 5739 B15R0.366 CCCCCC#CCSCCC(=O)OCC 62a_100000765890_100009816472 [0,1,0,0,0,0|1,0,2]=4 5740 B15R0.366 CCCCCC#CCSCCC(=O)OCC 62a_100009816472_100000765890 [0,1,0,0,0,0|1,0,2]=4 5741 B15R0.366 CCCCCC/C=C/COCC(=O)OCC 34a_200016276170_100000188475 [0,1,0,0,0,0|1,0,2]=4 5742 B15R0.366 CCCCCC/C=C/COCC(=O)OCC 7a_200016276170_100000188475 [0,1,0,0,0,0|1,0,2]=4 5743 B15R0.366 CCCCCCC#CCOCC(=O)OCC 34a_200000037284_100000188475 [0,1,0,0,0,0|1,0,2]=4 5744 B15R0.366 CCCCCCC#CCOCC(=O)OCC 7a_200000037284_100000188475 [0,1,0,0,0,0|1,0,2]=4 5745 B15R0.366 CCCCCCCCC=NNC(=O)COC 4a_100000216845_100011218696 [0,1,0,0,0,0|2,0,1]=4 5746 B15R0.366 CCCCCCCCCC=CC(=O)CCC 1458a_200015352897_100000210303 [0,1,0,0,0,0|1,0,2]=4 5747 B15R0.366 CCCCCCCCCC=CC(=O)CCF 1458a_200015352897_100011217306 [0,1,0,0,0,0|1,0,2]=4 5748 B15R0.366 CCCCCCCCCC=CC(=O)CCO 1458a_200015352897_100000211926 [0,1,0,0,0,0|1,0,2]=4 5749 B15R0.366 CCCCCCCCCC=CC(=O)NCC 11a_100015525214_200015352897 [0,1,0,0,0,0|1,0,2]=4 5750 B15R0.366 CCCCCCCCCC=CC(=O)NCC 240690a_100015525214_200015352897 [0,1,0,0,0,0|1,0,2]=4 5751 B15R0.366 CCCCCCCCCC=CC(=O)NNC 22a_100016993582_200015352897 [0,1,0,0,0,0|1,0,2]=4 5752 B15R0.366 CCCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100011215454 [0,1,0,0,0,0|1,0,1]=3 5753 B15R0.366 CCCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100011215454 [0,1,0,0,0,0|1,0,1]=3 5754 B15R0.366 CCCCCCCCCCCC(=O)C=CI 1458a_100016256311_100011215454 [0,1,0,0,0,0|1,0,1]=3 5755 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100000210736_100011214920 [0,1,0,0,0,0|1,0,1]=3 5756 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100011215454 [0,1,0,0,0,0|1,0,1]=3 5757 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000210736_100000210303 [0,1,0,0,0,0|1,0,0]=2 5758 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011215454 [0,1,0,0,0,0|1,0,0]=2 5759 B15R0.366 CCCCCCCCCCCC(=O)CCF 1458a_100000210736_100011217306 [0,1,0,0,0,0|1,0,0]=2 5760 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100000210736_100000211926 [0,1,0,0,0,0|1,0,0]=2 5761 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011215454 [0,1,0,0,0,0|1,0,0]=2 5762 B15R0.366 CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011215454 [0,1,0,0,0,0|0,0,0]=1 5763 B15R0.366 CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011215454 [0,1,0,0,0,0|0,1,0]=2 5764 B15R0.366 CCCCCCCCCCCC(=O)NCC 11a_100015525214_100000210736 [0,1,0,0,0,0|1,0,0]=2 5765 B15R0.366 CCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210736 [0,1,0,0,0,0|1,0,0]=2 5766 B15R0.366 CCCCCCCCCCCC(=O)NNC 22a_100016993582_100000210736 [0,1,0,0,0,0|1,0,0]=2 5767 B15R0.366 CCCCCCCCCCCC(C)NCC 270004a_100015525214_100011216755 [0,1,0,0,0,0|2,0,1]=4 5768 B15R0.366 CCCCCCCCCCCC(C)OCC 34a_100011217895_100000210202 [0,1,0,0,0,0|1,0,1]=3 5769 B15R0.366 CCCCCCCCCCCC(C)OCC 7a_100011217895_100000210202 [0,1,0,0,0,0|1,0,1]=3 5770 B15R0.366 CCCCCCCCCCCC(C)OCF 34a_100011217895_100015361967 [0,1,0,0,0,0|1,0,1]=3 5771 B15R0.366 CCCCCCCCCCCC(C)OCF 7a_100011217895_100015361967 [0,1,0,0,0,0|1,0,1]=3 5772 B15R0.366 CCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215454 [0,1,0,0,0,0|3,0,0]=4 5773 B15R0.366 CCCCCCCCCCCN(C)CCC 269982a_100000747261_100011215454 [0,1,0,0,0,0|3,0,0]=4 5774 B15R0.366 CCCCCCCCCCCN(C)CCO 2230a_100000210263_100011215454 [0,1,0,0,0,0|3,0,0]=4 5775 B15R0.366 CCCCCCCCCCCN(C)CCO 269982a_100000210263_100011215454 [0,1,0,0,0,0|3,0,0]=4 5776 B15R0.366 CCCCCCCCCCNC(=O)C=CBr 1626a_100000684558_100016273825 [0,1,0,0,0,0|2,0,1]=4 5777 B15R0.366 CCCCCCCCCCNC(=O)C=CBr 240690a_100000684558_100016273825 [0,1,0,0,0,0|2,0,1]=4 5778 B15R0.366 CCCCCCCCCCNC(=O)C=CCl 11a_100000684558_200016279998 [0,1,0,0,0,0|2,0,1]=4 5779 B15R0.366 CCCCCCCCCCNC(=O)C=CCl 1626a_100000684558_200016279998 [0,1,0,0,0,0|2,0,1]=4 5780 B15R0.366 CCCCCCCCCCNC(=O)C=CCl 240690a_100000684558_200016279998 [0,1,0,0,0,0|2,0,1]=4 5781 B15R0.366 CCCCCCCCCCNC(=O)C=CI 1626a_100000684558_100016256311 [0,1,0,0,0,0|2,0,1]=4 5782 B15R0.366 CCCCCCCCCCNC(=O)CC#N 1626a_100000684558_100051588842 [0,1,0,0,0,0|2,0,1]=4 5783 B15R0.366 CCCCCCCCCCNC(=O)CC#N 240690a_100000684558_100051588842 [0,1,0,0,0,0|2,0,1]=4 5784 B15R0.366 CCCCCCCCCCNC(=O)CCC 11a_100000684558_100000211992 [0,1,0,0,0,0|2,0,0]=3 5785 B15R0.366 CCCCCCCCCCNC(=O)CCC 1626a_100000684558_100000211992 [0,1,0,0,0,0|2,0,0]=3 5786 B15R0.366 CCCCCCCCCCNC(=O)CCC 240690a_100000684558_100000211992 [0,1,0,0,0,0|2,0,0]=3 5787 B15R0.366 CCCCCCCCCCNC(=O)CCC 527a_100000684558_100000211992 [0,1,0,0,0,0|2,0,0]=3 5788 B15R0.366 CCCCCCCCCCNC(=O)CCO 240690a_100000684558_100011216618 [0,1,0,0,0,0|2,0,0]=3 5789 B15R0.366 CCCCCCCCCCNC(=O)COC 11a_100000684558_100000210968 [0,1,0,0,0,0|1,0,0]=2 5790 B15R0.366 CCCCCCCCCCNC(=O)COC 1626a_100000684558_100000210968 [0,1,0,0,0,0|1,0,0]=2 5791 B15R0.366 CCCCCCCCCCNC(=O)COC 240690a_100000684558_100000210968 [0,1,0,0,0,0|1,0,0]=2 5792 B15R0.366 CCCCCCCCCCNC(=O)COC 527a_100000684558_100000210968 [0,1,0,0,0,0|1,0,0]=2 5793 B15R0.366 CCCCCCCCCCNC(=O)CSC 11a_100000684558_100000184570 [0,1,0,0,0,0|1,1,0]=3 5794 B15R0.366 CCCCCCCCCCNC(=O)CSC 1626a_100000684558_100000184570 [0,1,0,0,0,0|1,1,0]=3 5795 B15R0.366 CCCCCCCCCCNC(=O)CSC 240690a_100000684558_100000184570 [0,1,0,0,0,0|1,1,0]=3 5796 B15R0.366 CCCCCCCCCCNC(=O)CSC 527a_100000684558_100000184570 [0,1,0,0,0,0|1,1,0]=3 5797 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100000684558_100015525214 [0,1,0,0,0,0|2,0,0]=3 5798 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000684558 [0,1,0,0,0,0|2,0,0]=3 5799 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100000684558_100015525214 [0,1,0,0,0,0|2,0,0]=3 5800 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000684558 [0,1,0,0,0,0|2,0,0]=3 5801 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100000684558_100015525214 [0,1,0,0,0,0|2,0,0]=3 5802 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100015525214_100000684558 [0,1,0,0,0,0|2,0,0]=3 5803 B15R0.366 CCCCCCCCCCNC(=O)NNC 273464a_100000684558_100016993582 [0,1,0,0,0,0|2,0,0]=3 5804 B15R0.366 CCCCCCCCCCNC(=O)NNC 512a_100000684558_100016993582 [0,1,0,0,0,0|2,0,0]=3 5805 B15R0.366 CCCCCCCCCCNC(=O)NNC 512a_100016993582_100000684558 [0,1,0,0,0,0|2,0,0]=3 5806 B15R0.366 CCCCCCCCCCNC(C)COC 2230a_100000684558_100000765312 [0,1,0,0,0,0|2,0,1]=4 5807 B15R0.366 CCCCCCCCCCNC(C)COC 270004a_100000684558_100000749346 [0,1,0,0,0,0|2,0,1]=4 5808 B15R0.366 CCCCCCCCCCNC(C)COC 34a_100000684558_100000765312 [0,1,0,0,0,0|2,0,1]=4 5809 B15R0.366 CCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100000210320 [0,1,0,0,0,0|2,0,1]=4 5810 B15R0.366 CCCCCCCCCCOC(=O)CNC 2230a_106832991635_100000210668 [0,1,0,0,0,0|2,0,0]=3 5811 B15R0.366 CCCCCCCCCCOC(=O)CNC 34a_100102657272_100000210668 [0,1,0,0,0,0|2,0,0]=3 5812 B15R0.366 CCCCCCCCCCOC(=O)CNC 7a_106832991635_100000210668 [0,1,0,0,0,0|2,0,0]=3 5813 B15R0.366 CCCCCCCCCCOC(=O)COC 34a_100138415774_100000210668 [0,1,0,0,0,0|1,0,0]=2 5814 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_100000680656_200000210301 [0,1,0,0,0,0|1,1,0]=3 5815 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_200000210301_100000680656 [0,1,0,0,0,0|1,1,0]=3 5816 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_100000680656_200025704644 [0,1,0,0,0,0|1,1,0]=3 5817 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_200025704644_100000680656 [0,1,0,0,0,0|1,1,0]=3 5818 B15R0.366 CCCCCCCCCCOC(C)COC 34a_100000210711_100000765312 [0,1,0,0,0,0|2,0,1]=4 5819 B15R0.366 CCCCCCCCCCOC(C)COC 7a_100000210711_100000765312 [0,1,0,0,0,0|2,0,1]=4 5820 B15R0.366 CCCCCCCCCCO[C@H](C)COC 34a_100011934205_100000210320 [0,1,0,0,0,0|2,0,1]=4 5821 B15R0.366 CCCCCCCCCCSC(C)COC 62a_100000765312_100000210320 [0,1,0,0,0,0|2,0,1]=4 5822 B15R0.366 CCCCCCCCCNCC(=O)CCC 2230a_100000212291_100000747444 [0,1,0,0,0,0|2,0,0]=3 5823 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100000212291_100000183381 [0,1,0,0,0,0|2,0,0]=3 5824 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011214924 [0,1,0,0,0,0|2,0,0]=3 5825 B15R0.366 CCCCCCCCCNCC(=O)NCC 34a_100000212291_100000183381 [0,1,0,0,0,0|2,0,0]=3 5826 B15R0.366 CCCCCCCCCNCC(=O)NCO 2230a_100000212291_100000185155 [0,1,0,0,0,0|2,0,0]=3 5827 B15R0.366 CCCCCCCCCNCC(=O)NCO 34a_100000212291_100000185155 [0,1,0,0,0,0|2,0,0]=3 5828 B15R0.366 CCCCCCCCCNCC(=O)OCC 2230a_100000212291_100000188475 [0,1,0,0,0,0|1,0,0]=2 5829 B15R0.366 CCCCCCCCCNCC(=O)OCC 34a_100000212291_100000188475 [0,1,0,0,0,0|1,0,0]=2 5830 B15R0.366 CCCCCCCCCNCC(O)COC 2230a_100000756049_100011214924 [0,1,0,0,0,0|1,0,2]=4 5831 B15R0.366 CCCCCCCCCNCC(O)COC 34a_100000212291_100011215053 [0,1,0,0,0,0|1,0,2]=4 5832 B15R0.366 CCCCCCCCCNCC(O)COC 34a_100000756049_100011214924 [0,1,0,0,0,0|1,0,2]=4 5833 B15R0.366 CCCCCCCCCOCC(=O)CCC 7a_100000210712_100000747444 [0,1,0,0,0,0|2,0,0]=3 5834 B15R0.366 CCCCCCCCCOCC(=O)NCC 34a_100000210712_100000183381 [0,1,0,0,0,0|2,0,0]=3 5835 B15R0.366 CCCCCCCCCOCC(=O)NCC 7a_100000210712_100000183381 [0,1,0,0,0,0|2,0,0]=3 5836 B15R0.366 CCCCCCCCCOCC(=O)NCO 34a_100000210712_100000185155 [0,1,0,0,0,0|2,0,0]=3 5837 B15R0.366 CCCCCCCCCOCC(=O)NCO 7a_100000210712_100000185155 [0,1,0,0,0,0|2,0,0]=3 5838 B15R0.366 CCCCCCCCCOCC(=O)OCC 34a_100000210712_100000188475 [0,1,0,0,0,0|1,0,0]=2 5839 B15R0.366 CCCCCCCCCOCC(=O)OCC 7a_100000210712_100000188475 [0,1,0,0,0,0|1,0,0]=2 5840 B15R0.366 CCCCCCCCCOCC(N)COC 34a_100000724102_100011214924 [0,1,0,0,0,0|2,0,1]=4 5841 B15R0.366 CCCCCCCCCOCC(O)COC 34a_100000210712_100011215053 [0,1,0,0,0,0|1,0,2]=4 5842 B15R0.366 CCCCCCCCCOCC(O)COC 7a_100000210712_100011215053 [0,1,0,0,0,0|1,0,2]=4 5843 B15R0.366 CCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210670 [0,1,0,0,0,0|2,0,0]=3 5844 B15R0.366 CCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210670 [0,1,0,0,0,0|2,0,0]=3 5845 B15R0.366 CCCCCCCCCSCC(=O)NCO 62a_100000185155_100000210670 [0,1,0,0,0,0|2,0,0]=3 5846 B15R0.366 CCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210670 [0,1,0,0,0,0|1,0,0]=2 5847 B15R0.366 CCCCCCCCCSCC(O)COC 62a_100011215053_100000210670 [0,1,0,0,0,0|1,0,2]=4 5848 B15R0.366 CCCCCCCCNCCC(=O)NCC 2230a_100000229939_100000737597 [0,1,0,0,0,0|2,0,0]=3 5849 B15R0.366 CCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210759 [0,1,0,0,0,0|2,0,0]=3 5850 B15R0.366 CCCCCCCCNCCC(=O)OCC 2230a_100000229939_100011206558 [0,1,0,0,0,0|1,0,0]=2 5851 B15R0.366 CCCCCCCCNCCC(=O)OCC 34a_100000229939_100000765890 [0,1,0,0,0,0|1,0,0]=2 5852 B15R0.366 CCCCCCCCNCOC(=O)CCC 2230a_100000229939_100000034017 [0,1,0,0,0,0|3,0,0]=4 5853 B15R0.366 CCCCCCCCNCOC(=O)CCC 34a_100000229939_100000034017 [0,1,0,0,0,0|3,0,0]=4 5854 B15R0.366 CCCCCCCCOCCC(=O)NCC 7a_100000210232_100000737597 [0,1,0,0,0,0|2,0,0]=3 5855 B15R0.366 CCCCCCCCOCCC(=O)OCC 34a_100000210232_100000765890 [0,1,0,0,0,0|1,0,0]=2 5856 B15R0.366 CCCCCCCCOCCC(=O)OCC 7a_100000210232_100011206558 [0,1,0,0,0,0|1,0,0]=2 5857 B15R0.366 CCCCCCCCOCOC(=O)CCC 34a_100000210232_100000034017 [0,1,0,0,0,0|3,0,0]=4 5858 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000210759_100000737597 [0,1,0,0,0,0|2,0,0]=3 5859 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210317 [0,1,0,0,0,0|2,0,0]=3 5860 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000210759_100000765890 [0,1,0,0,0,0|1,0,0]=2 5861 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210317 [0,1,0,0,0,0|1,0,0]=2 5862 B15R0.366 CCCCCCCCSCOC(=O)CCC 62a_100000210759_100000034017 [0,1,0,0,0,0|3,0,0]=4 5863 B15R0.366 CCCCCCCCSCOC(=O)OCC 62a_100000210759_100000075025 [0,1,0,0,0,0|2,0,0]=3 5864 B15R0.366 CCCCCCCNC/C=C/C(=O)OCC 2230a_100000229938_100016267167 [0,1,0,0,0,0|1,0,2]=4 5865 B15R0.366 CCCCCCCNCCCC(=O)OCC 2230a_100000229938_100009991533 [0,1,0,0,0,0|1,0,0]=2 5866 B15R0.366 CCCCCCCOC/C=C/C(=O)OCC 34a_100000210272_100016267167 [0,1,0,0,0,0|1,0,2]=4 5867 B15R0.366 CCCCCCCOC/C=C/C(=O)OCC 7a_100000210272_100016267167 [0,1,0,0,0,0|1,0,2]=4 5868 B15R0.366 CCCCCCCOCCCC(=O)OCC 34a_100000210272_100009991533 [0,1,0,0,0,0|1,0,0]=2 5869 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100000210272_100011215271 [0,1,0,0,0,0|1,0,0]=2 5870 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210614 [0,1,0,0,0,0|1,0,0]=2 5871 B15R0.366 CCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210614 [0,1,0,0,0,0|2,0,0]=3 5872 B15R0.366 CCCCCCCOCCNC(=O)OCC 7a_100000210272_200011445536 [0,1,0,0,0,0|2,0,0]=3 5873 B15R0.366 CCCCCCCSC/C=C/C(=O)OCC 62a_100000210614_100016267167 [0,1,0,0,0,0|1,0,2]=4 5874 B15R0.366 CCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210316 [0,1,0,0,0,0|1,0,2]=4 5875 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100000210614_100009991533 [0,1,0,0,0,0|1,0,0]=2 5876 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210316 [0,1,0,0,0,0|1,0,0]=2 5877 B15R0.366 CCCCCCCSCCNC(=O)OCC 62a_100000210614_200011445536 [0,1,0,0,0,0|2,0,0]=3 5878 B15R0.366 CCCCCCNCCCCC(=O)OCC 2230a_100000210581_100000750268 [0,1,0,0,0,0|1,0,0]=2 5879 B15R0.366 CCCCCCNCCOCC(=O)OCC 2230a_100000210581_100000088970 [0,1,0,0,0,0|2,0,0]=3 5880 B15R0.366 CCCCCCOCCCCC(=O)OCC 34a_100000210259_100000750268 [0,1,0,0,0,0|1,0,0]=2 5881 B15R0.366 CCCCCCOCCCCC(=O)OCC 7a_100000210259_100000750268 [0,1,0,0,0,0|1,0,0]=2 5882 B15R0.366 CCCCCCOCCOCC(=O)CCC 7a_100000691444_100000747444 [0,1,0,0,0,0|3,0,0]=4 5883 B15R0.366 CCCCCCOCCOCC(=O)NCC 34a_100000691444_100000183381 [0,1,0,0,0,0|3,0,0]=4 5884 B15R0.366 CCCCCCOCCOCC(=O)NCC 7a_100000691444_100000183381 [0,1,0,0,0,0|3,0,0]=4 5885 B15R0.366 CCCCCCOCCOCC(=O)NCO 34a_100000691444_100000185155 [0,1,0,0,0,0|3,0,0]=4 5886 B15R0.366 CCCCCCOCCOCC(=O)NCO 7a_100000691444_100000185155 [0,1,0,0,0,0|3,0,0]=4 5887 B15R0.366 CCCCCCOCCOCC(=O)OCC 34a_100000210259_100000088970 [0,1,0,0,0,0|2,0,0]=3 5888 B15R0.366 CCCCCCOCCOCC(=O)OCC 34a_100000691444_100000188475 [0,1,0,0,0,0|2,0,0]=3 5889 B15R0.366 CCCCCCOCCOCC(=O)OCC 7a_100000210259_100000088970 [0,1,0,0,0,0|2,0,0]=3 5890 B15R0.366 CCCCCCOCCOCC(=O)OCC 7a_100000691444_100000188475 [0,1,0,0,0,0|2,0,0]=3 5891 B15R0.366 CCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210314 [0,1,0,0,0,0|2,0,0]=3 5892 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000210314_100000750268 [0,1,0,0,0,0|1,0,0]=2 5893 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210757 [0,1,0,0,0,0|1,0,0]=2 5894 B15R0.366 CCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210757 [0,1,0,0,0,0|2,0,0]=3 5895 B15R0.366 CCCCCCSCCOCC(=O)OCC 62a_100000210314_100000088970 [0,1,0,0,0,0|2,0,0]=3 5896 B15R0.366 CCCCCNCCCCCC(=O)OCC 2230a_100000209983_100000755133 [0,1,0,0,0,0|1,0,0]=2 5897 B15R0.366 CCCCCNCCCOCC(=O)OCC 2230a_100000209983_100009893628 [0,1,0,0,0,0|2,0,0]=3 5898 B15R0.366 CCCCCNCCOCCC(=O)OCC 34a_100000224656_100000765890 [0,1,0,0,0,0|2,0,0]=3 5899 B15R0.366 CCCCCOCCCCCC(=O)OCC 34a_100000210253_100000755133 [0,1,0,0,0,0|1,0,0]=2 5900 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100000210253_100000755133 [0,1,0,0,0,0|1,0,0]=2 5901 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210326 [0,1,0,0,0,0|1,0,0]=2 5902 B15R0.366 CCCCCOCCCOCC(=O)OCC 34a_100000210253_100009893628 [0,1,0,0,0,0|2,0,0]=3 5903 B15R0.366 CCCCCOCCCOCC(=O)OCC 7a_100000210253_100009893628 [0,1,0,0,0,0|2,0,0]=3 5904 B15R0.366 CCCCCOCCOCCC(=O)NCC 7a_100011215259_100000737597 [0,1,0,0,0,0|3,0,0]=4 5905 B15R0.366 CCCCCOCCOCCC(=O)OCC 34a_100011215259_100000765890 [0,1,0,0,0,0|2,0,0]=3 5906 B15R0.366 CCCCCOCCOCCC(=O)OCC 7a_100011215259_100011206558 [0,1,0,0,0,0|2,0,0]=3 5907 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000210326_100000755133 [0,1,0,0,0,0|1,0,0]=2 5908 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210326 [0,1,0,0,0,0|1,0,0]=2 5909 B15R0.366 CCCCCSCCCOCC(=O)OCC 62a_100000210326_100009893628 [0,1,0,0,0,0|2,0,0]=3 5910 B15R0.366 CCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210326 [0,1,0,0,0,0|2,0,0]=3 5911 B15R0.366 CCCCNCCCCCCC(=O)OCC 2230a_100000102301_100009814379 [0,1,0,0,0,0|1,0,0]=2 5912 B15R0.366 CCCCNCCCCCCC(=O)OCC 7a_106832991798_100009814379 [0,1,0,0,0,0|1,0,0]=2 5913 B15R0.366 CCCCNCCCCOCC(=O)NCC 34a_200011216965_100000183381 [0,1,0,0,0,0|3,0,0]=4 5914 B15R0.366 CCCCNCCCCOCC(=O)NCO 34a_200011216965_100000185155 [0,1,0,0,0,0|3,0,0]=4 5915 B15R0.366 CCCCNCCCCOCC(=O)OCC 34a_200011216965_100000188475 [0,1,0,0,0,0|2,0,0]=3 5916 B15R0.366 CCCCNN=CCCCCC(=O)OCC 4a_100025702795_100012182868 [0,1,0,0,0,0|2,0,1]=4 5917 B15R0.366 CCCCOCCCCCCC(=O)OCC 34a_100000210227_100009814379 [0,1,0,0,0,0|1,0,0]=2 5918 B15R0.366 CCCCOCCCCCCC(=O)OCC 7a_100000210227_100009814379 [0,1,0,0,0,0|1,0,0]=2 5919 B15R0.366 CCCCOCCCCOCC(=O)CCC 7a_200000760531_100000747444 [0,1,0,0,0,0|3,0,0]=4 5920 B15R0.366 CCCCOCCCCOCC(=O)NCC 34a_200000760531_100000183381 [0,1,0,0,0,0|3,0,0]=4 5921 B15R0.366 CCCCOCCCCOCC(=O)NCC 7a_200000760531_100000183381 [0,1,0,0,0,0|3,0,0]=4 5922 B15R0.366 CCCCOCCCCOCC(=O)NCO 34a_200000760531_100000185155 [0,1,0,0,0,0|3,0,0]=4 5923 B15R0.366 CCCCOCCCCOCC(=O)NCO 7a_200000760531_100000185155 [0,1,0,0,0,0|3,0,0]=4 5924 B15R0.366 CCCCOCCCCOCC(=O)OCC 34a_200000760531_100000188475 [0,1,0,0,0,0|2,0,0]=3 5925 B15R0.366 CCCCOCCCCOCC(=O)OCC 7a_200000760531_100000188475 [0,1,0,0,0,0|2,0,0]=3 5926 B15R0.366 CCCCOCCCNCCC(=O)NCC 2230a_200000211371_100000737597 [0,1,0,0,0,0|3,0,0]=4 5927 B15R0.366 CCCCOCCCNCCC(=O)OCC 2230a_200000211371_100011206558 [0,1,0,0,0,0|2,0,0]=3 5928 B15R0.366 CCCCOCCCNCCC(=O)OCC 34a_200000211371_100000765890 [0,1,0,0,0,0|2,0,0]=3 5929 B15R0.366 CCCCOCCCOCCC(=O)NCC 7a_200011215613_100000737597 [0,1,0,0,0,0|3,0,0]=4 5930 B15R0.366 CCCCOCCCOCCC(=O)OCC 34a_200011215613_100000765890 [0,1,0,0,0,0|2,0,0]=3 5931 B15R0.366 CCCCOCCCOCCC(=O)OCC 7a_200011215613_100011206558 [0,1,0,0,0,0|2,0,0]=3 5932 B15R0.366 CCCCOCCOCCCC(=O)OCC 34a_100000210238_100009991533 [0,1,0,0,0,0|2,0,0]=3 5933 B15R0.366 CCCCOCCOCCCC(=O)OCC 7a_100000210238_100011215271 [0,1,0,0,0,0|2,0,0]=3 5934 B15R0.366 CCCCOCCOCCCC(=O)OCC 7a_100012001163_100000743108 [0,1,0,0,0,0|2,0,0]=3 5935 B15R0.366 CCCCOCCOCCNC(=O)OCC 34a_100000158857_100000743108 [0,1,0,0,0,0|3,0,0]=4 5936 B15R0.366 CCCCOCCOCCNC(=O)OCC 7a_100000210238_200011445536 [0,1,0,0,0,0|3,0,0]=4 5937 B15R0.366 CCCCOCCSCCCC(=O)OCC 62a_100000743108_100009991533 [0,1,0,0,0,0|2,0,0]=3 5938 B15R0.366 CCCCOCCSCCCC(=O)OCC 62a_100009991533_100000743108 [0,1,0,0,0,0|2,0,0]=3 5939 B15R0.366 CCCCOCCSCCNC(=O)OCC 62a_100000743108_200011445536 [0,1,0,0,0,0|3,0,0]=4 5940 B15R0.366 CCCCOCSCCCCC(=O)OCC 62a_100000750268_100011995733 [0,1,0,0,0,0|2,0,0]=3 5941 B15R0.366 CCCCOCSCCCCC(=O)OCC 62a_100011995733_100000750268 [0,1,0,0,0,0|2,0,0]=3 5942 B15R0.366 CCCCOCSCCOCC(=O)OCC 62a_100000088970_100011995733 [0,1,0,0,0,0|3,0,0]=4 5943 B15R0.366 CCCCOCSCCOCC(=O)OCC 62a_100011995733_100000088970 [0,1,0,0,0,0|3,0,0]=4 5944 B15R0.366 CCCCSCCCCCCC(=O)OCC 62a_100000210211_100009814379 [0,1,0,0,0,0|1,0,0]=2 5945 B15R0.366 CCCCSCCNCCCC(=O)OCC 2230a_100025743550_100009991533 [0,1,0,0,0,0|2,0,0]=3 5946 B15R0.366 CCCCSCCOCCCC(=O)OCC 34a_200000230436_100009991533 [0,1,0,0,0,0|2,0,0]=3 5947 B15R0.366 CCCCSCCOCCCC(=O)OCC 7a_200000230436_100011215271 [0,1,0,0,0,0|2,0,0]=3 5948 B15R0.366 CCCCSCCOCCNC(=O)OCC 7a_200000230436_200011445536 [0,1,0,0,0,0|3,0,0]=4 5949 B15R0.366 CCCNN=CCCCCCC(=O)OCC 4a_100000740057_100000085164 [0,1,0,0,0,0|2,0,1]=4 5950 B15R0.366 CCCOCCCCCCCC(=O)OCC 34a_100000210258_100009991516 [0,1,0,0,0,0|1,0,0]=2 5951 B15R0.366 CCCOCCCNCCCC(=O)OCC 2230a_100011217757_100009991533 [0,1,0,0,0,0|2,0,0]=3 5952 B15R0.366 CCCOCCCNCCCC(=O)OCC 34a_100011217757_100009991533 [0,1,0,0,0,0|2,0,0]=3 5953 B15R0.366 CCCOCCNCCCCC(=O)OCC 2230a_100161115042_100000750268 [0,1,0,0,0,0|2,0,0]=3 5954 B15R0.366 CCCOCCNCCCCC(=O)OCC 34a_100161115042_100000750268 [0,1,0,0,0,0|2,0,0]=3 5955 B15R0.366 CCCOCCNCCOCC(=O)OCC 2230a_100161115042_100000088970 [0,1,0,0,0,0|3,0,0]=4 5956 B15R0.366 CCCOCCNCCOCC(=O)OCC 34a_100161115042_100000088970 [0,1,0,0,0,0|3,0,0]=4 5957 B15R0.366 CCCOCCOCCCCC(=O)OCC 34a_100000752267_100000750268 [0,1,0,0,0,0|2,0,0]=3 5958 B15R0.366 CCCOCCOCCCCC(=O)OCC 7a_100000752267_100000750268 [0,1,0,0,0,0|2,0,0]=3 5959 B15R0.366 CCCOCCOCCNCC(=O)OCC 2230a_200011904461_100000188475 [0,1,0,0,0,0|3,0,0]=4 5960 B15R0.366 CCCOCCOCCNCC(=O)OCC 34a_200011904461_100000188475 [0,1,0,0,0,0|3,0,0]=4 5961 B15R0.366 CCCOCCOCCOCC(=O)OCC 34a_100000752267_100000088970 [0,1,0,0,0,0|3,0,0]=4 5962 B15R0.366 CCCOCCOCCOCC(=O)OCC 7a_100000752267_100000088970 [0,1,0,0,0,0|3,0,0]=4 5963 B15R0.366 CCCOCCOCCSCC(=O)OCC 7a_200000230590_100011215938 [0,1,0,0,0,0|3,0,0]=4 5964 B15R0.366 CCCOCCSCCCCC(=O)OCC 62a_100000750268_100011215938 [0,1,0,0,0,0|2,0,0]=3 5965 B15R0.366 CCCOCCSCCCCC(=O)OCC 62a_100011215938_100000750268 [0,1,0,0,0,0|2,0,0]=3 5966 B15R0.366 CCCOCCSCCOCC(=O)OCC 62a_100000088970_100011215938 [0,1,0,0,0,0|3,0,0]=4 5967 B15R0.366 CCCOCCSCCOCC(=O)OCC 62a_100011215938_100000088970 [0,1,0,0,0,0|3,0,0]=4 5968 B15R0.366 CCCSCCCCCCCC(=O)OCC 62a_100000210303_100009991516 [0,1,0,0,0,0|1,0,0]=2 5969 B15R0.366 CCCSCCNCCCCC(=O)OCC 2230a_100020603323_100000750268 [0,1,0,0,0,0|2,0,0]=3 5970 B15R0.366 CCCSCCNCCOCC(=O)OCC 2230a_100020603323_100000088970 [0,1,0,0,0,0|3,0,0]=4 5971 B15R0.366 CCCSCCOCCCCC(=O)OCC 34a_200000230433_100000750268 [0,1,0,0,0,0|2,0,0]=3 5972 B15R0.366 CCCSCCOCCCCC(=O)OCC 7a_200000230433_100000750268 [0,1,0,0,0,0|2,0,0]=3 5973 B15R0.366 CCCSCCOCCOCC(=O)OCC 34a_200000230433_100000088970 [0,1,0,0,0,0|3,0,0]=4 5974 B15R0.366 CCCSCCOCCOCC(=O)OCC 7a_200000230433_100000088970 [0,1,0,0,0,0|3,0,0]=4 5975 B15R0.366 CCNC(=O)CCCCCCCCCCO 240690a_100015525214_200000016029 [0,1,0,0,0,0|2,0,0]=3 5976 B15R0.366 CCNC(=O)CCNCCCCCCCO 2230a_100011996573_100000737597 [0,1,0,0,0,0|3,0,0]=4 5977 B15R0.366 CCNC(=O)CCNCCCCCCCO 34a_100025743525_100000760002 [0,1,0,0,0,0|3,0,0]=4 5978 B15R0.366 CCNC(=O)CCNCCCCCCOC 34a_100025743525_100011998445 [0,1,0,0,0,0|3,0,0]=4 5979 B15R0.366 CCNC(=O)CCOCCCCCCCBr 7a_100000760002_100000737597 [0,1,0,0,0,0|3,0,0]=4 5980 B15R0.366 CCNC(=O)CCOCCCCCCOC 7a_200012092642_100000737597 [0,1,0,0,0,0|3,0,0]=4 5981 B15R0.366 CCNC(=O)CCSCCCCCCCO 62a_100000737597_100000760002 [0,1,0,0,0,0|3,0,0]=4 5982 B15R0.366 CCNC(=O)CCSCCCCCCCO 62a_100000760002_100000737597 [0,1,0,0,0,0|3,0,0]=4 5983 B15R0.366 CCNC(=O)CCSCCCCCCOC 62a_100000737597_100011998445 [0,1,0,0,0,0|3,0,0]=4 5984 B15R0.366 CCNC(=O)CCSCCCCCCOC 62a_100011998445_100000737597 [0,1,0,0,0,0|3,0,0]=4 5985 B15R0.366 CCNC(=O)CNCCCCCCCCO 2230a_100016988866_100000033203 [0,1,0,0,0,0|3,0,0]=4 5986 B15R0.366 CCNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183381 [0,1,0,0,0,0|3,0,0]=4 5987 B15R0.366 CCNC(=O)CNCCCCCCCCO 34a_102515433106_100000183381 [0,1,0,0,0,0|3,0,0]=4 5988 B15R0.366 CCNC(=O)COCCCCCCCCBr 34a_100009813846_100000183381 [0,1,0,0,0,0|3,0,0]=4 5989 B15R0.366 CCNC(=O)COCCCCCCCCBr 7a_100009813846_100000183381 [0,1,0,0,0,0|3,0,0]=4 5990 B15R0.366 CCNC(=O)COCCCCCCCCCl 34a_100000033203_100000183381 [0,1,0,0,0,0|3,0,0]=4 5991 B15R0.366 CCNC(=O)COCCCCCCCCCl 7a_100000033203_100000183381 [0,1,0,0,0,0|3,0,0]=4 5992 B15R0.366 CCNC(=O)COCCCCCCCCN 34a_102515433106_100000183381 [0,1,0,0,0,0|3,0,0]=4 5993 B15R0.366 CCNC(=O)CSCCCCCCCCO 62a_100000033203_100000183381 [0,1,0,0,0,0|3,0,0]=4 5994 B15R0.366 CCNC(=O)CSCCCCCCCCO 62a_100000183381_100000033203 [0,1,0,0,0,0|3,0,0]=4 5995 B15R0.366 CCNC(=O)NCCCCCCCCCO 2708a_100000078944_100015525214 [0,1,0,0,0,0|3,0,0]=4 5996 B15R0.366 CCNC(=O)NCCCCCCCCCO 2708a_100015525214_100000078944 [0,1,0,0,0,0|3,0,0]=4 5997 B15R0.366 CCNC(=O)NCCCCCCCCCO 273464a_100000078944_100015525214 [0,1,0,0,0,0|3,0,0]=4 5998 B15R0.366 CCNC(=O)NCCCCCCCCCO 273464a_100015525214_100000078944 [0,1,0,0,0,0|3,0,0]=4 5999 B15R0.366 CCNC(=O)NCCCCCCCCCO 512a_100000078944_100015525214 [0,1,0,0,0,0|3,0,0]=4 6000 B15R0.366 CCNC(=O)NCCCCCCCCCO 512a_100015525214_100000078944 [0,1,0,0,0,0|3,0,0]=4 6001 B15R0.366 CCNCCCCCCCCC(=O)OCC 2230a_100015525214_100010175975 [0,1,0,0,0,0|1,0,0]=2 6002 B15R0.366 CCOC(=O)CCCCCCCCCNC 2230a_106832991635_100009828014 [0,1,0,0,0,0|1,0,0]=2 6003 B15R0.366 CCOC(=O)CCCCCCCCCNC 34a_100102657272_100009828014 [0,1,0,0,0,0|1,0,0]=2 6004 B15R0.366 CCOC(=O)CCCCCCCCCNC 7a_106832991635_100009828014 [0,1,0,0,0,0|1,0,0]=2 6005 B15R0.366 CCOC(=O)CCCCCCCCCOC 34a_100138415774_100009828014 [0,1,0,0,0,0|1,0,0]=2 6006 B15R0.366 CCOC(=O)CCCCCCCCCSC 62a_200000210301_100009828014 [0,1,0,0,0,0|1,0,0]=2 6007 B15R0.366 CCOC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009828014 [0,1,0,0,0,0|1,0,0]=2 6008 B15R0.366 CCOC(=O)CCCCCCCCSCC 62a_100000210202_100010175975 [0,1,0,0,0,0|1,0,0]=2 6009 B15R0.366 CCOC(=O)CCCCCCCCSCF 62a_100015361967_100010175975 [0,1,0,0,0,0|2,0,0]=3 6010 B15R0.366 CCOC(=O)CCCCCCCNCCF 34a_100000724931_100009991516 [0,1,0,0,0,0|2,0,0]=3 6011 B15R0.366 CCOC(=O)CCCCCCCNCCO 2230a_100016997473_100009991516 [0,1,0,0,0,0|2,0,0]=3 6012 B15R0.366 CCOC(=O)CCCCCCCNCCO 34a_100016990907_100009991516 [0,1,0,0,0,0|2,0,0]=3 6013 B15R0.366 CCOC(=O)CCCCCCCOCCBr 34a_100000211926_100009991516 [0,1,0,0,0,0|2,0,0]=3 6014 B15R0.366 CCOC(=O)CCCCCCCOCCN 34a_100000210304_100009991516 [0,1,0,0,0,0|2,0,0]=3 6015 B15R0.366 CCOC(=O)CCCCCCCSCC#N 62a_100011215382_100009991516 [0,1,0,0,0,0|2,0,1]=4 6016 B15R0.366 CCOC(=O)CCCCCCCSCC=O 62a_200015260668_100009991516 [0,1,0,0,0,0|2,0,1]=4 6017 B15R0.366 CCOC(=O)CCCCCCCSCCF 62a_100011217306_100009991516 [0,1,0,0,0,0|2,0,0]=3 6018 B15R0.366 CCOC(=O)CCCCCCCSCCO 62a_100000211926_100009991516 [0,1,0,0,0,0|2,0,0]=3 6019 B15R0.366 CCOC(=O)CCCCCCCSCOC 62a_100000766300_100009991516 [0,1,0,0,0,0|2,0,0]=3 6020 B15R0.366 CCOC(=O)CCCCCCCSCSC 62a_100011218213_100009991516 [0,1,0,0,0,0|2,0,0]=3 6021 B15R0.366 CCOC(=O)CCCCCCNCCCF 2230a_100015189416_100009814379 [0,1,0,0,0,0|2,0,0]=3 6022 B15R0.366 CCOC(=O)CCCCCCNCCCF 34a_100015189416_100009814379 [0,1,0,0,0,0|2,0,0]=3 6023 B15R0.366 CCOC(=O)CCCCCCNCCOC 2230a_100000209980_100009814379 [0,1,0,0,0,0|2,0,0]=3 6024 B15R0.366 CCOC(=O)CCCCCCNCCSC 2230a_100020590264_100009814379 [0,1,0,0,0,0|2,0,0]=3 6025 B15R0.366 CCOC(=O)CCCCCCOCCCBr 34a_100011217188_100009814379 [0,1,0,0,0,0|2,0,0]=3 6026 B15R0.366 CCOC(=O)CCCCCCOCCCCl 34a_100000230001_100009814379 [0,1,0,0,0,0|2,0,0]=3 6027 B15R0.366 CCOC(=O)CCCCCCOCCCF 34a_100000759539_100009814379 [0,1,0,0,0,0|2,0,0]=3 6028 B15R0.366 CCOC(=O)CCCCCCOCCCN 34a_100000182051_100009814379 [0,1,0,0,0,0|2,0,0]=3 6029 B15R0.366 CCOC(=O)CCCCCCOCCOC 34a_100000210237_100009814379 [0,1,0,0,0,0|2,0,0]=3 6030 B15R0.366 CCOC(=O)CCCCCCOCCON 34a_100000700252_100009814379 [0,1,0,0,0,0|3,0,0]=4 6031 B15R0.366 CCOC(=O)CCCCCCOCCSC 34a_100000230434_100009814379 [0,1,0,0,0,0|2,0,0]=3 6032 B15R0.366 CCOC(=O)CCCCCCOCCSC 7a_100000230434_100009814379 [0,1,0,0,0,0|2,0,0]=3 6033 B15R0.366 CCOC(=O)CCCCCCSCCC#N 62a_100011215226_100009814379 [0,1,0,0,0,0|2,0,1]=4 6034 B15R0.366 CCOC(=O)CCCCCCSCCCF 62a_100011934791_100009814379 [0,1,0,0,0,0|2,0,0]=3 6035 B15R0.366 CCOC(=O)CCCCCCSCCCO 62a_100011215043_100009814379 [0,1,0,0,0,0|2,0,0]=3 6036 B15R0.366 CCOC(=O)CCCCCCSCCOC 62a_100000233755_100009814379 [0,1,0,0,0,0|2,0,0]=3 6037 B15R0.366 CCOC(=O)CCCCCCSCCSC 62a_100000212216_100009814379 [0,1,0,0,0,0|2,0,0]=3 6038 B15R0.366 CCOC(=O)CCCCCNCCCCO 2230a_100000750430_100000755133 [0,1,0,0,0,0|2,0,0]=3 6039 B15R0.366 CCOC(=O)CCCCCNCCCCO 34a_100000750430_100000755133 [0,1,0,0,0,0|2,0,0]=3 6040 B15R0.366 CCOC(=O)CCCCCNCCCOC 34a_100150723488_100000755133 [0,1,0,0,0,0|2,0,0]=3 6041 B15R0.366 CCOC(=O)CCCCCNCCCSC 2230a_100000749238_100000755133 [0,1,0,0,0,0|2,0,0]=3 6042 B15R0.366 CCOC(=O)CCCCCNCCSCC 2230a_100000106463_100000755133 [0,1,0,0,0,0|2,0,0]=3 6043 B15R0.366 CCOC(=O)CCCCCOCCCC#N 7a_100011214988_100000687738 [0,1,0,0,0,0|2,0,1]=4 6044 B15R0.366 CCOC(=O)CCCCCOCCCC=O 7a_100011214988_200011292268 [0,1,0,0,0,0|2,0,1]=4 6045 B15R0.366 CCOC(=O)CCCCCOCCCCBr 34a_100011216708_100000755133 [0,1,0,0,0,0|2,0,0]=3 6046 B15R0.366 CCOC(=O)CCCCCOCCCCCl 34a_100000210776_100000755133 [0,1,0,0,0,0|2,0,0]=3 6047 B15R0.366 CCOC(=O)CCCCCOCCCCCl 7a_100000210776_100000755133 [0,1,0,0,0,0|2,0,0]=3 6048 B15R0.366 CCOC(=O)CCCCCOCCCCF 34a_100011995726_100000755133 [0,1,0,0,0,0|2,0,0]=3 6049 B15R0.366 CCOC(=O)CCCCCOCCCCF 7a_100011214988_100000729493 [0,1,0,0,0,0|2,0,0]=3 6050 B15R0.366 CCOC(=O)CCCCCOCCCCF 7a_100011995726_100000755133 [0,1,0,0,0,0|2,0,0]=3 6051 B15R0.366 CCOC(=O)CCCCCOCCCCI 34a_200012148704_100000755133 [0,1,0,0,0,0|2,0,0]=3 6052 B15R0.366 CCOC(=O)CCCCCOCCCCN 34a_100000750430_100000755133 [0,1,0,0,0,0|2,0,0]=3 6053 B15R0.366 CCOC(=O)CCCCCOCCCCO 7a_100011214988_100000210776 [0,1,0,0,0,0|2,0,0]=3 6054 B15R0.366 CCOC(=O)CCCCCOCCCNC 34a_100000213112_100000755133 [0,1,0,0,0,0|2,0,0]=3 6055 B15R0.366 CCOC(=O)CCCCCOCCCOC 34a_100000740835_100000755133 [0,1,0,0,0,0|2,0,0]=3 6056 B15R0.366 CCOC(=O)CCCCCOCCCOC 7a_100011214988_100000740836 [0,1,0,0,0,0|2,0,0]=3 6057 B15R0.366 CCOC(=O)CCCCCOCCCSC 34a_100000690336_100000755133 [0,1,0,0,0,0|2,0,0]=3 6058 B15R0.366 CCOC(=O)CCCCCOCCCSC 7a_100000690336_100000755133 [0,1,0,0,0,0|2,0,0]=3 6059 B15R0.366 CCOC(=O)CCCCCOCCSCC 34a_100000212035_100000755133 [0,1,0,0,0,0|2,0,0]=3 6060 B15R0.366 CCOC(=O)CCCCCOCCSCC 7a_100000212035_100000755133 [0,1,0,0,0,0|2,0,0]=3 6061 B15R0.366 CCOC(=O)CCCCCOCCSCC 7a_100011214988_100000757381 [0,1,0,0,0,0|2,0,0]=3 6062 B15R0.366 CCOC(=O)CCCCCSCCCC#N 62a_100000687738_100000755133 [0,1,0,0,0,0|2,0,1]=4 6063 B15R0.366 CCOC(=O)CCCCCSCCCC#N 62a_100000755133_100000687738 [0,1,0,0,0,0|2,0,1]=4 6064 B15R0.366 CCOC(=O)CCCCCSCCCC=O 62a_100000755133_200011292268 [0,1,0,0,0,0|2,0,1]=4 6065 B15R0.366 CCOC(=O)CCCCCSCCCC=O 62a_200011292268_100000755133 [0,1,0,0,0,0|2,0,1]=4 6066 B15R0.366 CCOC(=O)CCCCCSCCCCF 62a_100000729493_100000755133 [0,1,0,0,0,0|2,0,0]=3 6067 B15R0.366 CCOC(=O)CCCCCSCCCCF 62a_100000755133_100000729493 [0,1,0,0,0,0|2,0,0]=3 6068 B15R0.366 CCOC(=O)CCCCCSCCCCO 62a_100000210776_100000755133 [0,1,0,0,0,0|2,0,0]=3 6069 B15R0.366 CCOC(=O)CCCCCSCCCCO 62a_100000755133_100000210776 [0,1,0,0,0,0|2,0,0]=3 6070 B15R0.366 CCOC(=O)CCCCCSCCCOC 62a_100000709357_100000755133 [0,1,0,0,0,0|2,0,0]=3 6071 B15R0.366 CCOC(=O)CCCCCSCCCOC 62a_100000755133_100000709357 [0,1,0,0,0,0|2,0,0]=3 6072 B15R0.366 CCOC(=O)CCCCCSCCSCC 62a_100000755133_100000757381 [0,1,0,0,0,0|2,0,0]=3 6073 B15R0.366 CCOC(=O)CCCCCSCCSCC 62a_100000757381_100000755133 [0,1,0,0,0,0|2,0,0]=3 6074 B15R0.366 CCOC(=O)CCCCNCCCCCO 2230a_100000762737_100000750268 [0,1,0,0,0,0|2,0,0]=3 6075 B15R0.366 CCOC(=O)CCCCNCCCCCO 34a_100000762737_100000750268 [0,1,0,0,0,0|2,0,0]=3 6076 B15R0.366 CCOC(=O)CCCCNCCOCCO 2230a_100000211614_100000750268 [0,1,0,0,0,0|3,0,0]=4 6077 B15R0.366 CCOC(=O)CCCCNCCOCCO 34a_100000211614_100000750268 [0,1,0,0,0,0|3,0,0]=4 6078 B15R0.366 CCOC(=O)CCCCNCCSCCO 2230a_100011219999_100000750268 [0,1,0,0,0,0|3,0,0]=4 6079 B15R0.366 CCOC(=O)CCCCOCCCCCBr 34a_100000746331_100000750268 [0,1,0,0,0,0|2,0,0]=3 6080 B15R0.366 CCOC(=O)CCCCOCCCCCBr 7a_100000746331_100000750268 [0,1,0,0,0,0|2,0,0]=3 6081 B15R0.366 CCOC(=O)CCCCOCCCCCCl 34a_100000746330_100000750268 [0,1,0,0,0,0|2,0,0]=3 6082 B15R0.366 CCOC(=O)CCCCOCCCCCCl 7a_100000746330_100000750268 [0,1,0,0,0,0|2,0,0]=3 6083 B15R0.366 CCOC(=O)CCCCOCCCCCI 34a_200012148887_100000750268 [0,1,0,0,0,0|2,0,0]=3 6084 B15R0.366 CCOC(=O)CCCCOCCCCCI 7a_200012148887_100000750268 [0,1,0,0,0,0|2,0,0]=3 6085 B15R0.366 CCOC(=O)CCCCOCCCCCN 34a_100000762737_100000750268 [0,1,0,0,0,0|2,0,0]=3 6086 B15R0.366 CCOC(=O)CCCCOCCCCOC 34a_100000740925_100000750268 [0,1,0,0,0,0|2,0,0]=3 6087 B15R0.366 CCOC(=O)CCCCOCCCCSC 34a_100011217163_100000750268 [0,1,0,0,0,0|2,0,0]=3 6088 B15R0.366 CCOC(=O)CCCCOCCCCSC 7a_100011217163_100000750268 [0,1,0,0,0,0|2,0,0]=3 6089 B15R0.366 CCOC(=O)CCCCOCCCSCC 34a_100011216438_100000750268 [0,1,0,0,0,0|2,0,0]=3 6090 B15R0.366 CCOC(=O)CCCCOCCCSCC 7a_100011216438_100000750268 [0,1,0,0,0,0|2,0,0]=3 6091 B15R0.366 CCOC(=O)CCCCOCCOCCBr 34a_100000692535_100000750268 [0,1,0,0,0,0|3,0,0]=4 6092 B15R0.366 CCOC(=O)CCCCOCCOCCBr 7a_100000692535_100000750268 [0,1,0,0,0,0|3,0,0]=4 6093 B15R0.366 CCOC(=O)CCCCOCCOCCCl 34a_100011215305_100000750268 [0,1,0,0,0,0|3,0,0]=4 6094 B15R0.366 CCOC(=O)CCCCOCCOCCCl 7a_100011215305_100000750268 [0,1,0,0,0,0|3,0,0]=4 6095 B15R0.366 CCOC(=O)CCCCOCCOCCF 34a_200015357709_100000750268 [0,1,0,0,0,0|3,0,0]=4 6096 B15R0.366 CCOC(=O)CCCCOCCOCCF 7a_200015357709_100000750268 [0,1,0,0,0,0|3,0,0]=4 6097 B15R0.366 CCOC(=O)CCCCOCCOCCI 34a_100012149058_100000750268 [0,1,0,0,0,0|3,0,0]=4 6098 B15R0.366 CCOC(=O)CCCCOCCOCCI 7a_100012149058_100000750268 [0,1,0,0,0,0|3,0,0]=4 6099 B15R0.366 CCOC(=O)CCCCOCCOCCN 34a_100000211614_100000750268 [0,1,0,0,0,0|3,0,0]=4 6100 B15R0.366 CCOC(=O)CCCCSCCCCC#N 62a_100000750268_100000211819 [0,1,0,0,0,0|2,0,1]=4 6101 B15R0.366 CCOC(=O)CCCCSCCCCC#N 62a_100011219923_100000750268 [0,1,0,0,0,0|2,0,1]=4 6102 B15R0.366 CCOC(=O)CCCCSCCCCC=O 62a_100000139335_100000750268 [0,1,0,0,0,0|2,0,1]=4 6103 B15R0.366 CCOC(=O)CCCCSCCCCC=O 62a_100000750268_100000139335 [0,1,0,0,0,0|2,0,1]=4 6104 B15R0.366 CCOC(=O)CCCCSCCCCCF 62a_100000729378_100000750268 [0,1,0,0,0,0|2,0,0]=3 6105 B15R0.366 CCOC(=O)CCCCSCCCCCF 62a_100000750268_100000729378 [0,1,0,0,0,0|2,0,0]=3 6106 B15R0.366 CCOC(=O)CCCCSCCCCCO 62a_100000746330_100000750268 [0,1,0,0,0,0|2,0,0]=3 6107 B15R0.366 CCOC(=O)CCCCSCCCCCO 62a_100000750268_100000746330 [0,1,0,0,0,0|2,0,0]=3 6108 B15R0.366 CCOC(=O)CCCCSCCCCOC 62a_100000730899_100000750268 [0,1,0,0,0,0|2,0,0]=3 6109 B15R0.366 CCOC(=O)CCCCSCCCCOC 62a_100000750268_100000730899 [0,1,0,0,0,0|2,0,0]=3 6110 B15R0.366 CCOC(=O)CCCCSCCOCCO 62a_100000750268_100011215305 [0,1,0,0,0,0|3,0,0]=4 6111 B15R0.366 CCOC(=O)CCCCSCCOCCO 62a_100011215305_100000750268 [0,1,0,0,0,0|3,0,0]=4 6112 B15R0.366 CCOC(=O)CCCCSCOCCOC 62a_100000231047_100000750268 [0,1,0,0,0,0|3,0,0]=4 6113 B15R0.366 CCOC(=O)CCCCSCOCCOC 62a_100000750268_100000231047 [0,1,0,0,0,0|3,0,0]=4 6114 B15R0.366 CCOC(=O)CCCNCCCCCCO 2230a_100000686447_100009991533 [0,1,0,0,0,0|2,0,0]=3 6115 B15R0.366 CCOC(=O)CCCNCCCCCCO 34a_100000686447_100009991533 [0,1,0,0,0,0|2,0,0]=3 6116 B15R0.366 CCOC(=O)CCCNCCCCCOC 2230a_100000747528_100009991533 [0,1,0,0,0,0|2,0,0]=3 6117 B15R0.366 CCOC(=O)CCCNCCCCCOC 34a_100000747528_100009991533 [0,1,0,0,0,0|2,0,0]=3 6118 B15R0.366 CCOC(=O)CCCNCCOCCOC 2230a_100000745349_100009991533 [0,1,0,0,0,0|3,0,0]=4 6119 B15R0.366 CCOC(=O)CCCNCCOCCOC 34a_100000745349_100009991533 [0,1,0,0,0,0|3,0,0]=4 6120 B15R0.366 CCOC(=O)CCCOCCCCCC#N 7a_100012001163_100009813376 [0,1,0,0,0,0|2,0,1]=4 6121 B15R0.366 CCOC(=O)CCCOCCCCCC=O 7a_100012001163_100000139337 [0,1,0,0,0,0|2,0,1]=4 6122 B15R0.366 CCOC(=O)CCCOCCCCCCBr 34a_100011215345_100009991533 [0,1,0,0,0,0|2,0,0]=3 6123 B15R0.366 CCOC(=O)CCCOCCCCCCBr 7a_100011215345_100011215271 [0,1,0,0,0,0|2,0,0]=3 6124 B15R0.366 CCOC(=O)CCCOCCCCCCCl 34a_100000766143_100009991533 [0,1,0,0,0,0|2,0,0]=3 6125 B15R0.366 CCOC(=O)CCCOCCCCCCCl 7a_100000766143_100011215271 [0,1,0,0,0,0|2,0,0]=3 6126 B15R0.366 CCOC(=O)CCCOCCCCCCF 34a_100000732779_100009991533 [0,1,0,0,0,0|2,0,0]=3 6127 B15R0.366 CCOC(=O)CCCOCCCCCCF 7a_100000732779_100011215271 [0,1,0,0,0,0|2,0,0]=3 6128 B15R0.366 CCOC(=O)CCCOCCCCCCF 7a_100012001163_100015922095 [0,1,0,0,0,0|2,0,0]=3 6129 B15R0.366 CCOC(=O)CCCOCCCCCCN 34a_100000686447_100009991533 [0,1,0,0,0,0|2,0,0]=3 6130 B15R0.366 CCOC(=O)CCCOCCCCCCO 7a_100012001163_100000766143 [0,1,0,0,0,0|2,0,0]=3 6131 B15R0.366 CCOC(=O)CCCOCCCCCNC 34a_100000722520_100009991533 [0,1,0,0,0,0|2,0,0]=3 6132 B15R0.366 CCOC(=O)CCCOCCOCCNC 34a_100000228057_100009991533 [0,1,0,0,0,0|3,0,0]=4 6133 B15R0.366 CCOC(=O)CCCOCCOCCOC 34a_100011215163_100009991533 [0,1,0,0,0,0|3,0,0]=4 6134 B15R0.366 CCOC(=O)CCCOCCOCCOC 7a_100011215163_100011215271 [0,1,0,0,0,0|3,0,0]=4 6135 B15R0.366 CCOC(=O)CCCOCCOCCOC 7a_100012001163_100000695917 [0,1,0,0,0,0|3,0,0]=4 6136 B15R0.366 CCOC(=O)CCCSCCCCCC#N 62a_100009813376_100009991533 [0,1,0,0,0,0|2,0,1]=4 6137 B15R0.366 CCOC(=O)CCCSCCCCCC#N 62a_100009991533_100009813376 [0,1,0,0,0,0|2,0,1]=4 6138 B15R0.366 CCOC(=O)CCCSCCCCCC=O 62a_100000139337_100009991533 [0,1,0,0,0,0|2,0,1]=4 6139 B15R0.366 CCOC(=O)CCCSCCCCCC=O 62a_100009991533_100000139337 [0,1,0,0,0,0|2,0,1]=4 6140 B15R0.366 CCOC(=O)CCCSCCCCCCF 62a_100009991533_100015922095 [0,1,0,0,0,0|2,0,0]=3 6141 B15R0.366 CCOC(=O)CCCSCCCCCCF 62a_100015922095_100009991533 [0,1,0,0,0,0|2,0,0]=3 6142 B15R0.366 CCOC(=O)CCCSCCCCCCO 62a_100000766143_100009991533 [0,1,0,0,0,0|2,0,0]=3 6143 B15R0.366 CCOC(=O)CCCSCCCCCCO 62a_100009991533_100000766143 [0,1,0,0,0,0|2,0,0]=3 6144 B15R0.366 CCOC(=O)CCCSCCOCCOC 62a_100000695917_100009991533 [0,1,0,0,0,0|3,0,0]=4 6145 B15R0.366 CCOC(=O)CCCSCCOCCOC 62a_100009991533_100000695917 [0,1,0,0,0,0|3,0,0]=4 6146 B15R0.366 CCOC(=O)CCNCCCCCCCO 2230a_100011996573_100011206558 [0,1,0,0,0,0|2,0,0]=3 6147 B15R0.366 CCOC(=O)CCNCCCCCCCO 34a_100011996573_100000765890 [0,1,0,0,0,0|2,0,0]=3 6148 B15R0.366 CCOC(=O)CCNCCCOCCCO 2230a_100011310245_100011206558 [0,1,0,0,0,0|3,0,0]=4 6149 B15R0.366 CCOC(=O)CCNCCCOCCCO 34a_100011310245_100000765890 [0,1,0,0,0,0|3,0,0]=4 6150 B15R0.366 CCOC(=O)CCNCCCOCCOC 2230a_100000206027_100011206558 [0,1,0,0,0,0|3,0,0]=4 6151 B15R0.366 CCOC(=O)CCNCCCOCCOC 34a_100000206027_100000765890 [0,1,0,0,0,0|3,0,0]=4 6152 B15R0.366 CCOC(=O)CCOCCCCCCCBr 34a_100000760002_100000765890 [0,1,0,0,0,0|2,0,0]=3 6153 B15R0.366 CCOC(=O)CCOCCCCCCCBr 7a_100000760002_100011206558 [0,1,0,0,0,0|2,0,0]=3 6154 B15R0.366 CCOC(=O)CCOCCCCCCCN 34a_100011996573_100000765890 [0,1,0,0,0,0|2,0,0]=3 6155 B15R0.366 CCOC(=O)CCOCCCCCCOC 34a_200012092642_100000765890 [0,1,0,0,0,0|2,0,0]=3 6156 B15R0.366 CCOC(=O)CCOCCCCCCOC 7a_200012092642_100011206558 [0,1,0,0,0,0|2,0,0]=3 6157 B15R0.366 CCOC(=O)CCOCCCOCCCN 34a_100011310245_100000765890 [0,1,0,0,0,0|3,0,0]=4 6158 B15R0.366 CCOC(=O)CCSCCCCCCC#N 62a_100000765890_100009813337 [0,1,0,0,0,0|2,0,1]=4 6159 B15R0.366 CCOC(=O)CCSCCCCCCC#N 62a_100009813337_100000765890 [0,1,0,0,0,0|2,0,1]=4 6160 B15R0.366 CCOC(=O)CCSCCCCCCCO 62a_100000760002_100000765890 [0,1,0,0,0,0|2,0,0]=3 6161 B15R0.366 CCOC(=O)CCSCCCCCCCO 62a_100000765890_100000760002 [0,1,0,0,0,0|2,0,0]=3 6162 B15R0.366 CCOC(=O)CCSCCCCCCOC 62a_100000765890_100011998445 [0,1,0,0,0,0|2,0,0]=3 6163 B15R0.366 CCOC(=O)CCSCCCCCCOC 62a_100011998445_100000765890 [0,1,0,0,0,0|2,0,0]=3 6164 B15R0.366 CCOC(=O)CCSCCCOCCOC 62a_100000765890_100011216529 [0,1,0,0,0,0|3,0,0]=4 6165 B15R0.366 CCOC(=O)CCSCCCOCCOC 62a_100011216529_100000765890 [0,1,0,0,0,0|3,0,0]=4 6166 B15R0.366 CCOC(=O)CNCCCCCCCCO 2230a_102515433106_100000188475 [0,1,0,0,0,0|2,0,0]=3 6167 B15R0.366 CCOC(=O)CNCCCCCCCCO 34a_102515433106_100000188475 [0,1,0,0,0,0|2,0,0]=3 6168 B15R0.366 CCOC(=O)COCCCCCCCCBr 34a_100009813846_100000188475 [0,1,0,0,0,0|2,0,0]=3 6169 B15R0.366 CCOC(=O)COCCCCCCCCBr 7a_100009813846_100000188475 [0,1,0,0,0,0|2,0,0]=3 6170 B15R0.366 CCOC(=O)COCCCCCCCCCl 34a_100000033203_100000188475 [0,1,0,0,0,0|2,0,0]=3 6171 B15R0.366 CCOC(=O)COCCCCCCCCCl 7a_100000033203_100000188475 [0,1,0,0,0,0|2,0,0]=3 6172 B15R0.366 CCOC(=O)COCCCCCCCCN 34a_102515433106_100000188475 [0,1,0,0,0,0|2,0,0]=3 6173 B15R0.366 CCOC(=O)COCCCCCNCCN 34a_103619048469_100000188475 [0,1,0,0,0,0|3,0,0]=4 6174 B15R0.366 CCOC(=O)COCCCNCCCCO 2230a_100000750430_100009893628 [0,1,0,0,0,0|3,0,0]=4 6175 B15R0.366 CCOC(=O)COCCCNCCCCO 34a_100000750430_100009893628 [0,1,0,0,0,0|3,0,0]=4 6176 B15R0.366 CCOC(=O)COCCCNCCCOC 34a_100150723488_100009893628 [0,1,0,0,0,0|3,0,0]=4 6177 B15R0.366 CCOC(=O)COCCCNCCCSC 2230a_100000749238_100009893628 [0,1,0,0,0,0|3,0,0]=4 6178 B15R0.366 CCOC(=O)COCCCNCCSCC 2230a_100000106463_100009893628 [0,1,0,0,0,0|3,0,0]=4 6179 B15R0.366 CCOC(=O)COCCCOCCCCBr 34a_100011216708_100009893628 [0,1,0,0,0,0|3,0,0]=4 6180 B15R0.366 CCOC(=O)COCCCOCCCCCl 34a_100000210776_100009893628 [0,1,0,0,0,0|3,0,0]=4 6181 B15R0.366 CCOC(=O)COCCCOCCCCCl 7a_100000210776_100009893628 [0,1,0,0,0,0|3,0,0]=4 6182 B15R0.366 CCOC(=O)COCCCOCCCCF 34a_100011995726_100009893628 [0,1,0,0,0,0|3,0,0]=4 6183 B15R0.366 CCOC(=O)COCCCOCCCCF 7a_100011995726_100009893628 [0,1,0,0,0,0|3,0,0]=4 6184 B15R0.366 CCOC(=O)COCCCOCCCCI 34a_200012148704_100009893628 [0,1,0,0,0,0|3,0,0]=4 6185 B15R0.366 CCOC(=O)COCCCOCCCCN 34a_100000750430_100009893628 [0,1,0,0,0,0|3,0,0]=4 6186 B15R0.366 CCOC(=O)COCCCOCCCNC 34a_100000213112_100009893628 [0,1,0,0,0,0|3,0,0]=4 6187 B15R0.366 CCOC(=O)COCCCOCCCOC 34a_100000740835_100009893628 [0,1,0,0,0,0|3,0,0]=4 6188 B15R0.366 CCOC(=O)COCCCOCCCOC 34a_200011215475_100000188475 [0,1,0,0,0,0|3,0,0]=4 6189 B15R0.366 CCOC(=O)COCCCOCCCOC 7a_200011215475_100000188475 [0,1,0,0,0,0|3,0,0]=4 6190 B15R0.366 CCOC(=O)COCCCOCCCSC 34a_100000690336_100009893628 [0,1,0,0,0,0|3,0,0]=4 6191 B15R0.366 CCOC(=O)COCCCOCCCSC 7a_100000690336_100009893628 [0,1,0,0,0,0|3,0,0]=4 6192 B15R0.366 CCOC(=O)COCCCOCCSCC 34a_100000212035_100009893628 [0,1,0,0,0,0|3,0,0]=4 6193 B15R0.366 CCOC(=O)COCCCOCCSCC 7a_100000212035_100009893628 [0,1,0,0,0,0|3,0,0]=4 6194 B15R0.366 CCOC(=O)COCCCSCCCCF 62a_100000729493_100009893628 [0,1,0,0,0,0|3,0,0]=4 6195 B15R0.366 CCOC(=O)COCCCSCCCCF 62a_100009893628_100000729493 [0,1,0,0,0,0|3,0,0]=4 6196 B15R0.366 CCOC(=O)COCCCSCCCCO 62a_100000210776_100009893628 [0,1,0,0,0,0|3,0,0]=4 6197 B15R0.366 CCOC(=O)COCCCSCCCCO 62a_100009893628_100000210776 [0,1,0,0,0,0|3,0,0]=4 6198 B15R0.366 CCOC(=O)COCCCSCCCOC 62a_100000709357_100009893628 [0,1,0,0,0,0|3,0,0]=4 6199 B15R0.366 CCOC(=O)COCCCSCCCOC 62a_100009893628_100000709357 [0,1,0,0,0,0|3,0,0]=4 6200 B15R0.366 CCOC(=O)COCCCSCCSCC 62a_100000757381_100009893628 [0,1,0,0,0,0|3,0,0]=4 6201 B15R0.366 CCOC(=O)COCCCSCCSCC 62a_100009893628_100000757381 [0,1,0,0,0,0|3,0,0]=4 6202 B15R0.366 CCOC(=O)COCCNCCCCCO 2230a_100000762737_100000088970 [0,1,0,0,0,0|3,0,0]=4 6203 B15R0.366 CCOC(=O)COCCNCCCCCO 34a_100000762737_100000088970 [0,1,0,0,0,0|3,0,0]=4 6204 B15R0.366 CCOC(=O)COCCOCCCCCBr 34a_100000746331_100000088970 [0,1,0,0,0,0|3,0,0]=4 6205 B15R0.366 CCOC(=O)COCCOCCCCCBr 7a_100000746331_100000088970 [0,1,0,0,0,0|3,0,0]=4 6206 B15R0.366 CCOC(=O)COCCOCCCCCCl 34a_100000746330_100000088970 [0,1,0,0,0,0|3,0,0]=4 6207 B15R0.366 CCOC(=O)COCCOCCCCCCl 7a_100000746330_100000088970 [0,1,0,0,0,0|3,0,0]=4 6208 B15R0.366 CCOC(=O)COCCOCCCCCI 34a_200012148887_100000088970 [0,1,0,0,0,0|3,0,0]=4 6209 B15R0.366 CCOC(=O)COCCOCCCCCI 7a_200012148887_100000088970 [0,1,0,0,0,0|3,0,0]=4 6210 B15R0.366 CCOC(=O)COCCOCCCCCN 34a_100000762737_100000088970 [0,1,0,0,0,0|3,0,0]=4 6211 B15R0.366 CCOC(=O)COCCOCCCCOC 34a_100000740925_100000088970 [0,1,0,0,0,0|3,0,0]=4 6212 B15R0.366 CCOC(=O)COCCOCCCCSC 34a_100011217163_100000088970 [0,1,0,0,0,0|3,0,0]=4 6213 B15R0.366 CCOC(=O)COCCOCCCCSC 7a_100011217163_100000088970 [0,1,0,0,0,0|3,0,0]=4 6214 B15R0.366 CCOC(=O)COCCOCCCSCC 34a_100011216438_100000088970 [0,1,0,0,0,0|3,0,0]=4 6215 B15R0.366 CCOC(=O)COCCOCCCSCC 7a_100011216438_100000088970 [0,1,0,0,0,0|3,0,0]=4 6216 B15R0.366 CCOC(=O)COCCSCCCCCF 62a_100000088970_100000729378 [0,1,0,0,0,0|3,0,0]=4 6217 B15R0.366 CCOC(=O)COCCSCCCCCF 62a_100000729378_100000088970 [0,1,0,0,0,0|3,0,0]=4 6218 B15R0.366 CCOC(=O)COCCSCCCCCO 62a_100000088970_100000746330 [0,1,0,0,0,0|3,0,0]=4 6219 B15R0.366 CCOC(=O)COCCSCCCCCO 62a_100000746330_100000088970 [0,1,0,0,0,0|3,0,0]=4 6220 B15R0.366 CCOC(=O)COCCSCCCCOC 62a_100000088970_100000730899 [0,1,0,0,0,0|3,0,0]=4 6221 B15R0.366 CCOC(=O)COCCSCCCCOC 62a_100000730899_100000088970 [0,1,0,0,0,0|3,0,0]=4 6222 B15R0.366 CCOC(=O)CSCCCCCCCCO 62a_100000033203_100000188475 [0,1,0,0,0,0|2,0,0]=3 6223 B15R0.366 CCOC(=O)CSCCCCCCCCO 62a_100000188475_100000033203 [0,1,0,0,0,0|2,0,0]=3 6224 B15R0.366 CCOC(=O)CSCCOCCCCCF 7a_200000230590_100000729378 [0,1,0,0,0,0|3,0,0]=4 6225 B15R0.366 CCOC(=O)CSCCOCCCCCO 7a_200000230590_100000746330 [0,1,0,0,0,0|3,0,0]=4 6226 B15R0.366 CCOC(=O)CSCCOCCCCOC 7a_200000230590_100000730899 [0,1,0,0,0,0|3,0,0]=4 6227 B15R0.366 CCOC(=O)NCCOCCCCCCBr 7a_100011215345_200011445536 [0,1,0,0,0,0|3,0,0]=4 6228 B15R0.366 CCOC(=O)NCCOCCCCCCCl 7a_100000766143_200011445536 [0,1,0,0,0,0|3,0,0]=4 6229 B15R0.366 CCOC(=O)NCCOCCCCCCF 34a_100000158857_100015922095 [0,1,0,0,0,0|3,0,0]=4 6230 B15R0.366 CCOC(=O)NCCOCCCCCCF 7a_100000732779_200011445536 [0,1,0,0,0,0|3,0,0]=4 6231 B15R0.366 CCOC(=O)NCCOCCCCCCO 34a_100000158857_100000766143 [0,1,0,0,0,0|3,0,0]=4 6232 B15R0.366 CCOC(=O)NCCSCCCCCCF 62a_100015922095_200011445536 [0,1,0,0,0,0|3,0,0]=4 6233 B15R0.366 CCOC(=O)NCCSCCCCCCO 62a_100000766143_200011445536 [0,1,0,0,0,0|3,0,0]=4 6234 B15R0.366 CCOC(=O)OCSCCCCCCCO 62a_100000760002_100000075025 [0,1,0,0,0,0|3,0,0]=4 6235 B15R0.366 CCOC(=O)OCSCCCCCCOC 62a_100011998445_100000075025 [0,1,0,0,0,0|3,0,0]=4 6236 B15R0.366 CCOCCCCCCCCC(=O)OCC 34a_100121572206_100010175975 [0,1,0,0,0,0|1,0,0]=2 6237 B15R0.366 CCOCCCNCCCCC(=O)OCC 2230a_100000210961_100000750268 [0,1,0,0,0,0|2,0,0]=3 6238 B15R0.366 CCOCCCNCCCCC(=O)OCC 34a_100000210961_100000750268 [0,1,0,0,0,0|2,0,0]=3 6239 B15R0.366 CCOCCCNCCOCC(=O)OCC 2230a_100000210961_100000088970 [0,1,0,0,0,0|3,0,0]=4 6240 B15R0.366 CCOCCCNCCOCC(=O)OCC 34a_100000210961_100000088970 [0,1,0,0,0,0|3,0,0]=4 6241 B15R0.366 CCOCCCOCCCCC(=O)OCC 34a_100000757476_100000750268 [0,1,0,0,0,0|2,0,0]=3 6242 B15R0.366 CCOCCCOCCCCC(=O)OCC 7a_100000757476_100000750268 [0,1,0,0,0,0|2,0,0]=3 6243 B15R0.366 CCOCCCOCCOCC(=O)OCC 34a_100000757476_100000088970 [0,1,0,0,0,0|3,0,0]=4 6244 B15R0.366 CCOCCCOCCOCC(=O)OCC 7a_100000757476_100000088970 [0,1,0,0,0,0|3,0,0]=4 6245 B15R0.366 CCOCCCOCCSCC(=O)OCC 7a_200000230590_100012232248 [0,1,0,0,0,0|3,0,0]=4 6246 B15R0.366 CCOCCCSCCCCC(=O)OCC 62a_100000750268_100012232248 [0,1,0,0,0,0|2,0,0]=3 6247 B15R0.366 CCOCCCSCCCCC(=O)OCC 62a_100012232248_100000750268 [0,1,0,0,0,0|2,0,0]=3 6248 B15R0.366 CCOCCCSCCOCC(=O)OCC 62a_100000088970_100012232248 [0,1,0,0,0,0|3,0,0]=4 6249 B15R0.366 CCOCCCSCCOCC(=O)OCC 62a_100012232248_100000088970 [0,1,0,0,0,0|3,0,0]=4 6250 B15R0.366 CCOCCNCCCCCC(=O)OCC 2230a_102516460346_100000755133 [0,1,0,0,0,0|2,0,0]=3 6251 B15R0.366 CCOCCNCCCCCC(=O)OCC 34a_102516460346_100000755133 [0,1,0,0,0,0|2,0,0]=3 6252 B15R0.366 CCOCCNCCCOCC(=O)OCC 2230a_102516460346_100009893628 [0,1,0,0,0,0|3,0,0]=4 6253 B15R0.366 CCOCCNCCCOCC(=O)OCC 34a_102516460346_100009893628 [0,1,0,0,0,0|3,0,0]=4 6254 B15R0.366 CCOCCOCCCCCC(=O)OCC 34a_100000210136_100000755133 [0,1,0,0,0,0|2,0,0]=3 6255 B15R0.366 CCOCCOCCCCCC(=O)OCC 7a_100000210136_100000755133 [0,1,0,0,0,0|2,0,0]=3 6256 B15R0.366 CCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215890 [0,1,0,0,0,0|2,0,0]=3 6257 B15R0.366 CCOCCOCCCOCC(=O)OCC 34a_100000210136_100009893628 [0,1,0,0,0,0|3,0,0]=4 6258 B15R0.366 CCOCCOCCCOCC(=O)OCC 7a_100000210136_100009893628 [0,1,0,0,0,0|3,0,0]=4 6259 B15R0.366 CCOCCOCCNCCC(=O)OCC 2230a_100102712874_100011206558 [0,1,0,0,0,0|3,0,0]=4 6260 B15R0.366 CCOCCOCCNCCC(=O)OCC 34a_100102712874_100000765890 [0,1,0,0,0,0|3,0,0]=4 6261 B15R0.366 CCOCCOCCOCCC(=O)OCC 34a_100000210240_100000765890 [0,1,0,0,0,0|3,0,0]=4 6262 B15R0.366 CCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210202 [0,1,0,0,0,0|3,0,0]=4 6263 B15R0.366 CCOCCOCCOCCC(=O)OCC 7a_100000210240_100011206558 [0,1,0,0,0,0|3,0,0]=4 6264 B15R0.366 CCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210202 [0,1,0,0,0,0|3,0,0]=4 6265 B15R0.366 CCOCCOCCSCCC(=O)OCC 62a_100000765890_100011211534 [0,1,0,0,0,0|3,0,0]=4 6266 B15R0.366 CCOCCOCCSCCC(=O)OCC 62a_100011211534_100000765890 [0,1,0,0,0,0|3,0,0]=4 6267 B15R0.366 CCOCCSCCCCCC(=O)OCC 62a_100000210147_100000755133 [0,1,0,0,0,0|2,0,0]=3 6268 B15R0.366 CCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215890 [0,1,0,0,0,0|2,0,0]=3 6269 B15R0.366 CCOCCSCCCOCC(=O)OCC 62a_100000210147_100009893628 [0,1,0,0,0,0|3,0,0]=4 6270 B15R0.366 CCOCCSCCCOCC(=O)OCC 62a_100009893628_100011215890 [0,1,0,0,0,0|3,0,0]=4 6271 B15R0.366 CCOCSCCCCCCC(=O)OCC 62a_100000739092_100009814379 [0,1,0,0,0,0|2,0,0]=3 6272 B15R0.366 CNNC(=O)CCCCCCCCCCO 22a_100016993582_200000016029 [0,1,0,0,0,0|2,0,0]=3 6273 B15R0.366 CNNC(=O)NCCCCCCCCCO 273464a_100000078944_100016993582 [0,1,0,0,0,0|3,0,0]=4 6274 B15R0.366 CNNC(=O)NCCCCCCCCCO 512a_100000078944_100016993582 [0,1,0,0,0,0|3,0,0]=4 6275 B15R0.366 CNNC(=O)NCCCCCCCCCO 512a_100016993582_100000078944 [0,1,0,0,0,0|3,0,0]=4 6276 B15R0.366 COCC(=O)CCCCCCCCCCO 1458a_100000210968_100009813290 [0,1,0,0,0,0|1,0,0]=2 6277 B15R0.366 COCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210968 [0,1,0,0,0,0|2,0,0]=3 6278 B15R0.366 CSCC(=O)CCCCCCCCCCO 1458a_100000184570_100009813290 [0,1,0,0,0,0|1,1,0]=3 6279 B15R0.366 CSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000184570 [0,1,0,0,0,0|2,1,0]=4 6280 B15R0.366 N#CCC(=O)CCCCCCCCCCO 1458a_100051588842_100009813290 [0,1,0,0,0,0|2,0,1]=4 6281 B15R0.366 NCCCCCCCCOCC(=O)NCO 34a_102515433106_100000185155 [0,1,0,0,0,0|3,0,0]=4 6282 B15R0.366 O=C(C=CBr)CCCCCCCCCCO 1458a_100016273825_100009813290 [0,1,0,0,0,0|2,0,1]=4 6283 B15R0.366 O=C(C=CCl)CCCCCCCCCCO 1458a_200016279998_100009813290 [0,1,0,0,0,0|2,0,1]=4 6284 B15R0.366 O=C(C=CI)CCCCCCCCCCO 1458a_100016256311_100009813290 [0,1,0,0,0,0|2,0,1]=4 6285 B15R0.366 O=C(CCO)CCCCCCCCCCO 1458a_100011216618_100009813290 [0,1,0,0,0,0|2,0,0]=3 6286 B15R0.366 O=C(CCO)NCCCCCCCCCO 240690a_100000078944_100011216618 [0,1,0,0,0,0|3,0,0]=4 6287 B15R0.366 O=C(CNCCCCCCCCO)NCO 2230a_102515433106_100000185155 [0,1,0,0,0,0|3,0,0]=4 6288 B15R0.366 O=C(CNCCCCCCCCO)NCO 34a_102515433106_100000185155 [0,1,0,0,0,0|3,0,0]=4 6289 B15R0.366 O=C(COCCCCCCCCBr)NCO 34a_100009813846_100000185155 [0,1,0,0,0,0|3,0,0]=4 6290 B15R0.366 O=C(COCCCCCCCCBr)NCO 7a_100009813846_100000185155 [0,1,0,0,0,0|3,0,0]=4 6291 B15R0.366 O=C(COCCCCCCCCCl)NCO 34a_100000033203_100000185155 [0,1,0,0,0,0|3,0,0]=4 6292 B15R0.366 O=C(COCCCCCCCCCl)NCO 7a_100000033203_100000185155 [0,1,0,0,0,0|3,0,0]=4 6293 B15R0.366 O=C(CSCCCCCCCCO)NCO 62a_100000033203_100000185155 [0,1,0,0,0,0|3,0,0]=4 6294 B15R0.366 O=C(CSCCCCCCCCO)NCO 62a_100000185155_100000033203 [0,1,0,0,0,0|3,0,0]=4 6295 B15R0.384 C#CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000184674 [0,1,0,0,0,0|0,0,3]=4 6296 B15R0.384 C#CCC(=O)CCCCCCCC(=O)OC 1458a_100011220946_100010004213 [0,1,0,0,0,0|0,0,3]=4 6297 B15R0.384 C#CCC(C)OCCCCCCC(=O)OC 34a_100000685586_100009815986 [0,1,0,0,0,0|1,0,2]=4 6298 B15R0.384 C#CCC(C)OCCCCCCC(=O)OC 7a_100000685586_100009815986 [0,1,0,0,0,0|1,0,2]=4 6299 B15R0.384 C#CCN(C)CCCCCCCC(=O)OC 2230a_100000225692_100010004213 [0,1,0,0,0,0|1,0,2]=4 6300 B15R0.384 C#CCN(C)CCCCCCCC(=O)OC 34a_100000225692_100010004213 [0,1,0,0,0,0|1,0,2]=4 6301 B15R0.384 C/C=C/C(C)OCCCCCCC(=O)OC 34a_200102604097_100009815986 [0,1,0,0,0,0|1,0,2]=4 6302 B15R0.384 C=CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210623 [0,1,0,0,0,0|0,0,3]=4 6303 B15R0.384 C=CCC(=O)CCCCCCCC(=O)OC 1458a_100000210193_100010004213 [0,1,0,0,0,0|0,0,3]=4 6304 B15R0.384 C=CCC(C)COCCCCCC(=O)OC 34a_100009832082_100009816466 [0,1,0,0,0,0|1,0,2]=4 6305 B15R0.384 C=CCC(C)COCCCCCC(=O)OC 7a_100009832082_100009816466 [0,1,0,0,0,0|1,0,2]=4 6306 B15R0.384 C=CCN(C)CCCCCCCC(=O)OC 2230a_100000225617_100010004213 [0,1,0,0,0,0|1,0,2]=4 6307 B15R0.384 C=CCN(C)CCCCCCCC(=O)OC 269982a_100000225617_100010004213 [0,1,0,0,0,0|1,0,2]=4 6308 B15R0.384 C=CC[C@@H](C)OCCCCCCC(=O)OC 34a_100000731007_100009815986 [0,1,0,0,0,0|1,0,2]=4 6309 B15R0.384 C=CC[C@@H](C)OCCCCCCC(=O)OC 7a_100000731007_100009815986 [0,1,0,0,0,0|1,0,2]=4 6310 B15R0.384 C=CC[C@@H](N)COCCCCCC(=O)OC 34a_100020615467_100009816466 [0,1,0,0,0,0|1,0,2]=4 6311 B15R0.384 CC#CC(=O)CCCCCCCC(=O)OC 1458a_100000763181_100010004213 [0,1,0,0,0,0|0,0,3]=4 6312 B15R0.384 CC#CC(C)OCCCCCCC(=O)OC 34a_100011216543_100009815986 [0,1,0,0,0,0|1,0,2]=4 6313 B15R0.384 CC=CC(=O)CCCCCCCC(=O)OC 1458a_100000210699_100010004213 [0,1,0,0,0,0|0,0,3]=4 6314 B15R0.384 CCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210303 [0,1,0,0,0,0|0,0,1]=2 6315 B15R0.384 CCCC(=O)CCCCCCCC(=O)OC 1458a_100000211992_100010004213 [0,1,0,0,0,0|0,0,1]=2 6316 B15R0.384 CCCC(=O)COCCCCCC(=O)OC 7a_100000074720_100000747444 [0,1,0,0,0,0|1,0,1]=3 6317 B15R0.384 CCCC(=O)CSCCCCCC(=O)OC 62a_100000747444_100009816466 [0,1,0,0,0,0|1,0,1]=3 6318 B15R0.384 CCCC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000747444 [0,1,0,0,0,0|1,0,1]=3 6319 B15R0.384 CCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000211992 [0,1,0,0,0,0|1,0,1]=3 6320 B15R0.384 CCCC(=O)OCOCCCCC(=O)OC 34a_100000059025_100000034017 [0,1,0,0,0,0|2,0,1]=4 6321 B15R0.384 CCCC(=O)OCSCCCCC(=O)OC 62a_100000204269_100000034017 [0,1,0,0,0,0|2,0,1]=4 6322 B15R0.384 CCCC(C)CCCOC/C=C/C(=O)OC 34a_100011713154_100000742655 [0,1,0,0,0,0|1,0,2]=4 6323 B15R0.384 CCCC(C)CCCOC/C=C/C(=O)OC 7a_100011713154_100000742655 [0,1,0,0,0,0|1,0,2]=4 6324 B15R0.384 CCCC(C)CCCOCCCC(=O)NC 34a_100011713154_100000741757 [0,1,0,0,0,0|2,0,0]=3 6325 B15R0.384 CCCC(C)CCCOCCCC(=O)NC 7a_100011713154_100000741757 [0,1,0,0,0,0|2,0,0]=3 6326 B15R0.384 CCCC(C)CCCOCCCC(=O)OC 34a_100011713154_100000742333 [0,1,0,0,0,0|1,0,0]=2 6327 B15R0.384 CCCC(C)CCCOCCCC(=O)OC 7a_100011713154_100011218270 [0,1,0,0,0,0|1,0,0]=2 6328 B15R0.384 CCCC(C)CCCOCCOC(=O)NC 34a_100011713154_200011997002 [0,1,0,0,0,0|3,0,0]=4 6329 B15R0.384 CCCC(C)CCCOCCOC(=O)NC 7a_100011713154_200011997002 [0,1,0,0,0,0|3,0,0]=4 6330 B15R0.384 CCCC(C)CCOCCCCC(=O)OC 34a_100011217855_100000204269 [0,1,0,0,0,0|1,0,0]=2 6331 B15R0.384 CCCC(C)CCOCCCCC(=O)OC 7a_100011217855_100000204269 [0,1,0,0,0,0|1,0,0]=2 6332 B15R0.384 CCCC(C)CCOCCOCC(=O)OC 34a_100011217855_100000090808 [0,1,0,0,0,0|2,0,0]=3 6333 B15R0.384 CCCC(C)CCOCCOCC(=O)OC 7a_100011217855_100000090808 [0,1,0,0,0,0|2,0,0]=3 6334 B15R0.384 CCCC(C)COCCCCCC(=O)OC 34a_100000074720_100011216630 [0,1,0,0,0,0|1,0,0]=2 6335 B15R0.384 CCCC(C)COCCCCCC(=O)OC 34a_100000688023_100009816466 [0,1,0,0,0,0|1,0,0]=2 6336 B15R0.384 CCCC(C)COCCCCCC(=O)OC 7a_100000074720_100011216630 [0,1,0,0,0,0|1,0,0]=2 6337 B15R0.384 CCCC(C)COCCCCCC(=O)OC 7a_100000688023_100009816466 [0,1,0,0,0,0|1,0,0]=2 6338 B15R0.384 CCCC(C)CSCCCCCC(=O)OC 62a_100009816466_100011216630 [0,1,0,0,0,0|1,0,0]=2 6339 B15R0.384 CCCC(C)CSCCCCCC(=O)OC 62a_100011216630_100009816466 [0,1,0,0,0,0|1,0,0]=2 6340 B15R0.384 CCCC(C)NCCCCCCC(=O)OC 2230a_100000741246_100009815986 [0,1,0,0,0,0|1,0,0]=2 6341 B15R0.384 CCCC(C)OCCCCCCC(=O)OC 34a_100000764384_100009815986 [0,1,0,0,0,0|1,0,0]=2 6342 B15R0.384 CCCC(C)OCCCCCCC(=O)OC 34a_100009863599_100000766640 [0,1,0,0,0,0|1,0,0]=2 6343 B15R0.384 CCCC(C)OCCCCCCC(=O)OC 7a_100000764384_100009815986 [0,1,0,0,0,0|1,0,0]=2 6344 B15R0.384 CCCC(C)OCCCCCCC(=O)OC 7a_100009863599_100000766640 [0,1,0,0,0,0|1,0,0]=2 6345 B15R0.384 CCCC(C)SCCCCCCC(=O)OC 62a_100000766640_100009815986 [0,1,0,0,0,0|1,0,0]=2 6346 B15R0.384 CCCC(C)SCCCCCCC(=O)OC 62a_100009815986_100000766640 [0,1,0,0,0,0|1,0,0]=2 6347 B15R0.384 CCCN(C)CCCCCCCC(=O)OC 2230a_100000747261_100010004213 [0,1,0,0,0,0|1,0,0]=2 6348 B15R0.384 CCCN(C)CCCCCCCC(=O)OC 269982a_100000747261_100010004213 [0,1,0,0,0,0|1,0,0]=2 6349 B15R0.384 CCC[C@H](N)CCOCCCCC(=O)OC 34a_100015193777_100000204269 [0,1,0,0,0,0|1,0,0]=2 6350 B15R0.384 CCC[C@H](N)CCOCCOCC(=O)OC 34a_100015193777_100000090808 [0,1,0,0,0,0|2,0,0]=3 6351 B15R0.384 CCC[C@H](N)COCCCCCC(=O)OC 34a_100000732646_100009816466 [0,1,0,0,0,0|1,0,0]=2 6352 B15R0.384 CCNC(=O)CCCCCCCC(=O)OC 11a_100015525214_100000033222 [0,1,0,0,0,0|1,0,1]=3 6353 B15R0.384 CCNC(=O)CCCCCCCC(=O)OC 240690a_100015525214_100000033222 [0,1,0,0,0,0|1,0,1]=3 6354 B15R0.384 CCNC(=O)CCNCCCCC(=O)OC 34a_100025743525_100000204269 [0,1,0,0,0,0|2,0,1]=4 6355 B15R0.384 CCNC(=O)CCOCCCCC(=O)OC 7a_100000059025_100000737597 [0,1,0,0,0,0|2,0,1]=4 6356 B15R0.384 CCNC(=O)CCSCCCCC(=O)OC 62a_100000204269_100000737597 [0,1,0,0,0,0|2,0,1]=4 6357 B15R0.384 CCNC(=O)CCSCCCCC(=O)OC 62a_100000737597_100000204269 [0,1,0,0,0,0|2,0,1]=4 6358 B15R0.384 CCNC(=O)CNCCCCCC(=O)OC 2230a_100016988866_100009816466 [0,1,0,0,0,0|2,0,1]=4 6359 B15R0.384 CCNC(=O)COCCCCCC(=O)OC 34a_100000074720_100000183381 [0,1,0,0,0,0|2,0,1]=4 6360 B15R0.384 CCNC(=O)COCCCCCC(=O)OC 7a_100000074720_100000183381 [0,1,0,0,0,0|2,0,1]=4 6361 B15R0.384 CCNC(=O)CSCCCCCC(=O)OC 62a_100000183381_100009816466 [0,1,0,0,0,0|2,0,1]=4 6362 B15R0.384 CCNC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000183381 [0,1,0,0,0,0|2,0,1]=4 6363 B15R0.384 CCOC(=O)CCCCCCCC(=O)CC 1458a_100000210414_100009991516 [0,1,0,0,0,0|2,0,1]=4 6364 B15R0.384 CCOC(=O)CCCCCOCC(=O)OC 7a_100011214988_100000747449 [0,1,0,0,0,0|2,0,1]=4 6365 B15R0.384 CCOC(=O)CCCCCSCC(=O)OC 62a_100000747449_100000755133 [0,1,0,0,0,0|2,0,1]=4 6366 B15R0.384 CCOC(=O)CCCCCSCC(=O)OC 62a_100000755133_100000747449 [0,1,0,0,0,0|2,0,1]=4 6367 B15R0.384 CCOC(=O)CCCCSCCC(=O)OC 62a_100000204255_100000750268 [0,1,0,0,0,0|2,0,1]=4 6368 B15R0.384 CCOC(=O)CCCCSCCC(=O)OC 62a_100000750268_100000204255 [0,1,0,0,0,0|2,0,1]=4 6369 B15R0.384 CCOC(=O)CCCOCCCC(=O)OC 7a_100012001163_100011218270 [0,1,0,0,0,0|2,0,1]=4 6370 B15R0.384 CCOC(=O)CCCSCCCC(=O)OC 62a_100009991533_100011218270 [0,1,0,0,0,0|2,0,1]=4 6371 B15R0.384 CCOC(=O)CCCSCCCC(=O)OC 62a_100011218270_100009991533 [0,1,0,0,0,0|2,0,1]=4 6372 B15R0.384 CCOC(=O)CCOCCCCC(=O)OC 34a_100000059025_100000765890 [0,1,0,0,0,0|2,0,1]=4 6373 B15R0.384 CCOC(=O)CCOCCCCC(=O)OC 7a_100000059025_100011206558 [0,1,0,0,0,0|2,0,1]=4 6374 B15R0.384 CCOC(=O)CCSCCCCC(=O)OC 62a_100000204269_100000765890 [0,1,0,0,0,0|2,0,1]=4 6375 B15R0.384 CCOC(=O)CCSCCCCC(=O)OC 62a_100000765890_100000204269 [0,1,0,0,0,0|2,0,1]=4 6376 B15R0.384 CCOC(=O)COCCCCCC(=O)OC 34a_100000074720_100000188475 [0,1,0,0,0,0|2,0,1]=4 6377 B15R0.384 CCOC(=O)COCCCCCC(=O)OC 7a_100000074720_100000188475 [0,1,0,0,0,0|2,0,1]=4 6378 B15R0.384 CCOC(=O)CSCCCCCC(=O)OC 62a_100000188475_100009816466 [0,1,0,0,0,0|2,0,1]=4 6379 B15R0.384 CCOC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000188475 [0,1,0,0,0,0|2,0,1]=4 6380 B15R0.384 COC(=O)CCCCCCCC(=O)CC#N 1458a_100000033222_100011214920 [0,1,0,0,0,0|1,0,2]=4 6381 B15R0.384 COC(=O)CCCCCCCC(=O)CC#N 1458a_100051588842_100010004213 [0,1,0,0,0,0|1,0,2]=4 6382 B15R0.384 COC(=O)CCCCCCCC(=O)CCF 1458a_100000033222_100011217306 [0,1,0,0,0,0|1,0,1]=3 6383 B15R0.384 COC(=O)CCCCCCCC(=O)CCO 1458a_100000033222_100000211926 [0,1,0,0,0,0|1,0,1]=3 6384 B15R0.384 COC(=O)CCCCCCCC(=O)CCO 1458a_100011216618_100010004213 [0,1,0,0,0,0|1,0,1]=3 6385 B15R0.384 COC(=O)CCCCCCCC(=O)CSC 1458a_100000184570_100010004213 [0,1,0,0,0,0|1,0,1]=3 6386 B15R0.384 COC(=O)CCCCCCCN(C)CC#N 2230a_100000748184_100010004213 [0,1,0,0,0,0|2,0,1]=4 6387 B15R0.384 COC(=O)CCCCCCCN(C)CCO 2230a_100000210263_100010004213 [0,1,0,0,0,0|2,0,0]=3 6388 B15R0.384 COC(=O)CCCCCCCN(C)CCO 269982a_100000210263_100010004213 [0,1,0,0,0,0|2,0,0]=3 6389 B15R0.384 COC(=O)CCCCCCNC(=O)CSC 188690a_100000739044_100000184570 [0,1,0,0,0,0|2,0,1]=4 6390 B15R0.384 COC(=O)CCCCCCN[C@@H](C)CC#N 2230a_100016994482_100009815986 [0,1,0,0,0,0|2,0,1]=4 6391 B15R0.384 COC(=O)CCCCCCN[C@H](C)CCO 2230a_100000706166_100009815986 [0,1,0,0,0,0|2,0,0]=3 6392 B15R0.384 COC(=O)CCCCCCN[C@H](C)CCO 34a_100000706166_100009815986 [0,1,0,0,0,0|2,0,0]=3 6393 B15R0.384 COC(=O)CCCCCCOC(C)CC#N 7a_100009863599_100009813641 [0,1,0,0,0,0|2,0,1]=4 6394 B15R0.384 COC(=O)CCCCCCOC(C)CCBr 34a_100012276601_100009815986 [0,1,0,0,0,0|2,0,0]=3 6395 B15R0.384 COC(=O)CCCCCCOC(C)CCO 34a_100009863599_100009893172 [0,1,0,0,0,0|2,0,0]=3 6396 B15R0.384 COC(=O)CCCCCCOC(C)CCO 7a_100009863599_100009893172 [0,1,0,0,0,0|2,0,0]=3 6397 B15R0.384 COC(=O)CCCCCCSC(C)CC#N 62a_100009813641_100009815986 [0,1,0,0,0,0|2,0,1]=4 6398 B15R0.384 COC(=O)CCCCCCSC(C)CC#N 62a_100009815986_100009813641 [0,1,0,0,0,0|2,0,1]=4 6399 B15R0.384 COC(=O)CCCCCCSC(C)CCO 62a_100009815986_100009893172 [0,1,0,0,0,0|2,0,0]=3 6400 B15R0.384 COC(=O)CCCCCCSC(C)CCO 62a_100009893172_100009815986 [0,1,0,0,0,0|2,0,0]=3 6401 B15R0.384 COC(=O)CCCCCOCC(C)CCN 34a_106354213184_100009816466 [0,1,0,0,0,0|2,0,0]=3 6402 B15R0.384 COC(=O)CCCCCOC[C@@H](O)CC#N 7a_100000074720_100000001066 [0,1,0,0,0,0|2,0,1]=4 6403 B15R0.384 COC(=O)CCCCCSC[C@@H](O)CC#N 62a_100000001066_100009816466 [0,1,0,0,0,0|2,0,1]=4 6404 B15R0.384 COC(=O)CCCCCSC[C@@H](O)CC#N 62a_100009816466_100000001066 [0,1,0,0,0,0|2,0,1]=4 6405 B15R0.384 COCC(=O)CCCCCCCC(=O)OC 1458a_100000210968_100010004213 [0,1,0,0,0,0|1,0,1]=3 6406 B15R0.384 COCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000210968 [0,1,0,0,0,0|2,0,1]=4 6407 B15R0.384 COCC(C)OCCCCCCC(=O)OC 34a_100009863599_100000765312 [0,1,0,0,0,0|2,0,0]=3 6408 B15R0.384 COCC(C)OCCCCCCC(=O)OC 7a_100009863599_100000765312 [0,1,0,0,0,0|2,0,0]=3 6409 B15R0.384 COCC(C)SCCCCCCC(=O)OC 62a_100000765312_100009815986 [0,1,0,0,0,0|2,0,0]=3 6410 B15R0.384 COCC(C)SCCCCCCC(=O)OC 62a_100009815986_100000765312 [0,1,0,0,0,0|2,0,0]=3 6411 B15R0.384 COCC(N)COCCCCCC(=O)OC 34a_100000724102_100009816466 [0,1,0,0,0,0|2,0,0]=3 6412 B15R0.384 COCC(O)CNCCCCCC(=O)OC 2230a_100000756049_100009816466 [0,1,0,0,0,0|2,0,0]=3 6413 B15R0.384 COCC(O)CNCCCCCC(=O)OC 34a_100000756049_100009816466 [0,1,0,0,0,0|2,0,0]=3 6414 B15R0.384 COCC(O)COCCCCCC(=O)OC 34a_100000074720_100011215053 [0,1,0,0,0,0|2,0,0]=3 6415 B15R0.384 COCC(O)COCCCCCC(=O)OC 7a_100000074720_100011215053 [0,1,0,0,0,0|2,0,0]=3 6416 B15R0.384 COCC(O)CSCCCCCC(=O)OC 62a_100009816466_100011215053 [0,1,0,0,0,0|2,0,0]=3 6417 B15R0.384 COCC(O)CSCCCCCC(=O)OC 62a_100011215053_100009816466 [0,1,0,0,0,0|2,0,0]=3 6418 B15R0.384 COC[C@@H](C)NCCCCCCC(=O)OC 2230a_100000764878_100009815986 [0,1,0,0,0,0|2,0,0]=3 6419 B15R0.384 COC[C@@H](C)OCCCCCCC(=O)OC 34a_100011934205_100009815986 [0,1,0,0,0,0|2,0,0]=3 6420 B15R0.2405 C#CCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100012276617 [0,1,0,0,0,0|0,0,3]=4 6421 B15R0.2405 C#CCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100012276617 [0,1,0,0,0,0|1,0,2]=4 6422 B15R0.2405 C=CCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100011215473 [0,1,0,0,0,0|0,0,3]=4 6423 B15R0.2405 C=CCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100011215473 [0,1,0,0,0,0|1,0,2]=4 6424 B15R0.2405 CCCCCC#CCC(=O)CCC(=O)OC 1458a_100000187943_100009816472 [0,1,0,0,0,0|0,0,3]=4 6425 B15R0.2405 CCCCCC#CCN(C)CCC(=O)OC 269982a_100025711912_100009816472 [0,1,0,0,0,0|1,0,2]=4 6426 B15R0.2405 CCCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210759 [0,1,0,0,0,0|1,0,1]=3 6427 B15R0.2405 CCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210759 [0,1,0,0,0,0|0,0,1]=2 6428 B15R0.2405 CCCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100000210759 [0,1,0,0,0,0|2,0,1]=4 6429 B15R0.2405 CCCCCCCCC(=O)CNC(=O)CC 1458a_100000194589_100000210759 [0,1,0,0,0,0|2,0,1]=4 6430 B15R0.2405 CCCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210759 [0,1,0,0,0,0|1,0,1]=3 6431 B15R0.2405 CCCCCCCCC(=O)NCC(=O)NC 11a_100000693194_100000210188 [0,1,0,0,0,0|2,0,1]=4 6432 B15R0.2405 CCCCCCCCC(=O)NCC(=O)NC 240690a_100000693194_100000210188 [0,1,0,0,0,0|2,0,1]=4 6433 B15R0.2405 CCCCCCCCC(=O)NCC(=O)NC 527a_100000693194_100000210188 [0,1,0,0,0,0|2,0,1]=4 6434 B15R0.2405 CCCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000210188 [0,1,0,0,0,0|1,0,1]=3 6435 B15R0.2405 CCCCCCCCC(C)NCC(=O)NC 270004a_100000693194_100011216694 [0,1,0,0,0,0|2,0,0]=3 6436 B15R0.2405 CCCCCCCCC(C)NC[C@@H](C)OC 270004a_100020591295_100011216694 [0,1,0,0,0,0|2,0,1]=4 6437 B15R0.2405 CCCCCCCCC(C)OCC(=O)CC 7a_100000210740_100000747405 [0,1,0,0,0,0|2,0,0]=3 6438 B15R0.2405 CCCCCCCCC(C)OCC(=O)NC 34a_100000210740_100000183359 [0,1,0,0,0,0|2,0,0]=3 6439 B15R0.2405 CCCCCCCCC(C)OCC(=O)NC 7a_100000210740_100000183359 [0,1,0,0,0,0|2,0,0]=3 6440 B15R0.2405 CCCCCCCCC(C)OCC(=O)OC 34a_100000210740_100000747449 [0,1,0,0,0,0|1,0,0]=2 6441 B15R0.2405 CCCCCCCCC(C)OCC(=O)OC 7a_100000210740_100000747449 [0,1,0,0,0,0|1,0,0]=2 6442 B15R0.2405 CCCCCCCCN(C)CCC(=O)NC 2230a_100000207567_100000737683 [0,1,0,0,0,0|2,0,0]=3 6443 B15R0.2405 CCCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100000210759 [0,1,0,0,0,0|2,0,0]=3 6444 B15R0.2405 CCCCCCCCN(C)CCC(=O)NC 269982a_100000207567_100000737683 [0,1,0,0,0,0|2,0,0]=3 6445 B15R0.2405 CCCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100000210759 [0,1,0,0,0,0|2,0,0]=3 6446 B15R0.2405 CCCCCCCCN(C)CCC(=O)OC 2230a_100000207567_100000204255 [0,1,0,0,0,0|1,0,0]=2 6447 B15R0.2405 CCCCCCCCN(C)CCC(=O)OC 269982a_100000207567_100000204255 [0,1,0,0,0,0|1,0,0]=2 6448 B15R0.2405 CCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210759 [0,1,0,0,0,0|1,0,0]=2 6449 B15R0.2405 CCCCCCCNC(=O)CCC(=O)NC 11a_100000229938_100011309844 [0,1,0,0,0,0|2,0,1]=4 6450 B15R0.2405 CCCCCCCNC(=O)CCC(=O)NC 1626a_100000229938_100011309844 [0,1,0,0,0,0|2,0,1]=4 6451 B15R0.2405 CCCCCCCNC(=O)CCC(=O)NC 240690a_100000229938_100011309844 [0,1,0,0,0,0|2,0,1]=4 6452 B15R0.2405 CCCCCCCNC(=O)CCC(=O)NC 527a_100000229938_100011309844 [0,1,0,0,0,0|2,0,1]=4 6453 B15R0.2405 CCCCCCCNC(=O)CCC(=O)OC 11a_100000229938_100000187943 [0,1,0,0,0,0|1,0,1]=3 6454 B15R0.2405 CCCCCCCNC(=O)CCC(=O)OC 1626a_100000229938_100000187943 [0,1,0,0,0,0|1,0,1]=3 6455 B15R0.2405 CCCCCCCNC(=O)CCC(=O)OC 240690a_100000229938_100000187943 [0,1,0,0,0,0|1,0,1]=3 6456 B15R0.2405 CCCCCCCNC(=O)CCC(=O)OC 527a_100000229938_100000187943 [0,1,0,0,0,0|1,0,1]=3 6457 B15R0.2405 CCCCCCCNC(=O)CNC(=O)OC 11a_100000229938_100000215747 [0,1,0,0,0,0|2,0,1]=4 6458 B15R0.2405 CCCCCCCNC(=O)CNC(=O)OC 1626a_100000229938_100000215747 [0,1,0,0,0,0|2,0,1]=4 6459 B15R0.2405 CCCCCCCNC(=O)CNC(=O)OC 240690a_100000229938_100000215747 [0,1,0,0,0,0|2,0,1]=4 6460 B15R0.2405 CCCCCCCNC(=O)CNC(=O)OC 527a_100000229938_100000215747 [0,1,0,0,0,0|2,0,1]=4 6461 B15R0.2405 CCCCCCNCC(=O)CCC(=O)OC 2230a_100000210581_100000691467 [0,1,0,0,0,0|1,0,1]=3 6462 B15R0.2405 CCCCCCNCC(=O)NCC(=O)OC 2230a_100000210581_100000182966 [0,1,0,0,0,0|2,0,1]=4 6463 B15R0.2405 CCCCCCOCC(=O)CCC(=O)OC 34a_100000210259_100000691467 [0,1,0,0,0,0|1,0,1]=3 6464 B15R0.2405 CCCCCCOCC(=O)CCC(=O)OC 7a_100000210259_100000691467 [0,1,0,0,0,0|1,0,1]=3 6465 B15R0.2405 CCCCCCOCC(=O)NCC(=O)OC 34a_100000210259_100000182966 [0,1,0,0,0,0|2,0,1]=4 6466 B15R0.2405 CCCCCCOCC(=O)NCC(=O)OC 7a_100000210259_100000182966 [0,1,0,0,0,0|2,0,1]=4 6467 B15R0.2405 CCCCCCSCC(=O)CCC(=O)OC 62a_100000210314_100000691467 [0,1,0,0,0,0|1,0,1]=3 6468 B15R0.2405 CCCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210757 [0,1,0,0,0,0|1,0,1]=3 6469 B15R0.2405 CCCCCCSCC(=O)NCC(=O)OC 62a_100000182966_100000210757 [0,1,0,0,0,0|2,0,1]=4 6470 B15R0.2405 CCCCCCSCC(=O)NCC(=O)OC 62a_100000210314_100000182966 [0,1,0,0,0,0|2,0,1]=4 6471 B15R0.2405 CCCCOCSCC(=O)CCC(=O)OC 62a_100000691467_100011995733 [0,1,0,0,0,0|2,0,1]=4 6472 B15R0.2405 CCCCOCSCC(=O)CCC(=O)OC 62a_100011995733_100000691467 [0,1,0,0,0,0|2,0,1]=4 6473 B15R0.2405 CCCCSCCNC(=O)CCC(=O)OC 11a_100025743550_100000187943 [0,1,0,0,0,0|2,0,1]=4 6474 B15R0.2405 CCCCSCCNC(=O)CCC(=O)OC 1626a_100025743550_100000187943 [0,1,0,0,0,0|2,0,1]=4 6475 B15R0.2405 CCCCSCCNC(=O)CCC(=O)OC 240690a_100025743550_100000187943 [0,1,0,0,0,0|2,0,1]=4 6476 B15R0.2405 CCCCSCCNC(=O)CCC(=O)OC 527a_100025743550_100000187943 [0,1,0,0,0,0|2,0,1]=4 6477 B15R0.2405 CCCOCCCNC(=O)CCC(=O)OC 1626a_100011217757_100000187943 [0,1,0,0,0,0|2,0,1]=4 6478 B15R0.2405 CCCOCCCNC(=O)CCC(=O)OC 240690a_100011217757_100000187943 [0,1,0,0,0,0|2,0,1]=4 6479 B15R0.2405 CCCOCCCNC(=O)CCC(=O)OC 527a_100011217757_100000187943 [0,1,0,0,0,0|2,0,1]=4 6480 B15R0.2405 CCCOCCNCC(=O)CCC(=O)OC 2230a_100161115042_100000691467 [0,1,0,0,0,0|2,0,1]=4 6481 B15R0.2405 CCCOCCNCC(=O)CCC(=O)OC 34a_100161115042_100000691467 [0,1,0,0,0,0|2,0,1]=4 6482 B15R0.2405 CCCOCCOCC(=O)CCC(=O)OC 34a_100000752267_100000691467 [0,1,0,0,0,0|2,0,1]=4 6483 B15R0.2405 CCCOCCOCC(=O)CCC(=O)OC 7a_100000752267_100000691467 [0,1,0,0,0,0|2,0,1]=4 6484 B15R0.2405 CCCOCCSCC(=O)CCC(=O)OC 62a_100000691467_100011215938 [0,1,0,0,0,0|2,0,1]=4 6485 B15R0.2405 CCCOCCSCC(=O)CCC(=O)OC 62a_100011215938_100000691467 [0,1,0,0,0,0|2,0,1]=4 6486 B15R0.2405 CCCSCCNCC(=O)CCC(=O)OC 2230a_100020603323_100000691467 [0,1,0,0,0,0|2,0,1]=4 6487 B15R0.2405 CCCSCCOCC(=O)CCC(=O)OC 34a_200000230433_100000691467 [0,1,0,0,0,0|2,0,1]=4 6488 B15R0.2405 CCCSCCOCC(=O)CCC(=O)OC 7a_200000230433_100000691467 [0,1,0,0,0,0|2,0,1]=4 6489 B15R0.2405 CCOCCCNCC(=O)CCC(=O)OC 2230a_100000210961_100000691467 [0,1,0,0,0,0|2,0,1]=4 6490 B15R0.2405 CCOCCCNCC(=O)CCC(=O)OC 34a_100000210961_100000691467 [0,1,0,0,0,0|2,0,1]=4 6491 B15R0.2405 CCOCCCOCC(=O)CCC(=O)OC 34a_100000757476_100000691467 [0,1,0,0,0,0|2,0,1]=4 6492 B15R0.2405 CCOCCCOCC(=O)CCC(=O)OC 7a_100000757476_100000691467 [0,1,0,0,0,0|2,0,1]=4 6493 B15R0.2405 CCOCCCSCC(=O)CCC(=O)OC 62a_100000691467_100012232248 [0,1,0,0,0,0|2,0,1]=4 6494 B15R0.2405 CCOCCCSCC(=O)CCC(=O)OC 62a_100012232248_100000691467 [0,1,0,0,0,0|2,0,1]=4 6495 B15R0.2405 CCOCCOCCC(=O)CCC(=O)OC 1458a_100000187943_100011211534 [0,1,0,0,0,0|2,0,1]=4 6496 B15R0.2405 CCOCCOCCN(C)CCC(=O)OC 269982a_100025711912_100011211534 [0,1,0,0,0,0|3,0,0]=4 6497 B15R0.2405 CCSCCCOCC(=O)CCC(=O)OC 34a_100011216438_100000691467 [0,1,0,0,0,0|2,0,1]=4 6498 B15R0.2405 CCSCCCOCC(=O)CCC(=O)OC 7a_100011216438_100000691467 [0,1,0,0,0,0|2,0,1]=4 6499 B15R0.2405 CNC(=O)CCC(=O)CCCCCCCO 1458a_100011309844_100000760002 [0,1,0,0,0,0|2,0,1]=4 6500 B15R0.2405 CNC(=O)CCC(=O)CCCCCCOC 1458a_100011309844_100011998445 [0,1,0,0,0,0|2,0,1]=4 6501 B15R0.2405 CNC(=O)CCN(C)CCCCCCCO 2230a_100000750875_100000760002 [0,1,0,0,0,0|3,0,0]=4 6502 B15R0.2405 CNC(=O)CCN(C)CCCCCCCO 269982a_100000750875_100000760002 [0,1,0,0,0,0|3,0,0]=4 6503 B15R0.2405 CNC(=O)CCN(C)CCCCCCOC 2230a_100000750875_100011998445 [0,1,0,0,0,0|3,0,0]=4 6504 B15R0.2405 CNC(=O)CCN(C)CCCCCCOC 269982a_100000750875_100011998445 [0,1,0,0,0,0|3,0,0]=4 6505 B15R0.2405 COC(=O)CCC(=O)CCCCCCC#N 1458a_100000187943_100009813337 [0,1,0,0,0,0|1,0,2]=4 6506 B15R0.2405 COC(=O)CCC(=O)CCCCCCCO 1458a_100000187943_100000760002 [0,1,0,0,0,0|1,0,1]=3 6507 B15R0.2405 COC(=O)CCC(=O)CNCCCCCO 2230a_100000762737_100000691467 [0,1,0,0,0,0|2,0,1]=4 6508 B15R0.2405 COC(=O)CCC(=O)CNCCCCCO 34a_100000762737_100000691467 [0,1,0,0,0,0|2,0,1]=4 6509 B15R0.2405 COC(=O)CCC(=O)COCCCCCBr 34a_100000746331_100000691467 [0,1,0,0,0,0|2,0,1]=4 6510 B15R0.2405 COC(=O)CCC(=O)COCCCCCBr 7a_100000746331_100000691467 [0,1,0,0,0,0|2,0,1]=4 6511 B15R0.2405 COC(=O)CCC(=O)COCCCCCCl 34a_100000746330_100000691467 [0,1,0,0,0,0|2,0,1]=4 6512 B15R0.2405 COC(=O)CCC(=O)COCCCCCCl 7a_100000746330_100000691467 [0,1,0,0,0,0|2,0,1]=4 6513 B15R0.2405 COC(=O)CCC(=O)COCCCCCI 34a_200012148887_100000691467 [0,1,0,0,0,0|2,0,1]=4 6514 B15R0.2405 COC(=O)CCC(=O)COCCCCCI 7a_200012148887_100000691467 [0,1,0,0,0,0|2,0,1]=4 6515 B15R0.2405 COC(=O)CCC(=O)COCCCCCN 34a_100000762737_100000691467 [0,1,0,0,0,0|2,0,1]=4 6516 B15R0.2405 COC(=O)CCC(=O)COCCCCSC 34a_100011217163_100000691467 [0,1,0,0,0,0|2,0,1]=4 6517 B15R0.2405 COC(=O)CCC(=O)COCCCCSC 7a_100011217163_100000691467 [0,1,0,0,0,0|2,0,1]=4 6518 B15R0.2405 COC(=O)CCC(=O)CSCCCCCF 62a_100000691467_100000729378 [0,1,0,0,0,0|2,0,1]=4 6519 B15R0.2405 COC(=O)CCC(=O)CSCCCCCF 62a_100000729378_100000691467 [0,1,0,0,0,0|2,0,1]=4 6520 B15R0.2405 COC(=O)CCC(=O)CSCCCCCO 62a_100000691467_100000746330 [0,1,0,0,0,0|2,0,1]=4 6521 B15R0.2405 COC(=O)CCC(=O)CSCCCCCO 62a_100000746330_100000691467 [0,1,0,0,0,0|2,0,1]=4 6522 B15R0.2405 COC(=O)CCC(=O)NCCCCCCO 240690a_100000686447_100000187943 [0,1,0,0,0,0|2,0,1]=4 6523 B15R0.2405 COC(=O)CCC(=O)NCCCCCCO 527a_100000686447_100000187943 [0,1,0,0,0,0|2,0,1]=4 6524 B15R0.2405 COC(=O)CCN(C)CCCCCCC#N 269982a_100025711912_100009813337 [0,1,0,0,0,0|2,0,1]=4 6525 B15R0.2405 COC(=O)CCN(C)CCCCCCCO 269982a_100025711912_100000760002 [0,1,0,0,0,0|2,0,0]=3 6526 B15R0.2405 COC(=O)CNC(=O)CCCCCCCO 188690a_100000185156_100011219782 [0,1,0,0,0,0|2,0,1]=4 6527 B15R0.2405 COC(=O)NCC(=O)CCCCCCCO 1458a_100000215747_100000760002 [0,1,0,0,0,0|2,0,1]=4 6528 B15R0.2405 COCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100011998445 [0,1,0,0,0,0|1,0,1]=3 6529 B15R0.2405 COCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100011998445 [0,1,0,0,0,0|2,0,1]=4 6530 B15R0.2405 COCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100011998445 [0,1,0,0,0,0|2,0,0]=3 6531 B15R0.2405 COCCCCCNC(=O)CCC(=O)OC 11a_100000747528_100000187943 [0,1,0,0,0,0|2,0,1]=4 6532 B15R0.2405 COCCCCCNC(=O)CCC(=O)OC 1626a_100000747528_100000187943 [0,1,0,0,0,0|2,0,1]=4 6533 B15R0.2405 COCCCCCNC(=O)CCC(=O)OC 240690a_100000747528_100000187943 [0,1,0,0,0,0|2,0,1]=4 6534 B15R0.2405 COCCCCCNC(=O)CCC(=O)OC 527a_100000747528_100000187943 [0,1,0,0,0,0|2,0,1]=4 6535 B15R0.2405 COCCCCOCC(=O)CCC(=O)OC 34a_100000740925_100000691467 [0,1,0,0,0,0|2,0,1]=4 6536 B15R0.2405 COCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000730899 [0,1,0,0,0,0|2,0,1]=4 6537 B15R0.2405 COCCCCSCC(=O)CCC(=O)OC 62a_100000730899_100000691467 [0,1,0,0,0,0|2,0,1]=4 6538 B15R0.2405 COCCOCCCC(=O)CCC(=O)OC 1458a_100000187943_100011216529 [0,1,0,0,0,0|2,0,1]=4 6539 B15R0.2405 COCCOCCCN(C)CCC(=O)OC 269982a_100025711912_100011216529 [0,1,0,0,0,0|3,0,0]=4 6540 B15R0.3221 C#CCCCCCCCC(=O)CC(=O)OC 1458a_100000087357_100000747449 [0,1,0,0,0,0|0,0,3]=4 6541 B15R0.3221 C#CCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100153394163 [0,1,0,0,0,0|0,0,3]=4 6542 B15R0.3221 C#CCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100153394163 [0,1,0,0,0,0|1,0,2]=4 6543 B15R0.3221 C#CCCCCCCOC(C)CC(=O)OC 34a_100011217361_100009817358 [0,1,0,0,0,0|1,0,2]=4 6544 B15R0.3221 C#CCCCCCCOC(C)CC(=O)OC 7a_100011217361_100009817358 [0,1,0,0,0,0|1,0,2]=4 6545 B15R0.3221 C#CCCCCCCSC(C)CC(=O)OC 62a_100009817358_100012276617 [0,1,0,0,0,0|1,0,2]=4 6546 B15R0.3221 C#CCCCCCCSC(C)CC(=O)OC 62a_100012276617_100009817358 [0,1,0,0,0,0|1,0,2]=4 6547 B15R0.3221 C#CCCCCCOC[C@H](O)CC(=O)OC 34a_100000766912_100000754131 [0,1,0,0,0,0|1,0,2]=4 6548 B15R0.3221 C#CCCCCCOC[C@H](O)CC(=O)OC 7a_100000766912_100000754131 [0,1,0,0,0,0|1,0,2]=4 6549 B15R0.3221 C#CCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100012094781 [0,1,0,0,0,0|1,0,2]=4 6550 B15R0.3221 C#CCCCCCSC[C@H](O)CC(=O)OC 62a_100012094781_100000754131 [0,1,0,0,0,0|1,0,2]=4 6551 B15R0.3221 C=CCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100012355270 [0,1,0,0,0,0|0,0,3]=4 6552 B15R0.3221 C=CCCCCCCCC(=O)CC(=O)OC 1458a_100011216160_100000747449 [0,1,0,0,0,0|0,0,3]=4 6553 B15R0.3221 C=CCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100012355270 [0,1,0,0,0,0|1,0,2]=4 6554 B15R0.3221 C=CCCCCCCOC(C)CC(=O)OC 34a_200011216477_100009817358 [0,1,0,0,0,0|1,0,2]=4 6555 B15R0.3221 C=CCCCCCCOC(C)CC(=O)OC 7a_200011216477_100009817358 [0,1,0,0,0,0|1,0,2]=4 6556 B15R0.3221 C=CCCCCCCSC(C)CC(=O)OC 62a_100009817358_100011215473 [0,1,0,0,0,0|1,0,2]=4 6557 B15R0.3221 C=CCCCCCCSC(C)CC(=O)OC 62a_100011215473_100009817358 [0,1,0,0,0,0|1,0,2]=4 6558 B15R0.3221 C=CCCCCCOC[C@H](O)CC(=O)OC 34a_100011216702_100000754131 [0,1,0,0,0,0|1,0,2]=4 6559 B15R0.3221 C=CCCCCCOC[C@H](O)CC(=O)OC 7a_100011216702_100000754131 [0,1,0,0,0,0|1,0,2]=4 6560 B15R0.3221 C=CCCCCCSC[C@H](O)CC(=O)OC 62a_100000700193_100000754131 [0,1,0,0,0,0|1,0,2]=4 6561 B15R0.3221 C=CCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000700193 [0,1,0,0,0,0|1,0,2]=4 6562 B15R0.3221 CC/C=C/CCCOC[C@H](O)CC(=O)OC 34a_100016287902_100000754131 [0,1,0,0,0,0|1,0,2]=4 6563 B15R0.3221 CC/C=C/CCCOC[C@H](O)CC(=O)OC 7a_100016287902_100000754131 [0,1,0,0,0,0|1,0,2]=4 6564 B15R0.3221 CC/C=C\CCCCOC(C)CC(=O)OC 34a_100016287862_100009817358 [0,1,0,0,0,0|1,0,2]=4 6565 B15R0.3221 CC/C=C\CCCCOC(C)CC(=O)OC 7a_100016287862_100009817358 [0,1,0,0,0,0|1,0,2]=4 6566 B15R0.3221 CCCC#CCCOC[C@H](O)CC(=O)OC 34a_100000042726_100000754131 [0,1,0,0,0,0|1,0,2]=4 6567 B15R0.3221 CCCC#CCCOC[C@H](O)CC(=O)OC 7a_100000042726_100000754131 [0,1,0,0,0,0|1,0,2]=4 6568 B15R0.3221 CCCC/C=C/COC[C@H](O)CC(=O)OC 34a_200016272032_100000754131 [0,1,0,0,0,0|1,0,2]=4 6569 B15R0.3221 CCCC/C=C/COC[C@H](O)CC(=O)OC 7a_200016272032_100000754131 [0,1,0,0,0,0|1,0,2]=4 6570 B15R0.3221 CCCC/C=C\CCOC(C)CC(=O)OC 34a_200016286491_100009817358 [0,1,0,0,0,0|1,0,2]=4 6571 B15R0.3221 CCCC/C=C\CCOC(C)CC(=O)OC 7a_200016286491_100009817358 [0,1,0,0,0,0|1,0,2]=4 6572 B15R0.3221 CCCCC#CCCCC(=O)CC(=O)OC 1458a_100000211351_200000047210 [0,1,0,0,0,0|0,0,3]=4 6573 B15R0.3221 CCCCC#CCCCN(C)CC(=O)OC 2230a_100000198492_200000047210 [0,1,0,0,0,0|1,0,2]=4 6574 B15R0.3221 CCCCC#CCCOC(C)CC(=O)OC 34a_100000037610_100009817358 [0,1,0,0,0,0|1,0,2]=4 6575 B15R0.3221 CCCCC#CCCOC(C)CC(=O)OC 7a_100000037610_100009817358 [0,1,0,0,0,0|1,0,2]=4 6576 B15R0.3221 CCCCC#CCOC[C@H](O)CC(=O)OC 34a_200000034558_100000754131 [0,1,0,0,0,0|1,0,2]=4 6577 B15R0.3221 CCCCC#CCOC[C@H](O)CC(=O)OC 7a_200000034558_100000754131 [0,1,0,0,0,0|1,0,2]=4 6578 B15R0.3221 CCCCC/C=C/CCC(=O)CC(=O)OC 1458a_200015255902_100000747449 [0,1,0,0,0,0|0,0,3]=4 6579 B15R0.3221 CCCCC/C=C/COC(C)CC(=O)OC 34a_100016258190_100009817358 [0,1,0,0,0,0|1,0,2]=4 6580 B15R0.3221 CCCCC/C=C/COC(C)CC(=O)OC 7a_100016258190_100009817358 [0,1,0,0,0,0|1,0,2]=4 6581 B15R0.3221 CCCCCC#CCOC(C)CC(=O)OC 34a_200000033628_100009817358 [0,1,0,0,0,0|1,0,2]=4 6582 B15R0.3221 CCCCCC#CCOC(C)CC(=O)OC 7a_200000033628_100009817358 [0,1,0,0,0,0|1,0,2]=4 6583 B15R0.3221 CCCCCC#CCSC(C)CC(=O)OC 62a_100009816472_100009817358 [0,1,0,0,0,0|1,0,2]=4 6584 B15R0.3221 CCCCCC#CCSC(C)CC(=O)OC 62a_100009817358_100009816472 [0,1,0,0,0,0|1,0,2]=4 6585 B15R0.3221 CCCCCC/C=C/CC(=O)CC(=O)OC 1458a_100020681715_100000747449 [0,1,0,0,0,0|0,0,3]=4 6586 B15R0.3221 CCCCCCCC=CC(=O)CC(=O)OC 1458a_200015332781_100000747449 [0,1,0,0,0,0|0,0,3]=4 6587 B15R0.3221 CCCCCCCCCC(=O)CC(=O)CC 1458a_100000210558_100000747405 [0,1,0,0,0,0|1,0,1]=3 6588 B15R0.3221 CCCCCCCCCC(=O)CC(=O)NC 1458a_100000210558_100000183359 [0,1,0,0,0,0|1,0,1]=3 6589 B15R0.3221 CCCCCCCCCC(=O)CC(=O)OC 1458a_100000210558_100000747449 [0,1,0,0,0,0|0,0,1]=2 6590 B15R0.3221 CCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210670 [0,1,0,0,0,0|0,0,1]=2 6591 B15R0.3221 CCCCCCCCCC(O)CC(=O)NC 1626a_100102657272_200012339438 [0,1,0,0,0,0|1,0,0]=2 6592 B15R0.3221 CCCCCCCCCC(O)CC(=O)NC 240690a_100102657272_200012339438 [0,1,0,0,0,0|1,0,0]=2 6593 B15R0.3221 CCCCCCCCCN(C)CC(=O)CC 269982a_100000232482_100000747405 [0,1,0,0,0,0|2,0,0]=3 6594 B15R0.3221 CCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100011214924 [0,1,0,0,0,0|2,0,0]=3 6595 B15R0.3221 CCCCCCCCCN(C)CC(=O)NC 2230a_100000232482_100000183359 [0,1,0,0,0,0|2,0,0]=3 6596 B15R0.3221 CCCCCCCCCN(C)CC(=O)NC 269982a_100000232482_100000183359 [0,1,0,0,0,0|2,0,0]=3 6597 B15R0.3221 CCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011214924 [0,1,0,0,0,0|1,0,0]=2 6598 B15R0.3221 CCCCCCCCCN(C)CC(=O)OC 2230a_100000232482_100000747449 [0,1,0,0,0,0|1,0,0]=2 6599 B15R0.3221 CCCCCCCCCN(C)CC(=O)OC 269982a_100000232482_100000747449 [0,1,0,0,0,0|1,0,0]=2 6600 B15R0.3221 CCCCCCCCNC(=O)CC(=O)OC 240690a_100000229939_100000211351 [0,1,0,0,0,0|1,0,1]=3 6601 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC 2230a_100000229939_100009817358 [0,1,0,0,0,0|1,0,0]=2 6602 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC 34a_100000229939_100009817358 [0,1,0,0,0,0|1,0,0]=2 6603 B15R0.3221 CCCCCCCCOC(C)CC(=O)OC 34a_100000210232_100009817358 [0,1,0,0,0,0|1,0,0]=2 6604 B15R0.3221 CCCCCCCCOC(C)CC(=O)OC 7a_100000210232_100009817358 [0,1,0,0,0,0|1,0,0]=2 6605 B15R0.3221 CCCCCCCCSC(C)CC(=O)OC 62a_100000210759_100009817358 [0,1,0,0,0,0|1,0,0]=2 6606 B15R0.3221 CCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210317 [0,1,0,0,0,0|1,0,0]=2 6607 B15R0.3221 CCCCCCCOC[C@H](O)CC(=O)OC 34a_100000210272_100000754131 [0,1,0,0,0,0|1,0,0]=2 6608 B15R0.3221 CCCCCCCOC[C@H](O)CC(=O)OC 7a_100000210272_100000754131 [0,1,0,0,0,0|1,0,0]=2 6609 B15R0.3221 CCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210316 [0,1,0,0,0,0|1,0,1]=3 6610 B15R0.3221 CCCCCCCSCC(=O)CC(=O)OC 62a_100000210614_100000210525 [0,1,0,0,0,0|1,0,1]=3 6611 B15R0.3221 CCCCCCCSCC(=O)NC(=O)OC 62a_100000210614_100000010850 [0,1,0,0,0,0|2,0,1]=4 6612 B15R0.3221 CCCCCCCSC[C@H](O)CC(=O)OC 62a_100000210614_100000754131 [0,1,0,0,0,0|1,0,0]=2 6613 B15R0.3221 CCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210316 [0,1,0,0,0,0|1,0,0]=2 6614 B15R0.3221 CCCCCNCCOC(C)CC(=O)OC 34a_100000224656_100009817358 [0,1,0,0,0,0|2,0,0]=3 6615 B15R0.3221 CCCCCOCCOC(C)CC(=O)OC 34a_100011215259_100009817358 [0,1,0,0,0,0|2,0,0]=3 6616 B15R0.3221 CCCCCOCCOC(C)CC(=O)OC 7a_100011215259_100009817358 [0,1,0,0,0,0|2,0,0]=3 6617 B15R0.3221 CCCCOCCCNC(=O)CC(=O)OC 240690a_200000211371_100000211351 [0,1,0,0,0,0|2,0,1]=4 6618 B15R0.3221 CCCCOCCCNC(C)CC(=O)OC 2230a_200000211371_100009817358 [0,1,0,0,0,0|2,0,0]=3 6619 B15R0.3221 CCCCOCCCNC(C)CC(=O)OC 34a_200000211371_100009817358 [0,1,0,0,0,0|2,0,0]=3 6620 B15R0.3221 CCCCOCCCOC(C)CC(=O)OC 34a_200011215613_100009817358 [0,1,0,0,0,0|2,0,0]=3 6621 B15R0.3221 CCCCOCCCOC(C)CC(=O)OC 7a_200011215613_100009817358 [0,1,0,0,0,0|2,0,0]=3 6622 B15R0.3221 CCCCOCCOCC(=O)CC(=O)OC 1458a_100011216887_100000747449 [0,1,0,0,0,0|2,0,1]=4 6623 B15R0.3221 CCCCOCCOC[C@H](O)CC(=O)OC 34a_100000210238_100000754131 [0,1,0,0,0,0|2,0,0]=3 6624 B15R0.3221 CCCCOCCOC[C@H](O)CC(=O)OC 7a_100000210238_100000754131 [0,1,0,0,0,0|2,0,0]=3 6625 B15R0.3221 CCCCOCCSCC(=O)CC(=O)OC 62a_100000210525_100000743108 [0,1,0,0,0,0|2,0,1]=4 6626 B15R0.3221 CCCCOCCSCC(=O)CC(=O)OC 62a_100000743108_100000210525 [0,1,0,0,0,0|2,0,1]=4 6627 B15R0.3221 CCCCOCCSC[C@H](O)CC(=O)OC 62a_100000743108_100000754131 [0,1,0,0,0,0|2,0,0]=3 6628 B15R0.3221 CCCCOCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000743108 [0,1,0,0,0,0|2,0,0]=3 6629 B15R0.3221 CCCCSCCOC[C@H](O)CC(=O)OC 34a_200000230436_100000754131 [0,1,0,0,0,0|2,0,0]=3 6630 B15R0.3221 CCCCSCCOC[C@H](O)CC(=O)OC 7a_200000230436_100000754131 [0,1,0,0,0,0|2,0,0]=3 6631 B15R0.3221 CCCOCCCNC[C@H](O)CC(=O)OC 34a_100011217757_100000754131 [0,1,0,0,0,0|2,0,0]=3 6632 B15R0.3221 CCOCCOCCNC(C)CC(=O)OC 2230a_100102712874_100009817358 [0,1,0,0,0,0|3,0,0]=4 6633 B15R0.3221 CCOCCOCCNC(C)CC(=O)OC 34a_100102712874_100009817358 [0,1,0,0,0,0|3,0,0]=4 6634 B15R0.3221 CCOCCOCCOC(C)CC(=O)OC 34a_100000210240_100009817358 [0,1,0,0,0,0|3,0,0]=4 6635 B15R0.3221 CCOCCOCCOC(C)CC(=O)OC 7a_100000210240_100009817358 [0,1,0,0,0,0|3,0,0]=4 6636 B15R0.3221 CCOCCOCCSC(C)CC(=O)OC 62a_100009817358_100011211534 [0,1,0,0,0,0|3,0,0]=4 6637 B15R0.3221 CCOCCOCCSC(C)CC(=O)OC 62a_100011211534_100009817358 [0,1,0,0,0,0|3,0,0]=4 6638 B15R0.3221 CNC(=O)CN(C)CCCCCCCCO 2230a_100000189611_100000033203 [0,1,0,0,0,0|3,0,0]=4 6639 B15R0.3221 CNCCCCCOC[C@H](O)CC(=O)OC 34a_100000722520_100000754131 [0,1,0,0,0,0|2,0,0]=3 6640 B15R0.3221 CNCCOCCOC[C@H](O)CC(=O)OC 34a_100000228057_100000754131 [0,1,0,0,0,0|3,0,0]=4 6641 B15R0.3221 COC(=O)CC(=O)CCCCCCCCO 1458a_100000211351_100000033203 [0,1,0,0,0,0|1,0,1]=3 6642 B15R0.3221 COC(=O)CC(=O)CSCCCCCCF 62a_100000210525_100015922095 [0,1,0,0,0,0|2,0,1]=4 6643 B15R0.3221 COC(=O)CC(=O)CSCCCCCCF 62a_100015922095_100000210525 [0,1,0,0,0,0|2,0,1]=4 6644 B15R0.3221 COC(=O)CC(=O)CSCCCCCCO 62a_100000210525_100000766143 [0,1,0,0,0,0|2,0,1]=4 6645 B15R0.3221 COC(=O)CC(=O)CSCCCCCCO 62a_100000766143_100000210525 [0,1,0,0,0,0|2,0,1]=4 6646 B15R0.3221 COC(=O)CC(=O)NCCCCCCCO 240690a_100011996573_100000211351 [0,1,0,0,0,0|2,0,1]=4 6647 B15R0.3221 COC(=O)CC(C)NCCCCCCCO 2230a_100011996573_100009817358 [0,1,0,0,0,0|2,0,0]=3 6648 B15R0.3221 COC(=O)CC(C)NCCCCCCCO 34a_100011996573_100009817358 [0,1,0,0,0,0|2,0,0]=3 6649 B15R0.3221 COC(=O)CC(C)NCCCOCCCO 2230a_100011310245_100009817358 [0,1,0,0,0,0|3,0,0]=4 6650 B15R0.3221 COC(=O)CC(C)NCCCOCCCO 34a_100011310245_100009817358 [0,1,0,0,0,0|3,0,0]=4 6651 B15R0.3221 COC(=O)CC(C)OCCCCCCCBr 34a_100000760002_100009817358 [0,1,0,0,0,0|2,0,0]=3 6652 B15R0.3221 COC(=O)CC(C)OCCCCCCCBr 7a_100000760002_100009817358 [0,1,0,0,0,0|2,0,0]=3 6653 B15R0.3221 COC(=O)CC(C)OCCCCCCCN 34a_100011996573_100009817358 [0,1,0,0,0,0|2,0,0]=3 6654 B15R0.3221 COC(=O)CC(C)OCCCOCCCN 34a_100011310245_100009817358 [0,1,0,0,0,0|3,0,0]=4 6655 B15R0.3221 COC(=O)CC(C)SCCCCCCC#N 62a_100009813337_100009817358 [0,1,0,0,0,0|2,0,1]=4 6656 B15R0.3221 COC(=O)CC(C)SCCCCCCC#N 62a_100009817358_100009813337 [0,1,0,0,0,0|2,0,1]=4 6657 B15R0.3221 COC(=O)CC(C)SCCCCCCCO 62a_100000760002_100009817358 [0,1,0,0,0,0|2,0,0]=3 6658 B15R0.3221 COC(=O)CC(C)SCCCCCCCO 62a_100009817358_100000760002 [0,1,0,0,0,0|2,0,0]=3 6659 B15R0.3221 COC(=O)CN(C)CCCCCCCCO 2230a_100000198492_100000033203 [0,1,0,0,0,0|2,0,0]=3 6660 B15R0.3221 COC(=O)C[C@@H](O)CNCCCCCCO 34a_100000686447_100000754131 [0,1,0,0,0,0|2,0,0]=3 6661 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCBr 34a_100011215345_100000754131 [0,1,0,0,0,0|2,0,0]=3 6662 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCBr 7a_100011215345_100000754131 [0,1,0,0,0,0|2,0,0]=3 6663 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCCl 34a_100000766143_100000754131 [0,1,0,0,0,0|2,0,0]=3 6664 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCCl 7a_100000766143_100000754131 [0,1,0,0,0,0|2,0,0]=3 6665 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCF 34a_100000732779_100000754131 [0,1,0,0,0,0|2,0,0]=3 6666 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCF 7a_100000732779_100000754131 [0,1,0,0,0,0|2,0,0]=3 6667 B15R0.3221 COC(=O)C[C@@H](O)COCCCCCCN 34a_100000686447_100000754131 [0,1,0,0,0,0|2,0,0]=3 6668 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCC#N 62a_100000754131_100009813376 [0,1,0,0,0,0|2,0,1]=4 6669 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCC#N 62a_100009813376_100000754131 [0,1,0,0,0,0|2,0,1]=4 6670 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCC=O 62a_100000139337_100000754131 [0,1,0,0,0,0|2,0,1]=4 6671 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCC=O 62a_100000754131_100000139337 [0,1,0,0,0,0|2,0,1]=4 6672 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCCF 62a_100000754131_100015922095 [0,1,0,0,0,0|2,0,0]=3 6673 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCCF 62a_100015922095_100000754131 [0,1,0,0,0,0|2,0,0]=3 6674 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCCO 62a_100000754131_100000766143 [0,1,0,0,0,0|2,0,0]=3 6675 B15R0.3221 COC(=O)C[C@@H](O)CSCCCCCCO 62a_100000766143_100000754131 [0,1,0,0,0,0|2,0,0]=3 6676 B15R0.3221 COCCCCCCOC(C)CC(=O)OC 34a_200012092642_100009817358 [0,1,0,0,0,0|2,0,0]=3 6677 B15R0.3221 COCCCCCCOC(C)CC(=O)OC 7a_200012092642_100009817358 [0,1,0,0,0,0|2,0,0]=3 6678 B15R0.3221 COCCCCCCSC(C)CC(=O)OC 62a_100009817358_100011998445 [0,1,0,0,0,0|2,0,0]=3 6679 B15R0.3221 COCCCCCCSC(C)CC(=O)OC 62a_100011998445_100009817358 [0,1,0,0,0,0|2,0,0]=3 6680 B15R0.3221 COCCCCCNC[C@H](O)CC(=O)OC 34a_100000747528_100000754131 [0,1,0,0,0,0|2,0,0]=3 6681 B15R0.3221 COCCOCCCNC(C)CC(=O)OC 2230a_100000206027_100009817358 [0,1,0,0,0,0|3,0,0]=4 6682 B15R0.3221 COCCOCCCNC(C)CC(=O)OC 34a_100000206027_100009817358 [0,1,0,0,0,0|3,0,0]=4 6683 B15R0.3221 COCCOCCCSC(C)CC(=O)OC 62a_100009817358_100011216529 [0,1,0,0,0,0|3,0,0]=4 6684 B15R0.3221 COCCOCCCSC(C)CC(=O)OC 62a_100011216529_100009817358 [0,1,0,0,0,0|3,0,0]=4 6685 B15R0.3221 COCCOCCNC[C@H](O)CC(=O)OC 34a_100000745349_100000754131 [0,1,0,0,0,0|3,0,0]=4 6686 B15R0.3221 COCCOCCOC[C@H](O)CC(=O)OC 34a_100011215163_100000754131 [0,1,0,0,0,0|3,0,0]=4 6687 B15R0.3221 COCCOCCOC[C@H](O)CC(=O)OC 7a_100011215163_100000754131 [0,1,0,0,0,0|3,0,0]=4 6688 B15R0.3221 COCCOCCSC[C@H](O)CC(=O)OC 62a_100000695917_100000754131 [0,1,0,0,0,0|3,0,0]=4 6689 B15R0.3221 COCCOCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000695917 [0,1,0,0,0,0|3,0,0]=4 6690 B15R1.12 C=C1CCC(CC1)COCCCCCC 34a_100000074039_100000210314 [0,0,0,1,0,0|3,0,0]=4 6691 B15R1.12 C=C1CCC(CC1)NCCCCCCC 270004a_100000229938_100010272673 [0,0,0,1,0,0|3,0,0]=4 6692 B15R1.12 C=C1CCN(CC1)CCCCCCCC 2230a_100000752442_100000210759 [0,0,0,1,0,0|3,0,0]=4 6693 B15R1.12 C=C1CCN(CC1)CCCCCCCC 269982a_100000752442_100000210759 [0,0,0,1,0,0|3,0,0]=4 6694 B15R1.12 C=C1CCN(CC1)CCCCCCCC 34a_100000752442_100000210759 [0,0,0,1,0,0|3,0,0]=4 6695 B15R1.12 CCCCCCCCN1CC=C(CC1)C 2230a_100000693516_100000210759 [0,0,0,1,0,0|3,0,0]=4 6696 B15R1.12 CCCCCCCCN1CC=C(CC1)C 269982a_100000693516_100000210759 [0,0,0,1,0,0|3,0,0]=4 6697 B15R1.12 CCCCCCCCN1CC=C(CC1)C 34a_100000693516_100000210759 [0,0,0,1,0,0|3,0,0]=4 6698 B15R1.12 CCCCCCCCN1CCS(=O)CC1 2230a_100000752083_100000210759 [0,0,0,1,0,0|3,0,0]=4 6699 B15R1.12 CCCCCCCCN1CCS(=O)CC1 269982a_100000752083_100000210759 [0,0,0,1,0,0|3,0,0]=4 6700 B15R1.12 CCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210681 [0,0,0,1,0,0|2,0,0]=3 6701 B15R1.12 CCCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210614 [0,0,0,1,0,0|2,0,0]=3 6702 B15R1.12 CCCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210614 [0,0,0,1,0,0|2,0,0]=3 6703 B15R1.12 CCCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210614 [0,0,0,1,0,0|2,0,0]=3 6704 B15R1.12 CCCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210614 [0,0,0,1,0,0|2,0,0]=3 6705 B15R1.12 CCCCCCCOC1CNC(=O)NC1 34a_100000080929_100000210614 [0,0,0,1,0,0|3,0,0]=4 6706 B15R1.12 CCCCCCOCC1CCC(=O)CC1 34a_100000062911_100000210314 [0,0,0,1,0,0|2,0,0]=3 6707 B15R1.12 CCCCOCCNC1CCC(=O)NC1 2230a_100000748762_100000743108 [0,0,0,1,0,0|3,0,0]=4 6708 B15R1.12 CCCCOCCNC1CCC(=O)NC1 34a_100000748762_100000743108 [0,0,0,1,0,0|3,0,0]=4 6709 B15R1.12 CCCCOCCOC1CCC(=O)CC1 34a_100000764474_100000743108 [0,0,0,1,0,0|3,0,0]=4 6710 B15R1.12 CCCCOCCOC1CCC(=O)CC1 7a_100000764474_100000743108 [0,0,0,1,0,0|3,0,0]=4 6711 B15R1.12 CCCCOCCOC1CCC(=O)NC1 34a_100000079199_100000743108 [0,0,0,1,0,0|3,0,0]=4 6712 B15R1.12 CCCCOCOCC1CCC(=O)CC1 34a_100000062911_100011995733 [0,0,0,1,0,0|3,0,0]=4 6713 B15R1.12 CCCOCCOCC1CCC(=O)CC1 34a_100000062911_100011215938 [0,0,0,1,0,0|3,0,0]=4 6714 B15R1.12 CCOCCCOCC1CCC(=O)CC1 34a_100000062911_100012232248 [0,0,0,1,0,0|3,0,0]=4 6715 B15R1.12 COCCCCOCC1CCC(=O)CC1 34a_100000062911_100000755781 [0,0,0,1,0,0|3,0,0]=4 6716 B15R1.12 O=C1CCC(CC1)COCCCCCF 34a_100000062911_100000729378 [0,0,0,1,0,0|3,0,0]=4 6717 B15R1.12 O=C1CCC(CC1)COCCCCCO 34a_100000062911_100000746330 [0,0,0,1,0,0|3,0,0]=4 6718 B15R1.12 O=C1CCC(CC1)OCCCCCCF 34a_100000764474_100015922095 [0,0,0,1,0,0|3,0,0]=4 6719 B15R1.12 O=C1CCC(CC1)OCCCCCCF 7a_100000764474_100015922095 [0,0,0,1,0,0|3,0,0]=4 6720 B15R1.12 O=C1CCC(CC1)OCCCCCCO 34a_100000764474_100000766143 [0,0,0,1,0,0|3,0,0]=4 6721 B15R1.12 O=C1CCC(CC1)OCCCCCCO 7a_100000764474_100000766143 [0,0,0,1,0,0|3,0,0]=4 6722 B15R1.12 O=C1CCC(CN1)NCCCCCCF 2230a_100000748762_100015922095 [0,0,0,1,0,0|3,0,0]=4 6723 B15R1.12 O=C1CCC(CN1)NCCCCCCF 34a_100000748762_100015922095 [0,0,0,1,0,0|3,0,0]=4 6724 B15R1.12 O=C1CCC(CN1)NCCCCCCO 2230a_100000748762_100000766143 [0,0,0,1,0,0|3,0,0]=4 6725 B15R1.12 O=C1CCC(CN1)NCCCCCCO 34a_100000748762_100000766143 [0,0,0,1,0,0|3,0,0]=4 6726 B15R1.12 O=C1CCC(CN1)OCCCCCCF 34a_100000079199_100015922095 [0,0,0,1,0,0|3,0,0]=4 6727 B15R1.12 O=C1CCC(CN1)OCCCCCCO 34a_100000079199_100000766143 [0,0,0,1,0,0|3,0,0]=4 6728 B15R1.22 CCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100000210681 [0,0,0,1,0,0|3,0,0]=4 6729 B15R1.22 CCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210681 [0,0,0,1,0,0|3,0,0]=4 6730 B15R1.22 CCCCCCCN1CCNC(=O)C1C 34a_100000750721_100000210614 [0,0,0,1,0,0|3,0,0]=4 6731 B15R1.22 CCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210326 [0,0,0,1,0,0|2,0,0]=3 6732 B15R1.22 CCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000718602 [0,0,0,1,0,0|2,0,0]=3 6733 B15R1.22 CCOCCNCC1CCCC(=O)N1C 2230a_200010383782_100011215890 [0,0,0,1,0,0|3,0,0]=4 6734 B15R1.22 CCOCCNCC1CCCC(=O)N1C 34a_200010383782_100000210147 [0,0,0,1,0,0|3,0,0]=4 6735 B15R1.22 CCSCCNCC1CCCC(=O)N1C 2230a_200010383782_100000757381 [0,0,0,1,0,0|3,0,0]=4 6736 B15R1.22 CCSCCNCC1CCCC(=O)N1C 34a_200010383782_100000757381 [0,0,0,1,0,0|3,0,0]=4 6737 B15R1.22 CN1C(=O)CCCC1CNCCCCF 2230a_200010383782_100000729493 [0,0,0,1,0,0|3,0,0]=4 6738 B15R1.22 CN1C(=O)CCCC1CNCCCCF 34a_200010383782_100000729493 [0,0,0,1,0,0|3,0,0]=4 6739 B15R1.22 CN1C(=O)CCCC1CNCCCCO 2230a_200010383782_100000210776 [0,0,0,1,0,0|3,0,0]=4 6740 B15R1.22 CN1C(=O)CCCC1CNCCCCO 34a_200010383782_100011216708 [0,0,0,1,0,0|3,0,0]=4 6741 B15R1.22 COCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000740836 [0,0,0,1,0,0|3,0,0]=4 6742 B15R1.22 COCCCNCC1CCCC(=O)N1C 34a_200010383782_100000740836 [0,0,0,1,0,0|3,0,0]=4 6743 B15R1.34 CCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100011214924 [0,0,0,1,0,0|2,0,0]=3 6744 B15R1.34 CCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210759 [0,0,0,1,0,0|2,0,0]=3 6745 B15R1.34 CCCCCCCCNC1COC(=O)O1 34a_100000229939_100000032252 [0,0,0,1,0,0|2,0,0]=3 6746 B15R1.34 CCCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210759 [0,0,0,1,0,0|2,0,0]=3 6747 B15R1.34 CCCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210759 [0,0,0,1,0,0|2,0,0]=3 6748 B15R1.34 CCCCCCCCOC1COC(=O)O1 34a_100000210232_100000032252 [0,0,0,1,0,0|2,0,0]=3 6749 B15R1.34 CCCCCCCCSC1COC(=O)O1 62a_100000210759_100000032252 [0,0,0,1,0,0|2,0,0]=3 6750 B15R1.34 CCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210681 [0,0,0,1,0,0|2,0,0]=3 6751 B15R1.34 CCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210614 [0,0,0,1,0,0|2,0,0]=3 6752 B15R1.34 CCCCCCCNCC1CNC(=O)O1 2230a_100000229938_100000181169 [0,0,0,1,0,0|3,0,0]=4 6753 B15R1.34 CCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000229938_100015189358 [0,0,0,1,0,0|3,0,0]=4 6754 B15R1.34 CCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210681 [0,0,0,1,0,0|3,0,0]=4 6755 B15R1.34 CCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210614 [0,0,0,1,0,0|3,0,0]=4 6756 B15R1.34 CCCCCCCNC[C@H]1COC(=O)N1 2230a_100000229938_100015307671 [0,0,0,1,0,0|2,0,0]=3 6757 B15R1.34 CCCCCCCOCC1=CC(=O)OC1 34a_100000210272_100000716558 [0,0,0,1,0,0|1,0,2]=4 6758 B15R1.34 CCCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210614 [0,0,0,1,0,0|3,0,0]=4 6759 B15R1.34 CCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210614 [0,0,0,1,0,0|2,0,0]=3 6760 B15R1.34 CCCCCCCOCC1CNC(=O)O1 34a_100000210272_100000181169 [0,0,0,1,0,0|3,0,0]=4 6761 B15R1.34 CCCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210614 [0,0,0,1,0,0|3,0,0]=4 6762 B15R1.34 CCCCCCCOCC1CNC(=O)O1 7a_100000210272_100000181169 [0,0,0,1,0,0|3,0,0]=4 6763 B15R1.34 CCCCCCCOCC1COC(=O)O1 34a_100000210272_100000073702 [0,0,0,1,0,0|2,0,0]=3 6764 B15R1.34 CCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210272_100015189358 [0,0,0,1,0,0|3,0,0]=4 6765 B15R1.34 CCCCCCCOC[C@H]1COC(=O)N1 34a_100000210272_100015307671 [0,0,0,1,0,0|2,0,0]=3 6766 B15R1.34 CCCCCCCOC[C@H]1COC(=O)N1 7a_100000210272_100015307671 [0,0,0,1,0,0|2,0,0]=3 6767 B15R1.34 CCCCCCCSCC1=CC(=O)OC1 62a_100000210614_100000716558 [0,0,0,1,0,0|1,0,2]=4 6768 B15R1.34 CCCCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210316 [0,0,0,1,0,0|1,0,2]=4 6769 B15R1.34 CCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210316 [0,0,0,1,0,0|3,0,0]=4 6770 B15R1.34 CCCCCCCSCC1CNC(=O)O1 62a_100000210614_100000181169 [0,0,0,1,0,0|3,0,0]=4 6771 B15R1.34 CCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210316 [0,0,0,1,0,0|2,0,0]=3 6772 B15R1.34 CCCCCCCSCC1COC(=O)O1 62a_100000210614_100000073702 [0,0,0,1,0,0|2,0,0]=3 6773 B15R1.34 CCCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210614_100015189358 [0,0,0,1,0,0|3,0,0]=4 6774 B15R1.34 CCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210316 [0,0,0,1,0,0|3,0,0]=4 6775 B15R1.34 CCCCCCCSC[C@H]1COC(=O)N1 62a_100000210614_100015307671 [0,0,0,1,0,0|2,0,0]=3 6776 B15R1.34 CCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210316 [0,0,0,1,0,0|2,0,0]=3 6777 B15R1.34 CCCCCCOCCC1COS(=O)O1 7a_100000210259_100009840081 [0,0,0,1,0,0|3,0,0]=4 6778 B15R1.34 CCCCCCSCCC1COS(=O)O1 62a_100000210314_100009840081 [0,0,0,1,0,0|3,0,0]=4 6779 B15R1.34 CCCCCNCCOC1COC(=O)O1 34a_100000224656_100000032252 [0,0,0,1,0,0|3,0,0]=4 6780 B15R1.34 CCCCCOCCOC1COC(=O)O1 34a_100011215259_100000032252 [0,0,0,1,0,0|3,0,0]=4 6781 B15R1.34 CCCCOCCCNC1COC(=O)O1 34a_200000211371_100000032252 [0,0,0,1,0,0|3,0,0]=4 6782 B15R1.34 CCCCOCCCOC1COC(=O)O1 34a_200011215613_100000032252 [0,0,0,1,0,0|3,0,0]=4 6783 B15R1.34 CCCCOCCNCC1CNC(=O)C1 2230a_100016993742_100000743108 [0,0,0,1,0,0|3,0,0]=4 6784 B15R1.34 CCCCOCCNCC1CNC(=O)C1 34a_100016993742_100000743108 [0,0,0,1,0,0|3,0,0]=4 6785 B15R1.34 CCCCOCCOCC1CNC(=O)C1 34a_100016041077_100000743108 [0,0,0,1,0,0|3,0,0]=4 6786 B15R1.34 CCCCOCCOCC1COC(=O)O1 34a_100000210238_100000073702 [0,0,0,1,0,0|3,0,0]=4 6787 B15R1.34 CCCCOCCOC[C@H]1COC(=O)N1 34a_100000210238_100015307671 [0,0,0,1,0,0|3,0,0]=4 6788 B15R1.34 CCCCOCCOC[C@H]1COC(=O)N1 7a_100000210238_100015307671 [0,0,0,1,0,0|3,0,0]=4 6789 B15R1.34 CCCCOCCSCC1COC(=O)O1 62a_100000073702_100000743108 [0,0,0,1,0,0|3,0,0]=4 6790 B15R1.34 CCCCOCCSCC1COC(=O)O1 62a_100000743108_100000073702 [0,0,0,1,0,0|3,0,0]=4 6791 B15R1.34 CCCCOCCSC[C@H]1COC(=O)N1 62a_100000743108_100015307671 [0,0,0,1,0,0|3,0,0]=4 6792 B15R1.34 CCCCOCCSC[C@H]1COC(=O)N1 62a_100015307671_100000743108 [0,0,0,1,0,0|3,0,0]=4 6793 B15R1.34 CCCCSCCNC[C@H]1COC(=O)N1 2230a_100025743550_100015307671 [0,0,0,1,0,0|3,0,0]=4 6794 B15R1.34 CCCCSCCOCC1COC(=O)O1 34a_200000230436_100000073702 [0,0,0,1,0,0|3,0,0]=4 6795 B15R1.34 CCCCSCCOC[C@H]1COC(=O)N1 34a_200000230436_100015307671 [0,0,0,1,0,0|3,0,0]=4 6796 B15R1.34 CCCCSCCOC[C@H]1COC(=O)N1 7a_200000230436_100015307671 [0,0,0,1,0,0|3,0,0]=4 6797 B15R1.34 CCCOCCCNCC1COC(=O)O1 34a_100011217757_100000073702 [0,0,0,1,0,0|3,0,0]=4 6798 B15R1.34 CCCOCCCNC[C@H]1COC(=O)N1 2230a_100011217757_100015307671 [0,0,0,1,0,0|3,0,0]=4 6799 B15R1.34 CCCOCCCNC[C@H]1COC(=O)N1 34a_100011217757_100015307671 [0,0,0,1,0,0|3,0,0]=4 6800 B15R1.34 CNCCCCCOCC1COC(=O)O1 34a_100000722520_100000073702 [0,0,0,1,0,0|3,0,0]=4 6801 B15R1.34 CNCCCCCOC[C@H]1COC(=O)N1 34a_100000722520_100015307671 [0,0,0,1,0,0|3,0,0]=4 6802 B15R1.34 COCCCCCCNC1CNC(=O)C1 2230a_100000697751_100011998445 [0,0,0,1,0,0|3,0,0]=4 6803 B15R1.34 COCCCCCCOC1CCC(=O)C1 34a_100012614533_100011998445 [0,0,0,1,0,0|3,0,0]=4 6804 B15R1.34 COCCCCCCOC1CNC(=O)C1 34a_100000690082_100011998445 [0,0,0,1,0,0|3,0,0]=4 6805 B15R1.34 COCCCCCCOC1COC(=O)O1 34a_200012092642_100000032252 [0,0,0,1,0,0|3,0,0]=4 6806 B15R1.34 COCCCCCCSC1COC(=O)O1 62a_100011998445_100000032252 [0,0,0,1,0,0|3,0,0]=4 6807 B15R1.34 COCCCCCNCC1COC(=O)O1 34a_100000747528_100000073702 [0,0,0,1,0,0|3,0,0]=4 6808 B15R1.34 COCCCCCNC[C@H]1COC(=O)N1 2230a_100000747528_100015307671 [0,0,0,1,0,0|3,0,0]=4 6809 B15R1.34 COCCCCCNC[C@H]1COC(=O)N1 34a_100000747528_100015307671 [0,0,0,1,0,0|3,0,0]=4 6810 B15R1.34 NCCCCCCCOC1COC(=O)O1 34a_100011996573_100000032252 [0,0,0,1,0,0|3,0,0]=4 6811 B15R1.34 NCCCCCCOCC1COC(=O)O1 34a_100000686447_100000073702 [0,0,0,1,0,0|3,0,0]=4 6812 B15R1.34 NCCCCCCOC[C@H]1COC(=O)N1 34a_100000686447_100015307671 [0,0,0,1,0,0|3,0,0]=4 6813 B15R1.34 O=C1CC(CN1)CNCCCCCCF 2230a_100016993742_100015922095 [0,0,0,1,0,0|3,0,0]=4 6814 B15R1.34 O=C1CC(CN1)CNCCCCCCF 34a_100016993742_100015922095 [0,0,0,1,0,0|3,0,0]=4 6815 B15R1.34 O=C1CC(CN1)CNCCCCCCO 2230a_100016993742_100000766143 [0,0,0,1,0,0|3,0,0]=4 6816 B15R1.34 O=C1CC(CN1)CNCCCCCCO 34a_100016993742_100000766143 [0,0,0,1,0,0|3,0,0]=4 6817 B15R1.34 O=C1CC(CN1)COCCCCCCF 34a_100016041077_100015922095 [0,0,0,1,0,0|3,0,0]=4 6818 B15R1.34 O=C1CC(CN1)COCCCCCCO 34a_100016041077_100000766143 [0,0,0,1,0,0|3,0,0]=4 6819 B15R1.34 O=C1CC(CN1)NCCCCCCCO 2230a_100000697751_100000760002 [0,0,0,1,0,0|3,0,0]=4 6820 B15R1.34 O=C1CC(CN1)OCCCCCCCO 34a_100000690082_100000760002 [0,0,0,1,0,0|3,0,0]=4 6821 B15R1.34 O=C1CCC(C1)OCCCCCCCO 34a_100012614533_100000760002 [0,0,0,1,0,0|3,0,0]=4 6822 B15R1.34 O=C1CN(CN1)CCCCCCCCO 2230a_200000708111_100000033203 [0,0,0,1,0,0|3,0,0]=4 6823 B15R1.34 O=C1N[C@H](CO1)CNCCCCCCO 2230a_100000686447_100015307671 [0,0,0,1,0,0|3,0,0]=4 6824 B15R1.34 O=C1N[C@H](CO1)CNCCCCCCO 34a_100000686447_100015307671 [0,0,0,1,0,0|3,0,0]=4 6825 B15R1.34 O=C1N[C@H](CO1)COCCCCCCBr 34a_100011215345_100015307671 [0,0,0,1,0,0|3,0,0]=4 6826 B15R1.34 O=C1N[C@H](CO1)COCCCCCCBr 7a_100011215345_100015307671 [0,0,0,1,0,0|3,0,0]=4 6827 B15R1.34 O=C1N[C@H](CO1)COCCCCCCCl 34a_100000766143_100015307671 [0,0,0,1,0,0|3,0,0]=4 6828 B15R1.34 O=C1N[C@H](CO1)COCCCCCCCl 7a_100000766143_100015307671 [0,0,0,1,0,0|3,0,0]=4 6829 B15R1.34 O=C1N[C@H](CO1)COCCCCCCF 34a_100000732779_100015307671 [0,0,0,1,0,0|3,0,0]=4 6830 B15R1.34 O=C1N[C@H](CO1)COCCCCCCF 7a_100000732779_100015307671 [0,0,0,1,0,0|3,0,0]=4 6831 B15R1.34 O=C1N[C@H](CO1)CSCCCCCCF 62a_100015307671_100015922095 [0,0,0,1,0,0|3,0,0]=4 6832 B15R1.34 O=C1N[C@H](CO1)CSCCCCCCF 62a_100015922095_100015307671 [0,0,0,1,0,0|3,0,0]=4 6833 B15R1.34 O=C1N[C@H](CO1)CSCCCCCCO 62a_100000766143_100015307671 [0,0,0,1,0,0|3,0,0]=4 6834 B15R1.34 O=C1N[C@H](CO1)CSCCCCCCO 62a_100015307671_100000766143 [0,0,0,1,0,0|3,0,0]=4 6835 B15R1.34 O=C1OCC(O1)CNCCCCCCO 34a_100000686447_100000073702 [0,0,0,1,0,0|3,0,0]=4 6836 B15R1.34 O=C1OCC(O1)COCCCCCCBr 34a_100011215345_100000073702 [0,0,0,1,0,0|3,0,0]=4 6837 B15R1.34 O=C1OCC(O1)COCCCCCCCl 34a_100000766143_100000073702 [0,0,0,1,0,0|3,0,0]=4 6838 B15R1.34 O=C1OCC(O1)COCCCCCCF 34a_100000732779_100000073702 [0,0,0,1,0,0|3,0,0]=4 6839 B15R1.34 O=C1OCC(O1)CSCCCCCCF 62a_100000073702_100015922095 [0,0,0,1,0,0|3,0,0]=4 6840 B15R1.34 O=C1OCC(O1)CSCCCCCCF 62a_100015922095_100000073702 [0,0,0,1,0,0|3,0,0]=4 6841 B15R1.34 O=C1OCC(O1)CSCCCCCCO 62a_100000073702_100000766143 [0,0,0,1,0,0|3,0,0]=4 6842 B15R1.34 O=C1OCC(O1)CSCCCCCCO 62a_100000766143_100000073702 [0,0,0,1,0,0|3,0,0]=4 6843 B15R1.34 O=C1OCC(O1)NCCCCCCCO 34a_100011996573_100000032252 [0,0,0,1,0,0|3,0,0]=4 6844 B15R1.34 O=C1OCC(O1)OCCCCCCCBr 34a_100000760002_100000032252 [0,0,0,1,0,0|3,0,0]=4 6845 B15R1.34 O=C1OCC(O1)SCCCCCCCO 62a_100000760002_100000032252 [0,0,0,1,0,0|3,0,0]=4 6846 B15R1.85 C#CC1CCCCN1CCCC(=O)OC 2230a_200020621307_100011218270 [0,0,0,1,0,0|1,0,2]=4 6847 B15R1.85 C#CC1CCCCN1CCCC(=O)OC 269982a_200020621307_100011218270 [0,0,0,1,0,0|1,0,2]=4 6848 B15R1.85 C#CC1CCCCN1CCCC(=O)OC 34a_200020621307_100000742333 [0,0,0,1,0,0|1,0,2]=4 6849 B15R1.85 CCC(=O)COCC1CCCCN1CC 7a_100000225091_100000747405 [0,0,0,1,0,0|3,0,0]=4 6850 B15R1.85 CCC(=O)NCCN1CCCCC1CC 11a_100000755458_100000210414 [0,0,0,1,0,0|3,0,0]=4 6851 B15R1.85 CCC(=O)NCCN1CCCCC1CC 1626a_100000755458_100000210414 [0,0,0,1,0,0|3,0,0]=4 6852 B15R1.85 CCC(=O)NCCN1CCCCC1CC 240690a_100000755458_100000210414 [0,0,0,1,0,0|3,0,0]=4 6853 B15R1.85 CCC(=O)NCCN1CCCCC1CC 527a_100000755458_100000210414 [0,0,0,1,0,0|3,0,0]=4 6854 B15R1.85 CCC1CCCCC1NCCC(=O)NC 269862a_100000738227_100000757040 [0,0,0,1,0,0|2,0,0]=3 6855 B15R1.85 CCC1CCCCC1NCCC(=O)NC 270004a_100000738227_100000757040 [0,0,0,1,0,0|2,0,0]=3 6856 B15R1.85 CCC1CCCCC1OCCC(=O)NC 34a_100000210738_100012179268 [0,0,0,1,0,0|2,0,0]=3 6857 B15R1.85 CCC1CCCCC1OCCC(=O)NC 7a_100000210738_100000737683 [0,0,0,1,0,0|2,0,0]=3 6858 B15R1.85 CCC1CCCCC1OCCC(=O)OC 34a_100000210738_100000742370 [0,0,0,1,0,0|1,0,0]=2 6859 B15R1.85 CCC1CCCCC1OCCC(=O)OC 7a_100000210738_100000204255 [0,0,0,1,0,0|1,0,0]=2 6860 B15R1.85 CCC1CCCCN1C/C=C/C(=O)OC 2230a_100000210034_100000742655 [0,0,0,1,0,0|1,0,2]=4 6861 B15R1.85 CCC1CCCCN1C/C=C/C(=O)OC 269982a_100000210034_100000742655 [0,0,0,1,0,0|1,0,2]=4 6862 B15R1.85 CCC1CCCCN1C/C=C/C(=O)OC 34a_100000210034_100000742655 [0,0,0,1,0,0|1,0,2]=4 6863 B15R1.85 CCC1CCCCN1CCCC(=O)NC 2230a_100000210034_100000741757 [0,0,0,1,0,0|2,0,0]=3 6864 B15R1.85 CCC1CCCCN1CCCC(=O)NC 269982a_100000210034_100000741757 [0,0,0,1,0,0|2,0,0]=3 6865 B15R1.85 CCC1CCCCN1CCCC(=O)NC 34a_100000210034_100000741757 [0,0,0,1,0,0|2,0,0]=3 6866 B15R1.85 CCC1CCCCN1CCCC(=O)OC 2230a_100000210034_100011218270 [0,0,0,1,0,0|1,0,0]=2 6867 B15R1.85 CCC1CCCCN1CCCC(=O)OC 269982a_100000210034_100011218270 [0,0,0,1,0,0|1,0,0]=2 6868 B15R1.85 CCC1CCCCN1CCCC(=O)OC 34a_100000210034_100000742333 [0,0,0,1,0,0|1,0,0]=2 6869 B15R1.85 CCC1CCCCN1CCNC(=O)NC 2708a_100000755458_106832991635 [0,0,0,1,0,0|3,0,0]=4 6870 B15R1.85 CCC1CCCCN1CCNC(=O)NC 2708a_100102657272_100000755458 [0,0,0,1,0,0|3,0,0]=4 6871 B15R1.85 CCC1CCCCN1CCNC(=O)NC 273464a_100000755458_100102657272 [0,0,0,1,0,0|3,0,0]=4 6872 B15R1.85 CCC1CCCCN1CCNC(=O)NC 273464a_100102657272_100000755458 [0,0,0,1,0,0|3,0,0]=4 6873 B15R1.85 CCC1CCCCN1CCNC(=O)NC 512a_100000755458_100102657272 [0,0,0,1,0,0|3,0,0]=4 6874 B15R1.85 CCC1CCCCN1CCNC(=O)NC 512a_106832991638_100000755458 [0,0,0,1,0,0|3,0,0]=4 6875 B15R1.85 CCC1CCCCN1CCOC(=O)NC 269982a_100000210034_200011997002 [0,0,0,1,0,0|3,0,0]=4 6876 B15R1.85 CCC1CCCCN1CCOC(=O)NC 34a_100000210034_200011997002 [0,0,0,1,0,0|3,0,0]=4 6877 B15R1.85 CCN1CCCCC1CNCC(=O)NC 2230a_100000754393_100000183359 [0,0,0,1,0,0|3,0,0]=4 6878 B15R1.85 CCN1CCCCC1CNCC(=O)NC 34a_100000754393_100000183359 [0,0,0,1,0,0|3,0,0]=4 6879 B15R1.85 CCN1CCCCC1CNCC(=O)OC 2230a_100000754393_100000747449 [0,0,0,1,0,0|2,0,0]=3 6880 B15R1.85 CCN1CCCCC1CNCC(=O)OC 34a_100000754393_100000747449 [0,0,0,1,0,0|2,0,0]=3 6881 B15R1.85 CCN1CCCCC1COCC(=O)NC 34a_100000225091_100000183359 [0,0,0,1,0,0|3,0,0]=4 6882 B15R1.85 CCN1CCCCC1COCC(=O)NC 7a_100000225091_100000183359 [0,0,0,1,0,0|3,0,0]=4 6883 B15R1.85 CCN1CCCCC1COCC(=O)OC 34a_100000225091_100000747449 [0,0,0,1,0,0|2,0,0]=3 6884 B15R1.85 CCN1CCCCC1COCC(=O)OC 7a_100000225091_100000747449 [0,0,0,1,0,0|2,0,0]=3 6885 B15R1.85 CC[C@H]1COCCN1CCCC(=O)NC 2230a_100016988097_100000741757 [0,0,0,1,0,0|3,0,0]=4 6886 B15R1.85 CC[C@H]1COCCN1CCCC(=O)NC 269982a_100016988097_100000741757 [0,0,0,1,0,0|3,0,0]=4 6887 B15R1.85 CC[C@H]1COCCN1CCCC(=O)NC 34a_100016988097_100000741757 [0,0,0,1,0,0|3,0,0]=4 6888 B15R1.85 CC[C@H]1COCCN1CCCC(=O)OC 2230a_100016988097_100011218270 [0,0,0,1,0,0|2,0,0]=3 6889 B15R1.85 CC[C@H]1COCCN1CCCC(=O)OC 269982a_100016988097_100011218270 [0,0,0,1,0,0|2,0,0]=3 6890 B15R1.85 CC[C@H]1COCCN1CCCC(=O)OC 34a_100016988097_100000742333 [0,0,0,1,0,0|2,0,0]=3 6891 B15R1.85 CNC(=O)CCCN1CCCCC1CO 2230a_100000210821_100000741757 [0,0,0,1,0,0|3,0,0]=4 6892 B15R1.85 CNC(=O)CCCN1CCCCC1CO 269982a_100000210821_100000741757 [0,0,0,1,0,0|3,0,0]=4 6893 B15R1.85 CNC(=O)CCCN1CCCCC1CO 34a_100000210821_100000741757 [0,0,0,1,0,0|3,0,0]=4 6894 B15R1.85 CNC(=O)CCNC1CCCCC1CO 270004a_100000738227_100009861125 [0,0,0,1,0,0|3,0,0]=4 6895 B15R1.85 CNC(=O)CCNC1CCCCC1OC 270004a_100000738227_100000740605 [0,0,0,1,0,0|3,0,0]=4 6896 B15R1.85 CNC(=O)CCNC1CCCCC1OC 34a_100011208099_100012179268 [0,0,0,1,0,0|3,0,0]=4 6897 B15R1.85 CNC(=O)CCOC1CCCCC1CN 34a_100011216029_100012179268 [0,0,0,1,0,0|3,0,0]=4 6898 B15R1.85 CNC(=O)CCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100012179268 [0,0,0,1,0,0|3,0,0]=4 6899 B15R1.85 CNC(=O)CCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100012179268 [0,0,0,1,0,0|3,0,0]=4 6900 B15R1.85 CNC(=O)CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000737683 [0,0,0,1,0,0|3,0,0]=4 6901 B15R1.85 CN[C@@H]1CCCC[C@H]1OCCC(=O)OC 34a_100000708425_100000742370 [0,0,0,1,0,0|2,0,0]=3 6902 B15R1.85 COC(=O)CCCN1CCCCC1C#N 34a_100016989756_100000742333 [0,0,0,1,0,0|2,0,1]=4 6903 B15R1.85 COC(=O)CCCN1CCCCC1CO 2230a_100000210821_100011218270 [0,0,0,1,0,0|2,0,0]=3 6904 B15R1.85 COC(=O)CCCN1CCCCC1CO 269982a_100000210821_100011218270 [0,0,0,1,0,0|2,0,0]=3 6905 B15R1.85 COC(=O)CCCN1CCCCC1CO 34a_100000210821_100000742333 [0,0,0,1,0,0|2,0,0]=3 6906 B15R1.85 COC(=O)CCCN1CCOC[C@H]1CO 2230a_100000717676_100011218270 [0,0,0,1,0,0|3,0,0]=4 6907 B15R1.85 COC(=O)CCCN1CCOC[C@H]1CO 269982a_100000717676_100011218270 [0,0,0,1,0,0|3,0,0]=4 6908 B15R1.85 COC(=O)CCCN1CCOC[C@H]1CO 34a_100000717676_100000742333 [0,0,0,1,0,0|3,0,0]=4 6909 B15R1.85 COC(=O)CCNC1CCCCC1OC 34a_100011208099_100000742370 [0,0,0,1,0,0|2,0,0]=3 6910 B15R1.85 COC(=O)CCNC1CCOCC1CO 2230a_214813039666_100000204255 [0,0,0,1,0,0|3,0,0]=4 6911 B15R1.85 COC(=O)CCNC1CCOCC1CO 34a_214813039666_100000742370 [0,0,0,1,0,0|3,0,0]=4 6912 B15R1.85 COC(=O)CCOC1CCCCC1CN 34a_100011216029_100000742370 [0,0,0,1,0,0|2,0,0]=3 6913 B15R1.85 COC(=O)CCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000742370 [0,0,0,1,0,0|2,0,0]=3 6914 B15R1.85 COC(=O)CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000204255 [0,0,0,1,0,0|2,0,0]=3 6915 B15R1.229 CCCCCCCCCCCN1CCC1 269982a_100000754969_100011215454 [0,0,0,1,0,0|3,0,0]=4 6916 B15R1.229 CCCCCCCCCNCC1CCO1 2230a_100000212291_100000103362 [0,0,0,1,0,0|2,0,1]=4 6917 B15R1.229 CCCCCCCCCNCC1CCO1 34a_100000212291_100000103362 [0,0,0,1,0,0|2,0,1]=4 6918 B15R1.229 CCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011214924 [0,0,0,1,0,0|2,0,1]=4 6919 B15R1.229 CCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100011214924 [0,0,0,1,0,0|2,0,1]=4 6920 B15R1.229 CCCCCCCCCOCC1CCO1 34a_100000039022_100011214924 [0,0,0,1,0,0|2,0,1]=4 6921 B15R1.229 CCCCCCCCCOCC1CCO1 34a_100000210712_100000103362 [0,0,0,1,0,0|2,0,1]=4 6922 B15R1.229 CCCCCCCCCOCC1CCO1 7a_100000210712_100000103362 [0,0,0,1,0,0|2,0,1]=4 6923 B15R1.229 CCCCCCCCCSCC1CCO1 62a_100000103362_100000210670 [0,0,0,1,0,0|2,0,1]=4 6924 B15R1.251 C#CCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100010269958 [0,0,0,1,0,0|1,0,2]=4 6925 B15R1.251 C#CCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100010269958 [0,0,0,1,0,0|1,0,2]=4 6926 B15R1.251 C#CCCCOC1CCCC1C(=O)OC 34a_200000081814_100000695029 [0,0,0,1,0,0|1,0,2]=4 6927 B15R1.251 C#CCCCOC1CCCC1C(=O)OC 7a_200000081814_100011215417 [0,0,0,1,0,0|1,0,2]=4 6928 B15R1.251 C=CCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011215482 [0,0,0,1,0,0|1,0,2]=4 6929 B15R1.251 C=CCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011215482 [0,0,0,1,0,0|1,0,2]=4 6930 B15R1.251 C=CCCCOC1CCCC1C(=O)OC 34a_200000081814_100000757094 [0,0,0,1,0,0|1,0,2]=4 6931 B15R1.251 C=CCCCOC1CCCC1C(=O)OC 7a_200000081814_100000757094 [0,0,0,1,0,0|1,0,2]=4 6932 B15R1.251 CC/C=C\CCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100015370543 [0,0,0,1,0,0|1,0,2]=4 6933 B15R1.251 CC/C=C\CCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100015370543 [0,0,0,1,0,0|1,0,2]=4 6934 B15R1.251 CC/C=C\COC1CCCC1C(=O)OC 34a_200000081814_100103147603 [0,0,0,1,0,0|1,0,2]=4 6935 B15R1.251 CC/C=C\COC1CCCC1C(=O)OC 7a_200000081814_100103147603 [0,0,0,1,0,0|1,0,2]=4 6936 B15R1.251 CCC#CCOC1CCCC1C(=O)OC 34a_200000081814_100009813939 [0,0,0,1,0,0|1,0,2]=4 6937 B15R1.251 CCC#CCOC1CCCC1C(=O)OC 7a_200000081814_100009813939 [0,0,0,1,0,0|1,0,2]=4 6938 B15R1.251 CCCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210314 [0,0,0,1,0,0|2,0,0]=3 6939 B15R1.251 CCCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210757 [0,0,0,1,0,0|2,0,0]=3 6940 B15R1.251 CCCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000210314 [0,0,0,1,0,0|2,0,0]=3 6941 B15R1.251 CCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210314 [0,0,0,1,0,0|1,0,0]=2 6942 B15R1.251 CCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210757 [0,0,0,1,0,0|1,0,0]=2 6943 B15R1.251 CCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210314 [0,0,0,1,0,0|2,0,0]=3 6944 B15R1.251 CCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210757 [0,0,0,1,0,0|2,0,0]=3 6945 B15R1.251 CCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210757 [0,0,0,1,0,0|2,0,0]=3 6946 B15R1.251 CCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000718602 [0,0,0,1,0,0|1,0,0]=2 6947 B15R1.251 CCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210326 [0,0,0,1,0,0|1,0,0]=2 6948 B15R1.251 CCCCNN=C1CCCC1C(=O)OC 4a_100025702795_100000685950 [0,0,0,1,0,0|2,0,1]=4 6949 B15R1.251 CCCCOCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100011995733 [0,0,0,1,0,0|3,0,0]=4 6950 B15R1.251 CCCCOCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100011995733 [0,0,0,1,0,0|3,0,0]=4 6951 B15R1.251 CCCCOCN1CCC[C@H]1C(=O)NC 34a_100015185040_100011995733 [0,0,0,1,0,0|3,0,0]=4 6952 B15R1.251 CCCCOCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011995733 [0,0,0,1,0,0|2,0,0]=3 6953 B15R1.251 CCCCOCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011995733 [0,0,0,1,0,0|2,0,0]=3 6954 B15R1.251 CCCCOCN1CCSC1C(=O)OC 2230a_100015296106_100011995733 [0,0,0,1,0,0|3,0,0]=4 6955 B15R1.251 CCCCOCN1CCSC1C(=O)OC 269982a_100015296106_100011995733 [0,0,0,1,0,0|3,0,0]=4 6956 B15R1.251 CCCCOCN1CSCC1C(=O)OC 269982a_200000724679_100011995733 [0,0,0,1,0,0|3,0,0]=4 6957 B15R1.251 CCCOCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100011215938 [0,0,0,1,0,0|3,0,0]=4 6958 B15R1.251 CCCOCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100011215938 [0,0,0,1,0,0|3,0,0]=4 6959 B15R1.251 CCCOCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100011215938 [0,0,0,1,0,0|3,0,0]=4 6960 B15R1.251 CCCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011215938 [0,0,0,1,0,0|2,0,0]=3 6961 B15R1.251 CCCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011215938 [0,0,0,1,0,0|2,0,0]=3 6962 B15R1.251 CCCOCCN1CCSC1C(=O)OC 2230a_100015296106_100011215938 [0,0,0,1,0,0|3,0,0]=4 6963 B15R1.251 CCCOCCN1CCSC1C(=O)OC 269982a_100015296106_100011215938 [0,0,0,1,0,0|3,0,0]=4 6964 B15R1.251 CCCOCCN1CSCC1C(=O)OC 269982a_200000724679_100011215938 [0,0,0,1,0,0|3,0,0]=4 6965 B15R1.251 CCOCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100012232248 [0,0,0,1,0,0|3,0,0]=4 6966 B15R1.251 CCOCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100012232248 [0,0,0,1,0,0|3,0,0]=4 6967 B15R1.251 CCOCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100012232248 [0,0,0,1,0,0|3,0,0]=4 6968 B15R1.251 CCOCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100012232248 [0,0,0,1,0,0|2,0,0]=3 6969 B15R1.251 CCOCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100012232248 [0,0,0,1,0,0|2,0,0]=3 6970 B15R1.251 CCOCCCN1CCSC1C(=O)OC 2230a_100015296106_100012232248 [0,0,0,1,0,0|3,0,0]=4 6971 B15R1.251 CCOCCCN1CCSC1C(=O)OC 269982a_100015296106_100012232248 [0,0,0,1,0,0|3,0,0]=4 6972 B15R1.251 CCOCCCN1CSCC1C(=O)OC 269982a_200000724679_100012232248 [0,0,0,1,0,0|3,0,0]=4 6973 B15R1.251 CCOCCOC1CCCC1C(=O)OC 34a_200000081814_100000210147 [0,0,0,1,0,0|2,0,0]=3 6974 B15R1.251 CCOCCOC1CCCC1C(=O)OC 7a_200000081814_100011215890 [0,0,0,1,0,0|2,0,0]=3 6975 B15R1.251 CCSCCOC1CCCC1C(=O)OC 34a_200000081814_100000757381 [0,0,0,1,0,0|2,0,0]=3 6976 B15R1.251 CCSCCOC1CCCC1C(=O)OC 7a_200000081814_100000757381 [0,0,0,1,0,0|2,0,0]=3 6977 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCCF 2230a_100015185040_100000729378 [0,0,0,1,0,0|3,0,0]=4 6978 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCCF 269982a_100015185040_100000729378 [0,0,0,1,0,0|3,0,0]=4 6979 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCCF 34a_100015185040_100000729378 [0,0,0,1,0,0|3,0,0]=4 6980 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCCO 2230a_100015185040_100000746330 [0,0,0,1,0,0|3,0,0]=4 6981 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCCO 269982a_100015185040_100000746330 [0,0,0,1,0,0|3,0,0]=4 6982 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCCO 34a_100015185040_100000746330 [0,0,0,1,0,0|3,0,0]=4 6983 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCOC 2230a_100015185040_100000730899 [0,0,0,1,0,0|3,0,0]=4 6984 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCOC 269982a_100015185040_100000730899 [0,0,0,1,0,0|3,0,0]=4 6985 B15R1.251 CNC(=O)[C@@H]1CCCN1CCCCOC 34a_100015185040_100000755781 [0,0,0,1,0,0|3,0,0]=4 6986 B15R1.251 COC(=O)C1CCCC1OCCCC#N 7a_200000081814_100000687738 [0,0,0,1,0,0|2,0,1]=4 6987 B15R1.251 COC(=O)C1CCCC1OCCCC=O 7a_200000081814_200011292268 [0,0,0,1,0,0|2,0,1]=4 6988 B15R1.251 COC(=O)C1CCCC1OCCCCF 34a_200000081814_100000729493 [0,0,0,1,0,0|2,0,0]=3 6989 B15R1.251 COC(=O)C1CCCC1OCCCCF 7a_200000081814_100000729493 [0,0,0,1,0,0|2,0,0]=3 6990 B15R1.251 COC(=O)C1CCCC1OCCCCO 34a_200000081814_100011216708 [0,0,0,1,0,0|2,0,0]=3 6991 B15R1.251 COC(=O)C1CCCC1OCCCCO 7a_200000081814_100000210776 [0,0,0,1,0,0|2,0,0]=3 6992 B15R1.251 COC(=O)C1CSCN1CCCCCF 269982a_200000724679_100000729378 [0,0,0,1,0,0|3,0,0]=4 6993 B15R1.251 COC(=O)C1CSCN1CCCCCO 269982a_200000724679_100000746330 [0,0,0,1,0,0|3,0,0]=4 6994 B15R1.251 COC(=O)C1SCCN1CCCCCF 2230a_100015296106_100000729378 [0,0,0,1,0,0|3,0,0]=4 6995 B15R1.251 COC(=O)C1SCCN1CCCCCF 269982a_100015296106_100000729378 [0,0,0,1,0,0|3,0,0]=4 6996 B15R1.251 COC(=O)C1SCCN1CCCCCO 2230a_100015296106_100000746330 [0,0,0,1,0,0|3,0,0]=4 6997 B15R1.251 COC(=O)C1SCCN1CCCCCO 269982a_100015296106_100000746330 [0,0,0,1,0,0|3,0,0]=4 6998 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCC#N 2230a_100000752040_100000211819 [0,0,0,1,0,0|2,0,1]=4 6999 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCC#N 269982a_100000752040_100011219923 [0,0,0,1,0,0|2,0,1]=4 7000 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCC=O 2230a_100000752040_100000139335 [0,0,0,1,0,0|2,0,1]=4 7001 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCC=O 269982a_100000752040_100000139335 [0,0,0,1,0,0|2,0,1]=4 7002 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCCF 2230a_100000752040_100000729378 [0,0,0,1,0,0|2,0,0]=3 7003 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCCF 269982a_100000752040_100000729378 [0,0,0,1,0,0|2,0,0]=3 7004 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCCO 2230a_100000752040_100000746330 [0,0,0,1,0,0|2,0,0]=3 7005 B15R1.251 COC(=O)[C@@H]1CCCN1CCCCCO 269982a_100000752040_100000746330 [0,0,0,1,0,0|2,0,0]=3 7006 B15R1.251 COC(=O)[C@@H]1CCCN1CCOCCO 2230a_100000752040_100011215305 [0,0,0,1,0,0|3,0,0]=4 7007 B15R1.251 COC(=O)[C@@H]1CCCN1CCOCCO 269982a_100000752040_100011215305 [0,0,0,1,0,0|3,0,0]=4 7008 B15R1.251 COCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000730899 [0,0,0,1,0,0|2,0,0]=3 7009 B15R1.251 COCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000730899 [0,0,0,1,0,0|2,0,0]=3 7010 B15R1.251 COCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000730899 [0,0,0,1,0,0|3,0,0]=4 7011 B15R1.251 COCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000730899 [0,0,0,1,0,0|3,0,0]=4 7012 B15R1.251 COCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000730899 [0,0,0,1,0,0|3,0,0]=4 7013 B15R1.251 COCCCOC1CCCC1C(=O)OC 34a_200000081814_100000740836 [0,0,0,1,0,0|2,0,0]=3 7014 B15R1.251 COCCCOC1CCCC1C(=O)OC 7a_200000081814_100000740836 [0,0,0,1,0,0|2,0,0]=3 7015 B15R1.251 COCCOCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000231047 [0,0,0,1,0,0|3,0,0]=4 7016 B15R1.251 COCCOCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000231047 [0,0,0,1,0,0|3,0,0]=4 7017 B15R1.273 CCCC1CCCCC1NCC(=O)NC 269862a_100000693194_100011218038 [0,0,0,1,0,0|2,0,0]=3 7018 B15R1.273 CCCC1CCCCC1NCC(=O)NC 270004a_100000693194_100011218038 [0,0,0,1,0,0|2,0,0]=3 7019 B15R1.273 CCCC1CCCCC1NC[C@@H](C)OC 269862a_100020591295_100011218038 [0,0,0,1,0,0|2,0,1]=4 7020 B15R1.273 CCCC1CCCCC1NC[C@@H](C)OC 270004a_100020591295_100011218038 [0,0,0,1,0,0|2,0,1]=4 7021 B15R1.273 CCCC1CCCCC1OCC(=O)CC 7a_100011217265_100000747405 [0,0,0,1,0,0|2,0,0]=3 7022 B15R1.273 CCCC1CCCCC1OCC(=O)NC 34a_100011217265_100000183359 [0,0,0,1,0,0|2,0,0]=3 7023 B15R1.273 CCCC1CCCCC1OCC(=O)NC 7a_100011217265_100000183359 [0,0,0,1,0,0|2,0,0]=3 7024 B15R1.273 CCCC1CCCCC1OCC(=O)OC 34a_100011217265_100000747449 [0,0,0,1,0,0|1,0,0]=2 7025 B15R1.273 CCCC1CCCCC1OCC(=O)OC 7a_100011217265_100000747449 [0,0,0,1,0,0|1,0,0]=2 7026 B15R1.273 CCCC1CCCCN1CCC(=O)NC 2230a_100000701414_100000737683 [0,0,0,1,0,0|2,0,0]=3 7027 B15R1.273 CCCC1CCCCN1CCC(=O)NC 269982a_100000701414_100000737683 [0,0,0,1,0,0|2,0,0]=3 7028 B15R1.273 CCCC1CCCCN1CCC(=O)NC 34a_100000701414_100012179268 [0,0,0,1,0,0|2,0,0]=3 7029 B15R1.273 CCCC1CCCCN1CCC(=O)OC 2230a_100000701414_100000204255 [0,0,0,1,0,0|1,0,0]=2 7030 B15R1.273 CCCC1CCCCN1CCC(=O)OC 269982a_100000701414_100000204255 [0,0,0,1,0,0|1,0,0]=2 7031 B15R1.273 CCCC1CCCCN1CCC(=O)OC 34a_100000701414_100000742370 [0,0,0,1,0,0|1,0,0]=2 7032 B15R1.273 CCCC1COCCN1CCC(=O)NC 2230a_102495339903_100000737683 [0,0,0,1,0,0|3,0,0]=4 7033 B15R1.273 CCCC1COCCN1CCC(=O)NC 269982a_102495339903_100000737683 [0,0,0,1,0,0|3,0,0]=4 7034 B15R1.273 CCCC1COCCN1CCC(=O)NC 34a_102495339903_100012179268 [0,0,0,1,0,0|3,0,0]=4 7035 B15R1.273 CCCC1COCCN1CCC(=O)OC 2230a_102495339903_100000204255 [0,0,0,1,0,0|2,0,0]=3 7036 B15R1.273 CCCC1COCCN1CCC(=O)OC 269982a_102495339903_100000204255 [0,0,0,1,0,0|2,0,0]=3 7037 B15R1.273 CCCC1COCCN1CCC(=O)OC 34a_102495339903_100000742370 [0,0,0,1,0,0|2,0,0]=3 7038 B15R1.273 CCOC1CCCCC1NCC(=O)NC 270004a_100000693194_200000031474 [0,0,0,1,0,0|3,0,0]=4 7039 B15R1.273 CNC(=O)CCN1CCCCC1CCO 2230a_100000211664_100000737683 [0,0,0,1,0,0|3,0,0]=4 7040 B15R1.273 CNC(=O)CCN1CCCCC1CCO 269982a_100000211664_100000737683 [0,0,0,1,0,0|3,0,0]=4 7041 B15R1.273 CNC(=O)CCN1CCCCC1CCO 34a_100000211664_100012179268 [0,0,0,1,0,0|3,0,0]=4 7042 B15R1.273 CNC(=O)CCN1CCCCC1COC 2230a_100015184032_100000737683 [0,0,0,1,0,0|3,0,0]=4 7043 B15R1.273 CNC(=O)CCN1CCCCC1COC 269982a_100015184032_100000737683 [0,0,0,1,0,0|3,0,0]=4 7044 B15R1.273 CNC(=O)CCN1CCCCC1COC 34a_100015184032_100012179268 [0,0,0,1,0,0|3,0,0]=4 7045 B15R1.273 COC(=O)CCN1CCCCC1CC#N 2230a_100000133382_100000204255 [0,0,0,1,0,0|2,0,1]=4 7046 B15R1.273 COC(=O)CCN1CCCCC1CC#N 34a_100000133382_100000742370 [0,0,0,1,0,0|2,0,1]=4 7047 B15R1.273 COC(=O)CCN1CCCCC1CCO 2230a_100000211664_100000204255 [0,0,0,1,0,0|2,0,0]=3 7048 B15R1.273 COC(=O)CCN1CCCCC1CCO 269982a_100000211664_100000204255 [0,0,0,1,0,0|2,0,0]=3 7049 B15R1.273 COC(=O)CCN1CCCCC1CCO 34a_100000211664_100000742370 [0,0,0,1,0,0|2,0,0]=3 7050 B15R1.273 COCC1CCCCN1CCC(=O)OC 2230a_100015184032_100000204255 [0,0,0,1,0,0|2,0,0]=3 7051 B15R1.273 COCC1CCCCN1CCC(=O)OC 269982a_100015184032_100000204255 [0,0,0,1,0,0|2,0,0]=3 7052 B15R1.273 COCC1CCCCN1CCC(=O)OC 34a_100015184032_100000742370 [0,0,0,1,0,0|2,0,0]=3 7053 B15R1.273 COC[C@H]1COCCN1CCC(=O)OC 2230a_100016989928_100000204255 [0,0,0,1,0,0|3,0,0]=4 7054 B15R1.273 COC[C@H]1COCCN1CCC(=O)OC 269982a_100016989928_100000204255 [0,0,0,1,0,0|3,0,0]=4 7055 B15R1.273 COC[C@H]1COCCN1CCC(=O)OC 34a_100016989928_100000742370 [0,0,0,1,0,0|3,0,0]=4 7056 B15R1.605 CCCC1CCCC1NCCC(=O)NC 269862a_100000738227_100000723119 [0,0,0,1,0,0|2,0,0]=3 7057 B15R1.605 CCCC1CCCC1NCCC(=O)NC 270004a_100000738227_100000723119 [0,0,0,1,0,0|2,0,0]=3 7058 B15R1.605 CCCN1CCCC1COCC(=O)CC 7a_200000694710_100000747405 [0,0,0,1,0,0|3,0,0]=4 7059 B15R1.605 CCCN1CCCC1COCC(=O)NC 34a_200000694710_100000183359 [0,0,0,1,0,0|3,0,0]=4 7060 B15R1.605 CCCN1CCCC1COCC(=O)NC 7a_200000694710_100000183359 [0,0,0,1,0,0|3,0,0]=4 7061 B15R1.605 CCCN1CCCC1COCC(=O)OC 34a_200000694710_100000747449 [0,0,0,1,0,0|2,0,0]=3 7062 B15R1.605 CCCN1CCCC1COCC(=O)OC 7a_200000694710_100000747449 [0,0,0,1,0,0|2,0,0]=3 7063 B15R1.605 CNC(=O)CCCN1CCC[C@H]1COC 2230a_100020646714_100000741757 [0,0,0,1,0,0|3,0,0]=4 7064 B15R1.605 CNC(=O)CCCN1CCC[C@H]1COC 269982a_100020646714_100000741757 [0,0,0,1,0,0|3,0,0]=4 7065 B15R1.605 CNC(=O)CCCN1CCC[C@H]1COC 34a_100020646714_100000741757 [0,0,0,1,0,0|3,0,0]=4 7066 B15R1.605 COC[C@@H]1CCCN1CCCC(=O)OC 2230a_100020646714_100011218270 [0,0,0,1,0,0|2,0,0]=3 7067 B15R1.605 COC[C@@H]1CCCN1CCCC(=O)OC 269982a_100020646714_100011218270 [0,0,0,1,0,0|2,0,0]=3 7068 B15R1.605 COC[C@@H]1CCCN1CCCC(=O)OC 34a_100020646714_100000742333 [0,0,0,1,0,0|2,0,0]=3 7069 B15R1.851 CCNN=C1CCCCCC1C(=O)OC 4a_100000756455_100000183596 [0,0,0,1,0,0|2,0,1]=4 7070 B15R1.853 CCCCC1C=CCN1CCC(=O)OC 2230a_100015184376_100000204255 [0,0,0,1,0,0|1,0,2]=4 7071 B15R1.853 CCCCC1C=CCN1CCC(=O)OC 269982a_100015184376_100000204255 [0,0,0,1,0,0|1,0,2]=4 7072 B15R1.853 CCCCC1C=CCN1CCC(=O)OC 34a_100015184376_100000742370 [0,0,0,1,0,0|1,0,2]=4 7073 B15R1.853 CCCCC1CCCC1NCC(=O)NC 269862a_100000693194_100000750825 [0,0,0,1,0,0|2,0,0]=3 7074 B15R1.853 CCCCC1CCCC1NCC(=O)NC 270004a_100000693194_100000750825 [0,0,0,1,0,0|2,0,0]=3 7075 B15R1.853 CCCCC1CCCC1NC[C@@H](C)OC 269862a_100020591295_100000750825 [0,0,0,1,0,0|2,0,1]=4 7076 B15R1.853 CCCCC1CCCC1NC[C@@H](C)OC 270004a_100020591295_100000750825 [0,0,0,1,0,0|2,0,1]=4 7077 B15R1.962 CCC(=O)CCCCCN1CCCCC1 1458a_100012051570_100000210202 [0,0,0,1,0,0|2,0,0]=3 7078 B15R1.962 CCC(=O)CCCCCN1CCOCC1 1458a_100012051560_100000210202 [0,0,0,1,0,0|3,0,0]=4 7079 B15R1.962 CCC(=O)CCCCOC1CCCCO1 1458a_100000210414_100000031530 [0,0,0,1,0,0|3,0,0]=4 7080 B15R1.962 CCC(=O)COCCCC1CCCCC1 34a_100000725409_100011713725 [0,0,0,1,0,0|2,0,0]=3 7081 B15R1.962 CCC(=O)COCCCC1CCCCC1 7a_100000198086_100000747405 [0,0,0,1,0,0|2,0,0]=3 7082 B15R1.962 CCC(=O)COCCCN1CCCCC1 34a_100000725409_100000690320 [0,0,0,1,0,0|3,0,0]=4 7083 B15R1.962 CCC(=O)COCCOC1CCCCC1 34a_100000725409_100011211530 [0,0,0,1,0,0|3,0,0]=4 7084 B15R1.962 CCC(=O)COCCOC1CCCCC1 7a_100011249652_100000747405 [0,0,0,1,0,0|3,0,0]=4 7085 B15R1.962 CCC(=O)CSCCCC1CCCCC1 62a_100000747405_100011713725 [0,0,0,1,0,0|2,0,0]=3 7086 B15R1.962 CCC(=O)CSCCCC1CCCCC1 62a_100011713725_100000747405 [0,0,0,1,0,0|2,0,0]=3 7087 B15R1.962 CCC(=O)CSCCCN1CCCCC1 62a_100000747405_100000007876 [0,0,0,1,0,0|3,0,0]=4 7088 B15R1.962 CCC(=O)CSCCCN1CCCCC1 62a_100132302099_100000747405 [0,0,0,1,0,0|3,0,0]=4 7089 B15R1.962 CCC(=O)CSCCOC1CCCCC1 62a_100000747405_100011211530 [0,0,0,1,0,0|3,0,0]=4 7090 B15R1.962 CCC(=O)CSCCOC1CCCCC1 62a_100011211530_100000747405 [0,0,0,1,0,0|3,0,0]=4 7091 B15R1.962 CCC(=O)NCCCCN1CCCCC1 240690a_200011207366_100000210414 [0,0,0,1,0,0|3,0,0]=4 7092 B15R1.962 CCC(=O)NCCCOC1CCCCC1 11a_100000205933_100000210414 [0,0,0,1,0,0|3,0,0]=4 7093 B15R1.962 CCC(=O)NCCCOC1CCCCC1 1626a_100000205933_100000210414 [0,0,0,1,0,0|3,0,0]=4 7094 B15R1.962 CCC(=O)NCCCOC1CCCCC1 240690a_100000205933_100000210414 [0,0,0,1,0,0|3,0,0]=4 7095 B15R1.962 CCC(=O)NCCCOC1CCCCC1 527a_100000205933_100000210414 [0,0,0,1,0,0|3,0,0]=4 7096 B15R1.962 CCC(=O)NCCNCC1CCCCC1 269862a_100132302217_100000211278 [0,0,0,1,0,0|3,0,0]=4 7097 B15R1.962 CCC(=O)NCCNCC1CCCCC1 34a_100132302217_100000211423 [0,0,0,1,0,0|3,0,0]=4 7098 B15R1.962 CCC(=O)NCCOCC1CCCCC1 34a_200000158885_100000211423 [0,0,0,1,0,0|3,0,0]=4 7099 B15R1.962 CCC(=O)NCCOCC1CCCCC1 7a_200000158885_100000211423 [0,0,0,1,0,0|3,0,0]=4 7100 B15R1.962 CCC(=O)OCCOCC1CCCCC1 7a_200000031056_100000211423 [0,0,0,1,0,0|3,0,0]=4 7101 B15R1.962 CNC(=O)CCCCCN1CCCCC1 11a_106832991635_100012051570 [0,0,0,1,0,0|2,0,0]=3 7102 B15R1.962 CNC(=O)CCCCCN1CCCCC1 240690a_100102657272_100012051570 [0,0,0,1,0,0|2,0,0]=3 7103 B15R1.962 CNC(=O)CCCCCN1CCOCC1 11a_106832991635_100012051560 [0,0,0,1,0,0|3,0,0]=4 7104 B15R1.962 CNC(=O)CCCCCN1CCOCC1 240690a_100102657272_100012051560 [0,0,0,1,0,0|3,0,0]=4 7105 B15R1.962 CNC(=O)CCCNCC1CCCCC1 2230a_100000210473_100000741757 [0,0,0,1,0,0|2,0,0]=3 7106 B15R1.962 CNC(=O)CCCNCC1CCCCC1 2230a_100000740002_100000211423 [0,0,0,1,0,0|2,0,0]=3 7107 B15R1.962 CNC(=O)CCCNCC1CCCCC1 269862a_100000740002_100000211278 [0,0,0,1,0,0|2,0,0]=3 7108 B15R1.962 CNC(=O)CCCNCC1CCCCC1 34a_100000210473_100000741757 [0,0,0,1,0,0|2,0,0]=3 7109 B15R1.962 CNC(=O)CCCNCC1CCCCC1 34a_100000740002_100000211423 [0,0,0,1,0,0|2,0,0]=3 7110 B15R1.962 CNC(=O)CCCNCC1CCCCO1 2230a_100000174945_100000741757 [0,0,0,1,0,0|3,0,0]=4 7111 B15R1.962 CNC(=O)CCCNCC1CCCCO1 2230a_100000740002_100000211543 [0,0,0,1,0,0|3,0,0]=4 7112 B15R1.962 CNC(=O)CCCNCC1CCCCO1 34a_100000174945_100000741757 [0,0,0,1,0,0|3,0,0]=4 7113 B15R1.962 CNC(=O)CCCNCC1CCCCO1 34a_100000740002_100000211543 [0,0,0,1,0,0|3,0,0]=4 7114 B15R1.962 CNC(=O)CCCNCC1CCCOC1 2230a_100000720124_100000741757 [0,0,0,1,0,0|3,0,0]=4 7115 B15R1.962 CNC(=O)CCCNCC1CCCOC1 2230a_100000740002_100000741521 [0,0,0,1,0,0|3,0,0]=4 7116 B15R1.962 CNC(=O)CCCNCC1CCCOC1 34a_100000720124_100000741757 [0,0,0,1,0,0|3,0,0]=4 7117 B15R1.962 CNC(=O)CCCNCC1CCCOC1 34a_100000740002_100000741521 [0,0,0,1,0,0|3,0,0]=4 7118 B15R1.962 CNC(=O)CCCNCC1CCOCC1 2230a_100000740002_100000754603 [0,0,0,1,0,0|3,0,0]=4 7119 B15R1.962 CNC(=O)CCCNCC1CCOCC1 2230a_100000746373_100000741757 [0,0,0,1,0,0|3,0,0]=4 7120 B15R1.962 CNC(=O)CCCNCC1CCOCC1 269862a_100000740002_100000749017 [0,0,0,1,0,0|3,0,0]=4 7121 B15R1.962 CNC(=O)CCCNCC1CCOCC1 34a_100000740002_100000754603 [0,0,0,1,0,0|3,0,0]=4 7122 B15R1.962 CNC(=O)CCCNCC1CCOCC1 34a_100000746373_100000741757 [0,0,0,1,0,0|3,0,0]=4 7123 B15R1.962 CNC(=O)CCCNCC1CCSCC1 2230a_100015188806_100000741757 [0,0,0,1,0,0|3,0,0]=4 7124 B15R1.962 CNC(=O)CCCNCC1CCSCC1 269862a_100000740002_100000067145 [0,0,0,1,0,0|3,0,0]=4 7125 B15R1.962 CNC(=O)CCCNCC1CCSCC1 270004a_100000740002_100000067145 [0,0,0,1,0,0|3,0,0]=4 7126 B15R1.962 CNC(=O)CCCNCC1CCSCC1 34a_100015188806_100000741757 [0,0,0,1,0,0|3,0,0]=4 7127 B15R1.962 CNC(=O)CCCOCC1CCCCC1 34a_100000212181_100000741757 [0,0,0,1,0,0|2,0,0]=3 7128 B15R1.962 CNC(=O)CCCOCC1CCCCC1 7a_100000212181_100000741757 [0,0,0,1,0,0|2,0,0]=3 7129 B15R1.962 CNC(=O)CCCOCC1CCCCN1 34a_100000210821_100000741757 [0,0,0,1,0,0|3,0,0]=4 7130 B15R1.962 CNC(=O)CCCOCC1CCCCO1 34a_100000211370_100000741757 [0,0,0,1,0,0|3,0,0]=4 7131 B15R1.962 CNC(=O)CCCOCC1CCCCO1 7a_100000211370_100000741757 [0,0,0,1,0,0|3,0,0]=4 7132 B15R1.962 CNC(=O)CCCOCC1CCCNC1 34a_100000211344_100000741757 [0,0,0,1,0,0|3,0,0]=4 7133 B15R1.962 CNC(=O)CCCOCC1CCCOC1 34a_100000741520_100000741757 [0,0,0,1,0,0|3,0,0]=4 7134 B15R1.962 CNC(=O)CCCOCC1CCNCC1 34a_100000738675_100000741757 [0,0,0,1,0,0|3,0,0]=4 7135 B15R1.962 CNC(=O)CCCOCC1CCOCC1 34a_100000749013_100000741757 [0,0,0,1,0,0|3,0,0]=4 7136 B15R1.962 CNC(=O)CCCOCC1CCSCC1 34a_100000070558_100000741757 [0,0,0,1,0,0|3,0,0]=4 7137 B15R1.962 CNC(=O)CCCOCC1CCSCC1 7a_100000070558_100000741757 [0,0,0,1,0,0|3,0,0]=4 7138 B15R1.962 CNC(=O)CCCSCC1CCCCC1 62a_100000211423_100000741757 [0,0,0,1,0,0|2,0,0]=3 7139 B15R1.962 CNC(=O)CCCSCC1CCCCC1 62a_100000741757_100000211423 [0,0,0,1,0,0|2,0,0]=3 7140 B15R1.962 CNC(=O)CCCSCC1CCCCO1 62a_100000211543_100000741757 [0,0,0,1,0,0|3,0,0]=4 7141 B15R1.962 CNC(=O)CCCSCC1CCCCO1 62a_100000741757_100000211543 [0,0,0,1,0,0|3,0,0]=4 7142 B15R1.962 CNC(=O)CCCSCC1CCCOC1 62a_100000741521_100000741757 [0,0,0,1,0,0|3,0,0]=4 7143 B15R1.962 CNC(=O)CCCSCC1CCCOC1 62a_100000741757_100000741521 [0,0,0,1,0,0|3,0,0]=4 7144 B15R1.962 CNC(=O)CCCSCC1CCOCC1 62a_100000741757_100000749018 [0,0,0,1,0,0|3,0,0]=4 7145 B15R1.962 CNC(=O)CCCSCC1CCOCC1 62a_100000754603_100000741757 [0,0,0,1,0,0|3,0,0]=4 7146 B15R1.962 CNC(=O)CCNCCC1CCCCC1 2230a_100000738074_100000737683 [0,0,0,1,0,0|2,0,0]=3 7147 B15R1.962 CNC(=O)CCNCCC1CCCCC1 2230a_100000738227_100012355289 [0,0,0,1,0,0|2,0,0]=3 7148 B15R1.962 CNC(=O)CCNCCC1CCCCC1 270004a_100000738227_100011713444 [0,0,0,1,0,0|2,0,0]=3 7149 B15R1.962 CNC(=O)CCNCCC1CCCCC1 34a_100000738074_100012179268 [0,0,0,1,0,0|2,0,0]=3 7150 B15R1.962 CNC(=O)CCNCCC1CCCCC1 34a_100000738227_100011209188 [0,0,0,1,0,0|2,0,0]=3 7151 B15R1.962 CNC(=O)CCNCCC1CCCCO1 2230a_100015183643_100000737683 [0,0,0,1,0,0|3,0,0]=4 7152 B15R1.962 CNC(=O)CCNCCC1CCCCO1 34a_100015183643_100012179268 [0,0,0,1,0,0|3,0,0]=4 7153 B15R1.962 CNC(=O)CCNCCC1CCOCC1 2230a_100000738227_100011934994 [0,0,0,1,0,0|3,0,0]=4 7154 B15R1.962 CNC(=O)CCNCCC1CCOCC1 2230a_100000755988_100000737683 [0,0,0,1,0,0|3,0,0]=4 7155 B15R1.962 CNC(=O)CCNCCC1CCOCC1 34a_100000738227_100011934994 [0,0,0,1,0,0|3,0,0]=4 7156 B15R1.962 CNC(=O)CCNCCC1CCOCC1 34a_100000755988_100012179268 [0,0,0,1,0,0|3,0,0]=4 7157 B15R1.962 CNC(=O)CCNCCN1CCCCC1 2230a_100000738227_100000739454 [0,0,0,1,0,0|3,0,0]=4 7158 B15R1.962 CNC(=O)CCNCCN1CCCCC1 34a_100000738227_100000739454 [0,0,0,1,0,0|3,0,0]=4 7159 B15R1.962 CNC(=O)CCNCOC1CCCCC1 2230a_100000738227_100011935260 [0,0,0,1,0,0|3,0,0]=4 7160 B15R1.962 CNC(=O)CCNCOC1CCCCC1 34a_100000738227_100011935260 [0,0,0,1,0,0|3,0,0]=4 7161 B15R1.962 CNC(=O)CCOCCC1CCCCC1 34a_100000754576_100011209188 [0,0,0,1,0,0|2,0,0]=3 7162 B15R1.962 CNC(=O)CCOCCC1CCCCC1 34a_100011217863_100012179268 [0,0,0,1,0,0|2,0,0]=3 7163 B15R1.962 CNC(=O)CCOCCC1CCCCC1 7a_100011217863_100000737683 [0,0,0,1,0,0|2,0,0]=3 7164 B15R1.962 CNC(=O)CCOCCC1CCCCN1 34a_100000211664_100012179268 [0,0,0,1,0,0|3,0,0]=4 7165 B15R1.962 CNC(=O)CCOCCC1CCCNC1 34a_100000752241_100012179268 [0,0,0,1,0,0|3,0,0]=4 7166 B15R1.962 CNC(=O)CCOCCC1CCNCC1 34a_100015190746_100012179268 [0,0,0,1,0,0|3,0,0]=4 7167 B15R1.962 CNC(=O)CCOCCC1CCOCC1 34a_100000754576_100011934994 [0,0,0,1,0,0|3,0,0]=4 7168 B15R1.962 CNC(=O)CCOCCC1CCOCC1 34a_100011933979_100012179268 [0,0,0,1,0,0|3,0,0]=4 7169 B15R1.962 CNC(=O)CCOCCC1CCOCC1 7a_100011933979_100000737683 [0,0,0,1,0,0|3,0,0]=4 7170 B15R1.962 CNC(=O)CCOCCN1CCCCC1 34a_100000754576_100000739454 [0,0,0,1,0,0|3,0,0]=4 7171 B15R1.962 CNC(=O)CCOCOC1CCCCC1 34a_100000754576_100011935260 [0,0,0,1,0,0|3,0,0]=4 7172 B15R1.962 CNC(=O)CCSCCC1CCCCC1 62a_100000737683_100012355289 [0,0,0,1,0,0|2,0,0]=3 7173 B15R1.962 CNC(=O)CCSCCC1CCCCC1 62a_100012355289_100000737683 [0,0,0,1,0,0|2,0,0]=3 7174 B15R1.962 CNC(=O)CCSCCC1CCOCC1 62a_100000737683_100011934994 [0,0,0,1,0,0|3,0,0]=4 7175 B15R1.962 CNC(=O)CCSCCC1CCOCC1 62a_100011934994_100000737683 [0,0,0,1,0,0|3,0,0]=4 7176 B15R1.962 CNC(=O)CCSCCN1CCCCC1 62a_100000737683_100000739454 [0,0,0,1,0,0|3,0,0]=4 7177 B15R1.962 CNC(=O)CCSCCN1CCCCC1 62a_100000739454_100000737683 [0,0,0,1,0,0|3,0,0]=4 7178 B15R1.962 CNC(=O)CCSCOC1CCCCC1 62a_100000737683_100011935260 [0,0,0,1,0,0|3,0,0]=4 7179 B15R1.962 CNC(=O)CCSCOC1CCCCC1 62a_100011935260_100000737683 [0,0,0,1,0,0|3,0,0]=4 7180 B15R1.962 CNC(=O)CNCCCC1CCCCC1 2230a_100000693194_100011713725 [0,0,0,1,0,0|2,0,0]=3 7181 B15R1.962 CNC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000183359 [0,0,0,1,0,0|2,0,0]=3 7182 B15R1.962 CNC(=O)CNCCCC1CCCCC1 34a_100011211642_100000183359 [0,0,0,1,0,0|2,0,0]=3 7183 B15R1.962 CNC(=O)CNCCCN1CCCCC1 2230a_100000693194_100000690320 [0,0,0,1,0,0|3,0,0]=4 7184 B15R1.962 CNC(=O)CNCCOC1CCCCC1 2230a_100000693194_100011211530 [0,0,0,1,0,0|3,0,0]=4 7185 B15R1.962 CNC(=O)CNCCOC1CCCCC1 34a_100015206981_100000183359 [0,0,0,1,0,0|3,0,0]=4 7186 B15R1.962 CNC(=O)COCCCC1CCCCC1 34a_100000198086_100000183359 [0,0,0,1,0,0|2,0,0]=3 7187 B15R1.962 CNC(=O)COCCCC1CCCCC1 34a_100000750040_100011713725 [0,0,0,1,0,0|2,0,0]=3 7188 B15R1.962 CNC(=O)COCCCC1CCCCC1 7a_100000198086_100000183359 [0,0,0,1,0,0|2,0,0]=3 7189 B15R1.962 CNC(=O)COCCCC1CCCCN1 34a_100011934581_100000183359 [0,0,0,1,0,0|3,0,0]=4 7190 B15R1.962 CNC(=O)COCCCC1CCCNC1 34a_100150707839_100000183359 [0,0,0,1,0,0|3,0,0]=4 7191 B15R1.962 CNC(=O)COCCCC1CCNCC1 34a_100016988962_100000183359 [0,0,0,1,0,0|3,0,0]=4 7192 B15R1.962 CNC(=O)COCCCN1CCCCC1 34a_100000212458_100000183359 [0,0,0,1,0,0|3,0,0]=4 7193 B15R1.962 CNC(=O)COCCCN1CCCCC1 34a_100000750040_100000690320 [0,0,0,1,0,0|3,0,0]=4 7194 B15R1.962 CNC(=O)COCCNC1CCCCC1 34a_100000200466_100000183359 [0,0,0,1,0,0|3,0,0]=4 7195 B15R1.962 CNC(=O)COCCOC1CCCCC1 34a_100000750040_100011211530 [0,0,0,1,0,0|3,0,0]=4 7196 B15R1.962 CNC(=O)COCCOC1CCCCC1 34a_100011249652_100000183359 [0,0,0,1,0,0|3,0,0]=4 7197 B15R1.962 CNC(=O)COCCOC1CCCCC1 7a_100011249652_100000183359 [0,0,0,1,0,0|3,0,0]=4 7198 B15R1.962 CNC(=O)CSCCCC1CCCCC1 62a_100000183359_100011713725 [0,0,0,1,0,0|2,0,0]=3 7199 B15R1.962 CNC(=O)CSCCCC1CCCCC1 62a_100011713725_100000183359 [0,0,0,1,0,0|2,0,0]=3 7200 B15R1.962 CNC(=O)CSCCCN1CCCCC1 62a_100000183359_100000007876 [0,0,0,1,0,0|3,0,0]=4 7201 B15R1.962 CNC(=O)CSCCCN1CCCCC1 62a_100132302099_100000183359 [0,0,0,1,0,0|3,0,0]=4 7202 B15R1.962 CNC(=O)CSCCOC1CCCCC1 62a_100000183359_100011211530 [0,0,0,1,0,0|3,0,0]=4 7203 B15R1.962 CNC(=O)CSCCOC1CCCCC1 62a_100011211530_100000183359 [0,0,0,1,0,0|3,0,0]=4 7204 B15R1.962 CNC(=O)NCCCCN1CCCCC1 2708a_100102657272_200011207366 [0,0,0,1,0,0|3,0,0]=4 7205 B15R1.962 CNC(=O)NCCCCN1CCCCC1 2708a_200011207366_106832991635 [0,0,0,1,0,0|3,0,0]=4 7206 B15R1.962 CNC(=O)NCCCCN1CCCCC1 273464a_100102657272_200011207366 [0,0,0,1,0,0|3,0,0]=4 7207 B15R1.962 CNC(=O)NCCCCN1CCCCC1 273464a_200011207366_100102657272 [0,0,0,1,0,0|3,0,0]=4 7208 B15R1.962 CNC(=O)NCCCCN1CCCCC1 512a_106832991638_200011207366 [0,0,0,1,0,0|3,0,0]=4 7209 B15R1.962 CNC(=O)NCCCOC1CCCCC1 2708a_100000205933_106832991635 [0,0,0,1,0,0|3,0,0]=4 7210 B15R1.962 CNC(=O)NCCCOC1CCCCC1 2708a_100102657272_100000205933 [0,0,0,1,0,0|3,0,0]=4 7211 B15R1.962 CNC(=O)NCCCOC1CCCCC1 273464a_100000205933_100102657272 [0,0,0,1,0,0|3,0,0]=4 7212 B15R1.962 CNC(=O)NCCCOC1CCCCC1 273464a_100102657272_100000205933 [0,0,0,1,0,0|3,0,0]=4 7213 B15R1.962 CNC(=O)NCCCOC1CCCCC1 512a_100000205933_100102657272 [0,0,0,1,0,0|3,0,0]=4 7214 B15R1.962 CNC(=O)NCCCOC1CCCCC1 512a_106832991638_100000205933 [0,0,0,1,0,0|3,0,0]=4 7215 B15R1.962 CNC(=O)NCCNCC1CCCCC1 269862a_100015205895_100000211278 [0,0,0,1,0,0|3,0,0]=4 7216 B15R1.962 CNC(=O)NCCNCC1CCCCC1 34a_100015205895_100000211423 [0,0,0,1,0,0|3,0,0]=4 7217 B15R1.962 CNC(=O)OCCNCC1CCCCC1 34a_100000210473_200011997002 [0,0,0,1,0,0|3,0,0]=4 7218 B15R1.962 CNC(=O)OCCOCC1CCCCC1 34a_100000212181_200011997002 [0,0,0,1,0,0|3,0,0]=4 7219 B15R1.962 CNC(=O)OCCOCC1CCCCC1 7a_100000212181_200011997002 [0,0,0,1,0,0|3,0,0]=4 7220 B15R1.962 CNC(=O)OCCSCC1CCCCC1 62a_100000211423_200011997002 [0,0,0,1,0,0|3,0,0]=4 7221 B15R1.962 CNC(=O)OCCSCC1CCCCC1 62a_200011997002_100000211423 [0,0,0,1,0,0|3,0,0]=4 7222 B15R1.962 COC(=O)/C=C/CNCC1CCCCC1 2230a_100000210473_100000742655 [0,0,0,1,0,0|1,0,2]=4 7223 B15R1.962 COC(=O)/C=C/CNCC1CCCCC1 34a_100000210473_100000742655 [0,0,0,1,0,0|1,0,2]=4 7224 B15R1.962 COC(=O)/C=C/COCC1CCCCC1 34a_100000212181_100000742655 [0,0,0,1,0,0|1,0,2]=4 7225 B15R1.962 COC(=O)/C=C/COCC1CCCCC1 7a_100000212181_100000742655 [0,0,0,1,0,0|1,0,2]=4 7226 B15R1.962 COC(=O)/C=C/CSCC1CCCCC1 62a_100000211423_100000742655 [0,0,0,1,0,0|1,0,2]=4 7227 B15R1.962 COC(=O)/C=C/CSCC1CCCCC1 62a_100000742655_100000211423 [0,0,0,1,0,0|1,0,2]=4 7228 B15R1.962 COC(=O)CC=NNCC1CCCCC1 4a_100000740227_200011552997 [0,0,0,1,0,0|2,0,1]=4 7229 B15R1.962 COC(=O)CCC=NNC1CCCCC1 4a_100000709804_100012047195 [0,0,0,1,0,0|2,0,1]=4 7230 B15R1.962 COC(=O)CCCCCN1CC=CCC1 2230a_100000698166_100009816466 [0,0,0,1,0,0|1,0,2]=4 7231 B15R1.962 COC(=O)CCCCCN1CC=CCC1 269982a_100000698166_100009816466 [0,0,0,1,0,0|1,0,2]=4 7232 B15R1.962 COC(=O)CCCCCN1CC=CCC1 34a_100000698166_100009816466 [0,0,0,1,0,0|1,0,2]=4 7233 B15R1.962 COC(=O)CCCCCN1CCCOC1 2230a_100000131196_100009816466 [0,0,0,1,0,0|2,0,0]=3 7234 B15R1.962 COC(=O)CCCCCN1CCCOC1 269982a_100000131196_100009816466 [0,0,0,1,0,0|2,0,0]=3 7235 B15R1.962 COC(=O)CCCCCN1CCCOC1 34a_100000131196_100009816466 [0,0,0,1,0,0|2,0,0]=3 7236 B15R1.962 COC(=O)CCCCCN1CCOCC1 2230a_100015191051_100009816466 [0,0,0,1,0,0|2,0,0]=3 7237 B15R1.962 COC(=O)CCCCCN1CCOCC1 269982a_100015191051_100009816466 [0,0,0,1,0,0|2,0,0]=3 7238 B15R1.962 COC(=O)CCCCCN1CCOCC1 34a_100015191051_100009816466 [0,0,0,1,0,0|2,0,0]=3 7239 B15R1.962 COC(=O)CCCCCN1CCSCC1 2230a_100000737611_100009816466 [0,0,0,1,0,0|2,0,0]=3 7240 B15R1.962 COC(=O)CCCCCN1CCSCC1 269982a_100000737611_100009816466 [0,0,0,1,0,0|2,0,0]=3 7241 B15R1.962 COC(=O)CCCCNC1CCCCC1 2230a_100000182618_100000204269 [0,0,0,1,0,0|1,0,0]=2 7242 B15R1.962 COC(=O)CCCCNC1CCCCC1 34a_100000182618_100000204269 [0,0,0,1,0,0|1,0,0]=2 7243 B15R1.962 COC(=O)CCCCNC1CCCOC1 2230a_100000719290_100000204269 [0,0,0,1,0,0|2,0,0]=3 7244 B15R1.962 COC(=O)CCCCNC1CCCOC1 34a_100000719290_100000204269 [0,0,0,1,0,0|2,0,0]=3 7245 B15R1.962 COC(=O)CCCCNC1CCOCC1 2230a_100000741149_100000204269 [0,0,0,1,0,0|2,0,0]=3 7246 B15R1.962 COC(=O)CCCCNC1CCOCC1 34a_100000741149_100000204269 [0,0,0,1,0,0|2,0,0]=3 7247 B15R1.962 COC(=O)CCCCNC1CCSCC1 2230a_100000748639_100000204269 [0,0,0,1,0,0|2,0,0]=3 7248 B15R1.962 COC(=O)CCCCNC1CCSCC1 34a_100000748639_100000204269 [0,0,0,1,0,0|2,0,0]=3 7249 B15R1.962 COC(=O)CCCCOC1C=CCCC1 34a_100011215024_100000204269 [0,0,0,1,0,0|1,0,2]=4 7250 B15R1.962 COC(=O)CCCCOC1C=CCCC1 7a_100000059025_100000751183 [0,0,0,1,0,0|1,0,2]=4 7251 B15R1.962 COC(=O)CCCCOC1CC=CCC1 34a_100000073881_100000204269 [0,0,0,1,0,0|1,0,2]=4 7252 B15R1.962 COC(=O)CCCCOC1CCCCC1 34a_100000059025_100000210327 [0,0,0,1,0,0|1,0,0]=2 7253 B15R1.962 COC(=O)CCCCOC1CCCCC1 34a_100000210231_100000204269 [0,0,0,1,0,0|1,0,0]=2 7254 B15R1.962 COC(=O)CCCCOC1CCCCC1 7a_100000059025_100000210327 [0,0,0,1,0,0|1,0,0]=2 7255 B15R1.962 COC(=O)CCCCOC1CCCCC1 7a_100000210231_100000204269 [0,0,0,1,0,0|1,0,0]=2 7256 B15R1.962 COC(=O)CCCCOC1CCCCO1 34a_100000033831_100000204269 [0,0,0,1,0,0|2,0,0]=3 7257 B15R1.962 COC(=O)CCCCOC1CCCOC1 34a_100000059025_100000693364 [0,0,0,1,0,0|2,0,0]=3 7258 B15R1.962 COC(=O)CCCCOC1CCCOC1 34a_100000754041_100000204269 [0,0,0,1,0,0|2,0,0]=3 7259 B15R1.962 COC(=O)CCCCOC1CCCOC1 7a_100000059025_100000693364 [0,0,0,1,0,0|2,0,0]=3 7260 B15R1.962 COC(=O)CCCCOC1CCCSC1 7a_100015962668_100000204269 [0,0,0,1,0,0|2,0,0]=3 7261 B15R1.962 COC(=O)CCCCOC1CCOCC1 34a_100000744328_100000204269 [0,0,0,1,0,0|2,0,0]=3 7262 B15R1.962 COC(=O)CCCCOC1CCOCC1 7a_100000059025_100000686592 [0,0,0,1,0,0|2,0,0]=3 7263 B15R1.962 COC(=O)CCCCOC1CCSCC1 34a_100000059025_100000069128 [0,0,0,1,0,0|2,0,0]=3 7264 B15R1.962 COC(=O)CCCCOC1CCSCC1 34a_100000731022_100000204269 [0,0,0,1,0,0|2,0,0]=3 7265 B15R1.962 COC(=O)CCCCOC1CCSCC1 7a_100000059025_100011500858 [0,0,0,1,0,0|2,0,0]=3 7266 B15R1.962 COC(=O)CCCCOC1CCSCC1 7a_100000731022_100000204269 [0,0,0,1,0,0|2,0,0]=3 7267 B15R1.962 COC(=O)CCCCSC1C=CCCC1 62a_100000204269_100000751183 [0,0,0,1,0,0|1,0,2]=4 7268 B15R1.962 COC(=O)CCCCSC1C=CCCC1 62a_100000751183_100000204269 [0,0,0,1,0,0|1,0,2]=4 7269 B15R1.962 COC(=O)CCCCSC1CCCCC1 62a_100000204269_100000210327 [0,0,0,1,0,0|1,0,0]=2 7270 B15R1.962 COC(=O)CCCCSC1CCCCC1 62a_100000210327_100000204269 [0,0,0,1,0,0|1,0,0]=2 7271 B15R1.962 COC(=O)CCCCSC1CCCOC1 62a_100000204269_100000693364 [0,0,0,1,0,0|2,0,0]=3 7272 B15R1.962 COC(=O)CCCCSC1CCOCC1 62a_100000204269_100011324220 [0,0,0,1,0,0|2,0,0]=3 7273 B15R1.962 COC(=O)CCCCSC1CCSCC1 62a_100000204269_100000069128 [0,0,0,1,0,0|2,0,0]=3 7274 B15R1.962 COC(=O)CCCNCC1CCCCC1 2230a_100000210473_100011218270 [0,0,0,1,0,0|1,0,0]=2 7275 B15R1.962 COC(=O)CCCNCC1CCCCC1 34a_100000210473_100000742333 [0,0,0,1,0,0|1,0,0]=2 7276 B15R1.962 COC(=O)CCCNCC1CCCCO1 2230a_100000174945_100011218270 [0,0,0,1,0,0|2,0,0]=3 7277 B15R1.962 COC(=O)CCCNCC1CCCCO1 34a_100000174945_100000742333 [0,0,0,1,0,0|2,0,0]=3 7278 B15R1.962 COC(=O)CCCNCC1CCCOC1 2230a_100000720124_100011218270 [0,0,0,1,0,0|2,0,0]=3 7279 B15R1.962 COC(=O)CCCNCC1CCCOC1 34a_100000720124_100000742333 [0,0,0,1,0,0|2,0,0]=3 7280 B15R1.962 COC(=O)CCCNCC1CCOCC1 2230a_100000746373_100011218270 [0,0,0,1,0,0|2,0,0]=3 7281 B15R1.962 COC(=O)CCCNCC1CCOCC1 34a_100000746373_100000742333 [0,0,0,1,0,0|2,0,0]=3 7282 B15R1.962 COC(=O)CCCNCC1CCSCC1 2230a_100015188806_100011218270 [0,0,0,1,0,0|2,0,0]=3 7283 B15R1.962 COC(=O)CCCNCC1CCSCC1 34a_100015188806_100000742333 [0,0,0,1,0,0|2,0,0]=3 7284 B15R1.962 COC(=O)CCCNC[C@H]1COCCO1 2230a_100010981119_100011218270 [0,0,0,1,0,0|3,0,0]=4 7285 B15R1.962 COC(=O)CCCNC[C@H]1COCCO1 34a_100010981119_100000742333 [0,0,0,1,0,0|3,0,0]=4 7286 B15R1.962 COC(=O)CCCOCC1CC=CCC1 34a_100000210713_100000742333 [0,0,0,1,0,0|1,0,2]=4 7287 B15R1.962 COC(=O)CCCOCC1CCCCC1 34a_100000212181_100000742333 [0,0,0,1,0,0|1,0,0]=2 7288 B15R1.962 COC(=O)CCCOCC1CCCCC1 7a_100000212181_100011218270 [0,0,0,1,0,0|1,0,0]=2 7289 B15R1.962 COC(=O)CCCOCC1CCCCN1 34a_100000210821_100000742333 [0,0,0,1,0,0|2,0,0]=3 7290 B15R1.962 COC(=O)CCCOCC1CCCCO1 34a_100000211370_100000742333 [0,0,0,1,0,0|2,0,0]=3 7291 B15R1.962 COC(=O)CCCOCC1CCCCO1 7a_100000211370_100011218270 [0,0,0,1,0,0|2,0,0]=3 7292 B15R1.962 COC(=O)CCCOCC1CCCNC1 34a_100000211344_100000742333 [0,0,0,1,0,0|2,0,0]=3 7293 B15R1.962 COC(=O)CCCOCC1CCCOC1 34a_100000741520_100000742333 [0,0,0,1,0,0|2,0,0]=3 7294 B15R1.962 COC(=O)CCCOCC1CCNCC1 34a_100000738675_100000742333 [0,0,0,1,0,0|2,0,0]=3 7295 B15R1.962 COC(=O)CCCOCC1CCOCC1 34a_100000749013_100000742333 [0,0,0,1,0,0|2,0,0]=3 7296 B15R1.962 COC(=O)CCCOCC1CCSCC1 34a_100000070558_100000742333 [0,0,0,1,0,0|2,0,0]=3 7297 B15R1.962 COC(=O)CCCOCC1CCSCC1 7a_100000070558_100011218270 [0,0,0,1,0,0|2,0,0]=3 7298 B15R1.962 COC(=O)CCCOC[C@@H]1CNCCO1 34a_100015189573_100000742333 [0,0,0,1,0,0|3,0,0]=4 7299 B15R1.962 COC(=O)CCCOC[C@@H]1COCCN1 34a_100000717676_100000742333 [0,0,0,1,0,0|3,0,0]=4 7300 B15R1.962 COC(=O)CCCOC[C@H]1COCCO1 34a_100009875890_100000742333 [0,0,0,1,0,0|3,0,0]=4 7301 B15R1.962 COC(=O)CCCSCC1CCCCC1 62a_100000211423_100011218270 [0,0,0,1,0,0|1,0,0]=2 7302 B15R1.962 COC(=O)CCCSCC1CCCCC1 62a_100011218270_100000211423 [0,0,0,1,0,0|1,0,0]=2 7303 B15R1.962 COC(=O)CCCSCC1CCCCO1 62a_100000211543_100011218270 [0,0,0,1,0,0|2,0,0]=3 7304 B15R1.962 COC(=O)CCCSCC1CCCCO1 62a_100011218270_100000211543 [0,0,0,1,0,0|2,0,0]=3 7305 B15R1.962 COC(=O)CCCSCC1CCCOC1 62a_100000741521_100011218270 [0,0,0,1,0,0|2,0,0]=3 7306 B15R1.962 COC(=O)CCCSCC1CCCOC1 62a_100011218270_100000741521 [0,0,0,1,0,0|2,0,0]=3 7307 B15R1.962 COC(=O)CCCSCC1CCOCC1 62a_100000754603_100011218270 [0,0,0,1,0,0|2,0,0]=3 7308 B15R1.962 COC(=O)CCCSCC1CCOCC1 62a_100011218270_100000749018 [0,0,0,1,0,0|2,0,0]=3 7309 B15R1.962 COC(=O)CCNCCC1=CCCCC1 2230a_100000212019_100000204255 [0,0,0,1,0,0|1,0,2]=4 7310 B15R1.962 COC(=O)CCNCCC1=CCCCC1 34a_100000212019_100000742370 [0,0,0,1,0,0|1,0,2]=4 7311 B15R1.962 COC(=O)CCNCCC1CCCCC1 2230a_100000738074_100000204255 [0,0,0,1,0,0|1,0,0]=2 7312 B15R1.962 COC(=O)CCNCCC1CCCCC1 34a_100000738074_100000742370 [0,0,0,1,0,0|1,0,0]=2 7313 B15R1.962 COC(=O)CCNCCC1CCCCO1 2230a_100015183643_100000204255 [0,0,0,1,0,0|2,0,0]=3 7314 B15R1.962 COC(=O)CCNCCC1CCCCO1 34a_100015183643_100000742370 [0,0,0,1,0,0|2,0,0]=3 7315 B15R1.962 COC(=O)CCNCCC1CCOCC1 2230a_100000755988_100000204255 [0,0,0,1,0,0|2,0,0]=3 7316 B15R1.962 COC(=O)CCNCCC1CCOCC1 34a_100000755988_100000742370 [0,0,0,1,0,0|2,0,0]=3 7317 B15R1.962 COC(=O)CCNCCN1CCSCC1 2230a_100000755026_100000204255 [0,0,0,1,0,0|3,0,0]=4 7318 B15R1.962 COC(=O)CCOCCC1CCCCC1 34a_100011217863_100000742370 [0,0,0,1,0,0|1,0,0]=2 7319 B15R1.962 COC(=O)CCOCCC1CCCCC1 7a_100011217863_100000204255 [0,0,0,1,0,0|1,0,0]=2 7320 B15R1.962 COC(=O)CCOCCC1CCCCN1 34a_100000211664_100000742370 [0,0,0,1,0,0|2,0,0]=3 7321 B15R1.962 COC(=O)CCOCCC1CCCNC1 34a_100000752241_100000742370 [0,0,0,1,0,0|2,0,0]=3 7322 B15R1.962 COC(=O)CCOCCC1CCNCC1 34a_100015190746_100000742370 [0,0,0,1,0,0|2,0,0]=3 7323 B15R1.962 COC(=O)CCOCCC1CCOCC1 34a_100011933979_100000742370 [0,0,0,1,0,0|2,0,0]=3 7324 B15R1.962 COC(=O)CCOCCC1CCOCC1 7a_100011933979_100000204255 [0,0,0,1,0,0|2,0,0]=3 7325 B15R1.962 COC(=O)CCOCCC1SCCCS1 34a_200011025297_100000742370 [0,0,0,1,0,0|3,0,0]=4 7326 B15R1.962 COC(=O)CCOCCC1SCCCS1 7a_200011025297_100000204255 [0,0,0,1,0,0|3,0,0]=4 7327 B15R1.962 COC(=O)CCOCCN1CCSCC1 7a_100000686052_100000204255 [0,0,0,1,0,0|3,0,0]=4 7328 B15R1.962 COC(=O)CCOCC[C@@H]1CNCCN1 34a_100016989929_100000742370 [0,0,0,1,0,0|3,0,0]=4 7329 B15R1.962 COC(=O)CCSCCC1CCCCC1 62a_100000204255_100012355289 [0,0,0,1,0,0|1,0,0]=2 7330 B15R1.962 COC(=O)CCSCCC1CCCCC1 62a_100012355289_100000204255 [0,0,0,1,0,0|1,0,0]=2 7331 B15R1.962 COC(=O)CCSCCC1CCOCC1 62a_100000204255_100011934994 [0,0,0,1,0,0|2,0,0]=3 7332 B15R1.962 COC(=O)CCSCCC1CCOCC1 62a_100011934994_100000204255 [0,0,0,1,0,0|2,0,0]=3 7333 B15R1.962 COC(=O)CCSCCC1OCCCO1 62a_100000204255_100000764188 [0,0,0,1,0,0|3,0,0]=4 7334 B15R1.962 COC(=O)CCSCCC1OCCCO1 62a_100000764188_100000204255 [0,0,0,1,0,0|3,0,0]=4 7335 B15R1.962 COC(=O)CCSCCN1CCCCC1 62a_100000204255_100000739454 [0,0,0,1,0,0|2,0,0]=3 7336 B15R1.962 COC(=O)CCSCCN1CCCCC1 62a_100000739454_100000204255 [0,0,0,1,0,0|2,0,0]=3 7337 B15R1.962 COC(=O)CCSCCN1CCOCC1 62a_100000204255_100000211760 [0,0,0,1,0,0|3,0,0]=4 7338 B15R1.962 COC(=O)CCSCOC1CCCCC1 62a_100000204255_100011935260 [0,0,0,1,0,0|2,0,0]=3 7339 B15R1.962 COC(=O)CCSCOC1CCCCC1 62a_100011935260_100000204255 [0,0,0,1,0,0|2,0,0]=3 7340 B15R1.962 COC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000747449 [0,0,0,1,0,0|1,0,0]=2 7341 B15R1.962 COC(=O)CNCCCC1CCCCC1 34a_100011211642_100000747449 [0,0,0,1,0,0|1,0,0]=2 7342 B15R1.962 COC(=O)CNCCOC1CCCCC1 34a_100015206981_100000747449 [0,0,0,1,0,0|2,0,0]=3 7343 B15R1.962 COC(=O)COCCCC1CCCCC1 34a_100000198086_100000747449 [0,0,0,1,0,0|1,0,0]=2 7344 B15R1.962 COC(=O)COCCCC1CCCCC1 7a_100000198086_100000747449 [0,0,0,1,0,0|1,0,0]=2 7345 B15R1.962 COC(=O)COCCCC1CCCCN1 34a_100011934581_100000747449 [0,0,0,1,0,0|2,0,0]=3 7346 B15R1.962 COC(=O)COCCCC1CCCNC1 34a_100150707839_100000747449 [0,0,0,1,0,0|2,0,0]=3 7347 B15R1.962 COC(=O)COCCCC1CCNCC1 34a_100016988962_100000747449 [0,0,0,1,0,0|2,0,0]=3 7348 B15R1.962 COC(=O)COCCCN1CCCCC1 34a_100000212458_100000747449 [0,0,0,1,0,0|2,0,0]=3 7349 B15R1.962 COC(=O)COCCCN1CCOCC1 34a_100000212840_100000747449 [0,0,0,1,0,0|3,0,0]=4 7350 B15R1.962 COC(=O)COCCNC1CCCCC1 2230a_100000182618_100000090808 [0,0,0,1,0,0|2,0,0]=3 7351 B15R1.962 COC(=O)COCCNC1CCCCC1 34a_100000182618_100000090808 [0,0,0,1,0,0|2,0,0]=3 7352 B15R1.962 COC(=O)COCCNC1CCCCC1 34a_100000200466_100000747449 [0,0,0,1,0,0|2,0,0]=3 7353 B15R1.962 COC(=O)COCCNC1CCCOC1 2230a_100000719290_100000090808 [0,0,0,1,0,0|3,0,0]=4 7354 B15R1.962 COC(=O)COCCNC1CCCOC1 34a_100000719290_100000090808 [0,0,0,1,0,0|3,0,0]=4 7355 B15R1.962 COC(=O)COCCNC1CCOCC1 2230a_100000741149_100000090808 [0,0,0,1,0,0|3,0,0]=4 7356 B15R1.962 COC(=O)COCCNC1CCOCC1 34a_100000708129_100000747449 [0,0,0,1,0,0|3,0,0]=4 7357 B15R1.962 COC(=O)COCCNC1CCOCC1 34a_100000741149_100000090808 [0,0,0,1,0,0|3,0,0]=4 7358 B15R1.962 COC(=O)COCCNC1CCSCC1 2230a_100000748639_100000090808 [0,0,0,1,0,0|3,0,0]=4 7359 B15R1.962 COC(=O)COCCNC1CCSCC1 34a_100000748639_100000090808 [0,0,0,1,0,0|3,0,0]=4 7360 B15R1.962 COC(=O)COCCOC1CCCCC1 34a_100000210231_100000090808 [0,0,0,1,0,0|2,0,0]=3 7361 B15R1.962 COC(=O)COCCOC1CCCCC1 34a_100011249652_100000747449 [0,0,0,1,0,0|2,0,0]=3 7362 B15R1.962 COC(=O)COCCOC1CCCCC1 7a_100000210231_100000090808 [0,0,0,1,0,0|2,0,0]=3 7363 B15R1.962 COC(=O)COCCOC1CCCCC1 7a_100011249652_100000747449 [0,0,0,1,0,0|2,0,0]=3 7364 B15R1.962 COC(=O)COCCOC1CCCCO1 34a_100000033831_100000090808 [0,0,0,1,0,0|3,0,0]=4 7365 B15R1.962 COC(=O)COCCOC1CCCCO1 34a_100000034223_100000747449 [0,0,0,1,0,0|3,0,0]=4 7366 B15R1.962 COC(=O)COCCOC1CCCCO1 7a_100000034223_100000747449 [0,0,0,1,0,0|3,0,0]=4 7367 B15R1.962 COC(=O)COCCOC1CCCOC1 34a_100000754041_100000090808 [0,0,0,1,0,0|3,0,0]=4 7368 B15R1.962 COC(=O)COCCOC1CCCSC1 7a_100015962668_100000090808 [0,0,0,1,0,0|3,0,0]=4 7369 B15R1.962 COC(=O)COCCOC1CCOCC1 34a_100000744328_100000090808 [0,0,0,1,0,0|3,0,0]=4 7370 B15R1.962 COC(=O)COCCOC1CCSCC1 34a_100000731022_100000090808 [0,0,0,1,0,0|3,0,0]=4 7371 B15R1.962 COC(=O)COCCOC1CCSCC1 7a_100000731022_100000090808 [0,0,0,1,0,0|3,0,0]=4 7372 B15R1.962 COC(=O)COCCSC1CCCCC1 62a_100000090808_100000210327 [0,0,0,1,0,0|2,0,0]=3 7373 B15R1.962 COC(=O)COCCSC1CCCCC1 62a_100000210327_100000090808 [0,0,0,1,0,0|2,0,0]=3 7374 B15R1.962 COC(=O)COCCSC1CCCOC1 62a_100000090808_100000693364 [0,0,0,1,0,0|3,0,0]=4 7375 B15R1.962 COC(=O)COCCSC1CCOCC1 62a_100000090808_100011324220 [0,0,0,1,0,0|3,0,0]=4 7376 B15R1.962 COC(=O)COCCSC1CCSCC1 62a_100000090808_100000069128 [0,0,0,1,0,0|3,0,0]=4 7377 B15R1.962 COC(=O)CSCCCC1CCCCC1 62a_100000747449_100011713725 [0,0,0,1,0,0|1,0,0]=2 7378 B15R1.962 COC(=O)CSCCCC1CCCCC1 62a_100011713725_100000747449 [0,0,0,1,0,0|1,0,0]=2 7379 B15R1.962 COC(=O)CSCCCN1CCCCC1 62a_100000747449_100000007876 [0,0,0,1,0,0|2,0,0]=3 7380 B15R1.962 COC(=O)CSCCCN1CCCCC1 62a_100132302099_100000747449 [0,0,0,1,0,0|2,0,0]=3 7381 B15R1.962 COC(=O)CSCCCN1CCOCC1 62a_100000747449_100000748698 [0,0,0,1,0,0|3,0,0]=4 7382 B15R1.962 COC(=O)CSCCOC1CCCCC1 62a_100000747449_100011211530 [0,0,0,1,0,0|2,0,0]=3 7383 B15R1.962 COC(=O)CSCCOC1CCCCC1 62a_100011211530_100000747449 [0,0,0,1,0,0|2,0,0]=3 7384 B15R1.962 COC(=O)CSCCOC1CCCCO1 62a_100000744793_100000747449 [0,0,0,1,0,0|3,0,0]=4 7385 B15R1.962 COC(=O)CSCCOC1CCCCO1 62a_100000747449_100000744793 [0,0,0,1,0,0|3,0,0]=4 7386 B15R1.962 COC(=O)NCCOCC1CCCCC1 34a_100000757965_100000211423 [0,0,0,1,0,0|2,0,0]=3 7387 B15R1.962 COC(=O)NCCOCC1CCCCO1 34a_100000757965_100000211543 [0,0,0,1,0,0|3,0,0]=4 7388 B15R1.962 COC(=O)NCCOCC1CCCOC1 34a_100000757965_100000741521 [0,0,0,1,0,0|3,0,0]=4 7389 B15R1.962 COC(=O)NCCOCC1CCOCC1 34a_100000757965_100000754603 [0,0,0,1,0,0|3,0,0]=4 7390 B15R1.962 COC(=O)OCCOCC1CCCCC1 34a_100010262106_100000211423 [0,0,0,1,0,0|2,0,0]=3 7391 B15R1.962 COC(=O)OCCOCC1CCCCO1 34a_100010262106_100000211543 [0,0,0,1,0,0|3,0,0]=4 7392 B15R1.962 COC(=O)OCCOCC1CCCOC1 34a_100010262106_100000741521 [0,0,0,1,0,0|3,0,0]=4 7393 B15R1.962 COC(=O)OCCOCC1CCOCC1 34a_100010262106_100000754603 [0,0,0,1,0,0|3,0,0]=4 7394 B15R1.962 COC(=O)OCSCCC1CCCCC1 62a_100012355289_100000139417 [0,0,0,1,0,0|2,0,0]=3 7395 B15R1.962 COC(=O)OCSCCC1CCOCC1 62a_100011934994_100000139417 [0,0,0,1,0,0|3,0,0]=4 7396 B15R1.962 COC(=O)OCSCCN1CCCCC1 62a_100000739454_100000139417 [0,0,0,1,0,0|3,0,0]=4 7397 B15R1.962 COC(=O)OCSCOC1CCCCC1 62a_100011935260_100000139417 [0,0,0,1,0,0|3,0,0]=4 7398 B15R1.962 COC(C)CCOCCC1CCCCC1 7a_100000764861_100011273959 [0,0,0,1,0,0|2,0,1]=4 7399 B15R1.962 COC(C)COCCCC1CCCCC1 34a_100000690652_100011713725 [0,0,0,1,0,0|2,0,1]=4 7400 B15R1.962 CO[C@H](C)CNCCCC1CCCCC1 2230a_100020591295_100011713725 [0,0,0,1,0,0|2,0,1]=4 7401 B15R1.962 NNC(=O)CCCOCC1CCCCC1 34a_100000211488_100000211423 [0,0,0,1,0,0|3,0,0]=4 7402 B15R1.962 O=C(CF)CCCCCN1CCCCC1 1458a_100012051570_100015361967 [0,0,0,1,0,0|3,0,0]=4 7403 B15R1.975 CCC(=O)NCCCCCN1CCCC1 1626a_100011491779_100000210414 [0,0,0,1,0,0|3,0,0]=4 7404 B15R1.975 CCC(=O)NCCCCCN1CCCC1 240690a_100011491779_100000210414 [0,0,0,1,0,0|3,0,0]=4 7405 B15R1.975 CCC(=O)NCCNCCC1CCCC1 34a_100132302217_100000760354 [0,0,0,1,0,0|3,0,0]=4 7406 B15R1.975 CCC(=O)NCCOCCC1CCCC1 34a_200000158885_100000760354 [0,0,0,1,0,0|3,0,0]=4 7407 B15R1.975 CCC(=O)NCCOCCC1CCCC1 7a_200000158885_100000760354 [0,0,0,1,0,0|3,0,0]=4 7408 B15R1.975 CCC(=O)OCCOCCC1CCCC1 7a_200000031056_100000760354 [0,0,0,1,0,0|3,0,0]=4 7409 B15R1.975 CNC(=O)CCCNCCC1CCCC1 2230a_100000739158_100000741757 [0,0,0,1,0,0|2,0,0]=3 7410 B15R1.975 CNC(=O)CCCNCCC1CCCC1 2230a_100000740002_100000760354 [0,0,0,1,0,0|2,0,0]=3 7411 B15R1.975 CNC(=O)CCCNCCC1CCCC1 34a_100000739158_100000741757 [0,0,0,1,0,0|2,0,0]=3 7412 B15R1.975 CNC(=O)CCCNCCC1CCCC1 34a_100000740002_100000760354 [0,0,0,1,0,0|2,0,0]=3 7413 B15R1.975 CNC(=O)CCCOCCC1CCCC1 34a_100000749090_100000741757 [0,0,0,1,0,0|2,0,0]=3 7414 B15R1.975 CNC(=O)CCCOCCC1CCCC1 7a_100000749090_100000741757 [0,0,0,1,0,0|2,0,0]=3 7415 B15R1.975 CNC(=O)CCCOCCC1CCNC1 34a_100016987287_100000741757 [0,0,0,1,0,0|3,0,0]=4 7416 B15R1.975 CNC(=O)CCCOCCC1CCOC1 34a_100011879284_100000741757 [0,0,0,1,0,0|3,0,0]=4 7417 B15R1.975 CNC(=O)CCCSCCC1CCCC1 62a_100000741757_100000760354 [0,0,0,1,0,0|2,0,0]=3 7418 B15R1.975 CNC(=O)CCCSCCC1CCCC1 62a_100000760354_100000741757 [0,0,0,1,0,0|2,0,0]=3 7419 B15R1.975 CNC(=O)CCCSCCN1CCCC1 62a_100000700749_100000741757 [0,0,0,1,0,0|3,0,0]=4 7420 B15R1.975 CNC(=O)CCCSCCN1CCCC1 62a_100000741757_100000004467 [0,0,0,1,0,0|3,0,0]=4 7421 B15R1.975 CNC(=O)CCNCCCC1CCCC1 2230a_100000736752_100000737683 [0,0,0,1,0,0|2,0,0]=3 7422 B15R1.975 CNC(=O)CCNCCCC1CCCC1 2230a_100000738227_100011713738 [0,0,0,1,0,0|2,0,0]=3 7423 B15R1.975 CNC(=O)CCNCCCC1CCCC1 34a_100000736752_100012179268 [0,0,0,1,0,0|2,0,0]=3 7424 B15R1.975 CNC(=O)CCNCCCC1CCCC1 34a_100000738227_100011713738 [0,0,0,1,0,0|2,0,0]=3 7425 B15R1.975 CNC(=O)CCNCCCN1CCCC1 2230a_100000738227_100011445909 [0,0,0,1,0,0|3,0,0]=4 7426 B15R1.975 CNC(=O)CCNCCCN1CCCC1 34a_100000738227_100016991639 [0,0,0,1,0,0|3,0,0]=4 7427 B15R1.975 CNC(=O)CCNCCOC1CCCC1 34a_100000741755_100012179268 [0,0,0,1,0,0|3,0,0]=4 7428 B15R1.975 CNC(=O)CCOCCCC1CCCC1 34a_100000754576_100011713738 [0,0,0,1,0,0|2,0,0]=3 7429 B15R1.975 CNC(=O)CCOCCCC1CCCC1 34a_100011215328_100012179268 [0,0,0,1,0,0|2,0,0]=3 7430 B15R1.975 CNC(=O)CCOCCCC1CCCC1 7a_100011215328_100000737683 [0,0,0,1,0,0|2,0,0]=3 7431 B15R1.975 CNC(=O)CCOCCCN1CCCC1 34a_100000754576_100016991639 [0,0,0,1,0,0|3,0,0]=4 7432 B15R1.975 CNC(=O)CCOCCNC1CCCC1 34a_200000200444_100012179268 [0,0,0,1,0,0|3,0,0]=4 7433 B15R1.975 CNC(=O)CCOCCOC1CCCC1 34a_100000738311_100012179268 [0,0,0,1,0,0|3,0,0]=4 7434 B15R1.975 CNC(=O)CCOCCOC1CCCC1 7a_100000738311_100000737683 [0,0,0,1,0,0|3,0,0]=4 7435 B15R1.975 CNC(=O)CCSCCCC1CCCC1 62a_100000737683_100011713738 [0,0,0,1,0,0|2,0,0]=3 7436 B15R1.975 CNC(=O)CCSCCCC1CCCC1 62a_100011713738_100000737683 [0,0,0,1,0,0|2,0,0]=3 7437 B15R1.975 CNC(=O)CCSCCCN1CCCC1 62a_100000737683_100011445909 [0,0,0,1,0,0|3,0,0]=4 7438 B15R1.975 CNC(=O)CCSCCCN1CCCC1 62a_100016991639_100000737683 [0,0,0,1,0,0|3,0,0]=4 7439 B15R1.975 CNC(=O)CNCCCOC1CCCC1 34a_100000747560_100000183359 [0,0,0,1,0,0|3,0,0]=4 7440 B15R1.975 CNC(=O)NCCCCCN1CCCC1 2708a_100011491779_106832991635 [0,0,0,1,0,0|3,0,0]=4 7441 B15R1.975 CNC(=O)NCCCCCN1CCCC1 2708a_100102657272_100011491779 [0,0,0,1,0,0|3,0,0]=4 7442 B15R1.975 CNC(=O)NCCCCCN1CCCC1 273464a_100011491779_100102657272 [0,0,0,1,0,0|3,0,0]=4 7443 B15R1.975 CNC(=O)NCCCCCN1CCCC1 273464a_100102657272_100011491779 [0,0,0,1,0,0|3,0,0]=4 7444 B15R1.975 CNC(=O)NCCCCCN1CCCC1 512a_106832991638_100011491779 [0,0,0,1,0,0|3,0,0]=4 7445 B15R1.975 CNC(=O)NCCNCCC1CCCC1 34a_100015205895_100000760354 [0,0,0,1,0,0|3,0,0]=4 7446 B15R1.975 CNC(=O)OCCNCCC1CCCC1 34a_100000739158_200011997002 [0,0,0,1,0,0|3,0,0]=4 7447 B15R1.975 CNC(=O)OCCOCCC1CCCC1 34a_100000749090_200011997002 [0,0,0,1,0,0|3,0,0]=4 7448 B15R1.975 CNC(=O)OCCOCCC1CCCC1 7a_100000749090_200011997002 [0,0,0,1,0,0|3,0,0]=4 7449 B15R1.975 CNC(=O)OCCSCCC1CCCC1 62a_100000760354_200011997002 [0,0,0,1,0,0|3,0,0]=4 7450 B15R1.975 CNC(=O)OCCSCCC1CCCC1 62a_200011997002_100000760354 [0,0,0,1,0,0|3,0,0]=4 7451 B15R1.975 COC(=O)/C=C/CNCCC1CCCC1 2230a_100000739158_100000742655 [0,0,0,1,0,0|1,0,2]=4 7452 B15R1.975 COC(=O)/C=C/CNCCC1CCCC1 34a_100000739158_100000742655 [0,0,0,1,0,0|1,0,2]=4 7453 B15R1.975 COC(=O)/C=C/COCCC1CCCC1 34a_100000749090_100000742655 [0,0,0,1,0,0|1,0,2]=4 7454 B15R1.975 COC(=O)/C=C/COCCC1CCCC1 7a_100000749090_100000742655 [0,0,0,1,0,0|1,0,2]=4 7455 B15R1.975 COC(=O)/C=C/CSCCC1CCCC1 62a_100000742655_100000760354 [0,0,0,1,0,0|1,0,2]=4 7456 B15R1.975 COC(=O)/C=C/CSCCC1CCCC1 62a_100000760354_100000742655 [0,0,0,1,0,0|1,0,2]=4 7457 B15R1.975 COC(=O)CCCC=NNC1CCCC1 4a_100000737850_100000094087 [0,0,0,1,0,0|2,0,1]=4 7458 B15R1.975 COC(=O)CCCCCCN1CC=CC1 269982a_100015195280_100009815986 [0,0,0,1,0,0|1,0,2]=4 7459 B15R1.975 COC(=O)CCCCCCN1CCCC1 2230a_100000188435_100009815986 [0,0,0,1,0,0|1,0,0]=2 7460 B15R1.975 COC(=O)CCCCCCN1CCCC1 269982a_100000188435_100009815986 [0,0,0,1,0,0|1,0,0]=2 7461 B15R1.975 COC(=O)CCCCCCN1CCSC1 2230a_100011215254_100009815986 [0,0,0,1,0,0|2,0,0]=3 7462 B15R1.975 COC(=O)CCCCCCN1CCSC1 269982a_100011215254_100009815986 [0,0,0,1,0,0|2,0,0]=3 7463 B15R1.975 COC(=O)CCCCCNC1CC=CC1 2230a_100015188752_100009816466 [0,0,0,1,0,0|1,0,2]=4 7464 B15R1.975 COC(=O)CCCCCNC1CCCC1 2230a_100000211070_100009816466 [0,0,0,1,0,0|1,0,0]=2 7465 B15R1.975 COC(=O)CCCCCNC1CCCC1 34a_100000211070_100009816466 [0,0,0,1,0,0|1,0,0]=2 7466 B15R1.975 COC(=O)CCCCCN[C@@H]1CCOC1 2230a_200015188469_100009816466 [0,0,0,1,0,0|2,0,0]=3 7467 B15R1.975 COC(=O)CCCCCN[C@H]1CCOC1 2230a_100015188467_100009816466 [0,0,0,1,0,0|2,0,0]=3 7468 B15R1.975 COC(=O)CCCCCN[C@H]1CCOC1 34a_100015188467_100009816466 [0,0,0,1,0,0|2,0,0]=3 7469 B15R1.975 COC(=O)CCCCCOC1CCCC1 34a_100000074720_100000179811 [0,0,0,1,0,0|1,0,0]=2 7470 B15R1.975 COC(=O)CCCCCOC1CCCC1 34a_100000210269_100009816466 [0,0,0,1,0,0|1,0,0]=2 7471 B15R1.975 COC(=O)CCCCCOC1CCCC1 7a_100000074720_100000179811 [0,0,0,1,0,0|1,0,0]=2 7472 B15R1.975 COC(=O)CCCCCOC1CCCC1 7a_100000210269_100009816466 [0,0,0,1,0,0|1,0,0]=2 7473 B15R1.975 COC(=O)CCCCCOC1CCCO1 34a_100000085407_100009816466 [0,0,0,1,0,0|2,0,0]=3 7474 B15R1.975 COC(=O)CCCCCOC1CCOC1 34a_100000074720_100000690089 [0,0,0,1,0,0|2,0,0]=3 7475 B15R1.975 COC(=O)CCCCCOC1CCOC1 7a_100000074720_100000731011 [0,0,0,1,0,0|2,0,0]=3 7476 B15R1.975 COC(=O)CCCCCOC1CCSC1 7a_100011232664_100009816466 [0,0,0,1,0,0|2,0,0]=3 7477 B15R1.975 COC(=O)CCCCCO[C@H]1CCOC1 34a_100000717292_100009816466 [0,0,0,1,0,0|2,0,0]=3 7478 B15R1.975 COC(=O)CCCCCSC1CCCC1 62a_100009816466_100000179811 [0,0,0,1,0,0|1,0,0]=2 7479 B15R1.975 COC(=O)CCCCCSC1CCCC1 62a_100011217020_100009816466 [0,0,0,1,0,0|1,0,0]=2 7480 B15R1.975 COC(=O)CCCCCSC1CCOC1 62a_100009816466_100000690089 [0,0,0,1,0,0|2,0,0]=3 7481 B15R1.975 COC(=O)CCCCNCC1CCCC1 2230a_100000737975_100000204269 [0,0,0,1,0,0|1,0,0]=2 7482 B15R1.975 COC(=O)CCCCNCC1CCCC1 34a_100000737975_100000204269 [0,0,0,1,0,0|1,0,0]=2 7483 B15R1.975 COC(=O)CCCCNCC1CCOC1 2230a_100000737293_100000204269 [0,0,0,1,0,0|2,0,0]=3 7484 B15R1.975 COC(=O)CCCCNCC1CCOC1 34a_100000737293_100000204269 [0,0,0,1,0,0|2,0,0]=3 7485 B15R1.975 COC(=O)CCCCNCC1OCCO1 2230a_100000036311_100000204269 [0,0,0,1,0,0|3,0,0]=4 7486 B15R1.975 COC(=O)CCCCNCC1OCCO1 34a_100000036311_100000204269 [0,0,0,1,0,0|3,0,0]=4 7487 B15R1.975 COC(=O)CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000204269 [0,0,0,1,0,0|2,0,0]=3 7488 B15R1.975 COC(=O)CCCCNC[C@@H]1CCCO1 34a_100020590478_100000204269 [0,0,0,1,0,0|2,0,0]=3 7489 B15R1.975 COC(=O)CCCCOCC1CC=CC1 34a_100000688395_100000204269 [0,0,0,1,0,0|1,0,2]=4 7490 B15R1.975 COC(=O)CCCCOCC1CCCC1 34a_100000059025_100000740388 [0,0,0,1,0,0|1,0,0]=2 7491 B15R1.975 COC(=O)CCCCOCC1CCCC1 34a_100000742336_100000204269 [0,0,0,1,0,0|1,0,0]=2 7492 B15R1.975 COC(=O)CCCCOCC1CCCC1 7a_100000059025_100000740388 [0,0,0,1,0,0|1,0,0]=2 7493 B15R1.975 COC(=O)CCCCOCC1CCCC1 7a_100000742336_100000204269 [0,0,0,1,0,0|1,0,0]=2 7494 B15R1.975 COC(=O)CCCCOCC1CCCO1 34a_100000210270_100000204269 [0,0,0,1,0,0|2,0,0]=3 7495 B15R1.975 COC(=O)CCCCOCC1CCCO1 7a_100000059025_100000203698 [0,0,0,1,0,0|2,0,0]=3 7496 B15R1.975 COC(=O)CCCCOCC1CCCO1 7a_100000210270_100000204269 [0,0,0,1,0,0|2,0,0]=3 7497 B15R1.975 COC(=O)CCCCOCC1CCNC1 34a_100000748654_100000204269 [0,0,0,1,0,0|2,0,0]=3 7498 B15R1.975 COC(=O)CCCCOCC1CCOC1 34a_100000059025_100011261433 [0,0,0,1,0,0|2,0,0]=3 7499 B15R1.975 COC(=O)CCCCOCC1CCOC1 34a_100000740260_100000204269 [0,0,0,1,0,0|2,0,0]=3 7500 B15R1.975 COC(=O)CCCCOCC1CCOC1 7a_100000059025_100000702531 [0,0,0,1,0,0|2,0,0]=3 7501 B15R1.975 COC(=O)CCCCOCC1COCO1 34a_100011216627_100000204269 [0,0,0,1,0,0|3,0,0]=4 7502 B15R1.975 COC(=O)CCCCOCC1OCCO1 34a_100000059025_100000755774 [0,0,0,1,0,0|3,0,0]=4 7503 B15R1.975 COC(=O)CCCCOCC1OCCO1 34a_100000087154_100000204269 [0,0,0,1,0,0|3,0,0]=4 7504 B15R1.975 COC(=O)CCCCOCC1OCCO1 7a_100000059025_100000755774 [0,0,0,1,0,0|3,0,0]=4 7505 B15R1.975 COC(=O)CCCCOC[C@H]1CCCN1 34a_100000745186_100000204269 [0,0,0,1,0,0|2,0,0]=3 7506 B15R1.975 COC(=O)CCCCSCC1CCCC1 62a_100000204269_100000740388 [0,0,0,1,0,0|1,0,0]=2 7507 B15R1.975 COC(=O)CCCCSCC1CCCC1 62a_100000740388_100000204269 [0,0,0,1,0,0|1,0,0]=2 7508 B15R1.975 COC(=O)CCCCSCC1CCCO1 62a_100000203698_100000204269 [0,0,0,1,0,0|2,0,0]=3 7509 B15R1.975 COC(=O)CCCCSCC1CCCO1 62a_100000204269_100000203698 [0,0,0,1,0,0|2,0,0]=3 7510 B15R1.975 COC(=O)CCCCSCC1CCOC1 62a_100000204269_100000702531 [0,0,0,1,0,0|2,0,0]=3 7511 B15R1.975 COC(=O)CCCCSCC1CCOC1 62a_100000702531_100000204269 [0,0,0,1,0,0|2,0,0]=3 7512 B15R1.975 COC(=O)CCCCSCC1OCCO1 62a_100000204269_100000755774 [0,0,0,1,0,0|3,0,0]=4 7513 B15R1.975 COC(=O)CCCCSCC1OCCO1 62a_100000755774_100000204269 [0,0,0,1,0,0|3,0,0]=4 7514 B15R1.975 COC(=O)CCCNCCC1CCCC1 2230a_100000739158_100011218270 [0,0,0,1,0,0|1,0,0]=2 7515 B15R1.975 COC(=O)CCCNCCC1CCCC1 34a_100000739158_100000742333 [0,0,0,1,0,0|1,0,0]=2 7516 B15R1.975 COC(=O)CCCNCCC1OCCO1 2230a_100000034215_100011218270 [0,0,0,1,0,0|3,0,0]=4 7517 B15R1.975 COC(=O)CCCNCCC1OCCO1 34a_100000034215_100000742333 [0,0,0,1,0,0|3,0,0]=4 7518 B15R1.975 COC(=O)CCCOCCC1CCCC1 34a_100000749090_100000742333 [0,0,0,1,0,0|1,0,0]=2 7519 B15R1.975 COC(=O)CCCOCCC1CCCC1 7a_100000749090_100011218270 [0,0,0,1,0,0|1,0,0]=2 7520 B15R1.975 COC(=O)CCCOCCC1CCNC1 34a_100016987287_100000742333 [0,0,0,1,0,0|2,0,0]=3 7521 B15R1.975 COC(=O)CCCOCCC1CCOC1 34a_100011879284_100000742333 [0,0,0,1,0,0|2,0,0]=3 7522 B15R1.975 COC(=O)CCCSCCC1CCCC1 62a_100000760354_100011218270 [0,0,0,1,0,0|1,0,0]=2 7523 B15R1.975 COC(=O)CCCSCCC1CCCC1 62a_100011218270_100000760354 [0,0,0,1,0,0|1,0,0]=2 7524 B15R1.975 COC(=O)CCCSCCC1OCCO1 62a_100011218270_100000740749 [0,0,0,1,0,0|3,0,0]=4 7525 B15R1.975 COC(=O)CCCSCCN1CCCC1 62a_100000700749_100011218270 [0,0,0,1,0,0|2,0,0]=3 7526 B15R1.975 COC(=O)CCCSCCN1CCCC1 62a_100011218270_100000004467 [0,0,0,1,0,0|2,0,0]=3 7527 B15R1.975 COC(=O)CCNCCCC1CCCC1 2230a_100000736752_100000204255 [0,0,0,1,0,0|1,0,0]=2 7528 B15R1.975 COC(=O)CCNCCCC1CCCC1 34a_100000736752_100000742370 [0,0,0,1,0,0|1,0,0]=2 7529 B15R1.975 COC(=O)CCNCCOC1CCCC1 34a_100000741755_100000742370 [0,0,0,1,0,0|2,0,0]=3 7530 B15R1.975 COC(=O)CCOCCCC1CCCC1 34a_100011215328_100000742370 [0,0,0,1,0,0|1,0,0]=2 7531 B15R1.975 COC(=O)CCOCCCC1CCCC1 7a_100011215328_100000204255 [0,0,0,1,0,0|1,0,0]=2 7532 B15R1.975 COC(=O)CCOCCCC1OCCO1 34a_100009871617_100000742370 [0,0,0,1,0,0|3,0,0]=4 7533 B15R1.975 COC(=O)CCOCCCC1OCCO1 7a_100009871617_100000204255 [0,0,0,1,0,0|3,0,0]=4 7534 B15R1.975 COC(=O)CCOCCNC1CCCC1 34a_200000200444_100000742370 [0,0,0,1,0,0|2,0,0]=3 7535 B15R1.975 COC(=O)CCOCCOC1CCCC1 34a_100000738311_100000742370 [0,0,0,1,0,0|2,0,0]=3 7536 B15R1.975 COC(=O)CCOCCOC1CCCC1 7a_100000738311_100000204255 [0,0,0,1,0,0|2,0,0]=3 7537 B15R1.975 COC(=O)CCSCCCC1CCCC1 62a_100000204255_100011713738 [0,0,0,1,0,0|1,0,0]=2 7538 B15R1.975 COC(=O)CCSCCCC1CCCC1 62a_100011713738_100000204255 [0,0,0,1,0,0|1,0,0]=2 7539 B15R1.975 COC(=O)CCSCCCC1OCCO1 62a_100000204255_100000042513 [0,0,0,1,0,0|3,0,0]=4 7540 B15R1.975 COC(=O)CCSCCCN1CCCC1 62a_100000204255_100011445909 [0,0,0,1,0,0|2,0,0]=3 7541 B15R1.975 COC(=O)CCSCCCN1CCCC1 62a_100016991639_100000204255 [0,0,0,1,0,0|2,0,0]=3 7542 B15R1.975 COC(=O)CNCCCOC1CCCC1 34a_100000747560_100000747449 [0,0,0,1,0,0|2,0,0]=3 7543 B15R1.975 COC(=O)COCCNCC1CCCC1 2230a_100000737975_100000090808 [0,0,0,1,0,0|2,0,0]=3 7544 B15R1.975 COC(=O)COCCNCC1CCCC1 34a_100000737975_100000090808 [0,0,0,1,0,0|2,0,0]=3 7545 B15R1.975 COC(=O)COCCNCC1CCOC1 2230a_100000737293_100000090808 [0,0,0,1,0,0|3,0,0]=4 7546 B15R1.975 COC(=O)COCCNCC1CCOC1 34a_100000737293_100000090808 [0,0,0,1,0,0|3,0,0]=4 7547 B15R1.975 COC(=O)COCCNC[C@@H]1CCCO1 2230a_100020590478_100000090808 [0,0,0,1,0,0|3,0,0]=4 7548 B15R1.975 COC(=O)COCCNC[C@@H]1CCCO1 34a_100020590478_100000090808 [0,0,0,1,0,0|3,0,0]=4 7549 B15R1.975 COC(=O)COCCOCC1CCCC1 34a_100000742336_100000090808 [0,0,0,1,0,0|2,0,0]=3 7550 B15R1.975 COC(=O)COCCOCC1CCCC1 7a_100000742336_100000090808 [0,0,0,1,0,0|2,0,0]=3 7551 B15R1.975 COC(=O)COCCOCC1CCCO1 34a_100000210270_100000090808 [0,0,0,1,0,0|3,0,0]=4 7552 B15R1.975 COC(=O)COCCOCC1CCCO1 7a_100000210270_100000090808 [0,0,0,1,0,0|3,0,0]=4 7553 B15R1.975 COC(=O)COCCOCC1CCNC1 34a_100000748654_100000090808 [0,0,0,1,0,0|3,0,0]=4 7554 B15R1.975 COC(=O)COCCOCC1CCOC1 34a_100000740260_100000090808 [0,0,0,1,0,0|3,0,0]=4 7555 B15R1.975 COC(=O)COCCOC[C@H]1CCCN1 34a_100000745186_100000090808 [0,0,0,1,0,0|3,0,0]=4 7556 B15R1.975 COC(=O)COCCSCC1CCCC1 62a_100000090808_100000740388 [0,0,0,1,0,0|2,0,0]=3 7557 B15R1.975 COC(=O)COCCSCC1CCCC1 62a_100000740388_100000090808 [0,0,0,1,0,0|2,0,0]=3 7558 B15R1.975 COC(=O)COCCSCC1CCCO1 62a_100000090808_100000203698 [0,0,0,1,0,0|3,0,0]=4 7559 B15R1.975 COC(=O)COCCSCC1CCCO1 62a_100000203698_100000090808 [0,0,0,1,0,0|3,0,0]=4 7560 B15R1.975 COC(=O)COCCSCC1CCOC1 62a_100000090808_100000702531 [0,0,0,1,0,0|3,0,0]=4 7561 B15R1.975 COC(=O)COCCSCC1CCOC1 62a_100000702531_100000090808 [0,0,0,1,0,0|3,0,0]=4 7562 B15R1.975 COC(=O)CSCCCCC1OCCO1 62a_100000747449_100000034956 [0,0,0,1,0,0|3,0,0]=4 7563 B15R1.975 COC(=O)NCCOCCC1CCCC1 34a_100000757965_100000760354 [0,0,0,1,0,0|2,0,0]=3 7564 B15R1.975 COC(=O)OCCOCCC1CCCC1 34a_100010262106_100000760354 [0,0,0,1,0,0|2,0,0]=3 7565 B15R1.975 COC(=O)OCSCCCC1CCCC1 62a_100011713738_100000139417 [0,0,0,1,0,0|2,0,0]=3 7566 B15R1.975 COC(=O)OCSCCCN1CCCC1 62a_100016991639_100000139417 [0,0,0,1,0,0|3,0,0]=4 7567 B15R1.975 COC(C)CCOCCCC1CCCC1 7a_100000764861_100011713738 [0,0,0,1,0,0|2,0,1]=4 7568 B15R1.975 NNC(=O)CCCOCCC1CCCC1 34a_100000211488_100000760354 [0,0,0,1,0,0|3,0,0]=4 7569 B15R1.1052 CCC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000747405 [0,0,0,1,0,0|3,0,0]=4 7570 B15R1.1052 CCC(=O)CN1CCCCC1CCOC 269982a_100015186528_100000747405 [0,0,0,1,0,0|3,0,0]=4 7571 B15R1.1052 CCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210211 [0,0,0,1,0,0|2,0,0]=3 7572 B15R1.1052 CCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210210 [0,0,0,1,0,0|2,0,0]=3 7573 B15R1.1052 CNC(=O)CN1CCCCC1CCCO 2230a_100011934581_100000183359 [0,0,0,1,0,0|3,0,0]=4 7574 B15R1.1052 CNC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000183359 [0,0,0,1,0,0|3,0,0]=4 7575 B15R1.1052 CNC(=O)CN1CCCCC1CCCO 34a_100011934581_100000183359 [0,0,0,1,0,0|3,0,0]=4 7576 B15R1.1052 CNC(=O)CN1CCCCC1CCOC 2230a_100015186528_100000183359 [0,0,0,1,0,0|3,0,0]=4 7577 B15R1.1052 CNC(=O)CN1CCCCC1CCOC 269982a_100015186528_100000183359 [0,0,0,1,0,0|3,0,0]=4 7578 B15R1.1052 CNC(=O)CN1CCCCC1CCOC 34a_100015186528_100000183359 [0,0,0,1,0,0|3,0,0]=4 7579 B15R1.1052 COC(=O)CC1COCCN1CCCF 2230a_100000731486_100011934791 [0,0,0,1,0,0|3,0,0]=4 7580 B15R1.1052 COC(=O)CC1COCCN1CCCF 34a_100000731486_100011934791 [0,0,0,1,0,0|3,0,0]=4 7581 B15R1.1052 COC(=O)CC1COCCN1CCCO 2230a_100000731486_100000230001 [0,0,0,1,0,0|3,0,0]=4 7582 B15R1.1052 COC(=O)CC1COCCN1CCCO 34a_100000731486_100000230001 [0,0,0,1,0,0|3,0,0]=4 7583 B15R1.1052 COC(=O)CC1COCCN1CCSC 2230a_100000731486_100000751147 [0,0,0,1,0,0|3,0,0]=4 7584 B15R1.1052 COC(=O)CC1COCCN1CCSC 34a_100000731486_100000212216 [0,0,0,1,0,0|3,0,0]=4 7585 B15R1.1052 COC(=O)CN1CCCCC1CCCO 2230a_100011934581_100000747449 [0,0,0,1,0,0|2,0,0]=3 7586 B15R1.1052 COC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000747449 [0,0,0,1,0,0|2,0,0]=3 7587 B15R1.1052 COC(=O)CN1CCCCC1CCCO 34a_100011934581_100000747449 [0,0,0,1,0,0|2,0,0]=3 7588 B15R1.1052 COCCC1CCCCN1CC(=O)OC 2230a_100015186528_100000747449 [0,0,0,1,0,0|2,0,0]=3 7589 B15R1.1052 COCCC1CCCCN1CC(=O)OC 269982a_100015186528_100000747449 [0,0,0,1,0,0|2,0,0]=3 7590 B15R1.1052 COCCC1CCCCN1CC(=O)OC 34a_100015186528_100000747449 [0,0,0,1,0,0|2,0,0]=3 7591 B15R1.1052 COCCN1CCOCC1CC(=O)OC 2230a_100000731486_100011201679 [0,0,0,1,0,0|3,0,0]=4 7592 B15R1.1052 COCCN1CCOCC1CC(=O)OC 34a_100000731486_100011201679 [0,0,0,1,0,0|3,0,0]=4 7593 B15R1.1090 COC(=O)CCSC1CCCCCC1=O 62a_100000204255_100000243696 [0,0,0,1,0,0|2,0,1]=4 7594 B15R1.1090 COC(=O)CCSC1CCCCCC1=O 62a_100000243696_100000204255 [0,0,0,1,0,0|2,0,1]=4 7595 B15R1.1091 CCC(=O)COCCC1CCCCN1C 34a_100000725409_100000211948 [0,0,0,1,0,0|3,0,0]=4 7596 B15R1.1091 CCC(=O)CSCCC1CCCCN1C 62a_100000211948_100000747405 [0,0,0,1,0,0|3,0,0]=4 7597 B15R1.1091 CCC(=O)CSCCC1CCCCN1C 62a_100000747405_100000211948 [0,0,0,1,0,0|3,0,0]=4 7598 B15R1.1091 CCC(=O)NCCCN1CCCCC1C 240690a_100000212276_100000210414 [0,0,0,1,0,0|3,0,0]=4 7599 B15R1.1091 CCC(=O)NCCCN1CCCCC1C 527a_100000212276_100000210414 [0,0,0,1,0,0|3,0,0]=4 7600 B15R1.1091 CCC(=O)NCCNC1CCCCC1C 269862a_100132302217_100000210921 [0,0,0,1,0,0|3,0,0]=4 7601 B15R1.1091 CCC(=O)NCCNC1CCCCC1C 270004a_100132302217_100000210921 [0,0,0,1,0,0|3,0,0]=4 7602 B15R1.1091 CNC(=O)CCCNC1CCCCC1C 2230a_100000211402_100000741757 [0,0,0,1,0,0|2,0,0]=3 7603 B15R1.1091 CNC(=O)CCCNC1CCCCC1C 269862a_100000740002_100000210921 [0,0,0,1,0,0|2,0,0]=3 7604 B15R1.1091 CNC(=O)CCCNC1CCCCC1C 270004a_100000740002_100000210921 [0,0,0,1,0,0|2,0,0]=3 7605 B15R1.1091 CNC(=O)CCCNC1CCCCC1C 34a_100000211402_100000741757 [0,0,0,1,0,0|2,0,0]=3 7606 B15R1.1091 CNC(=O)CCCNC1CCCCC1F 34a_100000740002_100015423560 [0,0,0,1,0,0|3,0,0]=4 7607 B15R1.1091 CNC(=O)CCCNC1CCCCC1O 34a_100000740002_100000038908 [0,0,0,1,0,0|3,0,0]=4 7608 B15R1.1091 CNC(=O)CCCNC1CCNCC1C 270004a_100000740002_100000703950 [0,0,0,1,0,0|3,0,0]=4 7609 B15R1.1091 CNC(=O)CCCNC1CCOCC1C 270004a_100000740002_100000755695 [0,0,0,1,0,0|3,0,0]=4 7610 B15R1.1091 CNC(=O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000741757 [0,0,0,1,0,0|3,0,0]=4 7611 B15R1.1091 CNC(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000741757 [0,0,0,1,0,0|3,0,0]=4 7612 B15R1.1091 CNC(=O)CCCOC1CCCCC1C 34a_100000211207_100000741757 [0,0,0,1,0,0|2,0,0]=3 7613 B15R1.1091 CNC(=O)CCCOC1CCCCC1C 7a_100000211207_100000741757 [0,0,0,1,0,0|2,0,0]=3 7614 B15R1.1091 CNC(=O)CCCOC1CCCCC1Cl 34a_100000038908_100000741757 [0,0,0,1,0,0|3,0,0]=4 7615 B15R1.1091 CNC(=O)CCCOC1CCCCC1Cl 7a_100000038908_100000741757 [0,0,0,1,0,0|3,0,0]=4 7616 B15R1.1091 CNC(=O)CCCOC1CCNCC1C 34a_100011998114_100000741757 [0,0,0,1,0,0|3,0,0]=4 7617 B15R1.1091 CNC(=O)CCCOC1CNCCC1C 34a_100000696640_100000741757 [0,0,0,1,0,0|3,0,0]=4 7618 B15R1.1091 CNC(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000741757 [0,0,0,1,0,0|3,0,0]=4 7619 B15R1.1091 CNC(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000741757 [0,0,0,1,0,0|3,0,0]=4 7620 B15R1.1091 CNC(=O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000741757 [0,0,0,1,0,0|3,0,0]=4 7621 B15R1.1091 CNC(=O)CCCSC1CCCCC1F 62a_100000741757_100015423560 [0,0,0,1,0,0|3,0,0]=4 7622 B15R1.1091 CNC(=O)CCCSC1CCCCC1F 62a_100015423560_100000741757 [0,0,0,1,0,0|3,0,0]=4 7623 B15R1.1091 CNC(=O)CCCSC1CCCCC1O 62a_100000038908_100000741757 [0,0,0,1,0,0|3,0,0]=4 7624 B15R1.1091 CNC(=O)CCCSC1CCCCC1O 62a_100000741757_100000038908 [0,0,0,1,0,0|3,0,0]=4 7625 B15R1.1091 CNC(=O)CCNCC1CCCCC1O 34a_100011216029_100012179268 [0,0,0,1,0,0|3,0,0]=4 7626 B15R1.1091 CNC(=O)CCNCC1CCCCN1C 34a_100000738227_100015186950 [0,0,0,1,0,0|3,0,0]=4 7627 B15R1.1091 CNC(=O)CCNCC1CCCCN1C 34a_100011228421_100012179268 [0,0,0,1,0,0|3,0,0]=4 7628 B15R1.1091 CNC(=O)CCOCC1CCCCN1C 34a_100000225079_100012179268 [0,0,0,1,0,0|3,0,0]=4 7629 B15R1.1091 CNC(=O)CCOCC1CCCCN1C 34a_100000754576_100015186950 [0,0,0,1,0,0|3,0,0]=4 7630 B15R1.1091 CNC(=O)CCSCC1CCCCN1C 62a_100000737683_100015185383 [0,0,0,1,0,0|3,0,0]=4 7631 B15R1.1091 CNC(=O)CCSCC1CCCCN1C 62a_100015185383_100000737683 [0,0,0,1,0,0|3,0,0]=4 7632 B15R1.1091 CNC(=O)CNCCC1CCCCN1C 2230a_100000693194_100000211948 [0,0,0,1,0,0|3,0,0]=4 7633 B15R1.1091 CNC(=O)CNCCN1CCCCC1C 2230a_100000739827_100000183359 [0,0,0,1,0,0|3,0,0]=4 7634 B15R1.1091 CNC(=O)CNCCN1CCCCC1C 34a_100000739827_100000183359 [0,0,0,1,0,0|3,0,0]=4 7635 B15R1.1091 CNC(=O)COCCC1CCCCN1C 34a_100000750040_100000211948 [0,0,0,1,0,0|3,0,0]=4 7636 B15R1.1091 CNC(=O)COCCN1CCCCC1C 34a_100011305533_100000183359 [0,0,0,1,0,0|3,0,0]=4 7637 B15R1.1091 CNC(=O)CSCCC1CCCCN1C 62a_100000183359_100000211948 [0,0,0,1,0,0|3,0,0]=4 7638 B15R1.1091 CNC(=O)CSCCC1CCCCN1C 62a_100000211948_100000183359 [0,0,0,1,0,0|3,0,0]=4 7639 B15R1.1091 CNC(=O)NCCCN1CCCCC1C 2708a_100102657272_100000212276 [0,0,0,1,0,0|3,0,0]=4 7640 B15R1.1091 CNC(=O)NCCCN1CCCCC1C 273464a_100000212276_100102657272 [0,0,0,1,0,0|3,0,0]=4 7641 B15R1.1091 CNC(=O)NCCCN1CCCCC1C 273464a_100102657272_100000212276 [0,0,0,1,0,0|3,0,0]=4 7642 B15R1.1091 CNC(=O)NCCCN1CCCCC1C 512a_106832991638_100000212276 [0,0,0,1,0,0|3,0,0]=4 7643 B15R1.1091 CNC(=O)NCCNC1CCCCC1C 269862a_100015205895_100000210921 [0,0,0,1,0,0|3,0,0]=4 7644 B15R1.1091 CNC(=O)OCCNC1CCCCC1C 34a_100000211402_200011997002 [0,0,0,1,0,0|3,0,0]=4 7645 B15R1.1091 CNC(=O)OCCOC1CCCCC1C 34a_100000211207_200011997002 [0,0,0,1,0,0|3,0,0]=4 7646 B15R1.1091 CNC(=O)OCCOC1CCCCC1C 7a_100000211207_200011997002 [0,0,0,1,0,0|3,0,0]=4 7647 B15R1.1091 COC(=O)/C=C/CNC1CCCCC1C 2230a_100000211402_100000742655 [0,0,0,1,0,0|1,0,2]=4 7648 B15R1.1091 COC(=O)/C=C/CNC1CCCCC1C 34a_100000211402_100000742655 [0,0,0,1,0,0|1,0,2]=4 7649 B15R1.1091 COC(=O)/C=C/COC1CCCCC1C 34a_100000211207_100000742655 [0,0,0,1,0,0|1,0,2]=4 7650 B15R1.1091 COC(=O)/C=C/COC1CCCCC1C 7a_100000211207_100000742655 [0,0,0,1,0,0|1,0,2]=4 7651 B15R1.1091 COC(=O)CCCCN1CCCCC1C 2230a_100000211376_100000204269 [0,0,0,1,0,0|1,0,0]=2 7652 B15R1.1091 COC(=O)CCCCN1CCCCC1C 269982a_100000211376_100000204269 [0,0,0,1,0,0|1,0,0]=2 7653 B15R1.1091 COC(=O)CCCCN1CCCCC1C 34a_100000211376_100000204269 [0,0,0,1,0,0|1,0,0]=2 7654 B15R1.1091 COC(=O)CCCCN1CCOC[C@@H]1C 2230a_100009815349_100000204269 [0,0,0,1,0,0|2,0,0]=3 7655 B15R1.1091 COC(=O)CCCCN1CCOC[C@@H]1C 269982a_100009815349_100000204269 [0,0,0,1,0,0|2,0,0]=3 7656 B15R1.1091 COC(=O)CCCCN1CCOC[C@@H]1C 34a_100009815349_100000204269 [0,0,0,1,0,0|2,0,0]=3 7657 B15R1.1091 COC(=O)CCCNC1CCCCC1C 2230a_100000211402_100011218270 [0,0,0,1,0,0|1,0,0]=2 7658 B15R1.1091 COC(=O)CCCNC1CCCCC1C 34a_100000211402_100000742333 [0,0,0,1,0,0|1,0,0]=2 7659 B15R1.1091 COC(=O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011218270 [0,0,0,1,0,0|2,0,0]=3 7660 B15R1.1091 COC(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000742333 [0,0,0,1,0,0|2,0,0]=3 7661 B15R1.1091 COC(=O)CCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011218270 [0,0,0,1,0,0|3,0,0]=4 7662 B15R1.1091 COC(=O)CCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100011218270 [0,0,0,1,0,0|3,0,0]=4 7663 B15R1.1091 COC(=O)CCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000742333 [0,0,0,1,0,0|3,0,0]=4 7664 B15R1.1091 COC(=O)CCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011218270 [0,0,0,1,0,0|3,0,0]=4 7665 B15R1.1091 COC(=O)CCCOC1CCCCC1=O 34a_100011214950_100000742333 [0,0,0,1,0,0|2,0,1]=4 7666 B15R1.1091 COC(=O)CCCOC1CCCCC1C 34a_100000211207_100000742333 [0,0,0,1,0,0|1,0,0]=2 7667 B15R1.1091 COC(=O)CCCOC1CCCCC1C 7a_100000211207_100011218270 [0,0,0,1,0,0|1,0,0]=2 7668 B15R1.1091 COC(=O)CCCOC1CCCCC1Cl 34a_100000038908_100000742333 [0,0,0,1,0,0|2,0,0]=3 7669 B15R1.1091 COC(=O)CCCOC1CCCCC1Cl 7a_100000038908_100011218270 [0,0,0,1,0,0|2,0,0]=3 7670 B15R1.1091 COC(=O)CCCOC1CCNCC1C 34a_100011998114_100000742333 [0,0,0,1,0,0|2,0,0]=3 7671 B15R1.1091 COC(=O)CCCOC1CNCCC1C 34a_100000696640_100000742333 [0,0,0,1,0,0|2,0,0]=3 7672 B15R1.1091 COC(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000742333 [0,0,0,1,0,0|2,0,0]=3 7673 B15R1.1091 COC(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011218270 [0,0,0,1,0,0|2,0,0]=3 7674 B15R1.1091 COC(=O)CCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000742333 [0,0,0,1,0,0|3,0,0]=4 7675 B15R1.1091 COC(=O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000742333 [0,0,0,1,0,0|2,0,0]=3 7676 B15R1.1091 COC(=O)CCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000742333 [0,0,0,1,0,0|3,0,0]=4 7677 B15R1.1091 COC(=O)CCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000742333 [0,0,0,1,0,0|3,0,0]=4 7678 B15R1.1091 COC(=O)CCCSC1CCCCC1=O 62a_100000204591_100011218270 [0,0,0,1,0,0|2,0,1]=4 7679 B15R1.1091 COC(=O)CCCSC1CCCCC1=O 62a_100011218270_100000204591 [0,0,0,1,0,0|2,0,1]=4 7680 B15R1.1091 COC(=O)CCCSC1CCCCC1F 62a_100011218270_100015423560 [0,0,0,1,0,0|2,0,0]=3 7681 B15R1.1091 COC(=O)CCCSC1CCCCC1F 62a_100015423560_100011218270 [0,0,0,1,0,0|2,0,0]=3 7682 B15R1.1091 COC(=O)CCCSC1CCCCC1O 62a_100000038908_100011218270 [0,0,0,1,0,0|2,0,0]=3 7683 B15R1.1091 COC(=O)CCCSC1CCCCC1O 62a_100011218270_100000038908 [0,0,0,1,0,0|2,0,0]=3 7684 B15R1.1091 COC(=O)CCNCC1CCCCC1O 34a_100011216029_100000742370 [0,0,0,1,0,0|2,0,0]=3 7685 B15R1.1091 COC(=O)CCNCC1CCCCN1C 34a_100011228421_100000742370 [0,0,0,1,0,0|2,0,0]=3 7686 B15R1.1091 COC(=O)CCOCC1CC=CCC1C 34a_100000211322_100000742370 [0,0,0,1,0,0|1,0,2]=4 7687 B15R1.1091 COC(=O)CCOCC1CCCCC1=O 34a_100009861125_100000742370 [0,0,0,1,0,0|2,0,1]=4 7688 B15R1.1091 COC(=O)CCOCC1CCCCC1=O 7a_100009861125_100000204255 [0,0,0,1,0,0|2,0,1]=4 7689 B15R1.1091 COC(=O)CCOCC1CCCCN1C 34a_100000225079_100000742370 [0,0,0,1,0,0|2,0,0]=3 7690 B15R1.1091 COC(=O)CCOCC1COCCC1N 34a_214813039666_100000742370 [0,0,0,1,0,0|3,0,0]=4 7691 B15R1.1091 COC(=O)CCOCC1COCCN1C 34a_100013547906_100000742370 [0,0,0,1,0,0|3,0,0]=4 7692 B15R1.1091 COC(=O)CCSCC1CCCCN1C 62a_100000204255_100015185383 [0,0,0,1,0,0|2,0,0]=3 7693 B15R1.1091 COC(=O)CCSCC1CCCCN1C 62a_100015185383_100000204255 [0,0,0,1,0,0|2,0,0]=3 7694 B15R1.1091 COC(=O)CNCCN1CCCCC1C 2230a_100000739827_100000747449 [0,0,0,1,0,0|2,0,0]=3 7695 B15R1.1091 COC(=O)CNCCN1CCCCC1C 34a_100000739827_100000747449 [0,0,0,1,0,0|2,0,0]=3 7696 B15R1.1091 COC(=O)COCCN1CCCCC1C 2230a_100000211376_100000090808 [0,0,0,1,0,0|2,0,0]=3 7697 B15R1.1091 COC(=O)COCCN1CCCCC1C 34a_100000211376_100000090808 [0,0,0,1,0,0|2,0,0]=3 7698 B15R1.1091 COC(=O)COCCN1CCCCC1C 34a_100011305533_100000747449 [0,0,0,1,0,0|2,0,0]=3 7699 B15R1.1091 COC(=O)COCCN1CCOC[C@@H]1C 2230a_100009815349_100000090808 [0,0,0,1,0,0|3,0,0]=4 7700 B15R1.1091 COC(=O)COCCN1CCOC[C@@H]1C 34a_100009815349_100000090808 [0,0,0,1,0,0|3,0,0]=4 7701 B15R1.1091 COC(=O)CSCCC1CCCCN1C 62a_100000211948_100000747449 [0,0,0,1,0,0|2,0,0]=3 7702 B15R1.1091 COC(=O)CSCCC1CCCCN1C 62a_100000747449_100000211948 [0,0,0,1,0,0|2,0,0]=3 7703 B15R1.1091 COC(=O)NCCOC1CCCCC1F 34a_100000757965_100015423560 [0,0,0,1,0,0|3,0,0]=4 7704 B15R1.1091 COC(=O)NCCOC1CCCCC1O 34a_100000757965_100000038908 [0,0,0,1,0,0|3,0,0]=4 7705 B15R1.1091 COC(=O)OCCOC1CCCCC1F 34a_100010262106_100015423560 [0,0,0,1,0,0|3,0,0]=4 7706 B15R1.1091 COC(=O)OCCOC1CCCCC1O 34a_100010262106_100000038908 [0,0,0,1,0,0|3,0,0]=4 7707 B15R1.1091 COC(=O)OCSCC1CCCCN1C 62a_100015185383_100000139417 [0,0,0,1,0,0|3,0,0]=4 7708 B15R1.1101 COC(=O)CCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009815986 [0,0,0,1,0,0|2,0,0]=3 7709 B15R1.1101 COC(=O)CCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009815986 [0,0,0,1,0,0|2,0,0]=3 7710 B15R1.1101 COC(=O)CCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009815986 [0,0,0,1,0,0|2,0,0]=3 7711 B15R1.1101 COC(=O)CCCCCOCC1CC1C 34a_100000744939_100009816466 [0,0,0,1,0,0|1,0,0]=2 7712 B15R1.1101 COC(=O)CCCCCOCC1CC1C 7a_100000744939_100009816466 [0,0,0,1,0,0|1,0,0]=2 7713 B15R1.1102 COC(=O)CCCC=NNCC1CCC1 4a_200020586977_100000094087 [0,0,0,1,0,0|2,0,1]=4 7714 B15R1.1102 COC(=O)CCCCC=NNC1CCC1 4a_100000736358_100000052768 [0,0,0,1,0,0|2,0,1]=4 7715 B15R1.1102 COC(=O)CCCCCCCN1CCC1 269982a_100000754969_100010004213 [0,0,0,1,0,0|1,0,0]=2 7716 B15R1.1102 COC(=O)CCCCCCNC1CCC1 2230a_100000749019_100009815986 [0,0,0,1,0,0|1,0,0]=2 7717 B15R1.1102 COC(=O)CCCCCCNC1CCC1 34a_100000749019_100009815986 [0,0,0,1,0,0|1,0,0]=2 7718 B15R1.1102 COC(=O)CCCCCCNC1COC1 2230a_100016991112_100009815986 [0,0,0,1,0,0|2,0,0]=3 7719 B15R1.1102 COC(=O)CCCCCCOC1CCC1 34a_100000748187_100009815986 [0,0,0,1,0,0|1,0,0]=2 7720 B15R1.1102 COC(=O)CCCCCCOC1CCC1 34a_100009863599_100000749161 [0,0,0,1,0,0|1,0,0]=2 7721 B15R1.1102 COC(=O)CCCCCCOC1COC1 34a_100009863599_100009818527 [0,0,0,1,0,0|2,0,0]=3 7722 B15R1.1102 COC(=O)CCCCCCOC1COC1 7a_100009863599_100009818527 [0,0,0,1,0,0|2,0,0]=3 7723 B15R1.1102 COC(=O)CCCCCCOC1CSC1 7a_100000072292_100009815986 [0,0,0,1,0,0|2,0,0]=3 7724 B15R1.1102 COC(=O)CCCCCCSC1CCC1 62a_100009815986_100000749161 [0,0,0,1,0,0|1,0,0]=2 7725 B15R1.1102 COC(=O)CCCCCCSC1COC1 62a_100009815986_100009818527 [0,0,0,1,0,0|2,0,0]=3 7726 B15R1.1102 COC(=O)CCCCCNCC1CCC1 2230a_100000738700_100009816466 [0,0,0,1,0,0|1,0,0]=2 7727 B15R1.1102 COC(=O)CCCCCNCC1CCC1 34a_100000738700_100009816466 [0,0,0,1,0,0|1,0,0]=2 7728 B15R1.1102 COC(=O)CCCCCNCC1COC1 2230a_100015281925_100009816466 [0,0,0,1,0,0|2,0,0]=3 7729 B15R1.1102 COC(=O)CCCCCNCC1COC1 34a_100015281925_100009816466 [0,0,0,1,0,0|2,0,0]=3 7730 B15R1.1102 COC(=O)CCCCCNC[C@@H]1CCO1 2230a_100020831831_100009816466 [0,0,0,1,0,0|2,0,0]=3 7731 B15R1.1102 COC(=O)CCCCCNC[C@@H]1CCO1 34a_100020831831_100009816466 [0,0,0,1,0,0|2,0,0]=3 7732 B15R1.1102 COC(=O)CCCCCOCC1CCC1 34a_100000074720_100000763275 [0,0,0,1,0,0|1,0,0]=2 7733 B15R1.1102 COC(=O)CCCCCOCC1CCC1 34a_100000760304_100009816466 [0,0,0,1,0,0|1,0,0]=2 7734 B15R1.1102 COC(=O)CCCCCOCC1CCC1 7a_100000074720_100000763275 [0,0,0,1,0,0|1,0,0]=2 7735 B15R1.1102 COC(=O)CCCCCOCC1CCO1 34a_100000039022_100009816466 [0,0,0,1,0,0|2,0,0]=3 7736 B15R1.1102 COC(=O)CCCCCOCC1CCO1 34a_100000074720_100000103362 [0,0,0,1,0,0|2,0,0]=3 7737 B15R1.1102 COC(=O)CCCCCOCC1CCO1 7a_100000074720_100000103362 [0,0,0,1,0,0|2,0,0]=3 7738 B15R1.1102 COC(=O)CCCCCOCC1CNC1 34a_100016987283_100009816466 [0,0,0,1,0,0|2,0,0]=3 7739 B15R1.1102 COC(=O)CCCCCOCC1COC1 34a_100000060846_100009816466 [0,0,0,1,0,0|2,0,0]=3 7740 B15R1.1102 COC(=O)CCCCCOCC1COC1 34a_100000074720_100010264016 [0,0,0,1,0,0|2,0,0]=3 7741 B15R1.1102 COC(=O)CCCCCOCC1COC1 7a_100000074720_100010264016 [0,0,0,1,0,0|2,0,0]=3 7742 B15R1.1102 COC(=O)CCCCCSCC1CCC1 62a_100000763275_100009816466 [0,0,0,1,0,0|1,0,0]=2 7743 B15R1.1102 COC(=O)CCCCCSCC1CCC1 62a_100009816466_100000763275 [0,0,0,1,0,0|1,0,0]=2 7744 B15R1.1102 COC(=O)CCCCCSCC1CCO1 62a_100000103362_100009816466 [0,0,0,1,0,0|2,0,0]=3 7745 B15R1.1102 COC(=O)CCCCCSCC1CCO1 62a_100009816466_100000103362 [0,0,0,1,0,0|2,0,0]=3 7746 B15R1.1102 COC(=O)CCCCCSCC1COC1 62a_100009816466_100010264016 [0,0,0,1,0,0|2,0,0]=3 7747 B15R1.1102 COC(=O)CCCCCSCC1COC1 62a_100010264016_100009816466 [0,0,0,1,0,0|2,0,0]=3 7748 B15R1.1102 COC(=O)CCCCOCCC1COC1 34a_100009855314_100000204269 [0,0,0,1,0,0|2,0,0]=3 7749 B15R1.1102 COC(=O)COCCOCCC1COC1 34a_100009855314_100000090808 [0,0,0,1,0,0|3,0,0]=4 7750 B15R1.1191 C#CCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000731252 [0,0,0,1,0,0|1,0,2]=4 7751 B15R1.1191 C#CCCCN1CCCCC1C(=O)OC 269982a_100000734855_100011215417 [0,0,0,1,0,0|1,0,2]=4 7752 B15R1.1191 C#CCCCN1CCCCC1C(=O)OC 34a_100000734855_100000695029 [0,0,0,1,0,0|1,0,2]=4 7753 B15R1.1191 C#CCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000688953 [0,0,0,1,0,0|1,0,2]=4 7754 B15R1.1191 C#CCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000688953 [0,0,0,1,0,0|1,0,2]=4 7755 B15R1.1191 C/C=C/CO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100102629194 [0,0,0,1,0,0|1,0,2]=4 7756 B15R1.1191 C/C=C/CO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100102629194 [0,0,0,1,0,0|1,0,2]=4 7757 B15R1.1191 C=CCCCN1CCCCC1C(=O)OC 2230a_100000734855_100011713584 [0,0,0,1,0,0|1,0,2]=4 7758 B15R1.1191 C=CCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000757094 [0,0,0,1,0,0|1,0,2]=4 7759 B15R1.1191 C=CCCCN1CCCCC1C(=O)OC 34a_100000734855_100000757094 [0,0,0,1,0,0|1,0,2]=4 7760 B15R1.1191 C=CCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000754431 [0,0,0,1,0,0|1,0,2]=4 7761 B15R1.1191 C=CCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000754431 [0,0,0,1,0,0|1,0,2]=4 7762 B15R1.1191 CC#CCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000748600 [0,0,0,1,0,0|1,0,2]=4 7763 B15R1.1191 CC#CCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000748600 [0,0,0,1,0,0|1,0,2]=4 7764 B15R1.1191 CC/C=C\CN1CCCCC1C(=O)OC 2230a_100000734855_100103147603 [0,0,0,1,0,0|1,0,2]=4 7765 B15R1.1191 CC/C=C\CN1CCCCC1C(=O)OC 269982a_100000734855_100103147603 [0,0,0,1,0,0|1,0,2]=4 7766 B15R1.1191 CC/C=C\CN1CCCCC1C(=O)OC 34a_100000734855_100103147603 [0,0,0,1,0,0|1,0,2]=4 7767 B15R1.1191 CC=CCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000070051 [0,0,0,1,0,0|1,0,2]=4 7768 B15R1.1191 CC=CCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000070051 [0,0,0,1,0,0|1,0,2]=4 7769 B15R1.1191 CCC#CCN1CCCCC1C(=O)OC 2230a_100000734855_100009813939 [0,0,0,1,0,0|1,0,2]=4 7770 B15R1.1191 CCC#CCN1CCCCC1C(=O)OC 34a_100000734855_100009813939 [0,0,0,1,0,0|1,0,2]=4 7771 B15R1.1191 CCC(=O)N1CCCCC1CCCOC 11a_100011804088_100000210414 [0,0,0,1,0,0|3,0,0]=4 7772 B15R1.1191 CCC(=O)N1CCCCC1CCCOC 1626a_100011804088_100000210414 [0,0,0,1,0,0|3,0,0]=4 7773 B15R1.1191 CCC(=O)N1CCCCC1CCCOC 240690a_100011804088_100000210414 [0,0,0,1,0,0|3,0,0]=4 7774 B15R1.1191 CCC(=O)N1CCCCC1CCCOC 527a_100011804088_100000210414 [0,0,0,1,0,0|3,0,0]=4 7775 B15R1.1191 CCCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210326 [0,0,0,1,0,0|2,0,0]=3 7776 B15R1.1191 CCCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210215 [0,0,0,1,0,0|2,0,0]=3 7777 B15R1.1191 CCCCCN1CCCCC1C(=O)NC 34a_100011209383_100000718602 [0,0,0,1,0,0|2,0,0]=3 7778 B15R1.1191 CCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210326 [0,0,0,1,0,0|1,0,0]=2 7779 B15R1.1191 CCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210215 [0,0,0,1,0,0|1,0,0]=2 7780 B15R1.1191 CCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000718602 [0,0,0,1,0,0|1,0,0]=2 7781 B15R1.1191 CCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210326 [0,0,0,1,0,0|2,0,0]=3 7782 B15R1.1191 CCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000718602 [0,0,0,1,0,0|2,0,0]=3 7783 B15R1.1191 CCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210210 [0,0,0,1,0,0|2,0,0]=3 7784 B15R1.1191 CCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210210 [0,0,0,1,0,0|1,0,0]=2 7785 B15R1.1191 CCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210211 [0,0,0,1,0,0|1,0,0]=2 7786 B15R1.1191 CCCNN=C1CCCCC1C(=O)OC 4a_100000740057_100011215843 [0,0,0,1,0,0|2,0,1]=4 7787 B15R1.1191 CCOCCN1CCCCC1C(=O)NC 2230a_100011209383_100011215890 [0,0,0,1,0,0|3,0,0]=4 7788 B15R1.1191 CCOCCN1CCCCC1C(=O)NC 269982a_100011209383_100011215890 [0,0,0,1,0,0|3,0,0]=4 7789 B15R1.1191 CCOCCN1CCCCC1C(=O)NC 34a_100011209383_100000210147 [0,0,0,1,0,0|3,0,0]=4 7790 B15R1.1191 CCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100011215890 [0,0,0,1,0,0|2,0,0]=3 7791 B15R1.1191 CCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100011215890 [0,0,0,1,0,0|2,0,0]=3 7792 B15R1.1191 CCOCCN1CCCCC1C(=O)OC 34a_100000734855_100000210147 [0,0,0,1,0,0|2,0,0]=3 7793 B15R1.1191 CCOCCN1CCOCC1C(=O)OC 2230a_100000765174_100011215890 [0,0,0,1,0,0|3,0,0]=4 7794 B15R1.1191 CCOCCN1CCOCC1C(=O)OC 34a_100000765174_100000210147 [0,0,0,1,0,0|3,0,0]=4 7795 B15R1.1191 CCSCCN1CCCCC1C(=O)NC 2230a_100011209383_100000757381 [0,0,0,1,0,0|3,0,0]=4 7796 B15R1.1191 CCSCCN1CCCCC1C(=O)NC 269982a_100011209383_100000757381 [0,0,0,1,0,0|3,0,0]=4 7797 B15R1.1191 CCSCCN1CCCCC1C(=O)NC 34a_100011209383_100000757381 [0,0,0,1,0,0|3,0,0]=4 7798 B15R1.1191 CCSCCN1CCCCC1C(=O)OC 2230a_100000734855_100000757381 [0,0,0,1,0,0|2,0,0]=3 7799 B15R1.1191 CCSCCN1CCCCC1C(=O)OC 269982a_100000734855_100000757381 [0,0,0,1,0,0|2,0,0]=3 7800 B15R1.1191 CCSCCN1CCCCC1C(=O)OC 34a_100000734855_100000757381 [0,0,0,1,0,0|2,0,0]=3 7801 B15R1.1191 CCSCCN1CCOCC1C(=O)OC 2230a_100000765174_100000757381 [0,0,0,1,0,0|3,0,0]=4 7802 B15R1.1191 CCSCCN1CCOCC1C(=O)OC 34a_100000765174_100000757381 [0,0,0,1,0,0|3,0,0]=4 7803 B15R1.1191 CNC(=O)C1CCCCN1CCCCF 2230a_100011209383_100000729493 [0,0,0,1,0,0|3,0,0]=4 7804 B15R1.1191 CNC(=O)C1CCCCN1CCCCF 269982a_100011209383_100000729493 [0,0,0,1,0,0|3,0,0]=4 7805 B15R1.1191 CNC(=O)C1CCCCN1CCCCF 34a_100011209383_100000729493 [0,0,0,1,0,0|3,0,0]=4 7806 B15R1.1191 CNC(=O)C1CCCCN1CCCCO 2230a_100011209383_100000210776 [0,0,0,1,0,0|3,0,0]=4 7807 B15R1.1191 CNC(=O)C1CCCCN1CCCCO 269982a_100011209383_100000210776 [0,0,0,1,0,0|3,0,0]=4 7808 B15R1.1191 CNC(=O)C1CCCCN1CCCCO 34a_100011209383_100011216708 [0,0,0,1,0,0|3,0,0]=4 7809 B15R1.1191 CNC(=O)C1CCCCN1CCCOC 2230a_100011209383_100000740836 [0,0,0,1,0,0|3,0,0]=4 7810 B15R1.1191 CNC(=O)C1CCCCN1CCCOC 269982a_100011209383_100000740836 [0,0,0,1,0,0|3,0,0]=4 7811 B15R1.1191 CNC(=O)C1CCCCN1CCCOC 34a_100011209383_100000740836 [0,0,0,1,0,0|3,0,0]=4 7812 B15R1.1191 CNC(=O)N1CCCCC1CCCOC 2708a_100102657272_100011804088 [0,0,0,1,0,0|3,0,0]=4 7813 B15R1.1191 CNC(=O)N1CCCCC1CCCOC 273464a_100102657272_100011804088 [0,0,0,1,0,0|3,0,0]=4 7814 B15R1.1191 COC(=O)C1CCCCN1CCCC#N 2230a_100000734855_100000687738 [0,0,0,1,0,0|2,0,1]=4 7815 B15R1.1191 COC(=O)C1CCCCN1CCCC#N 269982a_100000734855_100000687738 [0,0,0,1,0,0|2,0,1]=4 7816 B15R1.1191 COC(=O)C1CCCCN1CCCC=O 2230a_100000734855_200011292268 [0,0,0,1,0,0|2,0,1]=4 7817 B15R1.1191 COC(=O)C1CCCCN1CCCC=O 269982a_100000734855_200011292268 [0,0,0,1,0,0|2,0,1]=4 7818 B15R1.1191 COC(=O)C1CCCCN1CCCCF 2230a_100000734855_100000729493 [0,0,0,1,0,0|2,0,0]=3 7819 B15R1.1191 COC(=O)C1CCCCN1CCCCF 269982a_100000734855_100000729493 [0,0,0,1,0,0|2,0,0]=3 7820 B15R1.1191 COC(=O)C1CCCCN1CCCCF 34a_100000734855_100000729493 [0,0,0,1,0,0|2,0,0]=3 7821 B15R1.1191 COC(=O)C1CCCCN1CCCCO 2230a_100000734855_100000210776 [0,0,0,1,0,0|2,0,0]=3 7822 B15R1.1191 COC(=O)C1CCCCN1CCCCO 269982a_100000734855_100000210776 [0,0,0,1,0,0|2,0,0]=3 7823 B15R1.1191 COC(=O)C1CCCCN1CCCCO 34a_100000734855_100011216708 [0,0,0,1,0,0|2,0,0]=3 7824 B15R1.1191 COC(=O)C1CNCCC1OCCCF 34a_200103168510_100011934791 [0,0,0,1,0,0|3,0,0]=4 7825 B15R1.1191 COC(=O)C1CNCCC1OCCCO 34a_200103168510_100000230001 [0,0,0,1,0,0|3,0,0]=4 7826 B15R1.1191 COC(=O)C1CNCCC1OCCSC 34a_200103168510_100000212216 [0,0,0,1,0,0|3,0,0]=4 7827 B15R1.1191 COC(=O)C1COCCN1CCCCF 2230a_100000765174_100000729493 [0,0,0,1,0,0|3,0,0]=4 7828 B15R1.1191 COC(=O)C1COCCN1CCCCF 34a_100000765174_100000729493 [0,0,0,1,0,0|3,0,0]=4 7829 B15R1.1191 COC(=O)C1COCCN1CCCCO 2230a_100000765174_100000210776 [0,0,0,1,0,0|3,0,0]=4 7830 B15R1.1191 COC(=O)C1COCCN1CCCCO 34a_100000765174_100011216708 [0,0,0,1,0,0|3,0,0]=4 7831 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCC#N 7a_100015709673_100000184422 [0,0,0,1,0,0|2,0,1]=4 7832 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCCF 34a_100015709673_100011934791 [0,0,0,1,0,0|2,0,0]=3 7833 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCCF 7a_100015709673_100011934791 [0,0,0,1,0,0|2,0,0]=3 7834 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCCO 34a_100015709673_100000230001 [0,0,0,1,0,0|2,0,0]=3 7835 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCCO 7a_100015709673_100011215043 [0,0,0,1,0,0|2,0,0]=3 7836 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCSC 34a_100015709673_100000212216 [0,0,0,1,0,0|2,0,0]=3 7837 B15R1.1191 COC(=O)[C@@H]1CCCC[C@@H]1OCCSC 7a_100015709673_100000212216 [0,0,0,1,0,0|2,0,0]=3 7838 B15R1.1191 COCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000740836 [0,0,0,1,0,0|2,0,0]=3 7839 B15R1.1191 COCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000740836 [0,0,0,1,0,0|2,0,0]=3 7840 B15R1.1191 COCCCN1CCCCC1C(=O)OC 34a_100000734855_100000740836 [0,0,0,1,0,0|2,0,0]=3 7841 B15R1.1191 COCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000740836 [0,0,0,1,0,0|3,0,0]=4 7842 B15R1.1191 COCCCN1CCOCC1C(=O)OC 34a_100000765174_100000740836 [0,0,0,1,0,0|3,0,0]=4 7843 B15R1.1191 COCCOC1CCNCC1C(=O)OC 34a_200103168510_100011201679 [0,0,0,1,0,0|3,0,0]=4 7844 B15R1.1191 COCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011201679 [0,0,0,1,0,0|2,0,0]=3 7845 B15R1.1191 COCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000233755 [0,0,0,1,0,0|2,0,0]=3 7846 B15R1.1203 C#CCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000731252 [0,0,0,1,0,0|1,0,2]=4 7847 B15R1.1203 C#CCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215417 [0,0,0,1,0,0|1,0,2]=4 7848 B15R1.1203 C#CCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000695029 [0,0,0,1,0,0|1,0,2]=4 7849 B15R1.1203 C=CCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011713584 [0,0,0,1,0,0|1,0,2]=4 7850 B15R1.1203 C=CCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000757094 [0,0,0,1,0,0|1,0,2]=4 7851 B15R1.1203 C=CCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000757094 [0,0,0,1,0,0|1,0,2]=4 7852 B15R1.1203 CC/C=C\CN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100103147603 [0,0,0,1,0,0|1,0,2]=4 7853 B15R1.1203 CC/C=C\CN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100103147603 [0,0,0,1,0,0|1,0,2]=4 7854 B15R1.1203 CC/C=C\CN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100103147603 [0,0,0,1,0,0|1,0,2]=4 7855 B15R1.1203 CCC#CCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100009813939 [0,0,0,1,0,0|1,0,2]=4 7856 B15R1.1203 CCC#CCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100009813939 [0,0,0,1,0,0|1,0,2]=4 7857 B15R1.1203 CCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210326 [0,0,0,1,0,0|1,0,0]=2 7858 B15R1.1203 CCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210215 [0,0,0,1,0,0|1,0,0]=2 7859 B15R1.1203 CCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000718602 [0,0,0,1,0,0|1,0,0]=2 7860 B15R1.1203 CCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011215890 [0,0,0,1,0,0|2,0,0]=3 7861 B15R1.1203 CCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215890 [0,0,0,1,0,0|2,0,0]=3 7862 B15R1.1203 CCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210147 [0,0,0,1,0,0|2,0,0]=3 7863 B15R1.1203 CCSCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000757381 [0,0,0,1,0,0|2,0,0]=3 7864 B15R1.1203 CCSCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000757381 [0,0,0,1,0,0|2,0,0]=3 7865 B15R1.1203 CCSCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000757381 [0,0,0,1,0,0|2,0,0]=3 7866 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCC#N 2230a_100025726698_100000687738 [0,0,0,1,0,0|2,0,1]=4 7867 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCC#N 269982a_100025726698_100000687738 [0,0,0,1,0,0|2,0,1]=4 7868 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCC=O 2230a_100025726698_200011292268 [0,0,0,1,0,0|2,0,1]=4 7869 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCC=O 269982a_100025726698_200011292268 [0,0,0,1,0,0|2,0,1]=4 7870 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCCF 2230a_100025726698_100000729493 [0,0,0,1,0,0|2,0,0]=3 7871 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCCF 269982a_100025726698_100000729493 [0,0,0,1,0,0|2,0,0]=3 7872 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCCF 34a_100025726698_100000729493 [0,0,0,1,0,0|2,0,0]=3 7873 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCCO 2230a_100025726698_100000210776 [0,0,0,1,0,0|2,0,0]=3 7874 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCCO 269982a_100025726698_100000210776 [0,0,0,1,0,0|2,0,0]=3 7875 B15R1.1203 COC(=O)C[C@H]1CCCN1CCCCO 34a_100025726698_100011216708 [0,0,0,1,0,0|2,0,0]=3 7876 B15R1.1203 COCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000740836 [0,0,0,1,0,0|2,0,0]=3 7877 B15R1.1203 COCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000740836 [0,0,0,1,0,0|2,0,0]=3 7878 B15R1.1203 COCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000740836 [0,0,0,1,0,0|2,0,0]=3 7879 B15R1.1950 CCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210681 [0,0,0,1,0,0|3,0,0]=4 7880 B15R1.1950 CCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210681 [0,0,0,1,0,0|3,0,0]=4 7881 B15R1.3174 CNC(=O)CCCOCC1CCCN1C 34a_100000743107_100000741757 [0,0,0,1,0,0|3,0,0]=4 7882 B15R1.3174 CNC(=O)CCNCCC1CCCN1C 2230a_100000738227_100000005710 [0,0,0,1,0,0|3,0,0]=4 7883 B15R1.3174 CNC(=O)CCNCCC1CCCN1C 34a_100000738227_100000005710 [0,0,0,1,0,0|3,0,0]=4 7884 B15R1.3174 CNC(=O)CCOCCC1CCCN1C 34a_100000754576_100000005710 [0,0,0,1,0,0|3,0,0]=4 7885 B15R1.3174 CNC(=O)CCOCCC1CCCN1C 34a_100011215177_100012179268 [0,0,0,1,0,0|3,0,0]=4 7886 B15R1.3174 CNC(=O)CCOCCC1CCCN1C 7a_100011215177_100000737683 [0,0,0,1,0,0|3,0,0]=4 7887 B15R1.3174 CNC(=O)CCSCCC1CCCN1C 62a_100000005710_100000737683 [0,0,0,1,0,0|3,0,0]=4 7888 B15R1.3174 CNC(=O)CCSCCC1CCCN1C 62a_100000737683_100000005710 [0,0,0,1,0,0|3,0,0]=4 7889 B15R1.3174 COC(=O)CCCCCN1CCC[C@@H]1C 2230a_100020605311_100009816466 [0,0,0,1,0,0|1,0,0]=2 7890 B15R1.3174 COC(=O)CCCCCN1CCC[C@@H]1C 269982a_100020605311_100009816466 [0,0,0,1,0,0|1,0,0]=2 7891 B15R1.3174 COC(=O)CCCCCN1CCC[C@H]1C 2230a_100015189458_100009816466 [0,0,0,1,0,0|1,0,0]=2 7892 B15R1.3174 COC(=O)CCCCCN1CCC[C@H]1C 269982a_100015189458_100009816466 [0,0,0,1,0,0|1,0,0]=2 7893 B15R1.3174 COC(=O)CCCCCN1CCC[C@H]1C 34a_100015189458_100009816466 [0,0,0,1,0,0|1,0,0]=2 7894 B15R1.3174 COC(=O)CCCCCN1CCSC1C 2230a_200011216479_100009816466 [0,0,0,1,0,0|2,0,0]=3 7895 B15R1.3174 COC(=O)CCCCCN1CCSC1C 269982a_200011216479_100009816466 [0,0,0,1,0,0|2,0,0]=3 7896 B15R1.3174 COC(=O)CCCCCN1CCSC1C 34a_200011216479_100009816466 [0,0,0,1,0,0|2,0,0]=3 7897 B15R1.3174 COC(=O)CCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000204269 [0,0,0,1,0,0|3,0,0]=4 7898 B15R1.3174 COC(=O)CCCCOC1CCCC1=O 34a_100000059025_100000709159 [0,0,0,1,0,0|2,0,1]=4 7899 B15R1.3174 COC(=O)CCCCOC1CCCC1=O 34a_200000719330_100000204269 [0,0,0,1,0,0|2,0,1]=4 7900 B15R1.3174 COC(=O)CCCCOC1CCCC1=O 7a_100000059025_100000211823 [0,0,0,1,0,0|2,0,1]=4 7901 B15R1.3174 COC(=O)CCCCOC1CCCC1C 34a_100011216460_100000204269 [0,0,0,1,0,0|1,0,0]=2 7902 B15R1.3174 COC(=O)CCCCOC1CCCC1C 7a_100011216460_100000204269 [0,0,0,1,0,0|1,0,0]=2 7903 B15R1.3174 COC(=O)CCCCOC1COCC1O 34a_100000059025_200000725654 [0,0,0,1,0,0|3,0,0]=4 7904 B15R1.3174 COC(=O)CCCCOC1COCC1O 7a_100000059025_200000725654 [0,0,0,1,0,0|3,0,0]=4 7905 B15R1.3174 COC(=O)CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000204269 [0,0,0,1,0,0|2,0,0]=3 7906 B15R1.3174 COC(=O)CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000204269 [0,0,0,1,0,0|2,0,0]=3 7907 B15R1.3174 COC(=O)CCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000204269 [0,0,0,1,0,0|2,0,0]=3 7908 B15R1.3174 COC(=O)CCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000204269 [0,0,0,1,0,0|3,0,0]=4 7909 B15R1.3174 COC(=O)CCCCSC1CCCC1=O 62a_100000204269_100000211823 [0,0,0,1,0,0|2,0,1]=4 7910 B15R1.3174 COC(=O)CCCCSC1CCCC1=O 62a_100000211823_100000204269 [0,0,0,1,0,0|2,0,1]=4 7911 B15R1.3174 COC(=O)CCCCSC1COCC1O 62a_100000204269_200000725654 [0,0,0,1,0,0|3,0,0]=4 7912 B15R1.3174 COC(=O)CCCCSC1COCC1O 62a_200000725654_100000204269 [0,0,0,1,0,0|3,0,0]=4 7913 B15R1.3174 COC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_100000204269_200016002552 [0,0,0,1,0,0|2,0,0]=3 7914 B15R1.3174 COC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000204269 [0,0,0,1,0,0|2,0,0]=3 7915 B15R1.3174 COC(=O)CCCOCC1CCCN1C 34a_100000743107_100000742333 [0,0,0,1,0,0|2,0,0]=3 7916 B15R1.3174 COC(=O)CCOCCC1CCCN1C 34a_100011215177_100000742370 [0,0,0,1,0,0|2,0,0]=3 7917 B15R1.3174 COC(=O)CCOCCC1CCCN1C 7a_100011215177_100000204255 [0,0,0,1,0,0|2,0,0]=3 7918 B15R1.3174 COC(=O)CCSCCC1CCCN1C 62a_100000005710_100000204255 [0,0,0,1,0,0|2,0,0]=3 7919 B15R1.3174 COC(=O)CCSCCC1CCCN1C 62a_100000204255_100000005710 [0,0,0,1,0,0|2,0,0]=3 7920 B15R1.3174 COC(=O)COCCOC1CCCC1C 34a_100011216460_100000090808 [0,0,0,1,0,0|2,0,0]=3 7921 B15R1.3174 COC(=O)COCCOC1CCCC1C 7a_100011216460_100000090808 [0,0,0,1,0,0|2,0,0]=3 7922 B15R1.3174 COC(=O)COCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000090808 [0,0,0,1,0,0|3,0,0]=4 7923 B15R1.3174 COC(=O)COCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000090808 [0,0,0,1,0,0|3,0,0]=4 7924 B15R1.3174 COC(=O)COCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000090808 [0,0,0,1,0,0|3,0,0]=4 7925 B15R1.3174 COC(=O)COCCS[C@@H]1CCC[C@H]1O 62a_100000090808_200016002552 [0,0,0,1,0,0|3,0,0]=4 7926 B15R1.3174 COC(=O)COCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000090808 [0,0,0,1,0,0|3,0,0]=4 7927 B15R1.3174 COC(=O)OCSCCC1CCCN1C 62a_100000005710_100000139417 [0,0,0,1,0,0|3,0,0]=4 7928 B15R1.3179 COC(=O)CCCCCCN1CCC1C 269982a_100000755817_100009815986 [0,0,0,1,0,0|1,0,0]=2 7929 B15R1.3179 COC(=O)CCCCCCN1CCC1C 34a_100000755817_100009815986 [0,0,0,1,0,0|1,0,0]=2 7930 B15R1.3179 COC(=O)CCCCCOC1CCC1=O 34a_100000074720_100009892977 [0,0,0,1,0,0|2,0,1]=4 7931 B15R1.3179 COC(=O)CCCCCOC1CCC1=O 7a_100000074720_100009892977 [0,0,0,1,0,0|2,0,1]=4 7932 B15R1.3179 COC(=O)CCCCCSC1CCC1=O 62a_100009816466_100009892977 [0,0,0,1,0,0|2,0,1]=4 7933 B15R1.3179 COC(=O)CCCCCSC1CCC1=O 62a_100009892977_100009816466 [0,0,0,1,0,0|2,0,1]=4 7934 B15R1.3179 COC(=O)CCCSCCC1CCC1=O 62a_100011218270_200016118888 [0,0,0,1,0,0|2,0,1]=4 7935 B15R1.3179 COC(=O)CCCSCCC1CCC1=O 62a_200016118888_100011218270 [0,0,0,1,0,0|2,0,1]=4 7936 B15R1.3523 CCCCCCCCCNC1CCC1=O 34a_100000212291_100009892977 [0,0,0,1,0,0|2,0,0]=3 7937 B15R1.3523 CCCCCCCCCOC1CCC1=O 34a_100000210712_100009892977 [0,0,0,1,0,0|2,0,0]=3 7938 B15R1.3523 CCCCCCCCCOC1CCC1=O 7a_100000210712_100009892977 [0,0,0,1,0,0|2,0,0]=3 7939 B15R1.3523 CCCCCCCCCSC1CCC1=O 62a_100009892977_100000210670 [0,0,0,1,0,0|2,0,0]=3 7940 B15R1.3523 CCCCCCCNCCC1CCC1=O 2230a_100000229938_200016118888 [0,0,0,1,0,0|2,0,0]=3 7941 B15R1.3523 CCCCCCCOCCC1CCC1=O 7a_100000210272_200016118888 [0,0,0,1,0,0|2,0,0]=3 7942 B15R1.3523 CCCCCCCSCCC1CCC1=O 62a_100000210614_200016118888 [0,0,0,1,0,0|2,0,0]=3 7943 B15R1.3523 CCCCCCCSCCC1CCC1=O 62a_200016118888_100000210316 [0,0,0,1,0,0|2,0,0]=3 7944 B15R1.3523 CCCCCCOCCOC1CCC1=O 34a_100000691444_100009892977 [0,0,0,1,0,0|3,0,0]=4 7945 B15R1.3523 CCCCCCOCCOC1CCC1=O 7a_100000691444_100009892977 [0,0,0,1,0,0|3,0,0]=4 7946 B15R1.3523 CCCCNCCCCOC1CCC1=O 34a_200011216965_100009892977 [0,0,0,1,0,0|3,0,0]=4 7947 B15R1.3523 CCCCOCCCCOC1CCC1=O 34a_200000760531_100009892977 [0,0,0,1,0,0|3,0,0]=4 7948 B15R1.3523 CCCCOCCCCOC1CCC1=O 7a_200000760531_100009892977 [0,0,0,1,0,0|3,0,0]=4 7949 B15R1.3523 CCCCOCCOCCC1CCC1=O 7a_100000210238_200016118888 [0,0,0,1,0,0|3,0,0]=4 7950 B15R1.3523 CCCCOCCSCCC1CCC1=O 62a_100000743108_200016118888 [0,0,0,1,0,0|3,0,0]=4 7951 B15R1.3523 CCCCOCCSCCC1CCC1=O 62a_200016118888_100000743108 [0,0,0,1,0,0|3,0,0]=4 7952 B15R1.3523 CCCCSCCNCCC1CCC1=O 2230a_100025743550_200016118888 [0,0,0,1,0,0|3,0,0]=4 7953 B15R1.3523 CCCCSCCOCCC1CCC1=O 7a_200000230436_200016118888 [0,0,0,1,0,0|3,0,0]=4 7954 B15R1.3523 CCCOCCCNCCC1CCC1=O 2230a_100011217757_200016118888 [0,0,0,1,0,0|3,0,0]=4 7955 B15R1.3523 COCCCCCNCCC1CCC1=O 2230a_100000747528_200016118888 [0,0,0,1,0,0|3,0,0]=4 7956 B15R1.3523 NCCCCCCCCOC1CCC1=O 34a_102515433106_100009892977 [0,0,0,1,0,0|3,0,0]=4 7957 B15R1.3523 O=C1CCC1CCNCCCCCCO 2230a_100000686447_200016118888 [0,0,0,1,0,0|3,0,0]=4 7958 B15R1.3523 O=C1CCC1CCOCCCCCCBr 7a_100011215345_200016118888 [0,0,0,1,0,0|3,0,0]=4 7959 B15R1.3523 O=C1CCC1CCOCCCCCCCl 7a_100000766143_200016118888 [0,0,0,1,0,0|3,0,0]=4 7960 B15R1.3523 O=C1CCC1CCOCCCCCCF 7a_100000732779_200016118888 [0,0,0,1,0,0|3,0,0]=4 7961 B15R1.3523 O=C1CCC1CCSCCCCCCF 62a_100015922095_200016118888 [0,0,0,1,0,0|3,0,0]=4 7962 B15R1.3523 O=C1CCC1CCSCCCCCCF 62a_200016118888_100015922095 [0,0,0,1,0,0|3,0,0]=4 7963 B15R1.3523 O=C1CCC1CCSCCCCCCO 62a_100000766143_200016118888 [0,0,0,1,0,0|3,0,0]=4 7964 B15R1.3523 O=C1CCC1CCSCCCCCCO 62a_200016118888_100000766143 [0,0,0,1,0,0|3,0,0]=4 7965 B15R1.3523 O=C1CCC1NCCCCCCCCO 34a_102515433106_100009892977 [0,0,0,1,0,0|3,0,0]=4 7966 B15R1.3523 O=C1CCC1OCCCCCCCCBr 34a_100009813846_100009892977 [0,0,0,1,0,0|3,0,0]=4 7967 B15R1.3523 O=C1CCC1OCCCCCCCCBr 7a_100009813846_100009892977 [0,0,0,1,0,0|3,0,0]=4 7968 B15R1.3523 O=C1CCC1OCCCCCCCCCl 34a_100000033203_100009892977 [0,0,0,1,0,0|3,0,0]=4 7969 B15R1.3523 O=C1CCC1OCCCCCCCCCl 7a_100000033203_100009892977 [0,0,0,1,0,0|3,0,0]=4 7970 B15R1.3523 O=C1CCC1SCCCCCCCCO 62a_100000033203_100009892977 [0,0,0,1,0,0|3,0,0]=4 7971 B15R1.3523 O=C1CCC1SCCCCCCCCO 62a_100009892977_100000033203 [0,0,0,1,0,0|3,0,0]=4 7972 B15R1.3529 CCC(=O)NCCNC1CCCC1CC 269862a_100132302217_100000749056 [0,0,0,1,0,0|3,0,0]=4 7973 B15R1.3529 CCC(=O)NCCNC1CCCC1CC 270004a_100132302217_100000749056 [0,0,0,1,0,0|3,0,0]=4 7974 B15R1.3529 CCC1C=CCN1CCCCC(=O)OC 2230a_100000730860_100000204269 [0,0,0,1,0,0|1,0,2]=4 7975 B15R1.3529 CCC1C=CCN1CCCCC(=O)OC 269982a_100000730860_100000204269 [0,0,0,1,0,0|1,0,2]=4 7976 B15R1.3529 CCC1C=CCN1CCCCC(=O)OC 34a_100000730860_100000204269 [0,0,0,1,0,0|1,0,2]=4 7977 B15R1.3529 CCC1CCCC1NCCCC(=O)NC 269862a_100000740002_100000749056 [0,0,0,1,0,0|2,0,0]=3 7978 B15R1.3529 CCC1CCCC1NCCCC(=O)NC 270004a_100000740002_100000749056 [0,0,0,1,0,0|2,0,0]=3 7979 B15R1.3529 CCC1CCCC1NCCNC(=O)NC 269862a_100015205895_100000749056 [0,0,0,1,0,0|3,0,0]=4 7980 B15R1.3529 CCC1CCCN1CCCCC(=O)OC 2230a_100000754278_100000204269 [0,0,0,1,0,0|1,0,0]=2 7981 B15R1.3529 CCC1CCCN1CCCCC(=O)OC 269982a_100000754278_100000204269 [0,0,0,1,0,0|1,0,0]=2 7982 B15R1.3529 CCC1CCCN1CCCCC(=O)OC 34a_100000754278_100000204269 [0,0,0,1,0,0|1,0,0]=2 7983 B15R1.3529 CCC1CCCN1CCOCC(=O)OC 2230a_100000754278_100000090808 [0,0,0,1,0,0|2,0,0]=3 7984 B15R1.3529 CCC1CCCN1CCOCC(=O)OC 34a_100000754278_100000090808 [0,0,0,1,0,0|2,0,0]=3 7985 B15R1.3529 CCN1CCCC1CNCCC(=O)NC 2230a_100000211693_100000737683 [0,0,0,1,0,0|3,0,0]=4 7986 B15R1.3529 CCN1CCCC1CNCCC(=O)OC 2230a_100000211693_100000204255 [0,0,0,1,0,0|2,0,0]=3 7987 B15R1.3529 CCN1CCC[C@@H]1COCCC(=O)NC 34a_100011739246_100012179268 [0,0,0,1,0,0|3,0,0]=4 7988 B15R1.3529 CCN1CCC[C@@H]1COCCC(=O)NC 7a_100011739246_100000737683 [0,0,0,1,0,0|3,0,0]=4 7989 B15R1.3529 CCN1CCC[C@@H]1COCCC(=O)OC 34a_100011739246_100000742370 [0,0,0,1,0,0|2,0,0]=3 7990 B15R1.3529 CCN1CCC[C@@H]1COCCC(=O)OC 7a_100011739246_100000204255 [0,0,0,1,0,0|2,0,0]=3 7991 B15R1.3529 COC(=O)CCCCN1CCCC1C#N 2230a_100000701862_100000204269 [0,0,0,1,0,0|2,0,1]=4 7992 B15R1.3529 COC(=O)CCCCN1CCC[C@@H]1C#N 2230a_106645074975_100000204269 [0,0,0,1,0,0|2,0,1]=4 7993 B15R1.3529 COC(=O)CCCCN1CCC[C@@H]1C#N 269982a_106645074975_100000204269 [0,0,0,1,0,0|2,0,1]=4 7994 B15R1.3529 COC(=O)CCCCN1CCC[C@@H]1CO 2230a_100000745186_100000204269 [0,0,0,1,0,0|2,0,0]=3 7995 B15R1.3529 COC(=O)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100000204269 [0,0,0,1,0,0|2,0,0]=3 7996 B15R1.3529 COC(=O)CCCCN1CCC[C@@H]1CO 34a_100000745186_100000204269 [0,0,0,1,0,0|2,0,0]=3 7997 B15R1.3529 COC(=O)CCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000742333 [0,0,0,1,0,0|2,0,1]=4 7998 B15R1.3529 COC(=O)CCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100011218270 [0,0,0,1,0,0|2,0,1]=4 7999 B15R1.3529 COC(=O)COCCN1CCC[C@@H]1CO 2230a_100000745186_100000090808 [0,0,0,1,0,0|3,0,0]=4 8000 B15R1.3529 COC(=O)COCCN1CCC[C@@H]1CO 34a_100000745186_100000090808 [0,0,0,1,0,0|3,0,0]=4 8001 B15R1.3871 COCC1CCN1CCCCC(=O)OC 2230a_100015195929_100000204269 [0,0,0,1,0,0|2,0,0]=3 8002 B15R1.3871 COCC1CCN1CCCCC(=O)OC 269982a_100015195929_100000204269 [0,0,0,1,0,0|2,0,0]=3 8003 B15R1.3871 COCC1CCN1CCCCC(=O)OC 34a_100015195929_100000204269 [0,0,0,1,0,0|2,0,0]=3 8004 B15R1.3871 COCC1CCN1CCOCC(=O)OC 2230a_100015195929_100000090808 [0,0,0,1,0,0|3,0,0]=4 8005 B15R1.3871 COCC1CCN1CCOCC(=O)OC 34a_100015195929_100000090808 [0,0,0,1,0,0|3,0,0]=4 8006 B15R1.4155 C#CCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100012094781 [0,0,0,1,0,0|1,0,2]=4 8007 B15R1.4155 C#CCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100012094781 [0,0,0,1,0,0|1,0,2]=4 8008 B15R1.4155 C=CCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000700193 [0,0,0,1,0,0|1,0,2]=4 8009 B15R1.4155 C=CCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000700193 [0,0,0,1,0,0|1,0,2]=4 8010 B15R1.4155 CCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210681 [0,0,0,1,0,0|1,0,0]=2 8011 B15R1.4155 CCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210681 [0,0,0,1,0,0|1,0,0]=2 8012 B15R1.4155 CCCCOCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000743108 [0,0,0,1,0,0|2,0,0]=3 8013 B15R1.4155 CCCCOCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000743108 [0,0,0,1,0,0|2,0,0]=3 8014 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCC#N 2230a_102516456887_100009813376 [0,0,0,1,0,0|2,0,1]=4 8015 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCC#N 269982a_102516456887_100009813376 [0,0,0,1,0,0|2,0,1]=4 8016 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCC=O 2230a_102516456887_100000139337 [0,0,0,1,0,0|2,0,1]=4 8017 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCC=O 269982a_102516456887_100000139337 [0,0,0,1,0,0|2,0,1]=4 8018 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCCF 2230a_102516456887_100015922095 [0,0,0,1,0,0|2,0,0]=3 8019 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCCF 269982a_102516456887_100015922095 [0,0,0,1,0,0|2,0,0]=3 8020 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCCO 2230a_102516456887_100000766143 [0,0,0,1,0,0|2,0,0]=3 8021 B15R1.4155 COC(=O)[C@@H]1CCN1CCCCCCO 269982a_102516456887_100000766143 [0,0,0,1,0,0|2,0,0]=3 8022 B15R1.4155 COCCOCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000695917 [0,0,0,1,0,0|3,0,0]=4 8023 B15R1.4155 COCCOCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000695917 [0,0,0,1,0,0|3,0,0]=4 8024 B15R1.6326 C#CCCCCCCN1CC1C(=O)OC 2230a_200009830135_100012276617 [0,0,0,1,0,0|1,0,2]=4 8025 B15R1.6326 C=CCCCCCCN1CC1C(=O)OC 2230a_200009830135_100011215473 [0,0,0,1,0,0|1,0,2]=4 8026 B15R1.6326 CCCCCC#CCN1CC1C(=O)OC 2230a_200009830135_100009816472 [0,0,0,1,0,0|1,0,2]=4 8027 B15R1.6326 CCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100000210759 [0,0,0,1,0,0|1,0,0]=2 8028 B15R1.6326 CCOCCOCCN1CC1C(=O)OC 2230a_200009830135_100011211534 [0,0,0,1,0,0|3,0,0]=4 8029 B15R1.6326 COC(=O)C1CN1CCCCCCC#N 2230a_200009830135_100009813337 [0,0,0,1,0,0|2,0,1]=4 8030 B15R1.6326 COC(=O)C1CN1CCCCCCCO 2230a_200009830135_100000760002 [0,0,0,1,0,0|2,0,0]=3 8031 B15R1.6326 COCCCCCCN1CC1C(=O)OC 2230a_200009830135_100011998445 [0,0,0,1,0,0|2,0,0]=3 8032 B15R1.6326 COCCOCCCN1CC1C(=O)OC 2230a_200009830135_100011216529 [0,0,0,1,0,0|3,0,0]=4 8033 B15R1.9281 CCCCCCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210759 [0,0,0,1,0,0|2,0,1]=4 8034 B15R1.9281 CCCCCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210759 [0,0,0,1,0,0|2,0,1]=4 8035 B15R1.11427 CNC(=O)CCN1CCCCCCCC1 2230a_100000039187_100000737683 [0,0,0,1,0,0|2,0,0]=3 8036 B15R1.11427 CNC(=O)CCN1CCCCCCCC1 269982a_100000039187_100000737683 [0,0,0,1,0,0|2,0,0]=3 8037 B15R1.11427 CNC(=O)CCN1CCCCCCCC1 34a_100000039187_100012179268 [0,0,0,1,0,0|2,0,0]=3 8038 B15R1.11427 CNC(=O)CNC1CCCCCCCC1 270004a_100000693194_100000038600 [0,0,0,1,0,0|2,0,0]=3 8039 B15R1.11427 COC(=O)CCN1CCCCCCCC1 2230a_100000039187_100000204255 [0,0,0,1,0,0|1,0,0]=2 8040 B15R1.11427 COC(=O)CCN1CCCCCCCC1 269982a_100000039187_100000204255 [0,0,0,1,0,0|1,0,0]=2 8041 B15R1.11427 COC(=O)CCN1CCCCCCCC1 34a_100000039187_100000742370 [0,0,0,1,0,0|1,0,0]=2 8042 B15R1.11427 CO[C@H](C)CNC1CCCCCCCC1 270004a_100020591295_100000038600 [0,0,0,1,0,0|2,0,1]=4 8043 B15R1.11631 COC(=O)CCCCC=NNCC1CC1 4a_100000736359_100000052768 [0,0,0,1,0,0|2,0,1]=4 8044 B15R1.11631 COC(=O)CCCCCCCNC1CC1 34a_100000212008_100010004213 [0,0,0,1,0,0|1,0,0]=2 8045 B15R1.11631 COC(=O)CCCCCCCOC1CC1 34a_100011022521_100000211595 [0,0,0,1,0,0|1,0,0]=2 8046 B15R1.11631 COC(=O)CCCCCCCSC1CC1 62a_100010004213_100000211595 [0,0,0,1,0,0|1,0,0]=2 8047 B15R1.11631 COC(=O)CCCCCCNCC1CC1 2230a_100000735609_100009815986 [0,0,0,1,0,0|1,0,0]=2 8048 B15R1.11631 COC(=O)CCCCCCNCC1CC1 34a_100000735609_100009815986 [0,0,0,1,0,0|1,0,0]=2 8049 B15R1.11631 COC(=O)CCCCCCOCC1CC1 34a_100000211283_100009815986 [0,0,0,1,0,0|1,0,0]=2 8050 B15R1.11631 COC(=O)CCCCCCOCC1CC1 34a_100009863599_100000742324 [0,0,0,1,0,0|1,0,0]=2 8051 B15R1.11631 COC(=O)CCCCCCOCC1CC1 7a_100009863599_100000742324 [0,0,0,1,0,0|1,0,0]=2 8052 B15R1.11631 COC(=O)CCCCCCOCC1CO1 34a_100009863599_102125554688 [0,0,0,1,0,0|2,0,0]=3 8053 B15R1.11631 COC(=O)CCCCCCOCC1CO1 7a_100009863599_102125554688 [0,0,0,1,0,0|2,0,0]=3 8054 B15R1.11631 COC(=O)CCCCCCOCC1CS1 7a_100009863599_100000031435 [0,0,0,1,0,0|2,0,0]=3 8055 B15R1.11631 COC(=O)CCCCCCOC[C@@H]1CO1 34a_100000757423_100009815986 [0,0,0,1,0,0|2,0,0]=3 8056 B15R1.11631 COC(=O)CCCCCCOC[C@@H]1CO1 7a_100009863599_100000745022 [0,0,0,1,0,0|2,0,0]=3 8057 B15R1.11631 COC(=O)CCCCCCSCC1CC1 62a_100000756562_100009815986 [0,0,0,1,0,0|1,0,0]=2 8058 B15R1.11631 COC(=O)CCCCCCSCC1CC1 62a_100009815986_100000742324 [0,0,0,1,0,0|1,0,0]=2 8059 B15R1.11631 COC(=O)CCCCCCSCC1CO1 62a_100009815986_102125554688 [0,0,0,1,0,0|2,0,0]=3 8060 B15R1.11631 COC(=O)CCCCCCSCC1CO1 62a_102125554688_100009815986 [0,0,0,1,0,0|2,0,0]=3 8061 B15R1.11631 COC(=O)CCCCCCSCC1CS1 62a_100000031435_100009815986 [0,0,0,1,0,0|2,0,0]=3 8062 B15R1.11631 COC(=O)CCCCCCSCC1CS1 62a_100009815986_100000031435 [0,0,0,1,0,0|2,0,0]=3 8063 B15R1.11631 COC(=O)CCCCCCSC[C@@H]1CO1 62a_100000745022_100009815986 [0,0,0,1,0,0|2,0,0]=3 8064 B15R1.11631 COC(=O)CCCCCCSC[C@@H]1CO1 62a_100009815986_100000745022 [0,0,0,1,0,0|2,0,0]=3 8065 B15R1.11631 COC(=O)CCCCCNCCC1CC1 34a_100000764129_100009816466 [0,0,0,1,0,0|1,0,0]=2 8066 B15R1.11631 COC(=O)CCCCCOCCC1CC1 34a_100000074720_100000694398 [0,0,0,1,0,0|1,0,0]=2 8067 B15R1.11631 COC(=O)CCCCCOCCC1CC1 34a_100000754188_100009816466 [0,0,0,1,0,0|1,0,0]=2 8068 B15R1.11631 COC(=O)CCCCCOCCC1CC1 7a_100000074720_100000764125 [0,0,0,1,0,0|1,0,0]=2 8069 B15R1.11631 COC(=O)CCCCCOCCC1CC1 7a_100000754188_100009816466 [0,0,0,1,0,0|1,0,0]=2 8070 B15R1.11631 COC(=O)CCCCCOCCC1CO1 34a_100000074720_100000732470 [0,0,0,1,0,0|2,0,0]=3 8071 B15R1.11631 COC(=O)CCCCCOCCC1CO1 7a_100000074720_100000732470 [0,0,0,1,0,0|2,0,0]=3 8072 B15R1.11631 COC(=O)CCCCCOCC[C@@H]1CO1 34a_100009820653_100009816466 [0,0,0,1,0,0|2,0,0]=3 8073 B15R1.11631 COC(=O)CCCCCSCCC1CC1 62a_100000764125_100009816466 [0,0,0,1,0,0|1,0,0]=2 8074 B15R1.11631 COC(=O)CCCCCSCCC1CC1 62a_100009816466_100000764125 [0,0,0,1,0,0|1,0,0]=2 8075 B15R1.11631 COC(=O)CCCCCSCCC1CO1 62a_100000732470_100009816466 [0,0,0,1,0,0|2,0,0]=3 8076 B15R1.11631 COC(=O)CCCCCSCCC1CO1 62a_100009816466_100000732470 [0,0,0,1,0,0|2,0,0]=3 8077 B15R1.11631 COC(=O)CCCCOCC#CC1CC1 34a_100000059025_100009895102 [0,0,0,1,0,0|1,0,2]=4 8078 B15R1.11631 COC(=O)CCCCOCC#CC1CC1 34a_100000083941_100000204269 [0,0,0,1,0,0|1,0,2]=4 8079 B15R1.11631 COC(=O)CCCCOCC#CC1CC1 7a_100000059025_100009895102 [0,0,0,1,0,0|1,0,2]=4 8080 B15R1.11631 COC(=O)CCCCOCC#CC1CC1 7a_100000083941_100000204269 [0,0,0,1,0,0|1,0,2]=4 8081 B15R1.11631 COC(=O)CCCCOCCCC1CO1 34a_100000059025_100000733510 [0,0,0,1,0,0|2,0,0]=3 8082 B15R1.11631 COC(=O)CCCCOCCCC1CO1 7a_100000059025_100000733510 [0,0,0,1,0,0|2,0,0]=3 8083 B15R1.11631 COC(=O)CCCCOCCNC1CC1 34a_100000738766_100000204269 [0,0,0,1,0,0|2,0,0]=3 8084 B15R1.11631 COC(=O)CCCCSCC#CC1CC1 62a_100000204269_100009895102 [0,0,0,1,0,0|1,0,2]=4 8085 B15R1.11631 COC(=O)CCCCSCC#CC1CC1 62a_100009895102_100000204269 [0,0,0,1,0,0|1,0,2]=4 8086 B15R1.11631 COC(=O)CCCCSCCCC1CO1 62a_100000204269_100000733510 [0,0,0,1,0,0|2,0,0]=3 8087 B15R1.11631 COC(=O)CCCCSCCCC1CO1 62a_100000733510_100000204269 [0,0,0,1,0,0|2,0,0]=3 8088 B15R1.11631 COC(=O)COCCCCOCC1CO1 34a_100010889290_100000747449 [0,0,0,1,0,0|3,0,0]=4 8089 B15R1.11631 COC(=O)COCCCCOCC1CO1 7a_100010889290_100000747449 [0,0,0,1,0,0|3,0,0]=4 8090 B15R1.11631 COC(=O)COCCOCCNC1CC1 34a_100000738766_100000090808 [0,0,0,1,0,0|3,0,0]=4 8091 B15R1.11631 COC(=O)COCCOCCOC1CC1 34a_100011023656_100000211595 [0,0,0,1,0,0|3,0,0]=4 8092 B15R1.11631 COC(=O)COCCSCCCC1CO1 62a_100000090808_100000733510 [0,0,0,1,0,0|3,0,0]=4 8093 B15R1.11631 COC(=O)COCCSCCCC1CO1 62a_100000733510_100000090808 [0,0,0,1,0,0|3,0,0]=4 8094 B15R1.11842 CCCCCCCCCNCC1(CO1)C 34a_100000212291_100000760498 [0,0,0,1,0,0|2,0,1]=4 8095 B15R1.11842 CCCCCCCCCOCC1(CO1)C 34a_100000210712_100000760498 [0,0,0,1,0,0|2,0,1]=4 8096 B15R1.11842 CCCCCCCCCSCC1(CO1)C 62a_100000760498_100000210670 [0,0,0,1,0,0|2,0,1]=4 8097 B15R1.11890 CCCCCCCCCN1CC(C1)OC 269982a_100000755009_100000210670 [0,0,0,1,0,0|2,0,1]=4 8098 B15R1.11890 CCCCCCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100000210759 [0,0,0,1,0,0|2,0,1]=4 8099 B15R1.12031 CCCCCCCN1CCCC(C1)OC 2230a_100000695604_100000210681 [0,0,0,1,0,0|2,0,1]=4 8100 B15R1.12031 CCCCCCCN1CCCC(C1)OC 269982a_100000695604_100000210681 [0,0,0,1,0,0|2,0,1]=4 8101 B15R1.12031 CCCCCCCN1CCCC(C1)OC 34a_100000695604_100000210614 [0,0,0,1,0,0|2,0,1]=4 8102 B15R1.12309 CCC(=O)CSCCN1CCCCCC1 62a_100000722644_100000747405 [0,0,0,1,0,0|3,0,0]=4 8103 B15R1.12309 CCC(=O)CSCCN1CCCCCC1 62a_100000747405_100000722644 [0,0,0,1,0,0|3,0,0]=4 8104 B15R1.12309 CCC(=O)NCCCN1CCCCCC1 11a_100000181460_100000210414 [0,0,0,1,0,0|3,0,0]=4 8105 B15R1.12309 CCC(=O)NCCCN1CCCCCC1 240690a_100000181460_100000210414 [0,0,0,1,0,0|3,0,0]=4 8106 B15R1.12309 CCC(=O)NCCCN1CCCCCC1 527a_100000181460_100000210414 [0,0,0,1,0,0|3,0,0]=4 8107 B15R1.12309 CCC(=O)NCCNC1CCCCCC1 270004a_100132302217_100000210131 [0,0,0,1,0,0|3,0,0]=4 8108 B15R1.12309 CCC(=O)NCCNC1CCCCCC1 34a_100132302217_100011217769 [0,0,0,1,0,0|3,0,0]=4 8109 B15R1.12309 CCC(=O)NCCOC1CCCCCC1 34a_200000158885_100011217769 [0,0,0,1,0,0|3,0,0]=4 8110 B15R1.12309 CNC(=O)CCCNC1CCCCCC1 2230a_100000210984_100000741757 [0,0,0,1,0,0|2,0,0]=3 8111 B15R1.12309 CNC(=O)CCCNC1CCCCCC1 270004a_100000740002_100000210131 [0,0,0,1,0,0|2,0,0]=3 8112 B15R1.12309 CNC(=O)CCCNC1CCCCCC1 34a_100000210984_100000741757 [0,0,0,1,0,0|2,0,0]=3 8113 B15R1.12309 CNC(=O)CCCNC1CCCCCC1 34a_100000740002_100011217769 [0,0,0,1,0,0|2,0,0]=3 8114 B15R1.12309 CNC(=O)CCCNC1CCCNCC1 270004a_100000740002_100015187895 [0,0,0,1,0,0|3,0,0]=4 8115 B15R1.12309 CNC(=O)CCCOC1CCCCCC1 34a_100000210887_100000741757 [0,0,0,1,0,0|2,0,0]=3 8116 B15R1.12309 CNC(=O)CCCOC1CCCCCC1 7a_100000210887_100000741757 [0,0,0,1,0,0|2,0,0]=3 8117 B15R1.12309 CNC(=O)CCCSC1CCCCCC1 62a_100000741757_100011217769 [0,0,0,1,0,0|2,0,0]=3 8118 B15R1.12309 CNC(=O)CCCSC1CCCCCC1 62a_100011217769_100000741757 [0,0,0,1,0,0|2,0,0]=3 8119 B15R1.12309 CNC(=O)CCNCC1CCCCCC1 2230a_100000738227_200000696569 [0,0,0,1,0,0|2,0,0]=3 8120 B15R1.12309 CNC(=O)CCNCC1CCCCCC1 2230a_100015204231_100000737683 [0,0,0,1,0,0|2,0,0]=3 8121 B15R1.12309 CNC(=O)CCNCC1CCCCCC1 269862a_100000738227_200000763224 [0,0,0,1,0,0|2,0,0]=3 8122 B15R1.12309 CNC(=O)CCNCC1CCCCCC1 34a_100000738227_200000696569 [0,0,0,1,0,0|2,0,0]=3 8123 B15R1.12309 CNC(=O)CCNCC1CCCCCC1 34a_100015204231_100012179268 [0,0,0,1,0,0|2,0,0]=3 8124 B15R1.12309 CNC(=O)CCOCC1CCCCCC1 34a_100000699130_100012179268 [0,0,0,1,0,0|2,0,0]=3 8125 B15R1.12309 CNC(=O)CCOCC1CCCCCC1 34a_100000754576_200000696569 [0,0,0,1,0,0|2,0,0]=3 8126 B15R1.12309 CNC(=O)CCOCC1CCCCCC1 7a_100000699130_100000737683 [0,0,0,1,0,0|2,0,0]=3 8127 B15R1.12309 CNC(=O)CCSCC1CCCCCC1 62a_100000737683_200000696569 [0,0,0,1,0,0|2,0,0]=3 8128 B15R1.12309 CNC(=O)CCSCC1CCCCCC1 62a_200000696569_100000737683 [0,0,0,1,0,0|2,0,0]=3 8129 B15R1.12309 CNC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000183359 [0,0,0,1,0,0|2,0,0]=3 8130 B15R1.12309 CNC(=O)CNCCC1CCCCCC1 34a_100011532351_100000183359 [0,0,0,1,0,0|2,0,0]=3 8131 B15R1.12309 CNC(=O)COCCN1CCCCCC1 34a_100000238007_100000183359 [0,0,0,1,0,0|3,0,0]=4 8132 B15R1.12309 CNC(=O)CSCCN1CCCCCC1 62a_100000183359_100000722644 [0,0,0,1,0,0|3,0,0]=4 8133 B15R1.12309 CNC(=O)CSCCN1CCCCCC1 62a_100000722644_100000183359 [0,0,0,1,0,0|3,0,0]=4 8134 B15R1.12309 CNC(=O)NCCCN1CCCCCC1 2708a_100102657272_100000181460 [0,0,0,1,0,0|3,0,0]=4 8135 B15R1.12309 CNC(=O)NCCCN1CCCCCC1 273464a_100000181460_100102657272 [0,0,0,1,0,0|3,0,0]=4 8136 B15R1.12309 CNC(=O)NCCCN1CCCCCC1 273464a_100102657272_100000181460 [0,0,0,1,0,0|3,0,0]=4 8137 B15R1.12309 CNC(=O)NCCCN1CCCCCC1 512a_100000181460_100102657272 [0,0,0,1,0,0|3,0,0]=4 8138 B15R1.12309 CNC(=O)NCCCN1CCCCCC1 512a_106832991638_100000181460 [0,0,0,1,0,0|3,0,0]=4 8139 B15R1.12309 CNC(=O)NCCNC1CCCCCC1 34a_100015205895_100011217769 [0,0,0,1,0,0|3,0,0]=4 8140 B15R1.12309 CNC(=O)OCCNC1CCCCCC1 34a_100000210984_200011997002 [0,0,0,1,0,0|3,0,0]=4 8141 B15R1.12309 CNC(=O)OCCOC1CCCCCC1 34a_100000210887_200011997002 [0,0,0,1,0,0|3,0,0]=4 8142 B15R1.12309 CNC(=O)OCCOC1CCCCCC1 7a_100000210887_200011997002 [0,0,0,1,0,0|3,0,0]=4 8143 B15R1.12309 CNC(=O)OCCSC1CCCCCC1 62a_100011217769_200011997002 [0,0,0,1,0,0|3,0,0]=4 8144 B15R1.12309 CNC(=O)OCCSC1CCCCCC1 62a_200011997002_100011217769 [0,0,0,1,0,0|3,0,0]=4 8145 B15R1.12309 COC(=O)/C=C/CNC1CCCCCC1 2230a_100000210984_100000742655 [0,0,0,1,0,0|1,0,2]=4 8146 B15R1.12309 COC(=O)/C=C/CNC1CCCCCC1 34a_100000210984_100000742655 [0,0,0,1,0,0|1,0,2]=4 8147 B15R1.12309 COC(=O)/C=C/COC1CCCCCC1 34a_100000210887_100000742655 [0,0,0,1,0,0|1,0,2]=4 8148 B15R1.12309 COC(=O)/C=C/COC1CCCCCC1 7a_100000210887_100000742655 [0,0,0,1,0,0|1,0,2]=4 8149 B15R1.12309 COC(=O)/C=C/CSC1CCCCCC1 62a_100000742655_100011217769 [0,0,0,1,0,0|1,0,2]=4 8150 B15R1.12309 COC(=O)/C=C/CSC1CCCCCC1 62a_100011217769_100000742655 [0,0,0,1,0,0|1,0,2]=4 8151 B15R1.12309 COC(=O)CCCCN1CCCCCC1 2230a_100000185865_100000204269 [0,0,0,1,0,0|1,0,0]=2 8152 B15R1.12309 COC(=O)CCCCN1CCCCCC1 269982a_100000185865_100000204269 [0,0,0,1,0,0|1,0,0]=2 8153 B15R1.12309 COC(=O)CCCCN1CCCCCC1 34a_100000185865_100000204269 [0,0,0,1,0,0|1,0,0]=2 8154 B15R1.12309 COC(=O)CCCCN1CCCOCC1 2230a_100000685342_100000204269 [0,0,0,1,0,0|2,0,0]=3 8155 B15R1.12309 COC(=O)CCCCN1CCCOCC1 269982a_100000685342_100000204269 [0,0,0,1,0,0|2,0,0]=3 8156 B15R1.12309 COC(=O)CCCCN1CCCOCC1 34a_100000685342_100000204269 [0,0,0,1,0,0|2,0,0]=3 8157 B15R1.12309 COC(=O)CCCNC1CCCCCC1 2230a_100000210984_100011218270 [0,0,0,1,0,0|1,0,0]=2 8158 B15R1.12309 COC(=O)CCCNC1CCCCCC1 34a_100000210984_100000742333 [0,0,0,1,0,0|1,0,0]=2 8159 B15R1.12309 COC(=O)CCCOC1CCCCCC1 34a_100000210887_100000742333 [0,0,0,1,0,0|1,0,0]=2 8160 B15R1.12309 COC(=O)CCCOC1CCCCCC1 7a_100000210887_100011218270 [0,0,0,1,0,0|1,0,0]=2 8161 B15R1.12309 COC(=O)CCCSC1CCCCCC1 62a_100011217769_100011218270 [0,0,0,1,0,0|1,0,0]=2 8162 B15R1.12309 COC(=O)CCCSC1CCCCCC1 62a_100011218270_100011217769 [0,0,0,1,0,0|1,0,0]=2 8163 B15R1.12309 COC(=O)CCNCC1CCCCCC1 2230a_100015204231_100000204255 [0,0,0,1,0,0|1,0,0]=2 8164 B15R1.12309 COC(=O)CCNCC1CCCCCC1 34a_100015204231_100000742370 [0,0,0,1,0,0|1,0,0]=2 8165 B15R1.12309 COC(=O)CCOCC1CCCCCC1 34a_100000699130_100000742370 [0,0,0,1,0,0|1,0,0]=2 8166 B15R1.12309 COC(=O)CCOCC1CCCCCC1 7a_100000699130_100000204255 [0,0,0,1,0,0|1,0,0]=2 8167 B15R1.12309 COC(=O)CCOCC1CNCCOC1 34a_100103147999_100000742370 [0,0,0,1,0,0|3,0,0]=4 8168 B15R1.12309 COC(=O)CCSCC1CCCCCC1 62a_100000204255_200000696569 [0,0,0,1,0,0|1,0,0]=2 8169 B15R1.12309 COC(=O)CCSCC1CCCCCC1 62a_200000696569_100000204255 [0,0,0,1,0,0|1,0,0]=2 8170 B15R1.12309 COC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000747449 [0,0,0,1,0,0|1,0,0]=2 8171 B15R1.12309 COC(=O)CNCCC1CCCCCC1 34a_100011532351_100000747449 [0,0,0,1,0,0|1,0,0]=2 8172 B15R1.12309 COC(=O)COCCN1CCCCCC1 2230a_100000185865_100000090808 [0,0,0,1,0,0|2,0,0]=3 8173 B15R1.12309 COC(=O)COCCN1CCCCCC1 34a_100000185865_100000090808 [0,0,0,1,0,0|2,0,0]=3 8174 B15R1.12309 COC(=O)COCCN1CCCCCC1 34a_100000238007_100000747449 [0,0,0,1,0,0|2,0,0]=3 8175 B15R1.12309 COC(=O)COCCN1CCCOCC1 2230a_100000685342_100000090808 [0,0,0,1,0,0|3,0,0]=4 8176 B15R1.12309 COC(=O)COCCN1CCCOCC1 34a_100000685342_100000090808 [0,0,0,1,0,0|3,0,0]=4 8177 B15R1.12309 COC(=O)CSCCN1CCCCCC1 62a_100000722644_100000747449 [0,0,0,1,0,0|2,0,0]=3 8178 B15R1.12309 COC(=O)CSCCN1CCCCCC1 62a_100000747449_100000722644 [0,0,0,1,0,0|2,0,0]=3 8179 B15R1.12309 COC(=O)NCCOC1CCCCCC1 34a_100000757965_100011217769 [0,0,0,1,0,0|2,0,0]=3 8180 B15R1.12309 COC(=O)OCCOC1CCCCCC1 34a_100010262106_100011217769 [0,0,0,1,0,0|2,0,0]=3 8181 B15R1.12309 COC(=O)OCSCC1CCCCCC1 62a_200000696569_100000139417 [0,0,0,1,0,0|2,0,0]=3 8182 B15R1.12309 COC(C)CCOCC1CCCCCC1 7a_100000764861_200000696569 [0,0,0,1,0,0|2,0,1]=4 8183 B15R1.12309 NNC(=O)CCCOC1CCCCCC1 34a_100000211488_100011217769 [0,0,0,1,0,0|3,0,0]=4 8184 B15R1.12436 C=CC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000185746 [0,0,0,1,0,0|2,0,1]=4 8185 B15R1.12436 C=CC(=O)NCCC1CCCCCCC1 240690a_100011532352_200121576911 [0,0,0,1,0,0|2,0,1]=4 8186 B15R1.12436 CCC(=O)COCC1CCCCCCC1 7a_100011216312_100000747405 [0,0,0,1,0,0|2,0,0]=3 8187 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210414 [0,0,0,1,0,0|2,0,0]=3 8188 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210414 [0,0,0,1,0,0|2,0,0]=3 8189 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210414 [0,0,0,1,0,0|2,0,0]=3 8190 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000210414 [0,0,0,1,0,0|2,0,0]=3 8191 B15R1.12436 CNC(=O)CCCN1CCCCCCC1 2230a_100000211400_100000741757 [0,0,0,1,0,0|2,0,0]=3 8192 B15R1.12436 CNC(=O)CCCN1CCCCCCC1 269982a_100000211400_100000741757 [0,0,0,1,0,0|2,0,0]=3 8193 B15R1.12436 CNC(=O)CCCN1CCCCCCC1 34a_100000211400_100000741757 [0,0,0,1,0,0|2,0,0]=3 8194 B15R1.12436 CNC(=O)CCNC1CCCCCCC1 2230a_100000211152_100000737683 [0,0,0,1,0,0|2,0,0]=3 8195 B15R1.12436 CNC(=O)CCNC1CCCCCCC1 270004a_100000738227_100000210524 [0,0,0,1,0,0|2,0,0]=3 8196 B15R1.12436 CNC(=O)CCNC1CCCCCCC1 34a_100000211152_100012179268 [0,0,0,1,0,0|2,0,0]=3 8197 B15R1.12436 CNC(=O)CCOC1CCCCCCC1 34a_100000210054_100012179268 [0,0,0,1,0,0|2,0,0]=3 8198 B15R1.12436 CNC(=O)CCOC1CCCCCCC1 7a_100000210054_100000737683 [0,0,0,1,0,0|2,0,0]=3 8199 B15R1.12436 CNC(=O)COCC1CCCCCCC1 34a_100011216312_100000183359 [0,0,0,1,0,0|2,0,0]=3 8200 B15R1.12436 CNC(=O)COCC1CCCCCCC1 7a_100011216312_100000183359 [0,0,0,1,0,0|2,0,0]=3 8201 B15R1.12436 CNC(=O)NCCC1CCCCCCC1 2708a_100011532352_106832991635 [0,0,0,1,0,0|2,0,0]=3 8202 B15R1.12436 CNC(=O)NCCC1CCCCCCC1 2708a_100102657272_100011532352 [0,0,0,1,0,0|2,0,0]=3 8203 B15R1.12436 CNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100102657272 [0,0,0,1,0,0|2,0,0]=3 8204 B15R1.12436 CNC(=O)NCCC1CCCCCCC1 273464a_100102657272_100011532352 [0,0,0,1,0,0|2,0,0]=3 8205 B15R1.12436 CNC(=O)NCCC1CCCCCCC1 512a_106832991638_100011532352 [0,0,0,1,0,0|2,0,0]=3 8206 B15R1.12436 CNC(=O)OCCN1CCCCCCC1 269982a_100000211400_200011997002 [0,0,0,1,0,0|3,0,0]=4 8207 B15R1.12436 CNC(=O)OCCN1CCCCCCC1 34a_100000211400_200011997002 [0,0,0,1,0,0|3,0,0]=4 8208 B15R1.12436 COC(=O)/C=C/CN1CCCCCCC1 2230a_100000211400_100000742655 [0,0,0,1,0,0|1,0,2]=4 8209 B15R1.12436 COC(=O)/C=C/CN1CCCCCCC1 269982a_100000211400_100000742655 [0,0,0,1,0,0|1,0,2]=4 8210 B15R1.12436 COC(=O)/C=C/CN1CCCCCCC1 34a_100000211400_100000742655 [0,0,0,1,0,0|1,0,2]=4 8211 B15R1.12436 COC(=O)CCCN1CCCCCCC1 2230a_100000211400_100011218270 [0,0,0,1,0,0|1,0,0]=2 8212 B15R1.12436 COC(=O)CCCN1CCCCCCC1 269982a_100000211400_100011218270 [0,0,0,1,0,0|1,0,0]=2 8213 B15R1.12436 COC(=O)CCCN1CCCCCCC1 34a_100000211400_100000742333 [0,0,0,1,0,0|1,0,0]=2 8214 B15R1.12436 COC(=O)CCNC1CCCCCCC1 2230a_100000211152_100000204255 [0,0,0,1,0,0|1,0,0]=2 8215 B15R1.12436 COC(=O)CCNC1CCCCCCC1 34a_100000211152_100000742370 [0,0,0,1,0,0|1,0,0]=2 8216 B15R1.12436 COC(=O)CCOC1C=CCCCCC1 34a_100000688657_100000742370 [0,0,0,1,0,0|1,0,2]=4 8217 B15R1.12436 COC(=O)CCOC1CC/C=C\CCC1 34a_100016989180_100000742370 [0,0,0,1,0,0|1,0,2]=4 8218 B15R1.12436 COC(=O)CCOC1CCCCCCC1 34a_100000210054_100000742370 [0,0,0,1,0,0|1,0,0]=2 8219 B15R1.12436 COC(=O)CCOC1CCCCCCC1 7a_100000210054_100000204255 [0,0,0,1,0,0|1,0,0]=2 8220 B15R1.12436 COC(=O)CCSC1CC/C=C\CCC1 62a_100000204255_100021000466 [0,0,0,1,0,0|1,0,2]=4 8221 B15R1.12436 COC(=O)CCSC1CC/C=C\CCC1 62a_100021000466_100000204255 [0,0,0,1,0,0|1,0,2]=4 8222 B15R1.12436 COC(=O)CNCC1CC/C=C\CCC1 2230a_100102730862_100000747449 [0,0,0,1,0,0|1,0,2]=4 8223 B15R1.12436 COC(=O)CNCC1CC/C=C\CCC1 34a_100102730862_100000747449 [0,0,0,1,0,0|1,0,2]=4 8224 B15R1.12436 COC(=O)COCC1CCCCCCC1 34a_100011216312_100000747449 [0,0,0,1,0,0|1,0,0]=2 8225 B15R1.12436 COC(=O)COCC1CCCCCCC1 7a_100011216312_100000747449 [0,0,0,1,0,0|1,0,0]=2 8226 B15R1.12436 O=C(CO)NCCC1CCCCCCC1 240690a_100011532352_100000210174 [0,0,0,1,0,0|3,0,0]=4 8227 B15R1.12436 O=C(CO)NCCC1CCCCCCC1 527a_100011532352_100000210174 [0,0,0,1,0,0|3,0,0]=4 8228 B12R0.5 C#CCCCCCCCCCOC 34a_100000034437_200000210301 [2,0,0,0,0,0|0,0,2]=4 8229 B12R0.5 C#CCCCCCCCCCOC 7a_100000034437_200000210301 [2,0,0,0,0,0|0,0,2]=4 8230 B12R0.5 C#CCCCCCCCCCO[13CH3] 34a_100000034437_200025704644 [2,0,0,0,0,0|0,0,2]=4 8231 B12R0.5 C#CCCCCCCCCCO[13CH3] 7a_100000034437_200025704644 [2,0,0,0,0,0|0,0,2]=4 8232 B12R0.5 C/C=C/CCOCCCCCCC 34a_100016278192_100000210614 [2,0,0,0,0,0|1,0,1]=4 8233 B12R0.5 C/C=C/CNCCCCCCCC 34a_100000229939_100102629194 [2,0,0,0,0,0|1,0,1]=4 8234 B12R0.5 C/C=C/COCCCCCCCC 34a_100000210232_100102629194 [2,0,0,0,0,0|1,0,1]=4 8235 B12R0.5 C/C=C/COCCCCCCCC 34a_100016270725_100000210759 [2,0,0,0,0,0|1,0,1]=4 8236 B12R0.5 C/C=C/COCCCCCCCC 7a_100000210232_100102629194 [2,0,0,0,0,0|1,0,1]=4 8237 B12R0.5 C/C=C/CSCCCCCCCC 62a_100000210759_100102629194 [2,0,0,0,0,0|1,0,1]=4 8238 B12R0.5 C/C=C/CSCCCCCCCC 62a_100102629194_100000210317 [2,0,0,0,0,0|1,0,1]=4 8239 B12R0.5 C=CCCCCCCCCCNC 2230a_100000081888_200000210301 [2,0,0,0,0,0|1,0,1]=4 8240 B12R0.5 C=CCCCCCCCCCNC 2230a_106832991635_100009814027 [2,0,0,0,0,0|1,0,1]=4 8241 B12R0.5 C=CCCCCCCCCCNC 34a_100000081888_200000210301 [2,0,0,0,0,0|1,0,1]=4 8242 B12R0.5 C=CCCCCCCCCCNC 34a_100102657272_100009814027 [2,0,0,0,0,0|1,0,1]=4 8243 B12R0.5 C=CCCCCCCCCCNC 7a_106832991635_100009814027 [2,0,0,0,0,0|1,0,1]=4 8244 B12R0.5 C=CCCCCCCCCCN[13CH3] 2230a_100000081888_200025704644 [2,0,0,0,0,0|1,0,1]=4 8245 B12R0.5 C=CCCCCCCCCCN[13CH3] 34a_100000081888_200025704644 [2,0,0,0,0,0|1,0,1]=4 8246 B12R0.5 C=CCCCCCCCCCOC 34a_100000038209_200000210301 [2,0,0,0,0,0|0,0,2]=4 8247 B12R0.5 C=CCCCCCCCCCOC 34a_100138415774_100009814027 [2,0,0,0,0,0|0,0,2]=4 8248 B12R0.5 C=CCCCCCCCCCOC 7a_100000038209_200000210301 [2,0,0,0,0,0|0,0,2]=4 8249 B12R0.5 C=CCCCCCCCCCO[13CH3] 34a_100000038209_200025704644 [2,0,0,0,0,0|0,0,2]=4 8250 B12R0.5 C=CCCCCCCCCCO[13CH3] 7a_100000038209_200025704644 [2,0,0,0,0,0|0,0,2]=4 8251 B12R0.5 C=CCCCCCCCCCSC 62a_100009814027_200000210301 [2,0,0,0,0,0|1,0,1]=4 8252 B12R0.5 C=CCCCCCCCCCSC 62a_200000210301_100009814027 [2,0,0,0,0,0|1,0,1]=4 8253 B12R0.5 C=CCCCCCCCCCS[13CH3] 62a_100009814027_200025704644 [2,0,0,0,0,0|1,0,1]=4 8254 B12R0.5 C=CCCCCCCCCCS[13CH3] 62a_200025704644_100009814027 [2,0,0,0,0,0|1,0,1]=4 8255 B12R0.5 C=CCCCCCCCCNCC 2230a_100015525214_100011933949 [2,0,0,0,0,0|1,0,1]=4 8256 B12R0.5 C=CCCCCCCCCOCC 34a_100011215194_100000210202 [2,0,0,0,0,0|1,0,1]=4 8257 B12R0.5 C=CCCCCCCCCOCC 34a_100121572206_100011933949 [2,0,0,0,0,0|1,0,1]=4 8258 B12R0.5 C=CCCCCCCCCOCC 7a_100011215194_100000210202 [2,0,0,0,0,0|1,0,1]=4 8259 B12R0.5 C=CCCCCCCCCSCC 62a_100000210202_100011933949 [2,0,0,0,0,0|1,0,1]=4 8260 B12R0.5 C=CCCCCCCCCSCC 62a_100011933949_100000210202 [2,0,0,0,0,0|1,0,1]=4 8261 B12R0.5 C=CCCCCCCCOCCC 34a_100000210258_100012355270 [2,0,0,0,0,0|1,0,1]=4 8262 B12R0.5 C=CCCCCCCCOCCC 34a_100000730831_100000210303 [2,0,0,0,0,0|1,0,1]=4 8263 B12R0.5 C=CCCCCCCCOCCC 7a_100000730831_100000210303 [2,0,0,0,0,0|1,0,1]=4 8264 B12R0.5 C=CCCCCCCCSCCC 62a_100000210303_100012355270 [2,0,0,0,0,0|1,0,1]=4 8265 B12R0.5 C=CCCCCCCCSCCC 62a_100012355270_100000210303 [2,0,0,0,0,0|1,0,1]=4 8266 B12R0.5 C=CCCCCCCNCCCC 2230a_100000102301_100011215473 [2,0,0,0,0,0|1,0,1]=4 8267 B12R0.5 C=CCCCCCCNCCCC 7a_106832991798_100011215473 [2,0,0,0,0,0|1,0,1]=4 8268 B12R0.5 C=CCCCCCCOCCCC 34a_100000210227_100011215473 [2,0,0,0,0,0|1,0,1]=4 8269 B12R0.5 C=CCCCCCCOCCCC 34a_200011216477_100000210210 [2,0,0,0,0,0|1,0,1]=4 8270 B12R0.5 C=CCCCCCCOCCCC 7a_100000210227_100011215473 [2,0,0,0,0,0|1,0,1]=4 8271 B12R0.5 C=CCCCCCCOCCCC 7a_200011216477_100000210211 [2,0,0,0,0,0|1,0,1]=4 8272 B12R0.5 C=CCCCCCCSCCCC 62a_100000210211_100011215473 [2,0,0,0,0,0|1,0,1]=4 8273 B12R0.5 C=CCCCCCCSCCCC 62a_100011215473_100000210210 [2,0,0,0,0,0|1,0,1]=4 8274 B12R0.5 C=CCCCCCNCCCCC 2230a_100000209983_100000700193 [2,0,0,0,0,0|1,0,1]=4 8275 B12R0.5 C=CCCCCCOCCCCC 34a_100000210253_100000700193 [2,0,0,0,0,0|1,0,1]=4 8276 B12R0.5 C=CCCCCCOCCCCC 34a_100011216702_100000718602 [2,0,0,0,0,0|1,0,1]=4 8277 B12R0.5 C=CCCCCCOCCCCC 7a_100000210253_100000700193 [2,0,0,0,0,0|1,0,1]=4 8278 B12R0.5 C=CCCCCCOCCCCC 7a_100011216702_100000210326 [2,0,0,0,0,0|1,0,1]=4 8279 B12R0.5 C=CCCCCCSCCCCC 62a_100000210326_100000700193 [2,0,0,0,0,0|1,0,1]=4 8280 B12R0.5 C=CCCCCCSCCCCC 62a_100000700193_100000210326 [2,0,0,0,0,0|1,0,1]=4 8281 B12R0.5 C=CCCCCNCCCCCC 2230a_100000210581_100011215482 [2,0,0,0,0,0|1,0,1]=4 8282 B12R0.5 C=CCCCCNCCCCCC 2230a_100000703577_100000210314 [2,0,0,0,0,0|1,0,1]=4 8283 B12R0.5 C=CCCCCNCCCCCC 34a_100000703577_100000210314 [2,0,0,0,0,0|1,0,1]=4 8284 B12R0.5 C=CCCCCOCCCCCC 34a_100000210259_100011215482 [2,0,0,0,0,0|1,0,1]=4 8285 B12R0.5 C=CCCCCOCCCCCC 34a_100000766645_100000210314 [2,0,0,0,0,0|1,0,1]=4 8286 B12R0.5 C=CCCCCOCCCCCC 7a_100000210259_100011215482 [2,0,0,0,0,0|1,0,1]=4 8287 B12R0.5 C=CCCCCOCCCCCC 7a_100000766645_100000210314 [2,0,0,0,0,0|1,0,1]=4 8288 B12R0.5 C=CCCCCSCCCCCC 62a_100000210314_100011215482 [2,0,0,0,0,0|1,0,1]=4 8289 B12R0.5 C=CCCCCSCCCCCC 62a_100011215482_100000210757 [2,0,0,0,0,0|1,0,1]=4 8290 B12R0.5 C=CCCCNCCCCCCC 2230a_100000229938_100011713584 [2,0,0,0,0,0|1,0,1]=4 8291 B12R0.5 C=CCCCNCCCCCCC 2230a_100000700776_100000210681 [2,0,0,0,0,0|1,0,1]=4 8292 B12R0.5 C=CCCCNCCCCCCC 34a_100000700776_100000210614 [2,0,0,0,0,0|1,0,1]=4 8293 B12R0.5 C=CCCCOCCCCCCC 34a_100000210272_100000757094 [2,0,0,0,0,0|1,0,1]=4 8294 B12R0.5 C=CCCCOCCCCCCC 34a_100000758997_100000210614 [2,0,0,0,0,0|1,0,1]=4 8295 B12R0.5 C=CCCCOCCCCCCC 7a_100000210272_100000757094 [2,0,0,0,0,0|1,0,1]=4 8296 B12R0.5 C=CCCCOCCCCCCC 7a_100000758997_100000210614 [2,0,0,0,0,0|1,0,1]=4 8297 B12R0.5 C=CCCCSCCCCCCC 62a_100000210614_100000757094 [2,0,0,0,0,0|1,0,1]=4 8298 B12R0.5 C=CCCCSCCCCCCC 62a_100011713584_100000210316 [2,0,0,0,0,0|1,0,1]=4 8299 B12R0.5 C=CCCNCCCCCCCC 2230a_100000229939_100000754431 [2,0,0,0,0,0|1,0,1]=4 8300 B12R0.5 C=CCCNCCCCCCCC 2230a_100015191253_100000210759 [2,0,0,0,0,0|1,0,1]=4 8301 B12R0.5 C=CCCNCCCCCCCC 34a_100000229939_100000754431 [2,0,0,0,0,0|1,0,1]=4 8302 B12R0.5 C=CCCOCCCCCCCC 34a_100000210232_100000754431 [2,0,0,0,0,0|1,0,1]=4 8303 B12R0.5 C=CCCOCCCCCCCC 34a_100011205117_100000210759 [2,0,0,0,0,0|1,0,1]=4 8304 B12R0.5 C=CCCOCCCCCCCC 7a_100000210232_100000754431 [2,0,0,0,0,0|1,0,1]=4 8305 B12R0.5 C=CCCSCCCCCCCC 62a_100000210759_100000754431 [2,0,0,0,0,0|1,0,1]=4 8306 B12R0.5 C=CCCSCCCCCCCC 62a_100000754431_100000210317 [2,0,0,0,0,0|1,0,1]=4 8307 B12R0.5 C=CCNCCCCCCCCC 2230a_100000212291_100000210623 [2,0,0,0,0,0|1,0,1]=4 8308 B12R0.5 C=CCNCCCCCCCCC 2230a_100020586998_100011214924 [2,0,0,0,0,0|1,0,1]=4 8309 B12R0.5 C=CCNCCCCCCCCC 34a_100000212291_100015514636 [2,0,0,0,0,0|1,0,1]=4 8310 B12R0.5 C=CCOCCCCCCCCC 34a_100000210712_100015514636 [2,0,0,0,0,0|1,0,1]=4 8311 B12R0.5 C=CCOCCCCCCCCC 34a_200000210373_100011214924 [2,0,0,0,0,0|1,0,1]=4 8312 B12R0.5 C=CCOCCCCCCCCC 7a_100000210712_100015514636 [2,0,0,0,0,0|1,0,1]=4 8313 B12R0.5 C=CCSCCCCCCCCC 62a_100000210623_100000210670 [2,0,0,0,0,0|1,0,1]=4 8314 B12R0.5 CC=CCCCOCCCCCC 34a_100020645299_100000210314 [2,0,0,0,0,0|1,0,1]=4 8315 B12R0.5 CC=CCNCCCCCCCC 2230a_100000229939_100000070051 [2,0,0,0,0,0|1,0,1]=4 8316 B12R0.5 CC=CCNCCCCCCCC 34a_100000229939_100000070051 [2,0,0,0,0,0|1,0,1]=4 8317 B12R0.5 CC=CCOCCCCCCCC 34a_100000210232_100000070051 [2,0,0,0,0,0|1,0,1]=4 8318 B12R0.5 CC=CCOCCCCCCCC 7a_100000210232_100000070051 [2,0,0,0,0,0|1,0,1]=4 8319 B12R0.5 CC=CCSCCCCCCCC 62a_100000070051_100000210317 [2,0,0,0,0,0|1,0,1]=4 8320 B12R0.5 CC=CCSCCCCCCCC 62a_100000210759_100000070051 [2,0,0,0,0,0|1,0,1]=4 8321 B12R0.5 CCCCCCCC/C=C/COC 34a_200020667288_200000210301 [2,0,0,0,0,0|0,0,2]=4 8322 B12R0.5 CCCCCCCC/C=C/COC 7a_200020667288_200000210301 [2,0,0,0,0,0|0,0,2]=4 8323 B12R0.5 CCCCCCCC/C=C/CO[13CH3] 34a_200020667288_200025704644 [2,0,0,0,0,0|0,0,2]=4 8324 B12R0.5 CCCCCCCC/C=C/CO[13CH3] 7a_200020667288_200025704644 [2,0,0,0,0,0|0,0,2]=4 8325 B12R0.5 CCCCCCCCCCCNC 2230a_106832991635_100011215454 [2,0,0,0,0,0|1,0,0]=3 8326 B12R0.5 CCCCCCCCCCCNC 2230a_200011215754_200000210301 [2,0,0,0,0,0|1,0,0]=3 8327 B12R0.5 CCCCCCCCCCCNC 34a_100102657272_100011215454 [2,0,0,0,0,0|1,0,0]=3 8328 B12R0.5 CCCCCCCCCCCNC 34a_200011215754_200000210301 [2,0,0,0,0,0|1,0,0]=3 8329 B12R0.5 CCCCCCCCCCCNC 7a_106832991635_100011215454 [2,0,0,0,0,0|1,0,0]=3 8330 B12R0.5 CCCCCCCCCCCN[13CH3] 2230a_200011215754_200025704644 [2,0,0,0,0,0|1,0,0]=3 8331 B12R0.5 CCCCCCCCCCCN[13CH3] 34a_200011215754_200025704644 [2,0,0,0,0,0|1,0,0]=3 8332 B12R0.5 CCCCCCCCCCCOC 34a_100000210809_200000210301 [2,0,0,0,0,0|0,0,0]=2 8333 B12R0.5 CCCCCCCCCCCOC 34a_100138415774_100011215454 [2,0,0,0,0,0|0,0,0]=2 8334 B12R0.5 CCCCCCCCCCCOC 7a_100000210809_200000210301 [2,0,0,0,0,0|0,0,0]=2 8335 B12R0.5 CCCCCCCCCCCO[13CH3] 34a_100000210809_200025704644 [2,0,0,0,0,0|0,0,0]=2 8336 B12R0.5 CCCCCCCCCCCO[13CH3] 7a_100000210809_200025704644 [2,0,0,0,0,0|0,0,0]=2 8337 B12R0.5 CCCCCCCCCCCSC 62a_200000210301_100011215454 [2,0,0,0,0,0|0,1,0]=3 8338 B12R0.5 CCCCCCCCCCCS[13CH3] 62a_200025704644_100011215454 [2,0,0,0,0,0|0,1,0]=3 8339 B12R0.5 CCCCCCCCCCNCC 2230a_100000684558_100000210202 [2,0,0,0,0,0|1,0,1]=4 8340 B12R0.5 CCCCCCCCCCNCC 2230a_100015525214_100000210320 [2,0,0,0,0,0|1,0,1]=4 8341 B12R0.5 CCCCCCCCCCNCC 34a_100000684558_100000210202 [2,0,0,0,0,0|1,0,1]=4 8342 B12R0.5 CCCCCCCCCCOCC 34a_100000210711_100000210202 [2,0,0,0,0,0|1,0,1]=4 8343 B12R0.5 CCCCCCCCCCOCC 34a_100121572206_100000210320 [2,0,0,0,0,0|1,0,1]=4 8344 B12R0.5 CCCCCCCCCCOCC 7a_100000210711_100000210202 [2,0,0,0,0,0|1,0,1]=4 8345 B12R0.5 CCCCCCCCCCSCC 62a_100000210202_100000210320 [2,0,0,0,0,0|1,0,1]=4 8346 B12R0.5 CCCCCCCCCNCC=O 2230a_100000212291_200015260668 [2,0,0,0,0,0|1,0,0]=3 8347 B12R0.5 CCCCCCCCCNCC=O 34a_100000212291_200009817547 [2,0,0,0,0,0|1,0,0]=3 8348 B12R0.5 CCCCCCCCCNCCC 2230a_100000212291_100000210303 [2,0,0,0,0,0|1,0,1]=4 8349 B12R0.5 CCCCCCCCCNCCC 34a_100000212291_100000210303 [2,0,0,0,0,0|1,0,1]=4 8350 B12R0.5 CCCCCCCCCNCCO 2230a_100000212291_100000211926 [2,0,0,0,0,0|1,0,1]=4 8351 B12R0.5 CCCCCCCCCNCCO 2230a_100016997473_100011214924 [2,0,0,0,0,0|1,0,1]=4 8352 B12R0.5 CCCCCCCCCNCCO 34a_100000212291_100000211926 [2,0,0,0,0,0|1,0,1]=4 8353 B12R0.5 CCCCCCCCCNCCO 34a_100016990907_100011214924 [2,0,0,0,0,0|1,0,1]=4 8354 B12R0.5 CCCCCCCCCNCOC 2230a_100000212291_100000766300 [2,0,0,0,0,0|1,0,0]=3 8355 B12R0.5 CCCCCCCCCNCSC 2230a_100000212291_100011218213 [2,0,0,0,0,0|1,1,0]=4 8356 B12R0.5 CCCCCCCCCNCSC 34a_100000212291_100011218213 [2,0,0,0,0,0|1,1,0]=4 8357 B12R0.5 CCCCCCCCCOCC=O 34a_100000210712_200009817547 [2,0,0,0,0,0|1,0,0]=3 8358 B12R0.5 CCCCCCCCCOCC=O 7a_100000210712_200015260668 [2,0,0,0,0,0|1,0,0]=3 8359 B12R0.5 CCCCCCCCCOCCC 34a_100000210258_100011214924 [2,0,0,0,0,0|1,0,1]=4 8360 B12R0.5 CCCCCCCCCOCCC 34a_100000210712_100000210303 [2,0,0,0,0,0|1,0,1]=4 8361 B12R0.5 CCCCCCCCCOCCC 7a_100000210712_100000210303 [2,0,0,0,0,0|1,0,1]=4 8362 B12R0.5 CCCCCCCCCOCCO 34a_100000210712_100000211926 [2,0,0,0,0,0|1,0,1]=4 8363 B12R0.5 CCCCCCCCCOCCO 7a_100000210712_100000211926 [2,0,0,0,0,0|1,0,1]=4 8364 B12R0.5 CCCCCCCCCOCSC 34a_100000210712_100011218213 [2,0,0,0,0,0|1,1,0]=4 8365 B12R0.5 CCCCCCCCCSCC=O 62a_200015260668_100000210670 [2,0,0,0,0,0|1,0,0]=3 8366 B12R0.5 CCCCCCCCCSCCC 62a_100000210303_100000210670 [2,0,0,0,0,0|1,0,1]=4 8367 B12R0.5 CCCCCCCCCSCCO 62a_100000211926_100000210670 [2,0,0,0,0,0|1,0,1]=4 8368 B12R0.5 CCCCCCCCCSCOC 62a_100000766300_100000210670 [2,0,0,0,0,0|1,0,0]=3 8369 B12R0.5 CCCCCCCCCSCSC 62a_100011218213_100000210670 [2,0,0,0,0,0|1,1,0]=4 8370 B12R0.5 CCCCCCCCNCCCC 2230a_100000102301_100000210759 [2,0,0,0,0,0|1,0,1]=4 8371 B12R0.5 CCCCCCCCNCCCC 2230a_100000229939_100000210211 [2,0,0,0,0,0|1,0,1]=4 8372 B12R0.5 CCCCCCCCNCCCC 34a_100000229939_100000210210 [2,0,0,0,0,0|1,0,1]=4 8373 B12R0.5 CCCCCCCCNCCCC 7a_106832991798_100000210759 [2,0,0,0,0,0|1,0,1]=4 8374 B12R0.5 CCCCCCCCNCCCO 2230a_100000229939_100000230001 [2,0,0,0,0,0|1,0,1]=4 8375 B12R0.5 CCCCCCCCNCCCO 34a_100000229939_100000230001 [2,0,0,0,0,0|1,0,1]=4 8376 B12R0.5 CCCCCCCCNCCOC 2230a_100000209980_100000210759 [2,0,0,0,0,0|1,0,0]=3 8377 B12R0.5 CCCCCCCCNCCOC 2230a_100000229939_100011201679 [2,0,0,0,0,0|1,0,0]=3 8378 B12R0.5 CCCCCCCCNCCOC 34a_100000229939_100011201679 [2,0,0,0,0,0|1,0,0]=3 8379 B12R0.5 CCCCCCCCNCCSC 2230a_100000229939_100000751147 [2,0,0,0,0,0|1,1,0]=4 8380 B12R0.5 CCCCCCCCNCCSC 2230a_100020590264_100000210759 [2,0,0,0,0,0|1,1,0]=4 8381 B12R0.5 CCCCCCCCNCCSC 34a_100000229939_100000212216 [2,0,0,0,0,0|1,1,0]=4 8382 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [2,0,0,0,0,0|1,0,1]=4 8383 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [2,0,0,0,0,0|1,0,1]=4 8384 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [2,0,0,0,0,0|1,0,1]=4 8385 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [2,0,0,0,0,0|1,0,1]=4 8386 B12R0.5 CCCCCCCCOCCCO 34a_100000210232_100000230001 [2,0,0,0,0,0|1,0,1]=4 8387 B12R0.5 CCCCCCCCOCCCO 7a_100000210232_100011215043 [2,0,0,0,0,0|1,0,1]=4 8388 B12R0.5 CCCCCCCCOCCOC 34a_100000210232_100011201679 [2,0,0,0,0,0|1,0,0]=3 8389 B12R0.5 CCCCCCCCOCCOC 34a_100000210237_100000210759 [2,0,0,0,0,0|1,0,0]=3 8390 B12R0.5 CCCCCCCCOCCOC 7a_100000210232_100000233755 [2,0,0,0,0,0|1,0,0]=3 8391 B12R0.5 CCCCCCCCOCCON 34a_100000700252_100000210759 [2,0,0,0,0,0|2,0,0]=4 8392 B12R0.5 CCCCCCCCOCCSC 34a_100000210232_100000212216 [2,0,0,0,0,0|1,1,0]=4 8393 B12R0.5 CCCCCCCCOCCSC 34a_100000230434_100000210759 [2,0,0,0,0,0|1,1,0]=4 8394 B12R0.5 CCCCCCCCOCCSC 7a_100000210232_100000212216 [2,0,0,0,0,0|1,1,0]=4 8395 B12R0.5 CCCCCCCCOCCSC 7a_100000230434_100000210759 [2,0,0,0,0,0|1,1,0]=4 8396 B12R0.5 CCCCCCCCSCCCC 62a_100000210211_100000210317 [2,0,0,0,0,0|1,0,1]=4 8397 B12R0.5 CCCCCCCCSCCCC 62a_100000210759_100000210210 [2,0,0,0,0,0|1,0,1]=4 8398 B12R0.5 CCCCCCCCSCCCO 62a_100000210759_100011215043 [2,0,0,0,0,0|1,0,1]=4 8399 B12R0.5 CCCCCCCCSCCCO 62a_100011215043_100000210317 [2,0,0,0,0,0|1,0,1]=4 8400 B12R0.5 CCCCCCCCSCCOC 62a_100000210759_100000233755 [2,0,0,0,0,0|1,0,0]=3 8401 B12R0.5 CCCCCCCCSCCOC 62a_100000233755_100000210317 [2,0,0,0,0,0|1,0,0]=3 8402 B12R0.5 CCCCCCCCSCCSC 62a_100000210759_100000751147 [2,0,0,0,0,0|1,1,0]=4 8403 B12R0.5 CCCCCCCCSCCSC 62a_100000212216_100000210317 [2,0,0,0,0,0|1,1,0]=4 8404 B12R0.5 CCCCCCCNCCCC=O 2230a_100000229938_200011292268 [2,0,0,0,0,0|1,0,0]=3 8405 B12R0.5 CCCCCCCNCCCCC 2230a_100000209983_100000210681 [2,0,0,0,0,0|1,0,1]=4 8406 B12R0.5 CCCCCCCNCCCCC 2230a_100000229938_100000210326 [2,0,0,0,0,0|1,0,1]=4 8407 B12R0.5 CCCCCCCNCCCCO 2230a_100000229938_100000210776 [2,0,0,0,0,0|1,0,1]=4 8408 B12R0.5 CCCCCCCNCCCCO 2230a_100000750430_100000210681 [2,0,0,0,0,0|1,0,1]=4 8409 B12R0.5 CCCCCCCNCCCCO 34a_100000750430_100000210614 [2,0,0,0,0,0|1,0,1]=4 8410 B12R0.5 CCCCCCCNCCCOC 2230a_100000229938_100000740836 [2,0,0,0,0,0|1,0,0]=3 8411 B12R0.5 CCCCCCCNCCCOC 34a_100150723488_100000210614 [2,0,0,0,0,0|1,0,0]=3 8412 B12R0.5 CCCCCCCNCCCSC 2230a_100000749238_100000210681 [2,0,0,0,0,0|1,1,0]=4 8413 B12R0.5 CCCCCCCOCCCC=O 7a_100000210272_200011292268 [2,0,0,0,0,0|1,0,0]=3 8414 B12R0.5 CCCCCCCOCCCCC 34a_100000210253_100000210614 [2,0,0,0,0,0|1,0,1]=4 8415 B12R0.5 CCCCCCCOCCCCC 34a_100000210272_100000718602 [2,0,0,0,0,0|1,0,1]=4 8416 B12R0.5 CCCCCCCOCCCCC 7a_100000210253_100000210614 [2,0,0,0,0,0|1,0,1]=4 8417 B12R0.5 CCCCCCCOCCCCC 7a_100000210272_100000210326 [2,0,0,0,0,0|1,0,1]=4 8418 B12R0.5 CCCCCCCOCCCCO 34a_100000210272_100011216708 [2,0,0,0,0,0|1,0,1]=4 8419 B12R0.5 CCCCCCCOCCCCO 7a_100000210272_100000210776 [2,0,0,0,0,0|1,0,1]=4 8420 B12R0.5 CCCCCCCOCCCNC 34a_100000213112_100000210614 [2,0,0,0,0,0|2,0,0]=4 8421 B12R0.5 CCCCCCCOCCCOC 34a_100000210272_100000740836 [2,0,0,0,0,0|1,0,0]=3 8422 B12R0.5 CCCCCCCOCCCOC 34a_100000740835_100000210614 [2,0,0,0,0,0|1,0,0]=3 8423 B12R0.5 CCCCCCCOCCCOC 7a_100000210272_100000740836 [2,0,0,0,0,0|1,0,0]=3 8424 B12R0.5 CCCCCCCOCCCSC 34a_100000690336_100000210614 [2,0,0,0,0,0|1,1,0]=4 8425 B12R0.5 CCCCCCCOCCCSC 7a_100000690336_100000210614 [2,0,0,0,0,0|1,1,0]=4 8426 B12R0.5 CCCCCCCSCCCC=O 62a_100000210614_200011292268 [2,0,0,0,0,0|1,0,0]=3 8427 B12R0.5 CCCCCCCSCCCC=O 62a_200011292268_100000210316 [2,0,0,0,0,0|1,0,0]=3 8428 B12R0.5 CCCCCCCSCCCCC 62a_100000210326_100000210316 [2,0,0,0,0,0|1,0,1]=4 8429 B12R0.5 CCCCCCCSCCCCC 62a_100000210614_100000210326 [2,0,0,0,0,0|1,0,1]=4 8430 B12R0.5 CCCCCCCSCCCCO 62a_100000210614_100000210776 [2,0,0,0,0,0|1,0,1]=4 8431 B12R0.5 CCCCCCCSCCCCO 62a_100000210776_100000210316 [2,0,0,0,0,0|1,0,1]=4 8432 B12R0.5 CCCCCCCSCCCOC 62a_100000210614_100000709357 [2,0,0,0,0,0|1,0,0]=3 8433 B12R0.5 CCCCCCCSCCCOC 62a_100000709357_100000210316 [2,0,0,0,0,0|1,0,0]=3 8434 B12R0.5 CCCCCCNCCCCC=O 2230a_100000210581_100000139335 [2,0,0,0,0,0|1,0,0]=3 8435 B12R0.5 CCCCCCNCCCCCC 2230a_100000210581_100000210314 [2,0,0,0,0,0|1,0,1]=4 8436 B12R0.5 CCCCCCNCCCCCO 2230a_100000210581_100000746330 [2,0,0,0,0,0|1,0,1]=4 8437 B12R0.5 CCCCCCNCCCCCO 2230a_100000762737_100000210314 [2,0,0,0,0,0|1,0,1]=4 8438 B12R0.5 CCCCCCNCCCCCO 34a_100000762737_100000210314 [2,0,0,0,0,0|1,0,1]=4 8439 B12R0.5 CCCCCCNCCCCOC 2230a_100000210581_100000730899 [2,0,0,0,0,0|1,0,0]=3 8440 B12R0.5 CCCCCCNCOCCOC 2230a_100000210581_100000231047 [2,0,0,0,0,0|2,0,0]=4 8441 B12R0.5 CCCCCCOCCCCC=O 7a_100000210259_100000139335 [2,0,0,0,0,0|1,0,0]=3 8442 B12R0.5 CCCCCCOCCCCCC 34a_100000210259_100000210314 [2,0,0,0,0,0|1,0,1]=4 8443 B12R0.5 CCCCCCOCCCCCC 7a_100000210259_100000210314 [2,0,0,0,0,0|1,0,1]=4 8444 B12R0.5 CCCCCCOCCCCCO 34a_100000210259_100000746330 [2,0,0,0,0,0|1,0,1]=4 8445 B12R0.5 CCCCCCOCCCCCO 7a_100000210259_100000746330 [2,0,0,0,0,0|1,0,1]=4 8446 B12R0.5 CCCCCCOCCCCOC 34a_100000210259_100000755781 [2,0,0,0,0,0|1,0,0]=3 8447 B12R0.5 CCCCCCOCCCCOC 34a_100000740925_100000210314 [2,0,0,0,0,0|1,0,0]=3 8448 B12R0.5 CCCCCCOCCCCOC 7a_100000210259_100000730899 [2,0,0,0,0,0|1,0,0]=3 8449 B12R0.5 CCCCCCOCCCCSC 34a_100011217163_100000210314 [2,0,0,0,0,0|1,1,0]=4 8450 B12R0.5 CCCCCCOCCCCSC 7a_100011217163_100000210314 [2,0,0,0,0,0|1,1,0]=4 8451 B12R0.5 CCCCCCOCCOCC=O 34a_100000691444_200009817547 [2,0,0,0,0,0|2,0,0]=4 8452 B12R0.5 CCCCCCOCCOCC=O 7a_100000691444_200015260668 [2,0,0,0,0,0|2,0,0]=4 8453 B12R0.5 CCCCCCSCCCCC=O 62a_100000139335_100000210757 [2,0,0,0,0,0|1,0,0]=3 8454 B12R0.5 CCCCCCSCCCCC=O 62a_100000210314_100000139335 [2,0,0,0,0,0|1,0,0]=3 8455 B12R0.5 CCCCCCSCCCCCC 62a_100000210314_100000210757 [2,0,0,0,0,0|1,0,1]=4 8456 B12R0.5 CCCCCCSCCCCCO 62a_100000210314_100000746330 [2,0,0,0,0,0|1,0,1]=4 8457 B12R0.5 CCCCCCSCCCCCO 62a_100000746330_100000210757 [2,0,0,0,0,0|1,0,1]=4 8458 B12R0.5 CCCCCCSCCCCOC 62a_100000210314_100000730899 [2,0,0,0,0,0|1,0,0]=3 8459 B12R0.5 CCCCCCSCCCCOC 62a_100000730899_100000210757 [2,0,0,0,0,0|1,0,0]=3 8460 B12R0.5 CCCCCCSCOCCOC 62a_100000210314_100000231047 [2,0,0,0,0,0|2,0,0]=4 8461 B12R0.5 CCCCCCSCOCCOC 62a_100000231047_100000210757 [2,0,0,0,0,0|2,0,0]=4 8462 B12R0.5 CCCCCNCCCCCC=O 2230a_100000209983_100000139337 [2,0,0,0,0,0|1,0,0]=3 8463 B12R0.5 CCCCCNCCCCCCO 2230a_100000209983_100000766143 [2,0,0,0,0,0|1,0,1]=4 8464 B12R0.5 CCCCCNCCCCCCO 2230a_100000686447_100000210326 [2,0,0,0,0,0|1,0,1]=4 8465 B12R0.5 CCCCCNCCCCCCO 34a_100000686447_100000718602 [2,0,0,0,0,0|1,0,1]=4 8466 B12R0.5 CCCCCNCCCCCOC 2230a_100000747528_100000210326 [2,0,0,0,0,0|1,0,0]=3 8467 B12R0.5 CCCCCNCCCCCOC 34a_100000747528_100000718602 [2,0,0,0,0,0|1,0,0]=3 8468 B12R0.5 CCCCCNCCOCCOC 2230a_100000209983_100000695917 [2,0,0,0,0,0|2,0,0]=4 8469 B12R0.5 CCCCCNCCOCCOC 2230a_100000745349_100000210326 [2,0,0,0,0,0|2,0,0]=4 8470 B12R0.5 CCCCCNCCOCCOC 34a_100000224656_100011201679 [2,0,0,0,0,0|2,0,0]=4 8471 B12R0.5 CCCCCNCCOCCOC 34a_100000745349_100000718602 [2,0,0,0,0,0|2,0,0]=4 8472 B12R0.5 CCCCCOCCCCCC=O 7a_100000210253_100000139337 [2,0,0,0,0,0|1,0,0]=3 8473 B12R0.5 CCCCCOCCCCCCO 34a_100000210253_100000766143 [2,0,0,0,0,0|1,0,1]=4 8474 B12R0.5 CCCCCOCCCCCCO 7a_100000210253_100000766143 [2,0,0,0,0,0|1,0,1]=4 8475 B12R0.5 CCCCCOCCCCCNC 34a_100000722520_100000718602 [2,0,0,0,0,0|2,0,0]=4 8476 B12R0.5 CCCCCOCCOCCOC 34a_100000210253_100000695917 [2,0,0,0,0,0|2,0,0]=4 8477 B12R0.5 CCCCCOCCOCCOC 34a_100011215163_100000718602 [2,0,0,0,0,0|2,0,0]=4 8478 B12R0.5 CCCCCOCCOCCOC 34a_100011215259_100011201679 [2,0,0,0,0,0|2,0,0]=4 8479 B12R0.5 CCCCCOCCOCCOC 7a_100000210253_100000695917 [2,0,0,0,0,0|2,0,0]=4 8480 B12R0.5 CCCCCOCCOCCOC 7a_100011215163_100000210326 [2,0,0,0,0,0|2,0,0]=4 8481 B12R0.5 CCCCCOCCOCCOC 7a_100011215259_100000233755 [2,0,0,0,0,0|2,0,0]=4 8482 B12R0.5 CCCCCSCCCCCC=O 62a_100000139337_100000210326 [2,0,0,0,0,0|1,0,0]=3 8483 B12R0.5 CCCCCSCCCCCC=O 62a_100000210326_100000139337 [2,0,0,0,0,0|1,0,0]=3 8484 B12R0.5 CCCCCSCCCCCCO 62a_100000210326_100000766143 [2,0,0,0,0,0|1,0,1]=4 8485 B12R0.5 CCCCCSCCCCCCO 62a_100000766143_100000210326 [2,0,0,0,0,0|1,0,1]=4 8486 B12R0.5 CCCCCSCCOCCOC 62a_100000210326_100000695917 [2,0,0,0,0,0|2,0,0]=4 8487 B12R0.5 CCCCCSCCOCCOC 62a_100000695917_100000210326 [2,0,0,0,0,0|2,0,0]=4 8488 B12R0.5 CCCCNCCCCCCCO 2230a_100000102301_100000760002 [2,0,0,0,0,0|1,0,1]=4 8489 B12R0.5 CCCCNCCCCCCCO 2230a_100011996573_100000210211 [2,0,0,0,0,0|1,0,1]=4 8490 B12R0.5 CCCCNCCCCCCCO 34a_100011996573_100000210210 [2,0,0,0,0,0|1,0,1]=4 8491 B12R0.5 CCCCNCCCCCCCO 7a_106832991798_100000760002 [2,0,0,0,0,0|1,0,1]=4 8492 B12R0.5 CCCCNCCCCCCOC 2230a_100000102301_100011998445 [2,0,0,0,0,0|1,0,0]=3 8493 B12R0.5 CCCCNCCCCCCOC 7a_106832991798_100011998445 [2,0,0,0,0,0|1,0,0]=3 8494 B12R0.5 CCCCNCCCCOCC=O 34a_200011216965_200009817547 [2,0,0,0,0,0|2,0,0]=4 8495 B12R0.5 CCCCNCCCOCCOC 2230a_100000102301_100011216529 [2,0,0,0,0,0|2,0,0]=4 8496 B12R0.5 CCCCNCCCOCCOC 2230a_100000206027_100000210211 [2,0,0,0,0,0|2,0,0]=4 8497 B12R0.5 CCCCNCCCOCCOC 34a_100000206027_100000210210 [2,0,0,0,0,0|2,0,0]=4 8498 B12R0.5 CCCCNCCCOCCOC 7a_106832991798_100011216529 [2,0,0,0,0,0|2,0,0]=4 8499 B12R0.5 CCCCOCCCCCCCO 34a_100000210227_100000760002 [2,0,0,0,0,0|1,0,1]=4 8500 B12R0.5 CCCCOCCCCCCCO 7a_100000210227_100000760002 [2,0,0,0,0,0|1,0,1]=4 8501 B12R0.5 CCCCOCCCCCCOC 34a_100000210227_100011998445 [2,0,0,0,0,0|1,0,0]=3 8502 B12R0.5 CCCCOCCCCCCOC 34a_200012092642_100000210210 [2,0,0,0,0,0|1,0,0]=3 8503 B12R0.5 CCCCOCCCCCCOC 7a_100000210227_100011998445 [2,0,0,0,0,0|1,0,0]=3 8504 B12R0.5 CCCCOCCCCCCOC 7a_200012092642_100000210211 [2,0,0,0,0,0|1,0,0]=3 8505 B12R0.5 CCCCOCCCCOCC=O 34a_200000760531_200009817547 [2,0,0,0,0,0|2,0,0]=4 8506 B12R0.5 CCCCOCCCCOCC=O 7a_200000760531_200015260668 [2,0,0,0,0,0|2,0,0]=4 8507 B12R0.5 CCCCOCCCNCCOC 2230a_200000211371_100011201679 [2,0,0,0,0,0|2,0,0]=4 8508 B12R0.5 CCCCOCCCNCCOC 34a_200000211371_100011201679 [2,0,0,0,0,0|2,0,0]=4 8509 B12R0.5 CCCCOCCCOCCOC 34a_100000210227_100011216529 [2,0,0,0,0,0|2,0,0]=4 8510 B12R0.5 CCCCOCCCOCCOC 34a_200011215613_100011201679 [2,0,0,0,0,0|2,0,0]=4 8511 B12R0.5 CCCCOCCCOCCOC 7a_100000210227_100011216529 [2,0,0,0,0,0|2,0,0]=4 8512 B12R0.5 CCCCOCCCOCCOC 7a_200011215613_100000233755 [2,0,0,0,0,0|2,0,0]=4 8513 B12R0.5 CCCCOCCNCCCOC 34a_100150723488_100000743108 [2,0,0,0,0,0|2,0,0]=4 8514 B12R0.5 CCCCOCCOCCCC=O 7a_100000210238_200011292268 [2,0,0,0,0,0|2,0,0]=4 8515 B12R0.5 CCCCOCCOCCCOC 34a_100000210238_100000740836 [2,0,0,0,0,0|2,0,0]=4 8516 B12R0.5 CCCCOCCOCCCOC 34a_100000740835_100000743108 [2,0,0,0,0,0|2,0,0]=4 8517 B12R0.5 CCCCOCCOCCCOC 7a_100000210238_100000740836 [2,0,0,0,0,0|2,0,0]=4 8518 B12R0.5 CCCCOCCSCCCC=O 62a_100000743108_200011292268 [2,0,0,0,0,0|2,0,0]=4 8519 B12R0.5 CCCCOCCSCCCC=O 62a_200011292268_100000743108 [2,0,0,0,0,0|2,0,0]=4 8520 B12R0.5 CCCCOCCSCCCOC 62a_100000709357_100000743108 [2,0,0,0,0,0|2,0,0]=4 8521 B12R0.5 CCCCOCCSCCCOC 62a_100000743108_100000709357 [2,0,0,0,0,0|2,0,0]=4 8522 B12R0.5 CCCCOCOCCCCOC 34a_100000740925_100011995733 [2,0,0,0,0,0|2,0,0]=4 8523 B12R0.5 CCCCOCSCCCCC=O 62a_100000139335_100011995733 [2,0,0,0,0,0|2,0,0]=4 8524 B12R0.5 CCCCOCSCCCCC=O 62a_100011995733_100000139335 [2,0,0,0,0,0|2,0,0]=4 8525 B12R0.5 CCCCOCSCCCCOC 62a_100000730899_100011995733 [2,0,0,0,0,0|2,0,0]=4 8526 B12R0.5 CCCCOCSCCCCOC 62a_100011995733_100000730899 [2,0,0,0,0,0|2,0,0]=4 8527 B12R0.5 CCCCSCCCCCCCO 62a_100000210211_100000760002 [2,0,0,0,0,0|1,0,1]=4 8528 B12R0.5 CCCCSCCCCCCCO 62a_100000760002_100000210210 [2,0,0,0,0,0|1,0,1]=4 8529 B12R0.5 CCCCSCCCCCCOC 62a_100000210211_100011998445 [2,0,0,0,0,0|1,0,0]=3 8530 B12R0.5 CCCCSCCCCCCOC 62a_100011998445_100000210210 [2,0,0,0,0,0|1,0,0]=3 8531 B12R0.5 CCCCSCCCOCCOC 62a_100000210211_100011216529 [2,0,0,0,0,0|2,0,0]=4 8532 B12R0.5 CCCCSCCCOCCOC 62a_100011216529_100000210210 [2,0,0,0,0,0|2,0,0]=4 8533 B12R0.5 CCCCSCCNCCCC=O 2230a_100025743550_200011292268 [2,0,0,0,0,0|2,0,0]=4 8534 B12R0.5 CCCCSCCNCCCOC 2230a_100025743550_100000740836 [2,0,0,0,0,0|2,0,0]=4 8535 B12R0.5 CCCCSCCOCCCC=O 7a_200000230436_200011292268 [2,0,0,0,0,0|2,0,0]=4 8536 B12R0.5 CCCCSCCOCCCOC 34a_200000230436_100000740836 [2,0,0,0,0,0|2,0,0]=4 8537 B12R0.5 CCCCSCCOCCCOC 7a_200000230436_100000740836 [2,0,0,0,0,0|2,0,0]=4 8538 B12R0.5 CCCNCCCCCCCCO 2230a_102515433106_100000210303 [2,0,0,0,0,0|1,0,1]=4 8539 B12R0.5 CCCNCCCCCCCCO 34a_102515433106_100000210303 [2,0,0,0,0,0|1,0,1]=4 8540 B12R0.5 CCCOCCCCCCCCO 34a_100000210258_100000033203 [2,0,0,0,0,0|1,0,1]=4 8541 B12R0.5 CCCOCCCNCCCC=O 2230a_100011217757_200011292268 [2,0,0,0,0,0|2,0,0]=4 8542 B12R0.5 CCCOCCCNCCCOC 2230a_100011217757_100000740836 [2,0,0,0,0,0|2,0,0]=4 8543 B12R0.5 CCCOCCCNCCCOC 34a_100011217757_100000740836 [2,0,0,0,0,0|2,0,0]=4 8544 B12R0.5 CCCOCCCOCCCOC 34a_200011215475_100000210303 [2,0,0,0,0,0|2,0,0]=4 8545 B12R0.5 CCCOCCCOCCCOC 7a_200011215475_100000210303 [2,0,0,0,0,0|2,0,0]=4 8546 B12R0.5 CCCOCCNCCCCC=O 2230a_100161115042_100000139335 [2,0,0,0,0,0|2,0,0]=4 8547 B12R0.5 CCCOCCNCCCCOC 2230a_100161115042_100000730899 [2,0,0,0,0,0|2,0,0]=4 8548 B12R0.5 CCCOCCNCCCCOC 34a_100161115042_100000755781 [2,0,0,0,0,0|2,0,0]=4 8549 B12R0.5 CCCOCCOCCCCC=O 7a_100000752267_100000139335 [2,0,0,0,0,0|2,0,0]=4 8550 B12R0.5 CCCOCCOCCCCOC 34a_100000740925_100011215938 [2,0,0,0,0,0|2,0,0]=4 8551 B12R0.5 CCCOCCOCCCCOC 34a_100000752267_100000755781 [2,0,0,0,0,0|2,0,0]=4 8552 B12R0.5 CCCOCCOCCCCOC 7a_100000752267_100000730899 [2,0,0,0,0,0|2,0,0]=4 8553 B12R0.5 CCCOCCSCCCCC=O 62a_100000139335_100011215938 [2,0,0,0,0,0|2,0,0]=4 8554 B12R0.5 CCCOCCSCCCCC=O 62a_100011215938_100000139335 [2,0,0,0,0,0|2,0,0]=4 8555 B12R0.5 CCCOCCSCCCCOC 62a_100000730899_100011215938 [2,0,0,0,0,0|2,0,0]=4 8556 B12R0.5 CCCOCCSCCCCOC 62a_100011215938_100000730899 [2,0,0,0,0,0|2,0,0]=4 8557 B12R0.5 CCCSCCCCCCCCO 62a_100000033203_100000210303 [2,0,0,0,0,0|1,0,1]=4 8558 B12R0.5 CCCSCCCCCCCCO 62a_100000210303_100000033203 [2,0,0,0,0,0|1,0,1]=4 8559 B12R0.5 CCCSCCNCCCCC=O 2230a_100020603323_100000139335 [2,0,0,0,0,0|2,0,0]=4 8560 B12R0.5 CCCSCCNCCCCOC 2230a_100020603323_100000730899 [2,0,0,0,0,0|2,0,0]=4 8561 B12R0.5 CCCSCCOCCCCC=O 7a_200000230433_100000139335 [2,0,0,0,0,0|2,0,0]=4 8562 B12R0.5 CCCSCCOCCCCOC 34a_200000230433_100000755781 [2,0,0,0,0,0|2,0,0]=4 8563 B12R0.5 CCCSCCOCCCCOC 7a_200000230433_100000730899 [2,0,0,0,0,0|2,0,0]=4 8564 B12R0.5 CCNCCCCCCCCCO 2230a_100000078944_100000210202 [2,0,0,0,0,0|1,0,1]=4 8565 B12R0.5 CCNCCCCCCCCCO 2230a_100015525214_100009813782 [2,0,0,0,0,0|1,0,1]=4 8566 B12R0.5 CCNCCCCCCCCCO 34a_100000078944_100000210202 [2,0,0,0,0,0|1,0,1]=4 8567 B12R0.5 CCOCCCCCCCCCO 34a_100121572206_100009813782 [2,0,0,0,0,0|1,0,1]=4 8568 B12R0.5 CCOCCCNCCCCC=O 2230a_100000210961_100000139335 [2,0,0,0,0,0|2,0,0]=4 8569 B12R0.5 CCOCCCNCCCCOC 2230a_100000210961_100000730899 [2,0,0,0,0,0|2,0,0]=4 8570 B12R0.5 CCOCCCNCCCCOC 34a_100000210961_100000755781 [2,0,0,0,0,0|2,0,0]=4 8571 B12R0.5 CCOCCCOCCCCC=O 7a_100000757476_100000139335 [2,0,0,0,0,0|2,0,0]=4 8572 B12R0.5 CCOCCCOCCCCOC 34a_100000740925_100012232248 [2,0,0,0,0,0|2,0,0]=4 8573 B12R0.5 CCOCCCOCCCCOC 34a_100000757476_100000755781 [2,0,0,0,0,0|2,0,0]=4 8574 B12R0.5 CCOCCCOCCCCOC 7a_100000757476_100000730899 [2,0,0,0,0,0|2,0,0]=4 8575 B12R0.5 CCOCCCSCCCCC=O 62a_100000139335_100012232248 [2,0,0,0,0,0|2,0,0]=4 8576 B12R0.5 CCOCCCSCCCCC=O 62a_100012232248_100000139335 [2,0,0,0,0,0|2,0,0]=4 8577 B12R0.5 CCOCCCSCCCCOC 62a_100000730899_100012232248 [2,0,0,0,0,0|2,0,0]=4 8578 B12R0.5 CCOCCCSCCCCOC 62a_100012232248_100000730899 [2,0,0,0,0,0|2,0,0]=4 8579 B12R0.5 CCOCCNCCCCCC=O 2230a_102516460346_100000139337 [2,0,0,0,0,0|2,0,0]=4 8580 B12R0.5 CCOCCNCCCCCOC 2230a_100000747528_100011215890 [2,0,0,0,0,0|2,0,0]=4 8581 B12R0.5 CCOCCNCCCCCOC 34a_100000747528_100000210147 [2,0,0,0,0,0|2,0,0]=4 8582 B12R0.5 CCOCCOCCCCCC=O 7a_100000210136_100000139337 [2,0,0,0,0,0|2,0,0]=4 8583 B12R0.5 CCOCCSCCCCCC=O 62a_100000139337_100011215890 [2,0,0,0,0,0|2,0,0]=4 8584 B12R0.5 CCOCCSCCCCCC=O 62a_100000210147_100000139337 [2,0,0,0,0,0|2,0,0]=4 8585 B12R0.5 CCOCSCCCCCCOC 62a_100000739092_100011998445 [2,0,0,0,0,0|2,0,0]=4 8586 B12R0.5 CCOCSCCCCCCOC 62a_100011998445_100000739092 [2,0,0,0,0,0|2,0,0]=4 8587 B12R0.5 CCSCCCCCCCCCO 62a_100000210202_100009813782 [2,0,0,0,0,0|1,0,1]=4 8588 B12R0.5 CCSCCCCCCCCCO 62a_100009813782_100000210202 [2,0,0,0,0,0|1,0,1]=4 8589 B12R0.5 CCSCCCOCCCCC=O 7a_100011216438_100000139335 [2,0,0,0,0,0|2,0,0]=4 8590 B12R0.5 CCSCCCOCCCCOC 34a_100011216438_100000755781 [2,0,0,0,0,0|2,0,0]=4 8591 B12R0.5 CCSCCCOCCCCOC 7a_100011216438_100000730899 [2,0,0,0,0,0|2,0,0]=4 8592 B12R0.5 CCSCCNCCCCCC=O 2230a_100000106463_100000139337 [2,0,0,0,0,0|2,0,0]=4 8593 B12R0.5 CCSCCNCCCCCOC 2230a_100000747528_100000757381 [2,0,0,0,0,0|2,0,0]=4 8594 B12R0.5 CCSCCNCCCCCOC 34a_100000747528_100000757381 [2,0,0,0,0,0|2,0,0]=4 8595 B12R0.5 CCSCCOCCCCCC=O 7a_100000212035_100000139337 [2,0,0,0,0,0|2,0,0]=4 8596 B12R0.5 CCSCCSCCCCCC=O 62a_100000139337_100000757381 [2,0,0,0,0,0|2,0,0]=4 8597 B12R0.5 CCSCCSCCCCCC=O 62a_100000757381_100000139337 [2,0,0,0,0,0|2,0,0]=4 8598 B12R0.5 CNCCCCCCCCCCO 2230a_100000066964_200000210301 [2,0,0,0,0,0|1,0,1]=4 8599 B12R0.5 CNCCCCCCCCCCO 2230a_106832991635_100009813290 [2,0,0,0,0,0|1,0,1]=4 8600 B12R0.5 CNCCCCCCCCCCO 34a_100000066964_200000210301 [2,0,0,0,0,0|1,0,1]=4 8601 B12R0.5 CNCCCCCCCCCCO 34a_100102657272_100009813290 [2,0,0,0,0,0|1,0,1]=4 8602 B12R0.5 CNCCCCCCCCCCO 7a_106832991635_100009813290 [2,0,0,0,0,0|1,0,1]=4 8603 B12R0.5 CNCCCCCOCCCOC 34a_100000722520_100000740836 [2,0,0,0,0,0|2,0,0]=4 8604 B12R0.5 COCCCCCCCCCCBr 34a_100009813290_200000210301 [2,0,0,0,0,0|1,0,0]=3 8605 B12R0.5 COCCCCCCCCCCBr 7a_100009813290_200000210301 [2,0,0,0,0,0|1,0,0]=3 8606 B12R0.5 COCCCCCCCCCCCl 34a_200000033068_200000210301 [2,0,0,0,0,0|1,0,0]=3 8607 B12R0.5 COCCCCCCCCCCCl 7a_200000033068_200000210301 [2,0,0,0,0,0|1,0,0]=3 8608 B12R0.5 COCCCCCCCCCCN 34a_100000066964_200000210301 [2,0,0,0,0,0|1,0,0]=3 8609 B12R0.5 COCCCCCCCCCCO 34a_100138415774_100009813290 [2,0,0,0,0,0|1,0,0]=3 8610 B12R0.5 COCCCCCCNCCCF 2230a_100015189416_100011998445 [2,0,0,0,0,0|2,0,0]=4 8611 B12R0.5 COCCCCCCNCCCF 34a_100015189416_100011998445 [2,0,0,0,0,0|2,0,0]=4 8612 B12R0.5 COCCCCCCNCCOC 2230a_100000209980_100011998445 [2,0,0,0,0,0|2,0,0]=4 8613 B12R0.5 COCCCCCCNCCSC 2230a_100020590264_100011998445 [2,0,0,0,0,0|2,0,0]=4 8614 B12R0.5 COCCCCCCOCCCBr 34a_100011217188_100011998445 [2,0,0,0,0,0|2,0,0]=4 8615 B12R0.5 COCCCCCCOCCCCl 34a_100000230001_100011998445 [2,0,0,0,0,0|2,0,0]=4 8616 B12R0.5 COCCCCCCOCCCF 34a_100000759539_100011998445 [2,0,0,0,0,0|2,0,0]=4 8617 B12R0.5 COCCCCCCOCCCF 34a_200012092642_100011934791 [2,0,0,0,0,0|2,0,0]=4 8618 B12R0.5 COCCCCCCOCCCF 7a_200012092642_100011934791 [2,0,0,0,0,0|2,0,0]=4 8619 B12R0.5 COCCCCCCOCCCN 34a_100000182051_100011998445 [2,0,0,0,0,0|2,0,0]=4 8620 B12R0.5 COCCCCCCOCCCO 34a_200012092642_100000230001 [2,0,0,0,0,0|2,0,0]=4 8621 B12R0.5 COCCCCCCOCCCO 7a_200012092642_100011215043 [2,0,0,0,0,0|2,0,0]=4 8622 B12R0.5 COCCCCCCOCCOC 34a_100000210237_100011998445 [2,0,0,0,0,0|2,0,0]=4 8623 B12R0.5 COCCCCCCOCCOC 34a_200012092642_100011201679 [2,0,0,0,0,0|2,0,0]=4 8624 B12R0.5 COCCCCCCOCCOC 7a_200012092642_100000233755 [2,0,0,0,0,0|2,0,0]=4 8625 B12R0.5 COCCCCCCOCCSC 34a_100000230434_100011998445 [2,0,0,0,0,0|2,0,0]=4 8626 B12R0.5 COCCCCCCOCCSC 34a_200012092642_100000212216 [2,0,0,0,0,0|2,0,0]=4 8627 B12R0.5 COCCCCCCOCCSC 7a_100000230434_100011998445 [2,0,0,0,0,0|2,0,0]=4 8628 B12R0.5 COCCCCCCOCCSC 7a_200012092642_100000212216 [2,0,0,0,0,0|2,0,0]=4 8629 B12R0.5 COCCCCCCSCCCF 62a_100011934791_100011998445 [2,0,0,0,0,0|2,0,0]=4 8630 B12R0.5 COCCCCCCSCCCF 62a_100011998445_100011934791 [2,0,0,0,0,0|2,0,0]=4 8631 B12R0.5 COCCCCCCSCCCO 62a_100011215043_100011998445 [2,0,0,0,0,0|2,0,0]=4 8632 B12R0.5 COCCCCCCSCCCO 62a_100011998445_100011215043 [2,0,0,0,0,0|2,0,0]=4 8633 B12R0.5 COCCCCCCSCCOC 62a_100000233755_100011998445 [2,0,0,0,0,0|2,0,0]=4 8634 B12R0.5 COCCCCCCSCCOC 62a_100011998445_100000233755 [2,0,0,0,0,0|2,0,0]=4 8635 B12R0.5 COCCCCCCSCCSC 62a_100000212216_100011998445 [2,0,0,0,0,0|2,0,0]=4 8636 B12R0.5 COCCCCCCSCCSC 62a_100011998445_100000751147 [2,0,0,0,0,0|2,0,0]=4 8637 B12R0.5 COCCCCCNCCCC=O 2230a_100000747528_200011292268 [2,0,0,0,0,0|2,0,0]=4 8638 B12R0.5 COCCCCCNCCCCF 2230a_100000747528_100000729493 [2,0,0,0,0,0|2,0,0]=4 8639 B12R0.5 COCCCCCNCCCCF 34a_100000747528_100000729493 [2,0,0,0,0,0|2,0,0]=4 8640 B12R0.5 COCCCCCNCCCCO 2230a_100000747528_100000210776 [2,0,0,0,0,0|2,0,0]=4 8641 B12R0.5 COCCCCCNCCCCO 34a_100000747528_100011216708 [2,0,0,0,0,0|2,0,0]=4 8642 B12R0.5 COCCCCCNCCCOC 2230a_100000747528_100000740836 [2,0,0,0,0,0|2,0,0]=4 8643 B12R0.5 COCCCCCNCCCOC 34a_100000747528_100000740836 [2,0,0,0,0,0|2,0,0]=4 8644 B12R0.5 COCCCCNCCCCCO 2230a_100000762737_100000730899 [2,0,0,0,0,0|2,0,0]=4 8645 B12R0.5 COCCCCNCCCCCO 34a_100000762737_100000755781 [2,0,0,0,0,0|2,0,0]=4 8646 B12R0.5 COCCCCOCCCCCBr 34a_100000746331_100000755781 [2,0,0,0,0,0|2,0,0]=4 8647 B12R0.5 COCCCCOCCCCCBr 7a_100000746331_100000730899 [2,0,0,0,0,0|2,0,0]=4 8648 B12R0.5 COCCCCOCCCCCCl 34a_100000746330_100000755781 [2,0,0,0,0,0|2,0,0]=4 8649 B12R0.5 COCCCCOCCCCCCl 7a_100000746330_100000730899 [2,0,0,0,0,0|2,0,0]=4 8650 B12R0.5 COCCCCOCCCCCF 34a_100000740925_100000729378 [2,0,0,0,0,0|2,0,0]=4 8651 B12R0.5 COCCCCOCCCCCI 34a_200012148887_100000755781 [2,0,0,0,0,0|2,0,0]=4 8652 B12R0.5 COCCCCOCCCCCI 7a_200012148887_100000730899 [2,0,0,0,0,0|2,0,0]=4 8653 B12R0.5 COCCCCOCCCCCN 34a_100000762737_100000755781 [2,0,0,0,0,0|2,0,0]=4 8654 B12R0.5 COCCCCOCCCCCO 34a_100000740925_100000746330 [2,0,0,0,0,0|2,0,0]=4 8655 B12R0.5 COCCCCOCCCCOC 34a_100000740925_100000755781 [2,0,0,0,0,0|2,0,0]=4 8656 B12R0.5 COCCCCOCCCCSC 34a_100011217163_100000755781 [2,0,0,0,0,0|2,0,0]=4 8657 B12R0.5 COCCCCOCCCCSC 7a_100011217163_100000730899 [2,0,0,0,0,0|2,0,0]=4 8658 B12R0.5 COCCCCSCCCCC=O 62a_100000139335_100000730899 [2,0,0,0,0,0|2,0,0]=4 8659 B12R0.5 COCCCCSCCCCC=O 62a_100000730899_100000139335 [2,0,0,0,0,0|2,0,0]=4 8660 B12R0.5 COCCCCSCCCCCF 62a_100000729378_100000730899 [2,0,0,0,0,0|2,0,0]=4 8661 B12R0.5 COCCCCSCCCCCF 62a_100000730899_100000729378 [2,0,0,0,0,0|2,0,0]=4 8662 B12R0.5 COCCCCSCCCCCO 62a_100000730899_100000746330 [2,0,0,0,0,0|2,0,0]=4 8663 B12R0.5 COCCCCSCCCCCO 62a_100000746330_100000730899 [2,0,0,0,0,0|2,0,0]=4 8664 B12R0.5 COCCCCSCCCCOC 62a_100000730899_100000730899 [2,0,0,0,0,0|2,0,0]=4 8665 B12R0.5 COCCCNCCCCCCF 34a_100150723488_100015922095 [2,0,0,0,0,0|2,0,0]=4 8666 B12R0.5 COCCCNCCCCCCO 2230a_100000686447_100000740836 [2,0,0,0,0,0|2,0,0]=4 8667 B12R0.5 COCCCNCCCCCCO 34a_100000686447_100000740836 [2,0,0,0,0,0|2,0,0]=4 8668 B12R0.5 COCCCNCCCCCCO 34a_100150723488_100000766143 [2,0,0,0,0,0|2,0,0]=4 8669 B12R0.5 COCCCOCCCCCCBr 34a_100011215345_100000740836 [2,0,0,0,0,0|2,0,0]=4 8670 B12R0.5 COCCCOCCCCCCBr 7a_100011215345_100000740836 [2,0,0,0,0,0|2,0,0]=4 8671 B12R0.5 COCCCOCCCCCCCl 34a_100000766143_100000740836 [2,0,0,0,0,0|2,0,0]=4 8672 B12R0.5 COCCCOCCCCCCCl 7a_100000766143_100000740836 [2,0,0,0,0,0|2,0,0]=4 8673 B12R0.5 COCCCOCCCCCCF 34a_100000732779_100000740836 [2,0,0,0,0,0|2,0,0]=4 8674 B12R0.5 COCCCOCCCCCCF 34a_100000740835_100015922095 [2,0,0,0,0,0|2,0,0]=4 8675 B12R0.5 COCCCOCCCCCCF 7a_100000732779_100000740836 [2,0,0,0,0,0|2,0,0]=4 8676 B12R0.5 COCCCOCCCCCCN 34a_100000686447_100000740836 [2,0,0,0,0,0|2,0,0]=4 8677 B12R0.5 COCCCOCCCCCCO 34a_100000740835_100000766143 [2,0,0,0,0,0|2,0,0]=4 8678 B12R0.5 COCCCSCCCCCC=O 62a_100000139337_100000709357 [2,0,0,0,0,0|2,0,0]=4 8679 B12R0.5 COCCCSCCCCCC=O 62a_100000709357_100000139337 [2,0,0,0,0,0|2,0,0]=4 8680 B12R0.5 COCCCSCCCCCCF 62a_100000709357_100015922095 [2,0,0,0,0,0|2,0,0]=4 8681 B12R0.5 COCCCSCCCCCCF 62a_100015922095_100000709357 [2,0,0,0,0,0|2,0,0]=4 8682 B12R0.5 COCCCSCCCCCCO 62a_100000709357_100000766143 [2,0,0,0,0,0|2,0,0]=4 8683 B12R0.5 COCCCSCCCCCCO 62a_100000766143_100000709357 [2,0,0,0,0,0|2,0,0]=4 8684 B12R0.5 COCCNCCCCCCCO 2230a_100000209980_100000760002 [2,0,0,0,0,0|2,0,0]=4 8685 B12R0.5 COCCNCCCCCCCO 2230a_100011996573_100011201679 [2,0,0,0,0,0|2,0,0]=4 8686 B12R0.5 COCCNCCCCCCCO 34a_100011996573_100011201679 [2,0,0,0,0,0|2,0,0]=4 8687 B12R0.5 COCCOCCCCCCCBr 34a_100000760002_100011201679 [2,0,0,0,0,0|2,0,0]=4 8688 B12R0.5 COCCOCCCCCCCBr 7a_100000760002_100000233755 [2,0,0,0,0,0|2,0,0]=4 8689 B12R0.5 COCCOCCCCCCCN 34a_100011996573_100011201679 [2,0,0,0,0,0|2,0,0]=4 8690 B12R0.5 COCCOCCCCCCCO 34a_100000210237_100000760002 [2,0,0,0,0,0|2,0,0]=4 8691 B12R0.5 COCCSCCCCCCCO 62a_100000233755_100000760002 [2,0,0,0,0,0|2,0,0]=4 8692 B12R0.5 COCCSCCCCCCCO 62a_100000760002_100000233755 [2,0,0,0,0,0|2,0,0]=4 8693 B12R0.5 COCNCCCCCCCCO 2230a_102515433106_100000766300 [2,0,0,0,0,0|2,0,0]=4 8694 B12R0.5 COCSCCCCCCCCO 62a_100000033203_100000766300 [2,0,0,0,0,0|2,0,0]=4 8695 B12R0.5 COCSCCCCCCCCO 62a_100000766300_100000033203 [2,0,0,0,0,0|2,0,0]=4 8696 B12R0.5 CSCCCCCCCCCCO 62a_100009813290_200000210301 [2,0,0,0,0,0|1,0,1]=4 8697 B12R0.5 CSCCCCCCCCCCO 62a_200000210301_200000033068 [2,0,0,0,0,0|1,0,1]=4 8698 B12R0.5 CSCCCCOCCCCC=O 7a_100011217163_100000139335 [2,0,0,0,0,0|2,0,0]=4 8699 B12R0.5 CSCCCNCCCCCC=O 2230a_100000749238_100000139337 [2,0,0,0,0,0|2,0,0]=4 8700 B12R0.5 CSCCCOCCCCCC=O 7a_100000690336_100000139337 [2,0,0,0,0,0|2,0,0]=4 8701 B12R0.5 NCCCCCCCCOCC=O 34a_102515433106_200009817547 [2,0,0,0,0,0|2,0,0]=4 8702 B12R0.5 O=CCCCCCNCCCCO 2230a_100000750430_100000139337 [2,0,0,0,0,0|2,0,0]=4 8703 B12R0.5 O=CCCCCCOCCCCCl 7a_100000210776_100000139337 [2,0,0,0,0,0|2,0,0]=4 8704 B12R0.5 O=CCCCCCOCCCCF 7a_100011995726_100000139337 [2,0,0,0,0,0|2,0,0]=4 8705 B12R0.5 O=CCCCCCSCCCCF 62a_100000139337_100000729493 [2,0,0,0,0,0|2,0,0]=4 8706 B12R0.5 O=CCCCCCSCCCCF 62a_100000729493_100000139337 [2,0,0,0,0,0|2,0,0]=4 8707 B12R0.5 O=CCCCCCSCCCCO 62a_100000139337_100000210776 [2,0,0,0,0,0|2,0,0]=4 8708 B12R0.5 O=CCCCCCSCCCCO 62a_100000210776_100000139337 [2,0,0,0,0,0|2,0,0]=4 8709 B12R0.5 O=CCCCCNCCCCCO 2230a_100000762737_100000139335 [2,0,0,0,0,0|2,0,0]=4 8710 B12R0.5 O=CCCCCOCCCCCBr 7a_100000746331_100000139335 [2,0,0,0,0,0|2,0,0]=4 8711 B12R0.5 O=CCCCCOCCCCCCl 7a_100000746330_100000139335 [2,0,0,0,0,0|2,0,0]=4 8712 B12R0.5 O=CCCCCOCCCCCI 7a_200012148887_100000139335 [2,0,0,0,0,0|2,0,0]=4 8713 B12R0.5 O=CCCCCSCCCCCF 62a_100000139335_100000729378 [2,0,0,0,0,0|2,0,0]=4 8714 B12R0.5 O=CCCCCSCCCCCF 62a_100000729378_100000139335 [2,0,0,0,0,0|2,0,0]=4 8715 B12R0.5 O=CCCCCSCCCCCO 62a_100000139335_100000746330 [2,0,0,0,0,0|2,0,0]=4 8716 B12R0.5 O=CCCCCSCCCCCO 62a_100000746330_100000139335 [2,0,0,0,0,0|2,0,0]=4 8717 B12R0.5 O=CCCCNCCCCCCO 2230a_100000686447_200011292268 [2,0,0,0,0,0|2,0,0]=4 8718 B12R0.5 O=CCCCOCCCCCCBr 7a_100011215345_200011292268 [2,0,0,0,0,0|2,0,0]=4 8719 B12R0.5 O=CCCCOCCCCCCCl 7a_100000766143_200011292268 [2,0,0,0,0,0|2,0,0]=4 8720 B12R0.5 O=CCCCOCCCCCCF 7a_100000732779_200011292268 [2,0,0,0,0,0|2,0,0]=4 8721 B12R0.5 O=CCCCSCCCCCCF 62a_100015922095_200011292268 [2,0,0,0,0,0|2,0,0]=4 8722 B12R0.5 O=CCCCSCCCCCCF 62a_200011292268_100015922095 [2,0,0,0,0,0|2,0,0]=4 8723 B12R0.5 O=CCCCSCCCCCCO 62a_100000766143_200011292268 [2,0,0,0,0,0|2,0,0]=4 8724 B12R0.5 O=CCCCSCCCCCCO 62a_200011292268_100000766143 [2,0,0,0,0,0|2,0,0]=4 8725 B12R0.5 O=CCNCCCCCCCCO 2230a_102515433106_200015260668 [2,0,0,0,0,0|2,0,0]=4 8726 B12R0.5 O=CCNCCCCCCCCO 34a_102515433106_200009817547 [2,0,0,0,0,0|2,0,0]=4 8727 B12R0.5 O=CCOCCCCCCCCBr 34a_100009813846_200009817547 [2,0,0,0,0,0|2,0,0]=4 8728 B12R0.5 O=CCOCCCCCCCCBr 7a_100009813846_200015260668 [2,0,0,0,0,0|2,0,0]=4 8729 B12R0.5 O=CCOCCCCCCCCCl 34a_100000033203_200009817547 [2,0,0,0,0,0|2,0,0]=4 8730 B12R0.5 O=CCOCCCCCCCCCl 7a_100000033203_200015260668 [2,0,0,0,0,0|2,0,0]=4 8731 B12R0.5 O=CCSCCCCCCCCO 62a_100000033203_200015260668 [2,0,0,0,0,0|2,0,0]=4 8732 B12R0.5 O=CCSCCCCCCCCO 62a_200015260668_100000033203 [2,0,0,0,0,0|2,0,0]=4 8733 B12R0.5 [13CH3]NCCCCCCCCCCO 2230a_100000066964_200025704644 [2,0,0,0,0,0|1,0,1]=4 8734 B12R0.5 [13CH3]NCCCCCCCCCCO 34a_100000066964_200025704644 [2,0,0,0,0,0|1,0,1]=4 8735 B12R0.5 [13CH3]OCCCCCCCCCCBr 34a_100009813290_200025704644 [2,0,0,0,0,0|1,0,0]=3 8736 B12R0.5 [13CH3]OCCCCCCCCCCBr 7a_100009813290_200025704644 [2,0,0,0,0,0|1,0,0]=3 8737 B12R0.5 [13CH3]OCCCCCCCCCCCl 34a_200000033068_200025704644 [2,0,0,0,0,0|1,0,0]=3 8738 B12R0.5 [13CH3]OCCCCCCCCCCCl 7a_200000033068_200025704644 [2,0,0,0,0,0|1,0,0]=3 8739 B12R0.5 [13CH3]OCCCCCCCCCCN 34a_100000066964_200025704644 [2,0,0,0,0,0|1,0,0]=3 8740 B12R0.5 [13CH3]SCCCCCCCCCCO 62a_100009813290_200025704644 [2,0,0,0,0,0|1,0,1]=4 8741 B12R0.5 [13CH3]SCCCCCCCCCCO 62a_200025704644_200000033068 [2,0,0,0,0,0|1,0,1]=4 8742 B12R0.234 C#CCCCCCCCCC(=O)C 1458a_100000029693_200000210301 [2,0,0,0,0,0|0,0,2]=4 8743 B12R0.234 C#CCCCCCCCCC(=O)[13CH3] 1458a_100000029693_200025704644 [2,0,0,0,0,0|0,0,2]=4 8744 B12R0.234 C=C(C)CCNCCCCCCC 2230a_100000229938_100000730704 [2,0,0,0,0,0|2,0,0]=4 8745 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000210272_100000730704 [2,0,0,0,0,0|2,0,0]=4 8746 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000764851_100000210614 [2,0,0,0,0,0|2,0,0]=4 8747 B12R0.234 C=C(C)CCOCCCCCCC 7a_100000210272_100000730704 [2,0,0,0,0,0|2,0,0]=4 8748 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000210614_100000730704 [2,0,0,0,0,0|2,0,0]=4 8749 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000730704_100000210316 [2,0,0,0,0,0|2,0,0]=4 8750 B12R0.234 C=C(C)CNCCCCCCCC 2230a_100000229939_100000748629 [2,0,0,0,0,0|2,0,0]=4 8751 B12R0.234 C=C(C)CNCCCCCCCC 34a_100000229939_100000748629 [2,0,0,0,0,0|2,0,0]=4 8752 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210232_100000748629 [2,0,0,0,0,0|2,0,0]=4 8753 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210245_100000210759 [2,0,0,0,0,0|2,0,0]=4 8754 B12R0.234 C=C(C)COCCCCCCCC 7a_100000210232_100000748629 [2,0,0,0,0,0|2,0,0]=4 8755 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000210759_100000211660 [2,0,0,0,0,0|2,0,0]=4 8756 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000748629_100000210317 [2,0,0,0,0,0|2,0,0]=4 8757 B12R0.234 C=CCCCCCCCCC(=O)C 1458a_100000070787_100011933949 [2,0,0,0,0,0|0,0,2]=4 8758 B12R0.234 C=CCCCCCCCCC(=O)C 1458a_100000211349_200000210301 [2,0,0,0,0,0|0,0,2]=4 8759 B12R0.234 C=CCCCCCCCCC(=O)[13CH3] 1458a_100000211349_200025704644 [2,0,0,0,0,0|0,0,2]=4 8760 B12R0.234 CC#CCCCCCCCC(=O)C 1458a_100000066323_200000210301 [2,0,0,0,0,0|0,0,2]=4 8761 B12R0.234 CC#CCCCCCCCC(=O)[13CH3] 1458a_100000066323_200025704644 [2,0,0,0,0,0|0,0,2]=4 8762 B12R0.234 CC(=O)CCCCCCCCCF 1458a_200009909015_200000210301 [2,0,0,0,0,0|1,0,0]=3 8763 B12R0.234 CC(=O)CCCCCCCCCO 1458a_100000070787_100009813782 [2,0,0,0,0,0|1,0,0]=3 8764 B12R0.234 CC(=O)CCCCNCCCCO 34a_100000750430_100009817362 [2,0,0,0,0,0|2,0,0]=4 8765 B12R0.234 CC(=O)CCCCOCCCCBr 34a_100011216708_100009817362 [2,0,0,0,0,0|2,0,0]=4 8766 B12R0.234 CC(=O)CCCCOCCCCCl 34a_100000210776_100009817362 [2,0,0,0,0,0|2,0,0]=4 8767 B12R0.234 CC(=O)CCCCOCCCCCl 7a_100000210776_100000735457 [2,0,0,0,0,0|2,0,0]=4 8768 B12R0.234 CC(=O)CCCCOCCCCF 34a_100011995726_100009817362 [2,0,0,0,0,0|2,0,0]=4 8769 B12R0.234 CC(=O)CCCCOCCCCF 7a_100011995726_100000735457 [2,0,0,0,0,0|2,0,0]=4 8770 B12R0.234 CC(=O)CCCCOCCCCI 34a_200012148704_100009817362 [2,0,0,0,0,0|2,0,0]=4 8771 B12R0.234 CC(=O)CCCCOCCCCN 34a_100000750430_100009817362 [2,0,0,0,0,0|2,0,0]=4 8772 B12R0.234 CC(=O)CCCCSCCCCF 62a_100000729493_100000735457 [2,0,0,0,0,0|2,0,0]=4 8773 B12R0.234 CC(=O)CCCCSCCCCF 62a_100000735457_100000729493 [2,0,0,0,0,0|2,0,0]=4 8774 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000210776_100000735457 [2,0,0,0,0,0|2,0,0]=4 8775 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000735457_100000210776 [2,0,0,0,0,0|2,0,0]=4 8776 B12R0.234 CC(=O)CCCNCCCCCO 34a_100000762737_100000685027 [2,0,0,0,0,0|2,0,0]=4 8777 B12R0.234 CC(=O)CCCOCCCCCBr 34a_100000746331_100000685027 [2,0,0,0,0,0|2,0,0]=4 8778 B12R0.234 CC(=O)CCCOCCCCCBr 7a_100000746331_100011215641 [2,0,0,0,0,0|2,0,0]=4 8779 B12R0.234 CC(=O)CCCOCCCCCCl 34a_100000746330_100000685027 [2,0,0,0,0,0|2,0,0]=4 8780 B12R0.234 CC(=O)CCCOCCCCCCl 7a_100000746330_100011215641 [2,0,0,0,0,0|2,0,0]=4 8781 B12R0.234 CC(=O)CCCOCCCCCF 34a_100000759063_100000729378 [2,0,0,0,0,0|2,0,0]=4 8782 B12R0.234 CC(=O)CCCOCCCCCF 7a_100000759063_100000729378 [2,0,0,0,0,0|2,0,0]=4 8783 B12R0.234 CC(=O)CCCOCCCCCI 34a_200012148887_100000685027 [2,0,0,0,0,0|2,0,0]=4 8784 B12R0.234 CC(=O)CCCOCCCCCI 7a_200012148887_100011215641 [2,0,0,0,0,0|2,0,0]=4 8785 B12R0.234 CC(=O)CCCOCCCCCN 34a_100000762737_100000685027 [2,0,0,0,0,0|2,0,0]=4 8786 B12R0.234 CC(=O)CCCOCCCCCO 34a_100000759063_100000746330 [2,0,0,0,0,0|2,0,0]=4 8787 B12R0.234 CC(=O)CCCOCCCCCO 7a_100000759063_100000746330 [2,0,0,0,0,0|2,0,0]=4 8788 B12R0.234 CC(=O)CCCSCCCCCF 62a_100000729378_100011215641 [2,0,0,0,0,0|2,0,0]=4 8789 B12R0.234 CC(=O)CCCSCCCCCF 62a_100011215641_100000729378 [2,0,0,0,0,0|2,0,0]=4 8790 B12R0.234 CC(=O)CCCSCCCCCO 62a_100000746330_100011215641 [2,0,0,0,0,0|2,0,0]=4 8791 B12R0.234 CC(=O)CCCSCCCCCO 62a_100011215641_100000746330 [2,0,0,0,0,0|2,0,0]=4 8792 B12R0.234 CC(=O)CCOCCCCCCBr 7a_100011215345_100000053229 [2,0,0,0,0,0|2,0,0]=4 8793 B12R0.234 CC(=O)CCOCCCCCCCl 7a_100000766143_100000053229 [2,0,0,0,0,0|2,0,0]=4 8794 B12R0.234 CC(=O)CCOCCCCCCF 34a_100000759926_100015922095 [2,0,0,0,0,0|2,0,0]=4 8795 B12R0.234 CC(=O)CCOCCCCCCF 7a_100000732779_100000053229 [2,0,0,0,0,0|2,0,0]=4 8796 B12R0.234 CC(=O)CCOCCCCCCF 7a_100000759926_100015922095 [2,0,0,0,0,0|2,0,0]=4 8797 B12R0.234 CC(=O)CCOCCCCCCO 34a_100000759926_100000766143 [2,0,0,0,0,0|2,0,0]=4 8798 B12R0.234 CC(=O)CCOCCCCCCO 7a_100000759926_100000766143 [2,0,0,0,0,0|2,0,0]=4 8799 B12R0.234 CC(=O)CCSCCCCCCF 62a_100000053229_100015922095 [2,0,0,0,0,0|2,0,0]=4 8800 B12R0.234 CC(=O)CCSCCCCCCF 62a_100015922095_100000053229 [2,0,0,0,0,0|2,0,0]=4 8801 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000053229_100000766143 [2,0,0,0,0,0|2,0,0]=4 8802 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000766143_100000053229 [2,0,0,0,0,0|2,0,0]=4 8803 B12R0.234 CC(=O)COCCCCCCCO 34a_100000211253_100000760002 [2,0,0,0,0,0|2,0,0]=4 8804 B12R0.234 CC(=O)NCCCCCCCCO 240690a_102515433106_100015343762 [2,0,0,0,0,0|2,0,0]=4 8805 B12R0.234 CCC#CCCCCCCC(=O)C 1458a_100000070787_200000036426 [2,0,0,0,0,0|0,0,2]=4 8806 B12R0.234 CCCCCCCCC=CC(=O)C 1458a_100015345288_200000210301 [2,0,0,0,0,0|0,0,2]=4 8807 B12R0.234 CCCCCCCCC=CC(=O)[13CH3] 1458a_100015345288_200025704644 [2,0,0,0,0,0|0,0,2]=4 8808 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000070787_100000210319 [2,0,0,0,0,0|0,0,0]=2 8809 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000210375_200000210301 [2,0,0,0,0,0|0,0,0]=2 8810 B12R0.234 CCCCCCCCCCC(=O)[13CH3] 1458a_100000210375_200025704644 [2,0,0,0,0,0|0,0,0]=2 8811 B12R0.234 CCCCCCCCCCN(C)C 2230a_100000207566_200000210301 [2,0,0,0,0,0|2,0,0]=4 8812 B12R0.234 CCCCCCCCCCN(C)C 2230a_100102631434_100000210320 [2,0,0,0,0,0|2,0,0]=4 8813 B12R0.234 CCCCCCCCCCN(C)C 269982a_100000207566_200000210301 [2,0,0,0,0,0|2,0,0]=4 8814 B12R0.234 CCCCCCCCCCN(C)C 269982a_100102631434_100000210320 [2,0,0,0,0,0|2,0,0]=4 8815 B12R0.234 CCCCCCCCCCN(C)[13CH3] 2230a_100000207566_200025704644 [2,0,0,0,0,0|2,0,0]=4 8816 B12R0.234 CCCCCCCCCCN(C)[13CH3] 269982a_100000207566_200025704644 [2,0,0,0,0,0|2,0,0]=4 8817 B12R0.234 CCCCCCCCCNC(=O)C 11a_100000212291_100015343762 [2,0,0,0,0,0|1,0,0]=3 8818 B12R0.234 CCCCCCCCCNC(=O)C 1626a_100000212291_100015343762 [2,0,0,0,0,0|1,0,0]=3 8819 B12R0.234 CCCCCCCCCNC(=O)C 240690a_100000212291_100015343762 [2,0,0,0,0,0|1,0,0]=3 8820 B12R0.234 CCCCCCCCCNC(=O)C 527a_100000212291_100103153847 [2,0,0,0,0,0|1,0,0]=3 8821 B12R0.234 CCCCCCCCNCC(=O)N 2230a_100000229939_100000747473 [2,0,0,0,0,0|2,0,0]=4 8822 B12R0.234 CCCCCCCCNCC(=O)N 2230a_100000711301_100000210759 [2,0,0,0,0,0|2,0,0]=4 8823 B12R0.234 CCCCCCCCNCC(=O)N 34a_100000229939_100000187820 [2,0,0,0,0,0|2,0,0]=4 8824 B12R0.234 CCCCCCCCNCC(=O)O 269956a_100016091260_100000210759 [2,0,0,0,0,0|1,0,0]=3 8825 B12R0.234 CCCCCCCCNCC(=O)[O-] 34a_100000229939_100020667443 [2,0,0,0,0,0|1,0,1]=4 8826 B12R0.234 CCCCCCCCOCC(=O)C 1458a_100000759886_200000210301 [2,0,0,0,0,0|1,0,0]=3 8827 B12R0.234 CCCCCCCCOCC(=O)C 34a_100000211253_100000210759 [2,0,0,0,0,0|1,0,0]=3 8828 B12R0.234 CCCCCCCCOCC(=O)N 34a_100000210232_100000187820 [2,0,0,0,0,0|2,0,0]=4 8829 B12R0.234 CCCCCCCCOCC(=O)N 7a_100000210232_100000187820 [2,0,0,0,0,0|2,0,0]=4 8830 B12R0.234 CCCCCCCCOCC(=O)[13CH3] 1458a_100000759886_200025704644 [2,0,0,0,0,0|1,0,0]=3 8831 B12R0.234 CCCCCCCCOCC(=O)[O-] 34a_100000210232_100020667443 [2,0,0,0,0,0|1,0,1]=4 8832 B12R0.234 CCCCCCCCSCC(=O)N 62a_100000210759_100000747473 [2,0,0,0,0,0|2,0,0]=4 8833 B12R0.234 CCCCCCCCSCC(=O)N 62a_100000747473_100000210317 [2,0,0,0,0,0|2,0,0]=4 8834 B12R0.234 CCCCCCCCSCC(=O)[O-] 62a_100000210759_100020667443 [2,0,0,0,0,0|1,0,1]=4 8835 B12R0.234 CCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210317 [2,0,0,0,0,0|1,0,1]=4 8836 B12R0.234 CCCCCCCNCCC(=O)N 2230a_100000229938_100000744528 [2,0,0,0,0,0|2,0,0]=4 8837 B12R0.234 CCCCCCCNOCC(=O)O 269956a_100000106656_100000210614 [2,0,0,0,0,0|2,0,0]=4 8838 B12R0.234 CCCCCCCOCCC(=O)C 34a_100000759926_100000210614 [2,0,0,0,0,0|1,0,0]=3 8839 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000210272_100000053229 [2,0,0,0,0,0|1,0,0]=3 8840 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000759926_100000210614 [2,0,0,0,0,0|1,0,0]=3 8841 B12R0.234 CCCCCCCOCCC(=O)N 34a_100000210272_100000731001 [2,0,0,0,0,0|2,0,0]=4 8842 B12R0.234 CCCCCCCOCCC(=O)N 34a_100000757172_100000210614 [2,0,0,0,0,0|2,0,0]=4 8843 B12R0.234 CCCCCCCOCCC(=O)N 7a_100000210272_100000744528 [2,0,0,0,0,0|2,0,0]=4 8844 B12R0.234 CCCCCCCOCCC(=O)N 7a_100000757172_100000210614 [2,0,0,0,0,0|2,0,0]=4 8845 B12R0.234 CCCCCCCOCOC(=O)C 34a_100000210272_100009813279 [2,0,0,0,0,0|2,0,0]=4 8846 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000053229_100000210316 [2,0,0,0,0,0|1,0,0]=3 8847 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000210614_100000053229 [2,0,0,0,0,0|1,0,0]=3 8848 B12R0.234 CCCCCCCSCCC(=O)N 62a_100000210614_100000744528 [2,0,0,0,0,0|2,0,0]=4 8849 B12R0.234 CCCCCCCSCCC(=O)N 62a_100000744528_100000210316 [2,0,0,0,0,0|2,0,0]=4 8850 B12R0.234 CCCCCCCSCOC(=O)C 62a_100000076356_100000210316 [2,0,0,0,0,0|2,0,0]=4 8851 B12R0.234 CCCCCCCSCOC(=O)C 62a_100000210614_100000076356 [2,0,0,0,0,0|2,0,0]=4 8852 B12R0.234 CCCCCCNCCCC(=O)N 34a_100000739312_100000210314 [2,0,0,0,0,0|2,0,0]=4 8853 B12R0.234 CCCCCCNCCCS(=O)C 2230a_200000753449_100000210314 [2,0,0,0,0,0|2,0,0]=4 8854 B12R0.234 CCCCCCNCCNC(=O)C 2230a_100000209853_100000210314 [2,0,0,0,0,0|2,0,0]=4 8855 B12R0.234 CCCCCCNCCNC(=O)C 2230a_100000210581_100000189650 [2,0,0,0,0,0|2,0,0]=4 8856 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000210259_100000685027 [2,0,0,0,0,0|1,0,0]=3 8857 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000759063_100000210314 [2,0,0,0,0,0|1,0,0]=3 8858 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000210259_100011215641 [2,0,0,0,0,0|1,0,0]=3 8859 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000759063_100000210314 [2,0,0,0,0,0|1,0,0]=3 8860 B12R0.234 CCCCCCOCCCC(=O)N 34a_100000210259_100102525003 [2,0,0,0,0,0|2,0,0]=4 8861 B12R0.234 CCCCCCOCCCC(=O)N 7a_100000210259_100102525003 [2,0,0,0,0,0|2,0,0]=4 8862 B12R0.234 CCCCCCOCCNC(=O)C 34a_100000158858_100000210314 [2,0,0,0,0,0|2,0,0]=4 8863 B12R0.234 CCCCCCOCCNC(=O)C 7a_100000210259_100000189650 [2,0,0,0,0,0|2,0,0]=4 8864 B12R0.234 CCCCCCOCCOC(=O)C 34a_100000210259_100009814007 [2,0,0,0,0,0|2,0,0]=4 8865 B12R0.234 CCCCCCOCCOC(=O)C 7a_100000210259_100009814007 [2,0,0,0,0,0|2,0,0]=4 8866 B12R0.234 CCCCCCSCCCC(=O)C 62a_100000210314_100011215641 [2,0,0,0,0,0|1,0,0]=3 8867 B12R0.234 CCCCCCSCCCC(=O)C 62a_100011215641_100000210757 [2,0,0,0,0,0|1,0,0]=3 8868 B12R0.234 CCCCCCSCCCC(=O)N 62a_100000210314_100102525003 [2,0,0,0,0,0|2,0,0]=4 8869 B12R0.234 CCCCCCSCCCC(=O)N 62a_100102525003_100000210757 [2,0,0,0,0,0|2,0,0]=4 8870 B12R0.234 CCCCCCSCCNC(=O)C 62a_100000189650_100000210757 [2,0,0,0,0,0|2,0,0]=4 8871 B12R0.234 CCCCCCSCCNC(=O)C 62a_100000210314_100000189650 [2,0,0,0,0,0|2,0,0]=4 8872 B12R0.234 CCCCCCSCCOC(=O)C 62a_100000210314_100009814007 [2,0,0,0,0,0|2,0,0]=4 8873 B12R0.234 CCCCCCSCCOC(=O)C 62a_100009814007_100000210757 [2,0,0,0,0,0|2,0,0]=4 8874 B12R0.234 CCCCCNCCCCC(=O)N 34a_100000696515_100000718602 [2,0,0,0,0,0|2,0,0]=4 8875 B12R0.234 CCCCCNCCCNC(=O)C 34a_100000736810_100000718602 [2,0,0,0,0,0|2,0,0]=4 8876 B12R0.234 CCCCCNCCCSC(=O)C 2230a_100000209983_100000038929 [2,0,0,0,0,0|2,0,0]=4 8877 B12R0.234 CCCCCNCCOCC(=O)O 269956a_100000700818_100000210326 [2,0,0,0,0,0|2,0,0]=4 8878 B12R0.234 CCCCCOCCCCC(=O)C 34a_100000210253_100009817362 [2,0,0,0,0,0|1,0,0]=3 8879 B12R0.234 CCCCCOCCCCC(=O)C 7a_100000210253_100000735457 [2,0,0,0,0,0|1,0,0]=3 8880 B12R0.234 CCCCCOCCCCC(=O)N 34a_100012022536_100000718602 [2,0,0,0,0,0|2,0,0]=4 8881 B12R0.234 CCCCCOCCCCC(=O)N 7a_100012022536_100000210326 [2,0,0,0,0,0|2,0,0]=4 8882 B12R0.234 CCCCCOCCCNC(=O)C 34a_100000752032_100000718602 [2,0,0,0,0,0|2,0,0]=4 8883 B12R0.234 CCCCCOCCCOC(=O)C 34a_100000210253_100000042594 [2,0,0,0,0,0|2,0,0]=4 8884 B12R0.234 CCCCCOCCCOC(=O)C 7a_100000210253_100000042594 [2,0,0,0,0,0|2,0,0]=4 8885 B12R0.234 CCCCCOCCCSC(=O)C 34a_100000210253_100000038929 [2,0,0,0,0,0|2,0,0]=4 8886 B12R0.234 CCCCCOCCCSC(=O)C 7a_100000210253_100000038929 [2,0,0,0,0,0|2,0,0]=4 8887 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000210326_100000735457 [2,0,0,0,0,0|1,0,0]=3 8888 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000735457_100000210326 [2,0,0,0,0,0|1,0,0]=3 8889 B12R0.234 CCCCCSCCCOC(=O)C 62a_100000042594_100000210326 [2,0,0,0,0,0|2,0,0]=4 8890 B12R0.234 CCCCCSCCCOC(=O)C 62a_100000210326_100000042594 [2,0,0,0,0,0|2,0,0]=4 8891 B12R0.234 CCCCCSCCCSC(=O)C 62a_100000038929_100000210326 [2,0,0,0,0,0|2,0,0]=4 8892 B12R0.234 CCCCCSCCCSC(=O)C 62a_100000210326_100000038929 [2,0,0,0,0,0|2,0,0]=4 8893 B12R0.234 CCCCNCCCCCC(=O)N 2230a_100000102301_100009817443 [2,0,0,0,0,0|2,0,0]=4 8894 B12R0.234 CCCCNCCCCCC(=O)N 7a_106832991798_100009817443 [2,0,0,0,0,0|2,0,0]=4 8895 B12R0.234 CCCCNCCCCNC(=O)C 2230a_200011368371_100000210211 [2,0,0,0,0,0|2,0,0]=4 8896 B12R0.234 CCCCNCCCCNC(=O)C 34a_200011368371_100000210210 [2,0,0,0,0,0|2,0,0]=4 8897 B12R0.234 CCCCNCCCCOC(=O)C 7a_106832991798_100000033659 [2,0,0,0,0,0|2,0,0]=4 8898 B12R0.234 CCCCNCCCCSC(=O)C 2230a_100000102301_200010402107 [2,0,0,0,0,0|2,0,0]=4 8899 B12R0.234 CCCCNCCCCSC(=O)C 7a_106832991798_200010402107 [2,0,0,0,0,0|2,0,0]=4 8900 B12R0.234 CCCCOCCCCCC(=O)N 34a_100000123541_100000210210 [2,0,0,0,0,0|2,0,0]=4 8901 B12R0.234 CCCCOCCCCCC(=O)N 34a_100000210227_100009817443 [2,0,0,0,0,0|2,0,0]=4 8902 B12R0.234 CCCCOCCCCCC(=O)N 7a_100000123541_100000210211 [2,0,0,0,0,0|2,0,0]=4 8903 B12R0.234 CCCCOCCCCCC(=O)N 7a_100000210227_100009817443 [2,0,0,0,0,0|2,0,0]=4 8904 B12R0.234 CCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210211 [2,0,0,0,0,0|1,0,1]=4 8905 B12R0.234 CCCCOCCCCOC(=O)C 34a_100000073216_100000210210 [2,0,0,0,0,0|2,0,0]=4 8906 B12R0.234 CCCCOCCCCOC(=O)C 34a_100000210227_100000033659 [2,0,0,0,0,0|2,0,0]=4 8907 B12R0.234 CCCCOCCCCOC(=O)C 7a_100000073216_100000210211 [2,0,0,0,0,0|2,0,0]=4 8908 B12R0.234 CCCCOCCCCOC(=O)C 7a_100000210227_100000033659 [2,0,0,0,0,0|2,0,0]=4 8909 B12R0.234 CCCCOCCCCSC(=O)C 34a_100000210227_200010402107 [2,0,0,0,0,0|2,0,0]=4 8910 B12R0.234 CCCCOCCCCSC(=O)C 7a_100000210227_200010402107 [2,0,0,0,0,0|2,0,0]=4 8911 B12R0.234 CCCCOCCOCCC(=O)C 34a_100000759926_100000743108 [2,0,0,0,0,0|2,0,0]=4 8912 B12R0.234 CCCCOCCOCCC(=O)C 7a_100000210238_100000053229 [2,0,0,0,0,0|2,0,0]=4 8913 B12R0.234 CCCCOCCOCCC(=O)C 7a_100000759926_100000743108 [2,0,0,0,0,0|2,0,0]=4 8914 B12R0.234 CCCCOCCSCCC(=O)C 62a_100000053229_100000743108 [2,0,0,0,0,0|2,0,0]=4 8915 B12R0.234 CCCCOCCSCCC(=O)C 62a_100000743108_100000053229 [2,0,0,0,0,0|2,0,0]=4 8916 B12R0.234 CCCCOCOCCCC(=O)C 34a_100000759063_100011995733 [2,0,0,0,0,0|2,0,0]=4 8917 B12R0.234 CCCCOCSCCCC(=O)C 62a_100011215641_100011995733 [2,0,0,0,0,0|2,0,0]=4 8918 B12R0.234 CCCCOCSCCCC(=O)C 62a_100011995733_100011215641 [2,0,0,0,0,0|2,0,0]=4 8919 B12R0.234 CCCCSCCCCCC(=O)N 62a_100000210211_100009817443 [2,0,0,0,0,0|2,0,0]=4 8920 B12R0.234 CCCCSCCCCCC(=O)N 62a_100009817443_100000210210 [2,0,0,0,0,0|2,0,0]=4 8921 B12R0.234 CCCCSCCCCOC(=O)C 62a_100000033659_100000210210 [2,0,0,0,0,0|2,0,0]=4 8922 B12R0.234 CCCCSCCCCOC(=O)C 62a_100000210211_100000033659 [2,0,0,0,0,0|2,0,0]=4 8923 B12R0.234 CCCCSCCCCSC(=O)C 62a_100000210211_200010402107 [2,0,0,0,0,0|2,0,0]=4 8924 B12R0.234 CCCCSCCCCSC(=O)C 62a_200010402107_100000210210 [2,0,0,0,0,0|2,0,0]=4 8925 B12R0.234 CCCCSCCOCCC(=O)C 7a_200000230436_100000053229 [2,0,0,0,0,0|2,0,0]=4 8926 B12R0.234 CCCNCCCCCNC(=O)C 2230a_200012022750_100000210303 [2,0,0,0,0,0|2,0,0]=4 8927 B12R0.234 CCCNCCCCCNC(=O)C 34a_200012022750_100000210303 [2,0,0,0,0,0|2,0,0]=4 8928 B12R0.234 CCCOCCCCCOC(=O)C 34a_100000210258_100000033007 [2,0,0,0,0,0|2,0,0]=4 8929 B12R0.234 CCCOCCNCCCC(=O)C 34a_100161115042_100000685027 [2,0,0,0,0,0|2,0,0]=4 8930 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000752267_100000685027 [2,0,0,0,0,0|2,0,0]=4 8931 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000759063_100011215938 [2,0,0,0,0,0|2,0,0]=4 8932 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000752267_100011215641 [2,0,0,0,0,0|2,0,0]=4 8933 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000759063_100011215938 [2,0,0,0,0,0|2,0,0]=4 8934 B12R0.234 CCCOCCSCCCC(=O)C 62a_100011215641_100011215938 [2,0,0,0,0,0|2,0,0]=4 8935 B12R0.234 CCCOCCSCCCC(=O)C 62a_100011215938_100011215641 [2,0,0,0,0,0|2,0,0]=4 8936 B12R0.234 CCCSCCCCCOC(=O)C 62a_100000033007_100000210303 [2,0,0,0,0,0|2,0,0]=4 8937 B12R0.234 CCCSCCCCCOC(=O)C 62a_100000210303_100000033007 [2,0,0,0,0,0|2,0,0]=4 8938 B12R0.234 CCCSCCOCCCC(=O)C 34a_200000230433_100000685027 [2,0,0,0,0,0|2,0,0]=4 8939 B12R0.234 CCCSCCOCCCC(=O)C 7a_200000230433_100011215641 [2,0,0,0,0,0|2,0,0]=4 8940 B12R0.234 CCNCCCCCCNC(=O)C 2230a_200011996284_100000210202 [2,0,0,0,0,0|2,0,0]=4 8941 B12R0.234 CCNCCCCCCNC(=O)C 34a_200011996284_100000210202 [2,0,0,0,0,0|2,0,0]=4 8942 B12R0.234 CCOCCCNCCCC(=O)C 34a_100000210961_100000685027 [2,0,0,0,0,0|2,0,0]=4 8943 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000757476_100000685027 [2,0,0,0,0,0|2,0,0]=4 8944 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000759063_100012232248 [2,0,0,0,0,0|2,0,0]=4 8945 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000757476_100011215641 [2,0,0,0,0,0|2,0,0]=4 8946 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000759063_100012232248 [2,0,0,0,0,0|2,0,0]=4 8947 B12R0.234 CCOCCCSCCCC(=O)C 62a_100011215641_100012232248 [2,0,0,0,0,0|2,0,0]=4 8948 B12R0.234 CCOCCCSCCCC(=O)C 62a_100012232248_100011215641 [2,0,0,0,0,0|2,0,0]=4 8949 B12R0.234 CCOCCNCCCCC(=O)C 34a_102516460346_100009817362 [2,0,0,0,0,0|2,0,0]=4 8950 B12R0.234 CCOCCOCCCCC(=O)C 34a_100000210136_100009817362 [2,0,0,0,0,0|2,0,0]=4 8951 B12R0.234 CCOCCOCCCCC(=O)C 7a_100000210136_100000735457 [2,0,0,0,0,0|2,0,0]=4 8952 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000210147_100000735457 [2,0,0,0,0,0|2,0,0]=4 8953 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000735457_100011215890 [2,0,0,0,0,0|2,0,0]=4 8954 B12R0.234 CCSCCCOCCCC(=O)C 34a_100011216438_100000685027 [2,0,0,0,0,0|2,0,0]=4 8955 B12R0.234 CCSCCCOCCCC(=O)C 7a_100011216438_100011215641 [2,0,0,0,0,0|2,0,0]=4 8956 B12R0.234 CCSCCOCCCCC(=O)C 34a_100000212035_100009817362 [2,0,0,0,0,0|2,0,0]=4 8957 B12R0.234 CCSCCOCCCCC(=O)C 7a_100000212035_100000735457 [2,0,0,0,0,0|2,0,0]=4 8958 B12R0.234 CCSCCSCCCCC(=O)C 62a_100000735457_100000757381 [2,0,0,0,0,0|2,0,0]=4 8959 B12R0.234 CCSCCSCCCCC(=O)C 62a_100000757381_100000735457 [2,0,0,0,0,0|2,0,0]=4 8960 B12R0.234 CNCCCOCCCCC(=O)C 34a_100000213112_100009817362 [2,0,0,0,0,0|2,0,0]=4 8961 B12R0.234 COCCCCCCNCC(=O)O 269956a_100016091260_100011998445 [2,0,0,0,0,0|2,0,0]=4 8962 B12R0.234 COCCCCCCOCC(=O)C 34a_100000211253_100011998445 [2,0,0,0,0,0|2,0,0]=4 8963 B12R0.234 COCCCCOCCCC(=O)C 34a_100000740925_100000685027 [2,0,0,0,0,0|2,0,0]=4 8964 B12R0.234 COCCCCOCCCC(=O)C 34a_100000759063_100000755781 [2,0,0,0,0,0|2,0,0]=4 8965 B12R0.234 COCCCCOCCCC(=O)C 7a_100000759063_100000730899 [2,0,0,0,0,0|2,0,0]=4 8966 B12R0.234 COCCCCSCCCC(=O)C 62a_100000730899_100011215641 [2,0,0,0,0,0|2,0,0]=4 8967 B12R0.234 COCCCCSCCCC(=O)C 62a_100011215641_100000730899 [2,0,0,0,0,0|2,0,0]=4 8968 B12R0.234 COCCCNCCCCC(=O)C 34a_100150723488_100009817362 [2,0,0,0,0,0|2,0,0]=4 8969 B12R0.234 COCCCOCCCCC(=O)C 34a_100000740835_100009817362 [2,0,0,0,0,0|2,0,0]=4 8970 B12R0.234 COCCCSCCCCC(=O)C 62a_100000709357_100000735457 [2,0,0,0,0,0|2,0,0]=4 8971 B12R0.234 COCCCSCCCCC(=O)C 62a_100000735457_100000709357 [2,0,0,0,0,0|2,0,0]=4 8972 B12R0.234 CSCCCCOCCCC(=O)C 34a_100011217163_100000685027 [2,0,0,0,0,0|2,0,0]=4 8973 B12R0.234 CSCCCCOCCCC(=O)C 7a_100011217163_100011215641 [2,0,0,0,0,0|2,0,0]=4 8974 B12R0.234 CSCCCOCCCCC(=O)C 34a_100000690336_100009817362 [2,0,0,0,0,0|2,0,0]=4 8975 B12R0.234 CSCCCOCCCCC(=O)C 7a_100000690336_100000735457 [2,0,0,0,0,0|2,0,0]=4 8976 B12R0.234 O=C(O)CNCCCCCCCO 269956a_100016091260_100000760002 [2,0,0,0,0,0|2,0,0]=4 8977 B12R0.234 [13CH3]C(=O)CCCCCCCCCF 1458a_200009909015_200025704644 [2,0,0,0,0,0|1,0,0]=3 8978 B12R0.248 C#CC(=O)CCCCCCCCC 1458a_100000211873_100000210670 [2,0,0,0,0,0|1,0,1]=4 8979 B12R0.248 C=CC(=O)CCCCCCCCC 1458a_100000185746_100000210670 [2,0,0,0,0,0|1,0,1]=4 8980 B12R0.248 CCC(=O)CCCCCCCCO 1458a_100000210414_100000033203 [2,0,0,0,0,0|2,0,0]=4 8981 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210414_100000210670 [2,0,0,0,0,0|1,0,0]=3 8982 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210558_100000210202 [2,0,0,0,0,0|1,0,0]=3 8983 B12R0.248 CCCCCCCCCC(=O)CF 1458a_100000210558_100015361967 [2,0,0,0,0,0|2,0,0]=4 8984 B12R0.248 CCCCCCCCCC(=O)CO 1458a_100000210174_100000210670 [2,0,0,0,0,0|2,0,0]=4 8985 B12R0.248 CCCCCCCCCC(=O)NC 11a_106832991635_100000210558 [2,0,0,0,0,0|1,0,0]=3 8986 B12R0.248 CCCCCCCCCC(=O)NC 1626a_100102657272_100000210558 [2,0,0,0,0,0|1,0,0]=3 8987 B12R0.248 CCCCCCCCCC(=O)NC 240690a_100102657272_100000210558 [2,0,0,0,0,0|1,0,0]=3 8988 B12R0.248 CCCCCCCCCC(=O)NC 527a_100102657272_100000210558 [2,0,0,0,0,0|1,0,0]=3 8989 B12R0.248 CCCCCCCCCC(C)OC 34a_100011218016_200000210301 [2,0,0,0,0,0|1,0,1]=4 8990 B12R0.248 CCCCCCCCCC(C)OC 7a_100011218016_200000210301 [2,0,0,0,0,0|1,0,1]=4 8991 B12R0.248 CCCCCCCCCC(C)O[13CH3] 34a_100011218016_200025704644 [2,0,0,0,0,0|1,0,1]=4 8992 B12R0.248 CCCCCCCCCC(C)O[13CH3] 7a_100011218016_200025704644 [2,0,0,0,0,0|1,0,1]=4 8993 B12R0.248 CCCCCCCCNC(=O)CC 11a_100000229939_100000210414 [2,0,0,0,0,0|2,0,0]=4 8994 B12R0.248 CCCCCCCCNC(=O)CC 1626a_100000229939_100000210414 [2,0,0,0,0,0|2,0,0]=4 8995 B12R0.248 CCCCCCCCNC(=O)CC 240690a_100000229939_100000210414 [2,0,0,0,0,0|2,0,0]=4 8996 B12R0.248 CCCCCCCCNC(=O)CC 527a_100000229939_100000210414 [2,0,0,0,0,0|2,0,0]=4 8997 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100000229939_106832991635 [2,0,0,0,0,0|2,0,0]=4 8998 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100102657272_100000229939 [2,0,0,0,0,0|2,0,0]=4 8999 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100000229939_100102657272 [2,0,0,0,0,0|2,0,0]=4 9000 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100102657272_100000229939 [2,0,0,0,0,0|2,0,0]=4 9001 B12R0.248 CCCCCCCCNC(=O)NC 512a_100000229939_100102657272 [2,0,0,0,0,0|2,0,0]=4 9002 B12R0.248 CCCCCCCCNC(=O)NC 512a_106832991638_100000229939 [2,0,0,0,0,0|2,0,0]=4 9003 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000229938_100000183359 [2,0,0,0,0,0|2,0,0]=4 9004 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000693194_100000210681 [2,0,0,0,0,0|2,0,0]=4 9005 B12R0.248 CCCCCCCNCC(=O)OC 2230a_100000229938_100000747449 [2,0,0,0,0,0|1,0,0]=3 9006 B12R0.248 CCCCCCCOCC(=O)CC 34a_100000725409_100000210614 [2,0,0,0,0,0|2,0,0]=4 9007 B12R0.248 CCCCCCCOCC(=O)CC 7a_100000210272_100000747405 [2,0,0,0,0,0|2,0,0]=4 9008 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000210272_100000183359 [2,0,0,0,0,0|2,0,0]=4 9009 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000750040_100000210614 [2,0,0,0,0,0|2,0,0]=4 9010 B12R0.248 CCCCCCCOCC(=O)NC 7a_100000210272_100000183359 [2,0,0,0,0,0|2,0,0]=4 9011 B12R0.248 CCCCCCCOCC(=O)OC 34a_100000210272_100000747449 [2,0,0,0,0,0|1,0,0]=3 9012 B12R0.248 CCCCCCCOCC(=O)OC 7a_100000210272_100000747449 [2,0,0,0,0,0|1,0,0]=3 9013 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000210614_100000747405 [2,0,0,0,0,0|2,0,0]=4 9014 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000747405_100000210316 [2,0,0,0,0,0|2,0,0]=4 9015 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000183359_100000210316 [2,0,0,0,0,0|2,0,0]=4 9016 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000210614_100000183359 [2,0,0,0,0,0|2,0,0]=4 9017 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000210614_100000747449 [2,0,0,0,0,0|1,0,0]=3 9018 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000747449_100000210316 [2,0,0,0,0,0|1,0,0]=3 9019 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000210581_100000737683 [2,0,0,0,0,0|2,0,0]=4 9020 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000738227_100000210314 [2,0,0,0,0,0|2,0,0]=4 9021 B12R0.248 CCCCCCNCCC(=O)NC 34a_100000738227_100000210314 [2,0,0,0,0,0|2,0,0]=4 9022 B12R0.248 CCCCCCNCCC(=O)OC 2230a_100000210581_100000204255 [2,0,0,0,0,0|1,0,0]=3 9023 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000210259_100012179268 [2,0,0,0,0,0|2,0,0]=4 9024 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000754576_100000210314 [2,0,0,0,0,0|2,0,0]=4 9025 B12R0.248 CCCCCCOCCC(=O)NC 7a_100000210259_100000737683 [2,0,0,0,0,0|2,0,0]=4 9026 B12R0.248 CCCCCCOCCC(=O)OC 34a_100000210259_100000742370 [2,0,0,0,0,0|1,0,0]=3 9027 B12R0.248 CCCCCCOCCC(=O)OC 7a_100000210259_100000204255 [2,0,0,0,0,0|1,0,0]=3 9028 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000210314_100000737683 [2,0,0,0,0,0|2,0,0]=4 9029 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000737683_100000210757 [2,0,0,0,0,0|2,0,0]=4 9030 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000204255_100000210757 [2,0,0,0,0,0|1,0,0]=3 9031 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000210314_100000204255 [2,0,0,0,0,0|1,0,0]=3 9032 B12R0.248 CCCCCCSCOC(=O)OC 62a_100000210314_100000139417 [2,0,0,0,0,0|2,0,0]=4 9033 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000209983_100000741757 [2,0,0,0,0,0|2,0,0]=4 9034 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000740002_100000210326 [2,0,0,0,0,0|2,0,0]=4 9035 B12R0.248 CCCCCNCCCC(=O)NC 34a_100000740002_100000718602 [2,0,0,0,0,0|2,0,0]=4 9036 B12R0.248 CCCCCNCCCC(=O)OC 2230a_100000209983_100011218270 [2,0,0,0,0,0|1,0,0]=3 9037 B12R0.248 CCCCCOCCCC(=O)NC 34a_100000210253_100000741757 [2,0,0,0,0,0|2,0,0]=4 9038 B12R0.248 CCCCCOCCCC(=O)NC 7a_100000210253_100000741757 [2,0,0,0,0,0|2,0,0]=4 9039 B12R0.248 CCCCCOCCCC(=O)OC 34a_100000210253_100000742333 [2,0,0,0,0,0|1,0,0]=3 9040 B12R0.248 CCCCCOCCCC(=O)OC 7a_100000210253_100011218270 [2,0,0,0,0,0|1,0,0]=3 9041 B12R0.248 CCCCCOCCNC(=O)OC 34a_100000757965_100000718602 [2,0,0,0,0,0|2,0,0]=4 9042 B12R0.248 CCCCCOCCOC(=O)OC 34a_100010262106_100000718602 [2,0,0,0,0,0|2,0,0]=4 9043 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000210326_100000741757 [2,0,0,0,0,0|2,0,0]=4 9044 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000741757_100000210326 [2,0,0,0,0,0|2,0,0]=4 9045 B12R0.248 CCCCCSCCCC(=O)OC 62a_100000210326_100011218270 [2,0,0,0,0,0|1,0,0]=3 9046 B12R0.248 CCCCCSCCCC(=O)OC 62a_100011218270_100000210326 [2,0,0,0,0,0|1,0,0]=3 9047 B12R0.248 CCCCNCCCCC(=O)OC 2230a_100000102301_100000204269 [2,0,0,0,0,0|1,0,0]=3 9048 B12R0.248 CCCCNCCCCC(=O)OC 7a_106832991798_100000204269 [2,0,0,0,0,0|1,0,0]=3 9049 B12R0.248 CCCCNCCOCC(=O)OC 2230a_100000102301_100000090808 [2,0,0,0,0,0|2,0,0]=4 9050 B12R0.248 CCCCNCCOCC(=O)OC 7a_106832991798_100000090808 [2,0,0,0,0,0|2,0,0]=4 9051 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000059025_100000210210 [2,0,0,0,0,0|1,0,0]=3 9052 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000210227_100000204269 [2,0,0,0,0,0|1,0,0]=3 9053 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000059025_100000210211 [2,0,0,0,0,0|1,0,0]=3 9054 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000210227_100000204269 [2,0,0,0,0,0|1,0,0]=3 9055 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210227_100000090808 [2,0,0,0,0,0|2,0,0]=4 9056 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210238_100000747449 [2,0,0,0,0,0|2,0,0]=4 9057 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210227_100000090808 [2,0,0,0,0,0|2,0,0]=4 9058 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210238_100000747449 [2,0,0,0,0,0|2,0,0]=4 9059 B12R0.248 CCCCOCCSCC(=O)OC 62a_100000743108_100000747449 [2,0,0,0,0,0|2,0,0]=4 9060 B12R0.248 CCCCOCCSCC(=O)OC 62a_100000747449_100000743108 [2,0,0,0,0,0|2,0,0]=4 9061 B12R0.248 CCCCOCSCCC(=O)OC 62a_100000204255_100011995733 [2,0,0,0,0,0|2,0,0]=4 9062 B12R0.248 CCCCOCSCCC(=O)OC 62a_100011995733_100000204255 [2,0,0,0,0,0|2,0,0]=4 9063 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000204269_100000210210 [2,0,0,0,0,0|1,0,0]=3 9064 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000210211_100000204269 [2,0,0,0,0,0|1,0,0]=3 9065 B12R0.248 CCCCSCCNCC(=O)OC 2230a_100025743550_100000747449 [2,0,0,0,0,0|2,0,0]=4 9066 B12R0.248 CCCCSCCOCC(=O)OC 34a_200000230436_100000747449 [2,0,0,0,0,0|2,0,0]=4 9067 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000090808_100000210210 [2,0,0,0,0,0|2,0,0]=4 9068 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000210211_100000090808 [2,0,0,0,0,0|2,0,0]=4 9069 B12R0.248 CCCCSCCOCC(=O)OC 7a_200000230436_100000747449 [2,0,0,0,0,0|2,0,0]=4 9070 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000074720_100000210303 [2,0,0,0,0,0|1,0,0]=3 9071 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000210258_100009816466 [2,0,0,0,0,0|1,0,0]=3 9072 B12R0.248 CCCOCCCCCC(=O)OC 7a_100000074720_100000210303 [2,0,0,0,0,0|1,0,0]=3 9073 B12R0.248 CCCOCCCNCC(=O)OC 2230a_100011217757_100000747449 [2,0,0,0,0,0|2,0,0]=4 9074 B12R0.248 CCCOCCCNCC(=O)OC 34a_100011217757_100000747449 [2,0,0,0,0,0|2,0,0]=4 9075 B12R0.248 CCCOCCNCCC(=O)OC 2230a_100161115042_100000204255 [2,0,0,0,0,0|2,0,0]=4 9076 B12R0.248 CCCOCCNCCC(=O)OC 34a_100161115042_100000742370 [2,0,0,0,0,0|2,0,0]=4 9077 B12R0.248 CCCOCCOCCC(=O)OC 34a_100000752267_100000742370 [2,0,0,0,0,0|2,0,0]=4 9078 B12R0.248 CCCOCCOCCC(=O)OC 7a_100000752267_100000204255 [2,0,0,0,0,0|2,0,0]=4 9079 B12R0.248 CCCOCCSCCC(=O)OC 62a_100000204255_100011215938 [2,0,0,0,0,0|2,0,0]=4 9080 B12R0.248 CCCOCCSCCC(=O)OC 62a_100011215938_100000204255 [2,0,0,0,0,0|2,0,0]=4 9081 B12R0.248 CCCSCCCCCC(=O)OC 62a_100000210303_100009816466 [2,0,0,0,0,0|1,0,0]=3 9082 B12R0.248 CCCSCCCCCC(=O)OC 62a_100009816466_100000210303 [2,0,0,0,0,0|1,0,0]=3 9083 B12R0.248 CCCSCCNCCC(=O)OC 2230a_100020603323_100000204255 [2,0,0,0,0,0|2,0,0]=4 9084 B12R0.248 CCCSCCOCCC(=O)OC 34a_200000230433_100000742370 [2,0,0,0,0,0|2,0,0]=4 9085 B12R0.248 CCCSCCOCCC(=O)OC 7a_200000230433_100000204255 [2,0,0,0,0,0|2,0,0]=4 9086 B12R0.248 CCNCCCCCCC(=O)OC 2230a_100015525214_100009815986 [2,0,0,0,0,0|1,0,0]=3 9087 B12R0.248 CCOCCCCCCC(=O)OC 34a_100009863599_100000210202 [2,0,0,0,0,0|1,0,0]=3 9088 B12R0.248 CCOCCCCCCC(=O)OC 34a_100121572206_100009815986 [2,0,0,0,0,0|1,0,0]=3 9089 B12R0.248 CCOCCCCCCC(=O)OC 7a_100009863599_100000210202 [2,0,0,0,0,0|1,0,0]=3 9090 B12R0.248 CCOCCCNCCC(=O)OC 2230a_100000210961_100000204255 [2,0,0,0,0,0|2,0,0]=4 9091 B12R0.248 CCOCCCNCCC(=O)OC 34a_100000210961_100000742370 [2,0,0,0,0,0|2,0,0]=4 9092 B12R0.248 CCOCCCOCCC(=O)OC 34a_100000757476_100000742370 [2,0,0,0,0,0|2,0,0]=4 9093 B12R0.248 CCOCCCOCCC(=O)OC 7a_100000757476_100000204255 [2,0,0,0,0,0|2,0,0]=4 9094 B12R0.248 CCOCCCSCCC(=O)OC 62a_100000204255_100012232248 [2,0,0,0,0,0|2,0,0]=4 9095 B12R0.248 CCOCCCSCCC(=O)OC 62a_100012232248_100000204255 [2,0,0,0,0,0|2,0,0]=4 9096 B12R0.248 CCOCCNCCCC(=O)OC 2230a_102516460346_100011218270 [2,0,0,0,0,0|2,0,0]=4 9097 B12R0.248 CCOCCNCCCC(=O)OC 34a_102516460346_100000742333 [2,0,0,0,0,0|2,0,0]=4 9098 B12R0.248 CCOCCOCCCC(=O)OC 34a_100000210136_100000742333 [2,0,0,0,0,0|2,0,0]=4 9099 B12R0.248 CCOCCOCCCC(=O)OC 7a_100000210136_100011218270 [2,0,0,0,0,0|2,0,0]=4 9100 B12R0.248 CCOCCSCCCC(=O)OC 62a_100000210147_100011218270 [2,0,0,0,0,0|2,0,0]=4 9101 B12R0.248 CCOCCSCCCC(=O)OC 62a_100011218270_100011215890 [2,0,0,0,0,0|2,0,0]=4 9102 B12R0.248 CCOCSCCCCC(=O)OC 62a_100000204269_100000739092 [2,0,0,0,0,0|2,0,0]=4 9103 B12R0.248 CCOCSCCCCC(=O)OC 62a_100000739092_100000204269 [2,0,0,0,0,0|2,0,0]=4 9104 B12R0.248 CCSCCCCCCC(=O)OC 62a_100000210202_100009815986 [2,0,0,0,0,0|1,0,0]=3 9105 B12R0.248 CCSCCCCCCC(=O)OC 62a_100009815986_100000210202 [2,0,0,0,0,0|1,0,0]=3 9106 B12R0.248 CCSCCCOCCC(=O)OC 34a_100011216438_100000742370 [2,0,0,0,0,0|2,0,0]=4 9107 B12R0.248 CCSCCCOCCC(=O)OC 7a_100011216438_100000204255 [2,0,0,0,0,0|2,0,0]=4 9108 B12R0.248 CCSCCNCCCC(=O)OC 2230a_100000106463_100011218270 [2,0,0,0,0,0|2,0,0]=4 9109 B12R0.248 CCSCCOCCCC(=O)OC 34a_100000212035_100000742333 [2,0,0,0,0,0|2,0,0]=4 9110 B12R0.248 CCSCCOCCCC(=O)OC 7a_100000212035_100011218270 [2,0,0,0,0,0|2,0,0]=4 9111 B12R0.248 CCSCCSCCCC(=O)OC 62a_100000757381_100011218270 [2,0,0,0,0,0|2,0,0]=4 9112 B12R0.248 CCSCCSCCCC(=O)OC 62a_100011218270_100000757381 [2,0,0,0,0,0|2,0,0]=4 9113 B12R0.248 CNC(=O)CCCCCCCCO 240690a_100102657272_100000015970 [2,0,0,0,0,0|2,0,0]=4 9114 B12R0.248 CNCCCCCCCC(=O)OC 2230a_106832991635_100010004213 [2,0,0,0,0,0|1,0,0]=3 9115 B12R0.248 CNCCCCCCCC(=O)OC 34a_100102657272_100010004213 [2,0,0,0,0,0|1,0,0]=3 9116 B12R0.248 CNCCCCCCCC(=O)OC 7a_106832991635_100010004213 [2,0,0,0,0,0|1,0,0]=3 9117 B12R0.248 CNCCCCCOCC(=O)OC 34a_100000722520_100000747449 [2,0,0,0,0,0|2,0,0]=4 9118 B12R0.248 CNCCCOCCCC(=O)OC 34a_100000213112_100000742333 [2,0,0,0,0,0|2,0,0]=4 9119 B12R0.248 COC(=O)CCCCCCCO[13CH3] 34a_100011022521_200025704644 [2,0,0,0,0,0|1,0,0]=3 9120 B12R0.248 COC(=O)CCCCCCCO[13CH3] 7a_100011022521_200025704644 [2,0,0,0,0,0|1,0,0]=3 9121 B12R0.248 COC(=O)CCCCCCCSC 62a_100010004213_200000210301 [2,0,0,0,0,0|1,0,0]=3 9122 B12R0.248 COC(=O)CCCCCCCSC 62a_200000210301_100010004213 [2,0,0,0,0,0|1,0,0]=3 9123 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_100010004213_200025704644 [2,0,0,0,0,0|1,0,0]=3 9124 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_200025704644_100010004213 [2,0,0,0,0,0|1,0,0]=3 9125 B12R0.248 COC(=O)CCCCCCOCF 34a_100009863599_100015361967 [2,0,0,0,0,0|2,0,0]=4 9126 B12R0.248 COC(=O)CCCCCCOCF 7a_100009863599_100015361967 [2,0,0,0,0,0|2,0,0]=4 9127 B12R0.248 COC(=O)CCCCCCSCF 62a_100009815986_100015361967 [2,0,0,0,0,0|2,0,0]=4 9128 B12R0.248 COC(=O)CCCCCCSCF 62a_100015361967_100009815986 [2,0,0,0,0,0|2,0,0]=4 9129 B12R0.248 COC(=O)CCCCCNCCF 34a_100000724931_100009816466 [2,0,0,0,0,0|2,0,0]=4 9130 B12R0.248 COC(=O)CCCCCNCCO 2230a_100016997473_100009816466 [2,0,0,0,0,0|2,0,0]=4 9131 B12R0.248 COC(=O)CCCCCNCCO 34a_100016990907_100009816466 [2,0,0,0,0,0|2,0,0]=4 9132 B12R0.248 COC(=O)CCCCCOCCBr 34a_100000211926_100009816466 [2,0,0,0,0,0|2,0,0]=4 9133 B12R0.248 COC(=O)CCCCCOCCF 34a_100000074720_100011217306 [2,0,0,0,0,0|2,0,0]=4 9134 B12R0.248 COC(=O)CCCCCOCCF 7a_100000074720_100011217306 [2,0,0,0,0,0|2,0,0]=4 9135 B12R0.248 COC(=O)CCCCCOCCN 34a_100000210304_100009816466 [2,0,0,0,0,0|2,0,0]=4 9136 B12R0.248 COC(=O)CCCCCOCCO 34a_100000074720_100000211926 [2,0,0,0,0,0|2,0,0]=4 9137 B12R0.248 COC(=O)CCCCCOCCO 7a_100000074720_100000211926 [2,0,0,0,0,0|2,0,0]=4 9138 B12R0.248 COC(=O)CCCCCOCSC 34a_100000074720_100011218213 [2,0,0,0,0,0|2,0,0]=4 9139 B12R0.248 COC(=O)CCCCCSCCF 62a_100009816466_100011217306 [2,0,0,0,0,0|2,0,0]=4 9140 B12R0.248 COC(=O)CCCCCSCCF 62a_100011217306_100009816466 [2,0,0,0,0,0|2,0,0]=4 9141 B12R0.248 COC(=O)CCCCCSCCO 62a_100000211926_100009816466 [2,0,0,0,0,0|2,0,0]=4 9142 B12R0.248 COC(=O)CCCCCSCCO 62a_100009816466_100000211926 [2,0,0,0,0,0|2,0,0]=4 9143 B12R0.248 COC(=O)CCCCCSCSC 62a_100009816466_100011218213 [2,0,0,0,0,0|2,0,0]=4 9144 B12R0.248 COC(=O)CCCCCSCSC 62a_100011218213_100009816466 [2,0,0,0,0,0|2,0,0]=4 9145 B12R0.248 COC(=O)CCCCNCCCF 2230a_100015189416_100000204269 [2,0,0,0,0,0|2,0,0]=4 9146 B12R0.248 COC(=O)CCCCNCCCF 34a_100015189416_100000204269 [2,0,0,0,0,0|2,0,0]=4 9147 B12R0.248 COC(=O)CCCCNCCSC 2230a_100020590264_100000204269 [2,0,0,0,0,0|2,0,0]=4 9148 B12R0.248 COC(=O)CCCCOCCCBr 34a_100011217188_100000204269 [2,0,0,0,0,0|2,0,0]=4 9149 B12R0.248 COC(=O)CCCCOCCCCl 34a_100000230001_100000204269 [2,0,0,0,0,0|2,0,0]=4 9150 B12R0.248 COC(=O)CCCCOCCCF 34a_100000059025_100011934791 [2,0,0,0,0,0|2,0,0]=4 9151 B12R0.248 COC(=O)CCCCOCCCF 34a_100000759539_100000204269 [2,0,0,0,0,0|2,0,0]=4 9152 B12R0.248 COC(=O)CCCCOCCCF 7a_100000059025_100011934791 [2,0,0,0,0,0|2,0,0]=4 9153 B12R0.248 COC(=O)CCCCOCCCN 34a_100000182051_100000204269 [2,0,0,0,0,0|2,0,0]=4 9154 B12R0.248 COC(=O)CCCCOCCCO 34a_100000059025_100000230001 [2,0,0,0,0,0|2,0,0]=4 9155 B12R0.248 COC(=O)CCCCOCCCO 7a_100000059025_100011215043 [2,0,0,0,0,0|2,0,0]=4 9156 B12R0.248 COC(=O)CCCCOCCSC 34a_100000059025_100000212216 [2,0,0,0,0,0|2,0,0]=4 9157 B12R0.248 COC(=O)CCCCOCCSC 34a_100000230434_100000204269 [2,0,0,0,0,0|2,0,0]=4 9158 B12R0.248 COC(=O)CCCCOCCSC 7a_100000059025_100000212216 [2,0,0,0,0,0|2,0,0]=4 9159 B12R0.248 COC(=O)CCCCOCCSC 7a_100000230434_100000204269 [2,0,0,0,0,0|2,0,0]=4 9160 B12R0.248 COC(=O)CCCCSCCCF 62a_100000204269_100011934791 [2,0,0,0,0,0|2,0,0]=4 9161 B12R0.248 COC(=O)CCCCSCCCF 62a_100011934791_100000204269 [2,0,0,0,0,0|2,0,0]=4 9162 B12R0.248 COC(=O)CCCCSCCCO 62a_100000204269_100011215043 [2,0,0,0,0,0|2,0,0]=4 9163 B12R0.248 COC(=O)CCCCSCCCO 62a_100011215043_100000204269 [2,0,0,0,0,0|2,0,0]=4 9164 B12R0.248 COC(=O)CCCCSCCSC 62a_100000204269_100000751147 [2,0,0,0,0,0|2,0,0]=4 9165 B12R0.248 COC(=O)CCCCSCCSC 62a_100000212216_100000204269 [2,0,0,0,0,0|2,0,0]=4 9166 B12R0.248 COC(=O)CCCNCCCCO 2230a_100000750430_100011218270 [2,0,0,0,0,0|2,0,0]=4 9167 B12R0.248 COC(=O)CCCNCCCCO 34a_100000750430_100000742333 [2,0,0,0,0,0|2,0,0]=4 9168 B12R0.248 COC(=O)CCCNCCCSC 2230a_100000749238_100011218270 [2,0,0,0,0,0|2,0,0]=4 9169 B12R0.248 COC(=O)CCCOCCCCBr 34a_100011216708_100000742333 [2,0,0,0,0,0|2,0,0]=4 9170 B12R0.248 COC(=O)CCCOCCCCCl 34a_100000210776_100000742333 [2,0,0,0,0,0|2,0,0]=4 9171 B12R0.248 COC(=O)CCCOCCCCCl 7a_100000210776_100011218270 [2,0,0,0,0,0|2,0,0]=4 9172 B12R0.248 COC(=O)CCCOCCCCF 34a_100011995726_100000742333 [2,0,0,0,0,0|2,0,0]=4 9173 B12R0.248 COC(=O)CCCOCCCCF 7a_100011995726_100011218270 [2,0,0,0,0,0|2,0,0]=4 9174 B12R0.248 COC(=O)CCCOCCCCI 34a_200012148704_100000742333 [2,0,0,0,0,0|2,0,0]=4 9175 B12R0.248 COC(=O)CCCOCCCCN 34a_100000750430_100000742333 [2,0,0,0,0,0|2,0,0]=4 9176 B12R0.248 COC(=O)CCCOCCCSC 34a_100000690336_100000742333 [2,0,0,0,0,0|2,0,0]=4 9177 B12R0.248 COC(=O)CCCOCCCSC 7a_100000690336_100011218270 [2,0,0,0,0,0|2,0,0]=4 9178 B12R0.248 COC(=O)CCCSCCCCF 62a_100000729493_100011218270 [2,0,0,0,0,0|2,0,0]=4 9179 B12R0.248 COC(=O)CCCSCCCCF 62a_100011218270_100000729493 [2,0,0,0,0,0|2,0,0]=4 9180 B12R0.248 COC(=O)CCCSCCCCO 62a_100000210776_100011218270 [2,0,0,0,0,0|2,0,0]=4 9181 B12R0.248 COC(=O)CCCSCCCCO 62a_100011218270_100000210776 [2,0,0,0,0,0|2,0,0]=4 9182 B12R0.248 COC(=O)CCNCCCCCO 2230a_100000762737_100000204255 [2,0,0,0,0,0|2,0,0]=4 9183 B12R0.248 COC(=O)CCNCCCCCO 34a_100000762737_100000742370 [2,0,0,0,0,0|2,0,0]=4 9184 B12R0.248 COC(=O)CCOCCCCCBr 34a_100000746331_100000742370 [2,0,0,0,0,0|2,0,0]=4 9185 B12R0.248 COC(=O)CCOCCCCCBr 7a_100000746331_100000204255 [2,0,0,0,0,0|2,0,0]=4 9186 B12R0.248 COC(=O)CCOCCCCCCl 34a_100000746330_100000742370 [2,0,0,0,0,0|2,0,0]=4 9187 B12R0.248 COC(=O)CCOCCCCCCl 7a_100000746330_100000204255 [2,0,0,0,0,0|2,0,0]=4 9188 B12R0.248 COC(=O)CCOCCCCCI 34a_200012148887_100000742370 [2,0,0,0,0,0|2,0,0]=4 9189 B12R0.248 COC(=O)CCOCCCCCI 7a_200012148887_100000204255 [2,0,0,0,0,0|2,0,0]=4 9190 B12R0.248 COC(=O)CCOCCCCCN 34a_100000762737_100000742370 [2,0,0,0,0,0|2,0,0]=4 9191 B12R0.248 COC(=O)CCOCCCCSC 34a_100011217163_100000742370 [2,0,0,0,0,0|2,0,0]=4 9192 B12R0.248 COC(=O)CCOCCCCSC 7a_100011217163_100000204255 [2,0,0,0,0,0|2,0,0]=4 9193 B12R0.248 COC(=O)CCSCCCCCF 62a_100000204255_100000729378 [2,0,0,0,0,0|2,0,0]=4 9194 B12R0.248 COC(=O)CCSCCCCCF 62a_100000729378_100000204255 [2,0,0,0,0,0|2,0,0]=4 9195 B12R0.248 COC(=O)CCSCCCCCO 62a_100000204255_100000746330 [2,0,0,0,0,0|2,0,0]=4 9196 B12R0.248 COC(=O)CCSCCCCCO 62a_100000746330_100000204255 [2,0,0,0,0,0|2,0,0]=4 9197 B12R0.248 COC(=O)CNCCCCCCO 2230a_100000686447_100000747449 [2,0,0,0,0,0|2,0,0]=4 9198 B12R0.248 COC(=O)CNCCCCCCO 34a_100000686447_100000747449 [2,0,0,0,0,0|2,0,0]=4 9199 B12R0.248 COC(=O)COCCCCCCBr 34a_100011215345_100000747449 [2,0,0,0,0,0|2,0,0]=4 9200 B12R0.248 COC(=O)COCCCCCCBr 7a_100011215345_100000747449 [2,0,0,0,0,0|2,0,0]=4 9201 B12R0.248 COC(=O)COCCCCCCCl 34a_100000766143_100000747449 [2,0,0,0,0,0|2,0,0]=4 9202 B12R0.248 COC(=O)COCCCCCCCl 7a_100000766143_100000747449 [2,0,0,0,0,0|2,0,0]=4 9203 B12R0.248 COC(=O)COCCCCCCF 34a_100000732779_100000747449 [2,0,0,0,0,0|2,0,0]=4 9204 B12R0.248 COC(=O)COCCCCCCF 7a_100000732779_100000747449 [2,0,0,0,0,0|2,0,0]=4 9205 B12R0.248 COC(=O)COCCCCCCN 34a_100000686447_100000747449 [2,0,0,0,0,0|2,0,0]=4 9206 B12R0.248 COC(=O)CSCCCCCCF 62a_100000747449_100015922095 [2,0,0,0,0,0|2,0,0]=4 9207 B12R0.248 COC(=O)CSCCCCCCF 62a_100015922095_100000747449 [2,0,0,0,0,0|2,0,0]=4 9208 B12R0.248 COC(=O)CSCCCCCCO 62a_100000747449_100000766143 [2,0,0,0,0,0|2,0,0]=4 9209 B12R0.248 COC(=O)CSCCCCCCO 62a_100000766143_100000747449 [2,0,0,0,0,0|2,0,0]=4 9210 B12R0.248 COCCCCCCCC(=O)OC 34a_100011022521_200000210301 [2,0,0,0,0,0|1,0,0]=3 9211 B12R0.248 COCCCCCCCC(=O)OC 34a_100138415774_100010004213 [2,0,0,0,0,0|1,0,0]=3 9212 B12R0.248 COCCCCCCCC(=O)OC 7a_100011022521_200000210301 [2,0,0,0,0,0|1,0,0]=3 9213 B12R0.248 COCCCCCNCC(=O)OC 2230a_100000747528_100000747449 [2,0,0,0,0,0|2,0,0]=4 9214 B12R0.248 COCCCCCNCC(=O)OC 34a_100000747528_100000747449 [2,0,0,0,0,0|2,0,0]=4 9215 B12R0.248 COCCCCOCCC(=O)OC 34a_100000740925_100000742370 [2,0,0,0,0,0|2,0,0]=4 9216 B12R0.248 COCCCCSCCC(=O)OC 62a_100000204255_100000730899 [2,0,0,0,0,0|2,0,0]=4 9217 B12R0.248 COCCCCSCCC(=O)OC 62a_100000730899_100000204255 [2,0,0,0,0,0|2,0,0]=4 9218 B12R0.248 COCCCNCCCC(=O)OC 34a_100150723488_100000742333 [2,0,0,0,0,0|2,0,0]=4 9219 B12R0.248 COCCCOCCCC(=O)OC 34a_100000740835_100000742333 [2,0,0,0,0,0|2,0,0]=4 9220 B12R0.248 COCCCSCCCC(=O)OC 62a_100000709357_100011218270 [2,0,0,0,0,0|2,0,0]=4 9221 B12R0.248 COCCCSCCCC(=O)OC 62a_100011218270_100000709357 [2,0,0,0,0,0|2,0,0]=4 9222 B12R0.248 COCCNCCCCC(=O)OC 2230a_100000209980_100000204269 [2,0,0,0,0,0|2,0,0]=4 9223 B12R0.248 COCCOCCCCC(=O)OC 34a_100000059025_100011201679 [2,0,0,0,0,0|2,0,0]=4 9224 B12R0.248 COCCOCCCCC(=O)OC 34a_100000210237_100000204269 [2,0,0,0,0,0|2,0,0]=4 9225 B12R0.248 COCCOCCCCC(=O)OC 7a_100000059025_100000233755 [2,0,0,0,0,0|2,0,0]=4 9226 B12R0.248 COCCSCCCCC(=O)OC 62a_100000204269_100000233755 [2,0,0,0,0,0|2,0,0]=4 9227 B12R0.248 COCCSCCCCC(=O)OC 62a_100000233755_100000204269 [2,0,0,0,0,0|2,0,0]=4 9228 B12R0.248 COCSCCCCCC(=O)OC 62a_100000766300_100009816466 [2,0,0,0,0,0|2,0,0]=4 9229 B12R0.248 COCSCCCCCC(=O)OC 62a_100009816466_100000766300 [2,0,0,0,0,0|2,0,0]=4 9230 B14R0.2 C=C(C)CCOC(C)CCCCCCC 34a_100000764851_200011218727 [1,1,0,0,0,0|2,0,0]=4 9231 B14R0.2 C=C(C)CCOC(C)CCCCCCC 34a_200011215852_100000730704 [1,1,0,0,0,0|2,0,0]=4 9232 B14R0.2 C=C(C)CCOC(C)CCCCCCC 7a_200011215852_100000730704 [1,1,0,0,0,0|2,0,0]=4 9233 B14R0.2 C=C(C)CCSC(C)CCCCCCC 62a_100000730704_200011218727 [1,1,0,0,0,0|2,0,0]=4 9234 B14R0.2 C=C(C)CCSC(C)CCCCCCC 62a_200011218727_100000730704 [1,1,0,0,0,0|2,0,0]=4 9235 B14R0.2 CC(=O)CCCC(=O)CCCCCCO 1458a_100011996774_100011215641 [1,1,0,0,0,0|1,0,1]=4 9236 B14R0.2 CCCCCCCC(=O)CCCC(=O)C 1458a_100000211969_100011215641 [1,1,0,0,0,0|0,0,1]=3 9237 B14R0.2 CCCCCCCC(=O)CCCC(=O)N 1458a_100000211969_100102525003 [1,1,0,0,0,0|1,0,1]=4 9238 B14R0.2 CCCCCCCC(=O)CCNC(=O)C 1458a_100000183196_100000210614 [1,1,0,0,0,0|1,0,1]=4 9239 B14R0.2 CCCCCCCC(=O)CCNC(=O)C 1458a_100000211969_100000189650 [1,1,0,0,0,0|1,0,1]=4 9240 B14R0.2 CCCCCCCC(=O)CCOC(=O)C 1458a_100000211969_100009814007 [1,1,0,0,0,0|1,0,1]=4 9241 B14R0.2 CCCCCCCC(=O)CCSC(=O)C 1458a_100000048949_100000210614 [1,1,0,0,0,0|1,0,1]=4 9242 B14R0.2 CCCCCCCC(C)NOCC(=O)O 269956a_100000106656_200011218727 [1,1,0,0,0,0|2,0,0]=4 9243 B14R0.2 CCCCCCCC(C)OCCC(=O)C 34a_100000759926_200011218727 [1,1,0,0,0,0|1,0,0]=3 9244 B14R0.2 CCCCCCCC(C)OCCC(=O)C 7a_100000759926_200011218727 [1,1,0,0,0,0|1,0,0]=3 9245 B14R0.2 CCCCCCCC(C)OCCC(=O)C 7a_200011215852_100000053229 [1,1,0,0,0,0|1,0,0]=3 9246 B14R0.2 CCCCCCCC(C)OCCC(=O)N 34a_100000757172_200011218727 [1,1,0,0,0,0|2,0,0]=4 9247 B14R0.2 CCCCCCCC(C)OCCC(=O)N 34a_200011215852_100000731001 [1,1,0,0,0,0|2,0,0]=4 9248 B14R0.2 CCCCCCCC(C)OCCC(=O)N 7a_100000757172_200011218727 [1,1,0,0,0,0|2,0,0]=4 9249 B14R0.2 CCCCCCCC(C)OCCC(=O)N 7a_200011215852_100000744528 [1,1,0,0,0,0|2,0,0]=4 9250 B14R0.2 CCCCCCCC(C)OCOC(=O)C 34a_200011215852_100009813279 [1,1,0,0,0,0|2,0,0]=4 9251 B14R0.2 CCCCCCCC(C)SCCC(=O)C 62a_100000053229_200011218727 [1,1,0,0,0,0|1,0,0]=3 9252 B14R0.2 CCCCCCCC(C)SCCC(=O)C 62a_200011218727_100000053229 [1,1,0,0,0,0|1,0,0]=3 9253 B14R0.2 CCCCCCCC(C)SCCC(=O)N 62a_100000744528_200011218727 [1,1,0,0,0,0|2,0,0]=4 9254 B14R0.2 CCCCCCCC(C)SCCC(=O)N 62a_200011218727_100000744528 [1,1,0,0,0,0|2,0,0]=4 9255 B14R0.2 CCCCCCCC(C)SCOC(=O)C 62a_100000076356_200011218727 [1,1,0,0,0,0|2,0,0]=4 9256 B14R0.2 CCCCCCCC(C)SCOC(=O)C 62a_200011218727_100000076356 [1,1,0,0,0,0|2,0,0]=4 9257 B14R0.2 CCCCCCCN(C)CCCC(=O)C 269982a_100000228206_100011215641 [1,1,0,0,0,0|1,0,0]=3 9258 B14R0.2 CCCCCCCN(C)CCCC(=O)N 269982a_100000228206_100102525003 [1,1,0,0,0,0|2,0,0]=4 9259 B14R0.2 CCCCCCCN(C)CCCC(=O)O 269956a_100000719178_100000210614 [1,1,0,0,0,0|1,0,0]=3 9260 B14R0.2 CCCCCCCN(C)CCNC(=O)C 2230a_100000228206_100000189650 [1,1,0,0,0,0|2,0,0]=4 9261 B14R0.2 CCCCCCCN(C)CCNC(=O)C 269982a_100000228206_100000189650 [1,1,0,0,0,0|2,0,0]=4 9262 B14R0.2 CCCCCCCN(C)CCOC(=O)C 269982a_100000228206_100009814007 [1,1,0,0,0,0|2,0,0]=4 9263 B14R0.2 CCCCCCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210314 [1,1,0,0,0,0|1,0,1]=4 9264 B14R0.2 CCCCOCCN(C)CCCC(=O)O 269956a_100000719178_100000743108 [1,1,0,0,0,0|2,0,0]=4 9265 B14R0.2 CN(CCCCCCF)CCCC(=O)O 269956a_100000719178_100015922095 [1,1,0,0,0,0|2,0,0]=4 9266 B14R0.2 CN(CCCCCCO)CCCC(=O)O 269956a_100000719178_100000766143 [1,1,0,0,0,0|2,0,0]=4 9267 B14R0.2 COCCCCCC(=O)CCCC(=O)C 1458a_100011935119_100011215641 [1,1,0,0,0,0|1,0,1]=4 9268 B14R0.68 C=C(C)CCNCCCCCCC(C)C 2230a_100000211014_100000730704 [1,1,0,0,0,0|2,0,0]=4 9269 B14R0.68 C=C(C)CCNCCCCCCC(C)C 34a_100000211014_100000730704 [1,1,0,0,0,0|2,0,0]=4 9270 B14R0.68 C=C(C)COCCCCCCCC(C)C 34a_200000210741_100000748629 [1,1,0,0,0,0|2,0,0]=4 9271 B14R0.68 C=C(C)COCCCCCCCC(C)C 7a_200000210741_100000748629 [1,1,0,0,0,0|2,0,0]=4 9272 B14R0.68 CC(=O)CCCCNCCCOC(C)C 34a_100000737246_100009817362 [1,1,0,0,0,0|2,0,0]=4 9273 B14R0.68 CC(=O)CCCCOCCCCC(C)C 34a_100011214890_100009817362 [1,1,0,0,0,0|1,0,0]=3 9274 B14R0.68 CC(=O)CCCCOCCCCC(C)C 7a_100011214890_100000735457 [1,1,0,0,0,0|1,0,0]=3 9275 B14R0.68 CC(=O)CCCCOCCCNC(C)C 34a_100000182298_100009817362 [1,1,0,0,0,0|2,0,0]=4 9276 B14R0.68 CC(=O)CCCCOCCNCC(C)C 34a_100015185251_100009817362 [1,1,0,0,0,0|2,0,0]=4 9277 B14R0.68 CC(=O)CCCCOCCOCC(C)C 34a_100000703358_100009817362 [1,1,0,0,0,0|2,0,0]=4 9278 B14R0.68 CC(=O)CCCCOCCOCC(C)C 7a_100000703358_100000735457 [1,1,0,0,0,0|2,0,0]=4 9279 B14R0.68 CC(=O)CCCCOCCSCC(C)C 34a_200000230437_100009817362 [1,1,0,0,0,0|2,0,0]=4 9280 B14R0.68 CC(=O)CCCCOCCSCC(C)C 7a_200000230437_100000735457 [1,1,0,0,0,0|2,0,0]=4 9281 B14R0.68 CC(=O)CCCCSCCCCC(=O)C 62a_100000735457_100000735457 [1,1,0,0,0,0|1,0,1]=4 9282 B14R0.68 CC(=O)CCCCSCCCCC(C)C 62a_100000735457_100011216152 [1,1,0,0,0,0|1,0,0]=3 9283 B14R0.68 CC(=O)CCCCSCCCCC(C)C 62a_100011216152_100000735457 [1,1,0,0,0,0|1,0,0]=3 9284 B14R0.68 CC(=O)CCCCSCCCCN(C)C 62a_100000735457_100000690147 [1,1,0,0,0,0|2,0,0]=4 9285 B14R0.68 CC(=O)CCCNCCCCCC(C)C 34a_100011290863_100000685027 [1,1,0,0,0,0|1,0,0]=3 9286 B14R0.68 CC(=O)CCCNCCCOCC(C)C 34a_100000205972_100000685027 [1,1,0,0,0,0|2,0,0]=4 9287 B14R0.68 CC(=O)CCCOCCCCCC(C)C 34a_100000759063_100000210682 [1,1,0,0,0,0|1,0,0]=3 9288 B14R0.68 CC(=O)CCCOCCCCCC(C)C 34a_100011995859_100000685027 [1,1,0,0,0,0|1,0,0]=3 9289 B14R0.68 CC(=O)CCCOCCCCCC(C)C 7a_100000759063_100000210682 [1,1,0,0,0,0|1,0,0]=3 9290 B14R0.68 CC(=O)CCCOCCCCCC(C)C 7a_100011995859_100011215641 [1,1,0,0,0,0|1,0,0]=3 9291 B14R0.68 CC(=O)CCCOCCCCNC(C)C 34a_100011521146_100000685027 [1,1,0,0,0,0|2,0,0]=4 9292 B14R0.68 CC(=O)CCCSCCCCCC(C)C 62a_100000210682_100011215641 [1,1,0,0,0,0|1,0,0]=3 9293 B14R0.68 CC(=O)CCCSCCCCCC(C)C 62a_100011215641_100000210682 [1,1,0,0,0,0|1,0,0]=3 9294 B14R0.68 CC(=O)NCCCCCCNCC(C)C 2230a_200011996284_100000210760 [1,1,0,0,0,0|2,0,0]=4 9295 B14R0.68 CC(=O)NCCCCCCNCC(C)C 270004a_200011996284_100000210432 [1,1,0,0,0,0|2,0,0]=4 9296 B14R0.68 CC(=O)NCCCCCCNCC(C)C 34a_200011996284_100000210624 [1,1,0,0,0,0|2,0,0]=4 9297 B14R0.68 CC(=O)NCCCCCCNCC(C)O 2230a_200011996284_100011218427 [1,1,0,0,0,0|2,0,0]=4 9298 B14R0.68 CC(=O)NCCCCCCNCC(C)O 34a_200011996284_100011218427 [1,1,0,0,0,0|2,0,0]=4 9299 B14R0.68 CC(=O)NCCCCCCNC[C@@H](C)O 2230a_200011996284_100009817552 [1,1,0,0,0,0|2,0,0]=4 9300 B14R0.68 CC(=O)NCCCCCCNC[C@@H](C)O 34a_200011996284_100009817552 [1,1,0,0,0,0|2,0,0]=4 9301 B14R0.68 CC(=O)NCCCCCNCCC(C)C 2230a_200012022750_100000210312 [1,1,0,0,0,0|2,0,0]=4 9302 B14R0.68 CC(=O)NCCCCCNCCC(C)C 269862a_200012022750_100000185833 [1,1,0,0,0,0|2,0,0]=4 9303 B14R0.68 CC(=O)NCCCCCNCCC(C)C 34a_200012022750_100000210312 [1,1,0,0,0,0|2,0,0]=4 9304 B14R0.68 CC(=O)NCCCCCNCCC(C)O 2230a_200012022750_100012276601 [1,1,0,0,0,0|2,0,0]=4 9305 B14R0.68 CC(=O)NCCCCCNCCC(C)O 34a_200012022750_100012276601 [1,1,0,0,0,0|2,0,0]=4 9306 B14R0.68 CC(=O)NCCCCNCCCC(C)C 2230a_200011368371_100011214892 [1,1,0,0,0,0|2,0,0]=4 9307 B14R0.68 CC(=O)NCCCCNCCCC(C)C 34a_200011368371_100011214892 [1,1,0,0,0,0|2,0,0]=4 9308 B14R0.68 CC(=O)NCCCCNCCCC(C)O 2230a_200011368371_200000718107 [1,1,0,0,0,0|2,0,0]=4 9309 B14R0.68 CC(=O)NCCCCNCCCC(C)O 34a_200011368371_200000718107 [1,1,0,0,0,0|2,0,0]=4 9310 B14R0.68 CC(=O)NCCCNCCCCC(C)C 34a_100000736810_100011216152 [1,1,0,0,0,0|2,0,0]=4 9311 B14R0.68 CC(=O)NCCCOCCCCC(C)C 34a_100000752032_100011216152 [1,1,0,0,0,0|2,0,0]=4 9312 B14R0.68 CC(=O)NCCNCCCCCC(C)C 2230a_100000209853_100000210682 [1,1,0,0,0,0|2,0,0]=4 9313 B14R0.68 CC(=O)NCCNCCCCCC(C)C 2230a_100011290863_100000189650 [1,1,0,0,0,0|2,0,0]=4 9314 B14R0.68 CC(=O)NCCOCCCCCC(C)C 34a_100000158858_100000210682 [1,1,0,0,0,0|2,0,0]=4 9315 B14R0.68 CC(=O)NCCOCCCCCC(C)C 7a_100011995859_100000189650 [1,1,0,0,0,0|2,0,0]=4 9316 B14R0.68 CC(=O)NCCSCCCCCC(C)C 62a_100000189650_100000210682 [1,1,0,0,0,0|2,0,0]=4 9317 B14R0.68 CC(=O)NCCSCCCCCC(C)C 62a_100000210682_100000189650 [1,1,0,0,0,0|2,0,0]=4 9318 B14R0.68 CC(=O)OCCCCCNCCC(C)O 2230a_200000755665_100009813381 [1,1,0,0,0,0|2,0,0]=4 9319 B14R0.68 CC(=O)OCCCCCOCCC(C)Br 34a_100009893172_100000033007 [1,1,0,0,0,0|2,0,0]=4 9320 B14R0.68 CC(=O)OCCCCCOCCC(C)C 34a_100000210254_100000033007 [1,1,0,0,0,0|2,0,0]=4 9321 B14R0.68 CC(=O)OCCCCCOCCC(C)C 7a_100000210254_100000033007 [1,1,0,0,0,0|2,0,0]=4 9322 B14R0.68 CC(=O)OCCCCCOCC[C@@H](C)N 34a_100000706166_100000033007 [1,1,0,0,0,0|2,0,0]=4 9323 B14R0.68 CC(=O)OCCCCCSCCC(C)C 62a_100000033007_100000210312 [1,1,0,0,0,0|2,0,0]=4 9324 B14R0.68 CC(=O)OCCCCCSCCC(C)C 62a_100000210312_100000033007 [1,1,0,0,0,0|2,0,0]=4 9325 B14R0.68 CC(=O)OCCCCCSCCC(C)O 62a_100000033007_100012276601 [1,1,0,0,0,0|2,0,0]=4 9326 B14R0.68 CC(=O)OCCCCCSCCC(C)O 62a_100012276601_100000033007 [1,1,0,0,0,0|2,0,0]=4 9327 B14R0.68 CC(=O)OCCCCNCCCC(C)C 34a_200000737386_100000033659 [1,1,0,0,0,0|2,0,0]=4 9328 B14R0.68 CC(=O)OCCCCOCCCC(C)C 34a_100000073216_100011214892 [1,1,0,0,0,0|2,0,0]=4 9329 B14R0.68 CC(=O)OCCCCOCCCC(C)C 34a_100000210774_100000033659 [1,1,0,0,0,0|2,0,0]=4 9330 B14R0.68 CC(=O)OCCCCOCCCC(C)C 7a_100000073216_100011214892 [1,1,0,0,0,0|2,0,0]=4 9331 B14R0.68 CC(=O)OCCCCOCCCC(C)C 7a_100000210774_100000033659 [1,1,0,0,0,0|2,0,0]=4 9332 B14R0.68 CC(=O)OCCCCOCCCC(C)O 34a_100000073216_200000718107 [1,1,0,0,0,0|2,0,0]=4 9333 B14R0.68 CC(=O)OCCCCOCCCC(C)O 7a_100000073216_200000718107 [1,1,0,0,0,0|2,0,0]=4 9334 B14R0.68 CC(=O)OCCCCSCCCC(C)C 62a_100000033659_100011214892 [1,1,0,0,0,0|2,0,0]=4 9335 B14R0.68 CC(=O)OCCCCSCCCC(C)C 62a_100011214892_100000033659 [1,1,0,0,0,0|2,0,0]=4 9336 B14R0.68 CC(=O)OCCCCSCCCC(C)O 62a_100000033659_200000718107 [1,1,0,0,0,0|2,0,0]=4 9337 B14R0.68 CC(=O)OCCCCSCCCC(C)O 62a_200000718107_100000033659 [1,1,0,0,0,0|2,0,0]=4 9338 B14R0.68 CC(=O)OCCCOCCCCC(C)C 34a_100011214890_100000042594 [1,1,0,0,0,0|2,0,0]=4 9339 B14R0.68 CC(=O)OCCCOCCCCC(C)C 7a_100011214890_100000042594 [1,1,0,0,0,0|2,0,0]=4 9340 B14R0.68 CC(=O)OCCCSCCCCC(C)C 62a_100000042594_100011216152 [1,1,0,0,0,0|2,0,0]=4 9341 B14R0.68 CC(=O)OCCCSCCCCC(C)C 62a_100011216152_100000042594 [1,1,0,0,0,0|2,0,0]=4 9342 B14R0.68 CC(=O)OCCNCCCCCC(C)C 34a_100011290863_100009814007 [1,1,0,0,0,0|2,0,0]=4 9343 B14R0.68 CC(=O)OCCOCCCCCC(C)C 34a_100011995859_100009814007 [1,1,0,0,0,0|2,0,0]=4 9344 B14R0.68 CC(=O)OCCOCCCCCC(C)C 7a_100011995859_100009814007 [1,1,0,0,0,0|2,0,0]=4 9345 B14R0.68 CC(=O)OCCSCCCCCC(C)C 62a_100000210682_100009814007 [1,1,0,0,0,0|2,0,0]=4 9346 B14R0.68 CC(=O)OCCSCCCCCC(C)C 62a_100009814007_100000210682 [1,1,0,0,0,0|2,0,0]=4 9347 B14R0.68 CC(=O)OCNCCCCCCC(C)C 34a_100000211014_100009813279 [1,1,0,0,0,0|2,0,0]=4 9348 B14R0.68 CC(=O)SCCCCCCNCC(C)C 270004a_100000704104_100000210432 [1,1,0,0,0,0|2,0,0]=4 9349 B14R0.68 CC(=O)SCCCCNCCCC(C)C 2230a_200000737386_200010402107 [1,1,0,0,0,0|2,0,0]=4 9350 B14R0.68 CC(=O)SCCCCNCCCC(C)C 34a_200000737386_200010402107 [1,1,0,0,0,0|2,0,0]=4 9351 B14R0.68 CC(=O)SCCCCOCCCC(C)C 34a_100000210774_200010402107 [1,1,0,0,0,0|2,0,0]=4 9352 B14R0.68 CC(=O)SCCCCOCCCC(C)C 7a_100000210774_200010402107 [1,1,0,0,0,0|2,0,0]=4 9353 B14R0.68 CC(=O)SCCCCSCCCC(C)C 62a_100011214892_200010402107 [1,1,0,0,0,0|2,0,0]=4 9354 B14R0.68 CC(=O)SCCCCSCCCC(C)C 62a_200010402107_100011214892 [1,1,0,0,0,0|2,0,0]=4 9355 B14R0.68 CC(=O)SCCCCSCCCC(C)O 62a_200000718107_200010402107 [1,1,0,0,0,0|2,0,0]=4 9356 B14R0.68 CC(=O)SCCCCSCCCC(C)O 62a_200010402107_200000718107 [1,1,0,0,0,0|2,0,0]=4 9357 B14R0.68 CC(=O)SCCCOCCCCC(C)C 34a_100011214890_100000038929 [1,1,0,0,0,0|2,0,0]=4 9358 B14R0.68 CC(=O)SCCCOCCCCC(C)C 7a_100011214890_100000038929 [1,1,0,0,0,0|2,0,0]=4 9359 B14R0.68 CC(=O)SCCCSCCCCC(C)C 62a_100000038929_100011216152 [1,1,0,0,0,0|2,0,0]=4 9360 B14R0.68 CC(=O)SCCCSCCCCC(C)C 62a_100011216152_100000038929 [1,1,0,0,0,0|2,0,0]=4 9361 B14R0.68 CC(C)CCCCCCCOCC(=O)N 34a_200000210741_100000187820 [1,1,0,0,0,0|2,0,0]=4 9362 B14R0.68 CC(C)CCCCCCCOCC(=O)N 7a_200000210741_100000187820 [1,1,0,0,0,0|2,0,0]=4 9363 B14R0.68 CC(C)CCCCCCCOCC(=O)[O-] 34a_200000210741_100020667443 [1,1,0,0,0,0|1,0,1]=4 9364 B14R0.68 CC(C)CCCCCCNCCC(=O)N 2230a_100000211014_100000744528 [1,1,0,0,0,0|2,0,0]=4 9365 B14R0.68 CC(C)CCCCCCNCCC(=O)N 34a_100000211014_100000731001 [1,1,0,0,0,0|2,0,0]=4 9366 B14R0.68 CC(C)CCCCCNCCCC(=O)N 34a_100000739312_100000210682 [1,1,0,0,0,0|2,0,0]=4 9367 B14R0.68 CC(C)CCCCCNCCCC(=O)N 34a_100011290863_100102525003 [1,1,0,0,0,0|2,0,0]=4 9368 B14R0.68 CC(C)CCCCCNCCCS(=O)C 2230a_200000753449_100000210682 [1,1,0,0,0,0|2,0,0]=4 9369 B14R0.68 CC(C)CCCCCOCCCC(=O)N 34a_100011995859_100102525003 [1,1,0,0,0,0|2,0,0]=4 9370 B14R0.68 CC(C)CCCCCOCCCC(=O)N 7a_100011995859_100102525003 [1,1,0,0,0,0|2,0,0]=4 9371 B14R0.68 CC(C)CCCCCSCCCC(=O)N 62a_100000210682_100102525003 [1,1,0,0,0,0|2,0,0]=4 9372 B14R0.68 CC(C)CCCCCSCCCC(=O)N 62a_100102525003_100000210682 [1,1,0,0,0,0|2,0,0]=4 9373 B14R0.68 CC(C)CCCCNCCCCC(=O)N 34a_100000696515_100011216152 [1,1,0,0,0,0|2,0,0]=4 9374 B14R0.68 CC(C)CCCCNCCOCC(=O)O 269956a_100000700818_100011216152 [1,1,0,0,0,0|2,0,0]=4 9375 B14R0.68 CC(C)CCCCOCCCCC(=O)N 34a_100012022536_100011216152 [1,1,0,0,0,0|2,0,0]=4 9376 B14R0.68 CC(C)CCCCOCCCCC(=O)N 7a_100012022536_100011216152 [1,1,0,0,0,0|2,0,0]=4 9377 B14R0.68 CC(C)CCCNCCCCCC(=O)N 2230a_200000737386_100009817443 [1,1,0,0,0,0|2,0,0]=4 9378 B14R0.68 CC(C)CCCNCCCCCC(=O)N 34a_200000737386_100009817443 [1,1,0,0,0,0|2,0,0]=4 9379 B14R0.68 CC(C)CCCOCCCCCC(=O)N 34a_100000123541_100011214892 [1,1,0,0,0,0|2,0,0]=4 9380 B14R0.68 CC(C)CCCOCCCCCC(=O)N 34a_100000210774_100009817443 [1,1,0,0,0,0|2,0,0]=4 9381 B14R0.68 CC(C)CCCOCCCCCC(=O)N 7a_100000123541_100011214892 [1,1,0,0,0,0|2,0,0]=4 9382 B14R0.68 CC(C)CCCOCCCCCC(=O)N 7a_100000210774_100009817443 [1,1,0,0,0,0|2,0,0]=4 9383 B14R0.68 CC(C)CCCOCCCCCC(=O)[O-] 7a_100102619762_100011214892 [1,1,0,0,0,0|1,0,1]=4 9384 B14R0.68 CC(C)CCCSCCCCCC(=O)N 62a_100009817443_100011214892 [1,1,0,0,0,0|2,0,0]=4 9385 B14R0.68 CC(C)CCCSCCCCCC(=O)N 62a_100011214892_100009817443 [1,1,0,0,0,0|2,0,0]=4 9386 B14R0.68 CC(O)CCCOCCCCCC(=O)N 34a_100000123541_200000718107 [1,1,0,0,0,0|2,0,0]=4 9387 B14R0.68 CC(O)CCCOCCCCCC(=O)N 7a_100000123541_200000718107 [1,1,0,0,0,0|2,0,0]=4 9388 B14R0.68 CC(O)CCCOCCCCCC(=O)[O-] 7a_100102619762_200000718107 [1,1,0,0,0,0|1,0,1]=4 9389 B14R0.68 CC(O)CCCSCCCCCC(=O)N 62a_100009817443_200000718107 [1,1,0,0,0,0|2,0,0]=4 9390 B14R0.68 CC(O)CCCSCCCCCC(=O)N 62a_200000718107_100009817443 [1,1,0,0,0,0|2,0,0]=4 9391 B14R0.88 CCCCCCCCCCNS(=O)(=O)C 40a_100000684558_100000738038 [1,1,0,0,0,0|2,0,0]=4 9392 B14R0.88 CCCCCCCCNCCS(=O)(=O)C 2230a_100000229939_100000731031 [1,1,0,0,0,0|2,0,0]=4 9393 B14R0.88 CCCCCCCCNCCS(=O)(=O)C 2230a_100000740961_100000210759 [1,1,0,0,0,0|2,0,0]=4 9394 B14R0.88 CCCCCCCCNCCS(=O)(=O)C 34a_100000229939_100000731031 [1,1,0,0,0,0|2,0,0]=4 9395 B14R0.88 CCCCCCCCNCCS(=O)(=O)C 34a_100000740961_100000210759 [1,1,0,0,0,0|2,0,0]=4 9396 B14R0.88 CCCCCCCCOCCS(=O)(=O)C 34a_100000210232_100000731031 [1,1,0,0,0,0|2,0,0]=4 9397 B14R0.88 CCCCCCCCOCCS(=O)(=O)C 34a_100000211924_100000210759 [1,1,0,0,0,0|2,0,0]=4 9398 B14R0.88 CCCCCCCCOCCS(=O)(=O)C 7a_100000210232_100000230027 [1,1,0,0,0,0|2,0,0]=4 9399 B14R0.88 CCCCCCCCOCCS(=O)(=O)C 7a_100000211924_100000210759 [1,1,0,0,0,0|2,0,0]=4 9400 B14R0.88 CCCCCCCCSCCS(=O)(=O)C 62a_100000210759_100000230027 [1,1,0,0,0,0|2,0,0]=4 9401 B14R0.88 CCCCCCCCSCCS(=O)(=O)C 62a_100000731031_100000210317 [1,1,0,0,0,0|2,0,0]=4 9402 B14R0.88 CCCCCCCNCCCS(=O)(=O)C 2230a_100000229938_100000754308 [1,1,0,0,0,0|2,0,0]=4 9403 B14R0.88 CCCCCCCNCCCS(=O)(=O)C 2230a_100000742409_100000210681 [1,1,0,0,0,0|2,0,0]=4 9404 B14R0.88 CCCCCCCNCCCS(=O)(=O)C 34a_100000742409_100000210614 [1,1,0,0,0,0|2,0,0]=4 9405 B14R0.88 CCCCCCCOCCCS(=O)(=O)C 34a_100000210272_100000754308 [1,1,0,0,0,0|2,0,0]=4 9406 B14R0.88 CCCCCCCOCCCS(=O)(=O)C 34a_100000689940_100000210614 [1,1,0,0,0,0|2,0,0]=4 9407 B14R0.88 CCCCCCCOCCCS(=O)(=O)C 7a_100000210272_100000754308 [1,1,0,0,0,0|2,0,0]=4 9408 B14R0.88 CCCCCCCOCCCS(=O)(=O)C 7a_100000689940_100000210614 [1,1,0,0,0,0|2,0,0]=4 9409 B14R0.88 CCCCCCCSCCCS(=O)(=O)C 62a_100000210614_100000754308 [1,1,0,0,0,0|2,0,0]=4 9410 B14R0.88 CCCCCCCSCCCS(=O)(=O)C 62a_100000754308_100000210316 [1,1,0,0,0,0|2,0,0]=4 9411 B14R0.153 C=C(C)COCCCCC(C)CCCC 34a_200011021034_100000748629 [1,1,0,0,0,0|2,0,0]=4 9412 B14R0.153 C=C(C)COCCCCC(C)CCCC 7a_200011021034_100000748629 [1,1,0,0,0,0|2,0,0]=4 9413 B14R0.153 CC(=O)CCCCNC[C@H](C)CCCO 34a_100160569302_100009817362 [1,1,0,0,0,0|2,0,0]=4 9414 B14R0.153 CCCCC(=O)CCCCCNC(=O)C 1458a_100000183861_100000210211 [1,1,0,0,0,0|1,0,1]=4 9415 B14R0.153 CCCCC(=O)CCCCCOC(=O)C 1458a_100000210183_100000033007 [1,1,0,0,0,0|1,0,1]=4 9416 B14R0.153 CCCCC(C)CCCCOCC(=O)N 34a_200011021034_100000187820 [1,1,0,0,0,0|2,0,0]=4 9417 B14R0.153 CCCCC(C)CCCCOCC(=O)N 7a_200011021034_100000187820 [1,1,0,0,0,0|2,0,0]=4 9418 B14R0.153 CCCCC(C)CCCCOCC(=O)[O-] 34a_200011021034_100020667443 [1,1,0,0,0,0|1,0,1]=4 9419 B14R0.153 CCCCC(C)COCCCCC(=O)C 34a_100011995851_100009817362 [1,1,0,0,0,0|1,0,0]=3 9420 B14R0.153 CCCCC(C)COCCCCC(=O)C 7a_100011995851_100000735457 [1,1,0,0,0,0|1,0,0]=3 9421 B14R0.153 CCCCC(C)COCCCOC(=O)C 34a_100011995851_100000042594 [1,1,0,0,0,0|2,0,0]=4 9422 B14R0.153 CCCCC(C)COCCCOC(=O)C 7a_100011995851_100000042594 [1,1,0,0,0,0|2,0,0]=4 9423 B14R0.153 CCCCC(C)COCCCSC(=O)C 34a_100011995851_100000038929 [1,1,0,0,0,0|2,0,0]=4 9424 B14R0.153 CCCCC(C)COCCCSC(=O)C 7a_100011995851_100000038929 [1,1,0,0,0,0|2,0,0]=4 9425 B14R0.153 CCCCC(C)NCCCCCC(=O)N 2230a_100000126638_100009817443 [1,1,0,0,0,0|2,0,0]=4 9426 B14R0.153 CCCCC(C)NCCCCNC(=O)C 2230a_200011368371_200011215066 [1,1,0,0,0,0|2,0,0]=4 9427 B14R0.153 CCCCC(C)NCCCCNC(=O)C 270004a_200011368371_100000210087 [1,1,0,0,0,0|2,0,0]=4 9428 B14R0.153 CCCCC(C)NCCCCNC(=O)C 34a_200011368371_200011215066 [1,1,0,0,0,0|2,0,0]=4 9429 B14R0.153 CCCCC(C)NCCCCSC(=O)C 2230a_100000126638_200010402107 [1,1,0,0,0,0|2,0,0]=4 9430 B14R0.153 CCCCC(C)OCCCCCC(=O)N 34a_100000123541_200011215066 [1,1,0,0,0,0|2,0,0]=4 9431 B14R0.153 CCCCC(C)OCCCCCC(=O)N 34a_100000687866_100009817443 [1,1,0,0,0,0|2,0,0]=4 9432 B14R0.153 CCCCC(C)OCCCCCC(=O)N 7a_100000123541_200011215066 [1,1,0,0,0,0|2,0,0]=4 9433 B14R0.153 CCCCC(C)OCCCCCC(=O)N 7a_100000687866_100009817443 [1,1,0,0,0,0|2,0,0]=4 9434 B14R0.153 CCCCC(C)OCCCCCC(=O)[O-] 7a_100102619762_200011215066 [1,1,0,0,0,0|1,0,1]=4 9435 B14R0.153 CCCCC(C)OCCCCOC(=O)C 34a_100000073216_200011215066 [1,1,0,0,0,0|2,0,0]=4 9436 B14R0.153 CCCCC(C)OCCCCOC(=O)C 34a_100000687866_100000033659 [1,1,0,0,0,0|2,0,0]=4 9437 B14R0.153 CCCCC(C)OCCCCOC(=O)C 7a_100000073216_200011215066 [1,1,0,0,0,0|2,0,0]=4 9438 B14R0.153 CCCCC(C)OCCCCOC(=O)C 7a_100000687866_100000033659 [1,1,0,0,0,0|2,0,0]=4 9439 B14R0.153 CCCCC(C)OCCCCSC(=O)C 34a_100000687866_200010402107 [1,1,0,0,0,0|2,0,0]=4 9440 B14R0.153 CCCCC(C)OCCCCSC(=O)C 7a_100000687866_200010402107 [1,1,0,0,0,0|2,0,0]=4 9441 B14R0.153 CCCCC(C)SCCCCCC(=O)N 62a_100009817443_200011215066 [1,1,0,0,0,0|2,0,0]=4 9442 B14R0.153 CCCCC(C)SCCCCCC(=O)N 62a_200011215066_100009817443 [1,1,0,0,0,0|2,0,0]=4 9443 B14R0.153 CCCCC(C)SCCCCOC(=O)C 62a_100000033659_200011215066 [1,1,0,0,0,0|2,0,0]=4 9444 B14R0.153 CCCCC(C)SCCCCOC(=O)C 62a_200011215066_100000033659 [1,1,0,0,0,0|2,0,0]=4 9445 B14R0.153 CCCCC(C)SCCCCSC(=O)C 62a_200010402107_200011215066 [1,1,0,0,0,0|2,0,0]=4 9446 B14R0.153 CCCCC(C)SCCCCSC(=O)C 62a_200011215066_200010402107 [1,1,0,0,0,0|2,0,0]=4 9447 B14R0.153 CCCCN(C)CCCCCOC(=O)C 2230a_100000207549_100009813381 [1,1,0,0,0,0|2,0,0]=4 9448 B14R0.153 CCCCN(C)CCCCCOC(=O)C 269982a_100000207549_100000033007 [1,1,0,0,0,0|2,0,0]=4 9449 B14R0.153 CCCC[C@H](N)COCCCCC(=O)C 34a_100011934283_100009817362 [1,1,0,0,0,0|1,0,0]=3 9450 B14R0.153 CCCC[C@H](N)COCCCOC(=O)C 34a_100011934283_100000042594 [1,1,0,0,0,0|2,0,0]=4 9451 B14R0.153 CCCC[C@H](N)COCCCSC(=O)C 34a_100011934283_100000038929 [1,1,0,0,0,0|2,0,0]=4 9452 B14R0.153 CCCOC(C)CNCCCCC(=O)C 34a_100015185124_100009817362 [1,1,0,0,0,0|2,0,0]=4 9453 B14R0.153 CCOCC(O)CNCCCCC(=O)C 34a_102515437182_100009817362 [1,1,0,0,0,0|2,0,0]=4 9454 B14R0.153 CSCC[C@H](N)COCCCCC(=O)C 34a_100011827619_100009817362 [1,1,0,0,0,0|2,0,0]=4 9455 B14R0.231 CC(=O)CCCOC[C@@H](N)CCCCN 34a_100016993712_100000685027 [1,1,0,0,0,0|2,0,0]=4 9456 B14R0.231 CCCCCC(=O)CCCCCC(=O)N 1458a_100000212188_100009817443 [1,1,0,0,0,0|1,0,1]=4 9457 B14R0.231 CCCCCC(=O)CCCCOC(=O)C 1458a_100000212188_100000033659 [1,1,0,0,0,0|1,0,1]=4 9458 B14R0.231 CCCCCC(=O)CCCCSC(=O)C 1458a_100000212188_200010402107 [1,1,0,0,0,0|1,0,1]=4 9459 B14R0.231 CCCCCC(=O)COCCCC(=O)C 34a_100000759063_200012276598 [1,1,0,0,0,0|1,0,1]=4 9460 B14R0.231 CCCCCC(=O)COCCCC(=O)C 7a_100000759063_200012276598 [1,1,0,0,0,0|1,0,1]=4 9461 B14R0.231 CCCCCC(=O)CSCCCC(=O)C 62a_100011215641_200012276598 [1,1,0,0,0,0|1,0,1]=4 9462 B14R0.231 CCCCCC(=O)CSCCCC(=O)C 62a_200012276598_100011215641 [1,1,0,0,0,0|1,0,1]=4 9463 B14R0.231 CCCCCC(C)NCCCCC(=O)N 270004a_100000696515_100000211708 [1,1,0,0,0,0|2,0,0]=4 9464 B14R0.231 CCCCCC(C)NCCCCC(=O)N 34a_100000696515_200011218191 [1,1,0,0,0,0|2,0,0]=4 9465 B14R0.231 CCCCCC(C)NCCCNC(=O)C 270004a_100000736810_100000211708 [1,1,0,0,0,0|2,0,0]=4 9466 B14R0.231 CCCCCC(C)NCCCNC(=O)C 34a_100000736810_200011218191 [1,1,0,0,0,0|2,0,0]=4 9467 B14R0.231 CCCCCC(C)NCCCSC(=O)C 2230a_100000211957_100000038929 [1,1,0,0,0,0|2,0,0]=4 9468 B14R0.231 CCCCCC(C)NCCOCC(=O)O 269956a_100000700818_200011218191 [1,1,0,0,0,0|2,0,0]=4 9469 B14R0.231 CCCCCC(C)OCCCCC(=O)C 34a_100011215632_100009817362 [1,1,0,0,0,0|1,0,0]=3 9470 B14R0.231 CCCCCC(C)OCCCCC(=O)C 7a_100011215632_100000735457 [1,1,0,0,0,0|1,0,0]=3 9471 B14R0.231 CCCCCC(C)OCCCCC(=O)N 34a_100012022536_200011218191 [1,1,0,0,0,0|2,0,0]=4 9472 B14R0.231 CCCCCC(C)OCCCCC(=O)N 7a_100012022536_200011218191 [1,1,0,0,0,0|2,0,0]=4 9473 B14R0.231 CCCCCC(C)OCCCNC(=O)C 34a_100000752032_200011218191 [1,1,0,0,0,0|2,0,0]=4 9474 B14R0.231 CCCCCC(C)OCCCOC(=O)C 34a_100011215632_100000042594 [1,1,0,0,0,0|2,0,0]=4 9475 B14R0.231 CCCCCC(C)OCCCOC(=O)C 7a_100011215632_100000042594 [1,1,0,0,0,0|2,0,0]=4 9476 B14R0.231 CCCCCC(C)OCCCSC(=O)C 34a_100011215632_100000038929 [1,1,0,0,0,0|2,0,0]=4 9477 B14R0.231 CCCCCC(C)OCCCSC(=O)C 7a_100011215632_100000038929 [1,1,0,0,0,0|2,0,0]=4 9478 B14R0.231 CCCCCC(C)SCCCCC(=O)C 62a_100000735457_200011218191 [1,1,0,0,0,0|1,0,0]=3 9479 B14R0.231 CCCCCC(C)SCCCCC(=O)C 62a_200011218191_100000735457 [1,1,0,0,0,0|1,0,0]=3 9480 B14R0.231 CCCCCC(C)SCCCOC(=O)C 62a_100000042594_200011218191 [1,1,0,0,0,0|2,0,0]=4 9481 B14R0.231 CCCCCC(C)SCCCOC(=O)C 62a_200011218191_100000042594 [1,1,0,0,0,0|2,0,0]=4 9482 B14R0.231 CCCCCC(C)SCCCSC(=O)C 62a_100000038929_200011218191 [1,1,0,0,0,0|2,0,0]=4 9483 B14R0.231 CCCCCC(C)SCCCSC(=O)C 62a_200011218191_100000038929 [1,1,0,0,0,0|2,0,0]=4 9484 B14R0.231 CCCCCN(C)CCCCCC(=O)N 2230a_100000223495_100009817443 [1,1,0,0,0,0|2,0,0]=4 9485 B14R0.231 CCCCCN(C)CCCCCC(=O)N 269982a_100000223495_100009817443 [1,1,0,0,0,0|2,0,0]=4 9486 B14R0.231 CCCCCN(C)CCCCOC(=O)C 269982a_100000223495_100000033659 [1,1,0,0,0,0|2,0,0]=4 9487 B14R0.231 CCCCCN(C)CCCCSC(=O)C 2230a_100000223495_200010402107 [1,1,0,0,0,0|2,0,0]=4 9488 B14R0.231 CCCCCN(C)CCCCSC(=O)C 269982a_100000223495_200010402107 [1,1,0,0,0,0|2,0,0]=4 9489 B14R0.231 COCCCC(C)OCCCCC(=O)C 34a_200011539412_100009817362 [1,1,0,0,0,0|2,0,0]=4 9490 B14R0.231 COCCCC(C)OCCCCC(=O)C 7a_200011539412_100000735457 [1,1,0,0,0,0|2,0,0]=4 9491 B14R0.305 C=C(C)CCOCCCCCC(C)CC 7a_200000035636_100000730704 [1,1,0,0,0,0|2,0,0]=4 9492 B14R0.305 CC(=O)CCCCOCCC[C@@H](C)CN 34a_100160569302_100009817362 [1,1,0,0,0,0|2,0,0]=4 9493 B14R0.305 CCC(C)CCCCCOCCC(=O)C 7a_200000035636_100000053229 [1,1,0,0,0,0|1,0,0]=3 9494 B14R0.305 CCC(C)CCCCCOCCC(=O)N 7a_200000035636_100000744528 [1,1,0,0,0,0|2,0,0]=4 9495 B14R0.305 CCC(C)CCCOCCCCC(=O)C 7a_100011216074_100000735457 [1,1,0,0,0,0|1,0,0]=3 9496 B14R0.305 CCC(C)CCCOCCCOC(=O)C 7a_100011216074_100000042594 [1,1,0,0,0,0|2,0,0]=4 9497 B14R0.305 CCC(C)CCCOCCCSC(=O)C 7a_100011216074_100000038929 [1,1,0,0,0,0|2,0,0]=4 9498 B14R0.305 CCC(C)CCNCCCCCC(=O)N 2230a_100020591266_100009817443 [1,1,0,0,0,0|2,0,0]=4 9499 B14R0.305 CCC(C)CCNCCCCSC(=O)C 2230a_100020591266_200010402107 [1,1,0,0,0,0|2,0,0]=4 9500 B14R0.305 CCC(C)CCOCCCCCC(=O)N 7a_100011215188_100009817443 [1,1,0,0,0,0|2,0,0]=4 9501 B14R0.305 CCC(C)CCOCCCCOC(=O)C 7a_100011215188_100000033659 [1,1,0,0,0,0|2,0,0]=4 9502 B14R0.305 CCC(C)CCOCCCCSC(=O)C 7a_100011215188_200010402107 [1,1,0,0,0,0|2,0,0]=4 9503 B14R0.305 CCC(C)CNCCCCCNC(=O)C 2230a_200012022750_100000748023 [1,1,0,0,0,0|2,0,0]=4 9504 B14R0.305 CCC(C)CNCCCCCNC(=O)C 270004a_200012022750_100000243153 [1,1,0,0,0,0|2,0,0]=4 9505 B14R0.305 CCC(C)CNCCCCCNC(=O)C 34a_200012022750_100000748023 [1,1,0,0,0,0|2,0,0]=4 9506 B14R0.305 CCC(C)CNCCCCCOC(=O)C 2230a_100020588543_100009813381 [1,1,0,0,0,0|2,0,0]=4 9507 B14R0.305 CCC(C)CSCCCCCOC(=O)C 62a_100000033007_100000748023 [1,1,0,0,0,0|2,0,0]=4 9508 B14R0.305 CCC(C)CSCCCCCOC(=O)C 62a_100000748023_100000033007 [1,1,0,0,0,0|2,0,0]=4 9509 B14R0.305 CCC(C)NCCCCCCNC(=O)C 2230a_200011996284_100000758301 [1,1,0,0,0,0|2,0,0]=4 9510 B14R0.305 CCC(C)NCCCCCCNC(=O)C 34a_200011996284_100011215416 [1,1,0,0,0,0|2,0,0]=4 9511 B14R0.305 CCC(O)CNCCCCCNC(=O)C 2230a_200012022750_100011218378 [1,1,0,0,0,0|2,0,0]=4 9512 B14R0.305 CCC(O)CNCCCCCNC(=O)C 34a_200012022750_100011218378 [1,1,0,0,0,0|2,0,0]=4 9513 B14R0.305 CCC(O)CNCCCCCOC(=O)C 2230a_100011218483_100009813381 [1,1,0,0,0,0|2,0,0]=4 9514 B14R0.305 CCC(O)CSCCCCCOC(=O)C 62a_100000033007_100011218378 [1,1,0,0,0,0|2,0,0]=4 9515 B14R0.305 CCC(O)CSCCCCCOC(=O)C 62a_100011218378_100000033007 [1,1,0,0,0,0|2,0,0]=4 9516 B14R0.305 CCN(C)CCCSCCCCC(=O)C 62a_100000735457_100015186262 [1,1,0,0,0,0|2,0,0]=4 9517 B14R0.305 CC[C@H](C)CNCCCCCNC(=O)C 2230a_200012022750_100009816398 [1,1,0,0,0,0|2,0,0]=4 9518 B14R0.305 CC[C@H](C)CNCCCCCNC(=O)C 34a_200012022750_100009816398 [1,1,0,0,0,0|2,0,0]=4 9519 B14R0.305 CC[C@H](C)COCCCCCOC(=O)C 7a_100009816381_100000033007 [1,1,0,0,0,0|2,0,0]=4 9520 B14R0.305 CC[C@H](C)CSCCCCCOC(=O)C 62a_100000033007_100009816398 [1,1,0,0,0,0|2,0,0]=4 9521 B14R0.305 CC[C@H](C)CSCCCCCOC(=O)C 62a_100009816398_100000033007 [1,1,0,0,0,0|2,0,0]=4 9522 B14R0.305 COC(=O)CCCCCCCCC(=O)C 1458a_100000036616_200000210301 [1,1,0,0,0,0|1,0,1]=4 9523 B14R0.305 COC(=O)CCCCCCCCC(=O)C 1458a_100000070787_100010282707 [1,1,0,0,0,0|1,0,1]=4 9524 B14R0.305 COC(=O)CCCCCCCCC(=O)[13CH3] 1458a_100000036616_200025704644 [1,1,0,0,0,0|1,0,1]=4 9525 B14R0.340 C=C(C)C(=O)CCCCCCCCCC 1458a_100000185857_100000210319 [1,1,0,0,0,0|1,0,1]=4 9526 B14R0.340 C=C(C)C(C)NCCCCCCCCC 269862a_100000212291_100011216138 [1,1,0,0,0,0|2,0,0]=4 9527 B14R0.340 CC(=O)C(C)COCCCCCCCO 34a_100000032740_100000760002 [1,1,0,0,0,0|2,0,0]=4 9528 B14R0.340 CC(=O)C(C)COCCCCCCCO 7a_100000032740_100000760002 [1,1,0,0,0,0|2,0,0]=4 9529 B14R0.340 CC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100009814033 [1,1,0,0,0,0|2,0,0]=4 9530 B14R0.340 CC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100000179758 [1,1,0,0,0,0|2,0,0]=4 9531 B14R0.340 CC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100000179758 [1,1,0,0,0,0|2,0,0]=4 9532 B14R0.340 CC(=O)C(C)OCCCCCCCCO 34a_100000212229_100000033203 [1,1,0,0,0,0|2,0,0]=4 9533 B14R0.340 CC(=O)C(C)SCCCCCCCCO 62a_100000033203_100009814033 [1,1,0,0,0,0|2,0,0]=4 9534 B14R0.340 CC(=O)C(C)SCCCCCCCCO 62a_100009814033_100000033203 [1,1,0,0,0,0|2,0,0]=4 9535 B14R0.340 CC(CNCCCCCCCO)C(=O)O 269956a_100000749485_100000760002 [1,1,0,0,0,0|2,0,0]=4 9536 B14R0.340 CCCCCCCCCCC(C)N(C)C 270004a_100102631434_200011219864 [1,1,0,0,0,0|2,0,0]=4 9537 B14R0.340 CCCCCCCCCCN(C)C(=O)C 11a_100000207566_100015343762 [1,1,0,0,0,0|1,0,0]=3 9538 B14R0.340 CCCCCCCCCCN(C)C(=O)C 1626a_100000207566_100015343762 [1,1,0,0,0,0|1,0,0]=3 9539 B14R0.340 CCCCCCCCCCN(C)C(=O)C 240690a_100000207566_100015343762 [1,1,0,0,0,0|1,0,0]=3 9540 B14R0.340 CCCCCCCCCCN(C)C(=O)C 527a_100000207566_100103153847 [1,1,0,0,0,0|1,0,0]=3 9541 B14R0.340 CCCCCCCCCNC(C)C(=O)C 2230a_100000212291_100009814033 [1,1,0,0,0,0|1,0,0]=3 9542 B14R0.340 CCCCCCCCCNC(C)C(=O)N 2230a_100000212291_100000702099 [1,1,0,0,0,0|2,0,0]=4 9543 B14R0.340 CCCCCCCCCNC(C)C(=O)N 34a_100000212291_100000702099 [1,1,0,0,0,0|2,0,0]=4 9544 B14R0.340 CCCCCCCCCNC(F)C(=O)N 2230a_100000212291_100009813875 [1,1,0,0,0,0|2,0,0]=4 9545 B14R0.340 CCCCCCCCCNC(F)C(=O)N 34a_100000212291_100009813875 [1,1,0,0,0,0|2,0,0]=4 9546 B14R0.340 CCCCCCCCCNC(F)C(=O)[O-] 34a_100000212291_100020610796 [1,1,0,0,0,0|1,0,1]=4 9547 B14R0.340 CCCCCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210670 [1,1,0,0,0,0|1,0,0]=3 9548 B14R0.340 CCCCCCCCCN[C@H](C)C(=O)N 2230a_100000119354_100011214924 [1,1,0,0,0,0|2,0,0]=4 9549 B14R0.340 CCCCCCCCCN[C@H](C)C(=O)N 34a_100000119354_100011214924 [1,1,0,0,0,0|2,0,0]=4 9550 B14R0.340 CCCCCCCCCOC(C)C(=O)C 34a_100000212229_100011214924 [1,1,0,0,0,0|1,0,0]=3 9551 B14R0.340 CCCCCCCCCOC(C)C(=O)C 7a_100000210712_100000179758 [1,1,0,0,0,0|1,0,0]=3 9552 B14R0.340 CCCCCCCCCOC(C)C(=O)N 34a_100000210712_100000702099 [1,1,0,0,0,0|2,0,0]=4 9553 B14R0.340 CCCCCCCCCOC(C)C(=O)N 7a_100000210712_100000702099 [1,1,0,0,0,0|2,0,0]=4 9554 B14R0.340 CCCCCCCCCOC(F)C(=O)N 34a_100000210712_100009813875 [1,1,0,0,0,0|2,0,0]=4 9555 B14R0.340 CCCCCCCCCOC(F)C(=O)N 7a_100000210712_100009813875 [1,1,0,0,0,0|2,0,0]=4 9556 B14R0.340 CCCCCCCCCOC(F)C(=O)[O-] 34a_100000210712_100020610796 [1,1,0,0,0,0|1,0,1]=4 9557 B14R0.340 CCCCCCCCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210328 [1,1,0,0,0,0|1,0,1]=4 9558 B14R0.340 CCCCCCCCCO[C@H](C)C(=O)N 34a_100000731257_100011214924 [1,1,0,0,0,0|2,0,0]=4 9559 B14R0.340 CCCCCCCCCO[C@H](C)C(=O)N 7a_100000731257_100000210328 [1,1,0,0,0,0|2,0,0]=4 9560 B14R0.340 CCCCCCCCCSC(C)C(=O)C 62a_100009814033_100000210670 [1,1,0,0,0,0|1,0,0]=3 9561 B14R0.340 CCCCCCCCCSC(C)C(=O)N 62a_100000702099_100000210670 [1,1,0,0,0,0|2,0,0]=4 9562 B14R0.340 CCCCCCCCCSC(F)C(=O)N 62a_100009813875_100000210670 [1,1,0,0,0,0|2,0,0]=4 9563 B14R0.340 CCCCCCCCCSC(F)C(=O)[O-] 62a_100020610796_100000210670 [1,1,0,0,0,0|1,0,1]=4 9564 B14R0.340 CCCCCCCCNCC(=O)C(=O)C 34a_100000229939_100011261029 [1,1,0,0,0,0|1,0,1]=4 9565 B14R0.340 CCCCCCCCNCC(C)C(=O)O 269956a_100000749485_100000210759 [1,1,0,0,0,0|1,0,0]=3 9566 B14R0.340 CCCCCCCCNCC(F)C(=O)O 269956a_100000084737_100000210759 [1,1,0,0,0,0|1,0,0]=3 9567 B14R0.340 CCCCCCCCOCC(=O)C(=O)C 34a_100000210232_100011261029 [1,1,0,0,0,0|1,0,1]=4 9568 B14R0.340 CCCCCCCCOCC(C)C(=O)C 34a_100000032740_100000210759 [1,1,0,0,0,0|1,0,0]=3 9569 B14R0.340 CCCCCCCCOCC(C)C(=O)C 7a_100000032740_100000210759 [1,1,0,0,0,0|1,0,0]=3 9570 B14R0.340 CCCCCCCCOC[C@H](N)C(=O)N 34a_100000729942_100000210759 [1,1,0,0,0,0|2,0,0]=4 9571 B14R0.340 CCCCCCCCSCC(=O)C(=O)C 62a_100000210759_100011261029 [1,1,0,0,0,0|1,0,1]=4 9572 B14R0.340 CCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210317 [1,1,0,0,0,0|1,0,1]=4 9573 B14R0.340 CCCCCCOCCOC(C)C(=O)C 7a_100000691444_100000179758 [1,1,0,0,0,0|2,0,0]=4 9574 B14R0.340 CCCCOCCCCOC(C)C(=O)C 7a_200000760531_100000179758 [1,1,0,0,0,0|2,0,0]=4 9575 B14R0.340 COCCCCCCNCC(C)C(=O)O 269956a_100000749485_100011998445 [1,1,0,0,0,0|2,0,0]=4 9576 B14R0.340 COCCCCCCNCC(F)C(=O)O 269956a_100000084737_100011998445 [1,1,0,0,0,0|2,0,0]=4 9577 B14R0.340 COCCCCCCOCC(C)C(=O)C 34a_100000032740_100011998445 [1,1,0,0,0,0|2,0,0]=4 9578 B14R0.340 COCCCCCCOCC(C)C(=O)C 7a_100000032740_100011998445 [1,1,0,0,0,0|2,0,0]=4 9579 B14R0.340 C[C@H](NCCCCCCCCO)C(=O)O 269956a_100000743915_100000033203 [1,1,0,0,0,0|2,0,0]=4 9580 B14R0.340 O=C(O)C(F)CNCCCCCCCO 269956a_100000084737_100000760002 [1,1,0,0,0,0|2,0,0]=4 9581 B14R0.344 C=C(C)CCC(=O)CCCCCCCC 1458a_100000210188_100000730704 [1,1,0,0,0,0|1,0,1]=4 9582 B14R0.344 C=C(C)CCC(=O)CCCCCCCC 1458a_200000688413_100000210759 [1,1,0,0,0,0|1,0,1]=4 9583 B14R0.344 C=C(C)CCC(C)NCCCCCCC 270004a_100000229938_100011215600 [1,1,0,0,0,0|2,0,0]=4 9584 B14R0.344 C=C(C)CCN(C)CCCCCCCC 2230a_100000207567_100000730704 [1,1,0,0,0,0|2,0,0]=4 9585 B14R0.344 C=C(C)CCN(C)CCCCCCCC 269982a_100000207567_100000730704 [1,1,0,0,0,0|2,0,0]=4 9586 B14R0.344 C=C(C)COC(C)CCCCCCCC 34a_100000210740_100000748629 [1,1,0,0,0,0|2,0,0]=4 9587 B14R0.344 C=C(C)COC(C)CCCCCCCC 7a_100000210740_100000748629 [1,1,0,0,0,0|2,0,0]=4 9588 B14R0.344 CCCCCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210759 [1,1,0,0,0,0|1,0,1]=4 9589 B14R0.344 CCCCCCCCC(=O)CNC(=O)C 1458a_100000194580_100000210759 [1,1,0,0,0,0|1,0,1]=4 9590 B14R0.344 CCCCCCCCC(=O)COC(=O)C 1458a_100000183556_100000210759 [1,1,0,0,0,0|1,0,1]=4 9591 B14R0.344 CCCCCCCCC(=O)CSC(=O)C 1458a_100000049016_100000210759 [1,1,0,0,0,0|1,0,1]=4 9592 B14R0.344 CCCCCCCCC(C)OCC(=O)N 34a_100000210740_100000187820 [1,1,0,0,0,0|2,0,0]=4 9593 B14R0.344 CCCCCCCCC(C)OCC(=O)N 7a_100000210740_100000187820 [1,1,0,0,0,0|2,0,0]=4 9594 B14R0.344 CCCCCCCCC(C)OCC(=O)[O-] 34a_100000210740_100020667443 [1,1,0,0,0,0|1,0,1]=4 9595 B14R0.344 CCCCCCCCN(C)CCC(=O)C 269982a_100000207567_100000053229 [1,1,0,0,0,0|1,0,0]=3 9596 B14R0.344 CCCCCCCCN(C)CCC(=O)N 2230a_100000207567_100000744528 [1,1,0,0,0,0|2,0,0]=4 9597 B14R0.344 CCCCCCCCN(C)CCC(=O)N 2230a_100000730477_100000210759 [1,1,0,0,0,0|2,0,0]=4 9598 B14R0.344 CCCCCCCCN(C)CCC(=O)N 269982a_100000207567_100000744528 [1,1,0,0,0,0|2,0,0]=4 9599 B14R0.344 CCCCCCCCN(C)COC(=O)C 269982a_100000207567_100000076356 [1,1,0,0,0,0|2,0,0]=4 9600 B14R0.344 CCCCCCCNC(C)COC(=O)C 270004a_100000229938_100000000629 [1,1,0,0,0,0|2,0,0]=4 9601 B14R0.344 CCCCCCNCC(C)CSC(=O)C 2230a_100000210581_200000116872 [1,1,0,0,0,0|2,0,0]=4 9602 B14R0.344 CCCCCCOCC(C)CSC(=O)C 34a_100000210259_200000116872 [1,1,0,0,0,0|2,0,0]=4 9603 B14R0.344 CCCCCCOCC(C)CSC(=O)C 7a_100000210259_200000116872 [1,1,0,0,0,0|2,0,0]=4 9604 B14R0.344 CCCCCCOCC(O)COC(=O)C 34a_100000210259_200000139349 [1,1,0,0,0,0|2,0,0]=4 9605 B14R0.344 CCCCCCOCC(O)COC(=O)C 7a_100000210259_200000139349 [1,1,0,0,0,0|2,0,0]=4 9606 B14R0.344 CCCCCCSCC(C)CSC(=O)C 62a_100000210314_200000116872 [1,1,0,0,0,0|2,0,0]=4 9607 B14R0.344 CCCCCCSCC(C)CSC(=O)C 62a_200000116872_100000210757 [1,1,0,0,0,0|2,0,0]=4 9608 B14R0.344 CCCCCCSCC(O)COC(=O)C 62a_100000210314_200000139349 [1,1,0,0,0,0|2,0,0]=4 9609 B14R0.344 CCCCCCSCC(O)COC(=O)C 62a_200000139349_100000210757 [1,1,0,0,0,0|2,0,0]=4 9610 B14R0.391 C=C(C)CC(=O)CCCCCCCCC 1458a_100000210558_100000748629 [1,1,0,0,0,0|1,0,1]=4 9611 B14R0.391 C=C(C)CN(C)CCCCCCCCC 2230a_100000225649_100011214924 [1,1,0,0,0,0|2,0,0]=4 9612 B14R0.391 C=C(C)CN(C)CCCCCCCCC 2230a_100000232482_100000748629 [1,1,0,0,0,0|2,0,0]=4 9613 B14R0.391 C=C(C)CN(C)CCCCCCCCC 269982a_100000225649_100000210670 [1,1,0,0,0,0|2,0,0]=4 9614 B14R0.391 C=C(C)CN(C)CCCCCCCCC 269982a_100000232482_100000748629 [1,1,0,0,0,0|2,0,0]=4 9615 B14R0.391 CCCCCCCCCC(=O)CC(=O)N 1458a_100000210558_100000187820 [1,1,0,0,0,0|1,0,1]=4 9616 B14R0.391 CCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100000210670 [1,1,0,0,0,0|1,0,1]=4 9617 B14R0.391 CCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000210558_100020667443 [1,1,0,0,0,0|0,0,2]=4 9618 B14R0.391 CCCCCCCCCC(C)CN(C)C 270004a_100102631434_200011218516 [1,1,0,0,0,0|2,0,0]=4 9619 B14R0.391 CCCCCCCCCN(C)CC(=O)N 2230a_100000232482_100000747473 [1,1,0,0,0,0|2,0,0]=4 9620 B14R0.391 CCCCCCCCCN(C)CC(=O)N 2230a_100000739694_100011214924 [1,1,0,0,0,0|2,0,0]=4 9621 B14R0.391 CCCCCCCCCN(C)CC(=O)N 269982a_100000232482_100000187820 [1,1,0,0,0,0|2,0,0]=4 9622 B14R0.391 CCCCCCCCCN(C)CC(=O)O 269956a_100000746989_100000210670 [1,1,0,0,0,0|1,0,0]=3 9623 B14R0.391 CCCCCCCCCN(C)CC(=O)[O-] 269982a_100000232482_100020667443 [1,1,0,0,0,0|1,0,1]=4 9624 B14R0.391 CCCCCCCCSC(C)OC(=O)C 62a_100000210759_100009818208 [1,1,0,0,0,0|2,0,0]=4 9625 B14R0.391 CCCCCCCCSC(C)OC(=O)C 62a_100009818208_100000210317 [1,1,0,0,0,0|2,0,0]=4 9626 B14R0.391 CCCCCCCNCC(O)CC(=O)O 269956a_100011218706_100000210614 [1,1,0,0,0,0|1,0,0]=3 9627 B14R0.391 CCCCOCCNCC(O)CC(=O)O 269956a_100011218706_100000743108 [1,1,0,0,0,0|2,0,0]=4 9628 B14R0.391 CN(CCCCCCCCO)CC(=O)O 269956a_100000746989_100000033203 [1,1,0,0,0,0|2,0,0]=4 9629 B14R0.391 O=C(O)CC(O)CNCCCCCCF 269956a_100011218706_100015922095 [1,1,0,0,0,0|2,0,0]=4 9630 B14R0.391 O=C(O)CC(O)CNCCCCCCO 269956a_100011218706_100000766143 [1,1,0,0,0,0|2,0,0]=4 9631 B14R0.394 C#CCCCCCCCOCCC(=O)C 34a_100000759926_100153394163 [1,1,0,0,0,0|0,0,2]=4 9632 B14R0.394 C#CCCCCCCCOCCC(=O)C 7a_100000054614_100000053229 [1,1,0,0,0,0|0,0,2]=4 9633 B14R0.394 C#CCCCCCCCOCCC(=O)C 7a_100000759926_100153394163 [1,1,0,0,0,0|0,0,2]=4 9634 B14R0.394 C#CCCCCCCCSCCC(=O)C 62a_100000053229_100153394163 [1,1,0,0,0,0|0,0,2]=4 9635 B14R0.394 C#CCCCCCCCSCCC(=O)C 62a_100153394163_100000053229 [1,1,0,0,0,0|0,0,2]=4 9636 B14R0.394 C#CCCCCCCOCCCC(=O)C 34a_100000759063_100012276617 [1,1,0,0,0,0|0,0,2]=4 9637 B14R0.394 C#CCCCCCCOCCCC(=O)C 34a_100011217361_100000685027 [1,1,0,0,0,0|0,0,2]=4 9638 B14R0.394 C#CCCCCCCOCCCC(=O)C 7a_100000759063_100012276617 [1,1,0,0,0,0|0,0,2]=4 9639 B14R0.394 C#CCCCCCCOCCCC(=O)C 7a_100011217361_100011215641 [1,1,0,0,0,0|0,0,2]=4 9640 B14R0.394 C#CCCCCCCSCCCC(=O)C 62a_100011215641_100012276617 [1,1,0,0,0,0|0,0,2]=4 9641 B14R0.394 C#CCCCCCCSCCCC(=O)C 62a_100012276617_100011215641 [1,1,0,0,0,0|0,0,2]=4 9642 B14R0.394 C#CCCCCCOCCCCC(=O)C 34a_100000766912_100009817362 [1,1,0,0,0,0|0,0,2]=4 9643 B14R0.394 C#CCCCCCOCCCCC(=O)C 7a_100000766912_100000735457 [1,1,0,0,0,0|0,0,2]=4 9644 B14R0.394 C#CCCCCCSCCCCC(=O)C 62a_100000735457_100012094781 [1,1,0,0,0,0|0,0,2]=4 9645 B14R0.394 C#CCCCCCSCCCCC(=O)C 62a_100012094781_100000735457 [1,1,0,0,0,0|0,0,2]=4 9646 B14R0.394 C=C(Br)CCOCCCCCCCCC 34a_100009813270_100011214924 [1,1,0,0,0,0|1,0,1]=4 9647 B14R0.394 C=C(C)CCNCCCCCCCCC 2230a_100000212291_100000730704 [1,1,0,0,0,0|1,0,0]=3 9648 B14R0.394 C=C(C)CCNCCCCCCCCC 34a_100000212291_100000730704 [1,1,0,0,0,0|1,0,0]=3 9649 B14R0.394 C=C(C)CCNCCCCCCCCO 2230a_102515433106_100000730704 [1,1,0,0,0,0|2,0,0]=4 9650 B14R0.394 C=C(C)CCNCCCCCCCCO 34a_102515433106_100000730704 [1,1,0,0,0,0|2,0,0]=4 9651 B14R0.394 C=C(C)CCOCCCCCCCCBr 34a_100009813846_100000730704 [1,1,0,0,0,0|2,0,0]=4 9652 B14R0.394 C=C(C)CCOCCCCCCCCBr 7a_100009813846_100000730704 [1,1,0,0,0,0|2,0,0]=4 9653 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000210712_100000730704 [1,1,0,0,0,0|1,0,0]=3 9654 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000764851_100011214924 [1,1,0,0,0,0|1,0,0]=3 9655 B14R0.394 C=C(C)CCOCCCCCCCCC 7a_100000210712_100000730704 [1,1,0,0,0,0|1,0,0]=3 9656 B14R0.394 C=C(C)CCOCCCCCCCCCl 34a_100000033203_100000730704 [1,1,0,0,0,0|2,0,0]=4 9657 B14R0.394 C=C(C)CCOCCCCCCCCCl 7a_100000033203_100000730704 [1,1,0,0,0,0|2,0,0]=4 9658 B14R0.394 C=C(C)CCOCCCCCCCCN 34a_102515433106_100000730704 [1,1,0,0,0,0|2,0,0]=4 9659 B14R0.394 C=C(C)CCOCCCCCCCCO 34a_100000764851_100000033203 [1,1,0,0,0,0|2,0,0]=4 9660 B14R0.394 C=C(C)CCOCCCCNCCCC 34a_200011216965_100000730704 [1,1,0,0,0,0|2,0,0]=4 9661 B14R0.394 C=C(C)CCOCCCCOCCCC 34a_200000760531_100000730704 [1,1,0,0,0,0|2,0,0]=4 9662 B14R0.394 C=C(C)CCOCCCCOCCCC 7a_200000760531_100000730704 [1,1,0,0,0,0|2,0,0]=4 9663 B14R0.394 C=C(C)CCOCCOCCCCCC 34a_100000691444_100000730704 [1,1,0,0,0,0|2,0,0]=4 9664 B14R0.394 C=C(C)CCOCCOCCCCCC 7a_100000691444_100000730704 [1,1,0,0,0,0|2,0,0]=4 9665 B14R0.394 C=C(C)CCSCCCCCCCCC 62a_100000730704_100000210670 [1,1,0,0,0,0|1,0,0]=3 9666 B14R0.394 C=C(C)CCSCCCCCCCCO 62a_100000033203_100000730704 [1,1,0,0,0,0|2,0,0]=4 9667 B14R0.394 C=C(C)CCSCCCCCCCCO 62a_100000730704_100000033203 [1,1,0,0,0,0|2,0,0]=4 9668 B14R0.394 C=C(C)CNCCCCCCCCCC 2230a_100000684558_100000748629 [1,1,0,0,0,0|1,0,0]=3 9669 B14R0.394 C=C(C)CNCCCCCCCCCC 34a_100000684558_100000748629 [1,1,0,0,0,0|1,0,0]=3 9670 B14R0.394 C=C(C)CNCCCCCCCCCO 2230a_100000078944_100000748629 [1,1,0,0,0,0|2,0,0]=4 9671 B14R0.394 C=C(C)CNCCCCCCCCCO 34a_100000078944_100000748629 [1,1,0,0,0,0|2,0,0]=4 9672 B14R0.394 C=C(C)COCCCCCCCCCBr 34a_100009813782_100000748629 [1,1,0,0,0,0|2,0,0]=4 9673 B14R0.394 C=C(C)COCCCCCCCCCBr 7a_100009813782_100000748629 [1,1,0,0,0,0|2,0,0]=4 9674 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210245_100000210320 [1,1,0,0,0,0|1,0,0]=3 9675 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210711_100000748629 [1,1,0,0,0,0|1,0,0]=3 9676 B14R0.394 C=C(C)COCCCCCCCCCC 7a_100000210711_100000748629 [1,1,0,0,0,0|1,0,0]=3 9677 B14R0.394 C=C(C)COCCCCCCCCCCl 34a_100009868337_100000748629 [1,1,0,0,0,0|2,0,0]=4 9678 B14R0.394 C=C(C)COCCCCCCCCCCl 7a_100009868337_100000748629 [1,1,0,0,0,0|2,0,0]=4 9679 B14R0.394 C=C(C)COCCCCCCCCCN 34a_100000078944_100000748629 [1,1,0,0,0,0|2,0,0]=4 9680 B14R0.394 C=C(C)COCCCCCCCCCO 34a_100000210245_100009813782 [1,1,0,0,0,0|2,0,0]=4 9681 B14R0.394 C=C(C)CSCCCCCCCCCC 62a_100000748629_100000210320 [1,1,0,0,0,0|1,0,0]=3 9682 B14R0.394 C=C(C)CSCCCCCCCCCO 62a_100000748629_100009813782 [1,1,0,0,0,0|2,0,0]=4 9683 B14R0.394 C=C(C)CSCCCCCCCCCO 62a_100009813782_100000211660 [1,1,0,0,0,0|2,0,0]=4 9684 B14R0.394 C=C(F)CNCCCCCCCCCC 2230a_100000684558_100009893438 [1,1,0,0,0,0|1,0,1]=4 9685 B14R0.394 C=C(F)CNCCCCCCCCCC 34a_100000684558_100009893438 [1,1,0,0,0,0|1,0,1]=4 9686 B14R0.394 C=C(F)COCCCCCCCCCC 34a_100000210711_100009893438 [1,1,0,0,0,0|1,0,1]=4 9687 B14R0.394 C=C(F)COCCCCCCCCCC 34a_200010262243_100000210320 [1,1,0,0,0,0|1,0,1]=4 9688 B14R0.394 C=C(F)COCCCCCCCCCC 7a_100000210711_100000042424 [1,1,0,0,0,0|1,0,1]=4 9689 B14R0.394 C=C(F)CSCCCCCCCCCC 62a_100000042424_100000210320 [1,1,0,0,0,0|1,0,1]=4 9690 B14R0.394 C=CCCCCCCCCCCC(=O)C 1458a_100000070787_100011093070 [1,1,0,0,0,0|0,0,1]=3 9691 B14R0.394 C=CCCCCCCCCCNC(=O)C 11a_100000081888_100015343762 [1,1,0,0,0,0|0,0,2]=4 9692 B14R0.394 C=CCCCCCCCCCNC(=O)C 1626a_100000081888_100015343762 [1,1,0,0,0,0|0,0,2]=4 9693 B14R0.394 C=CCCCCCCCCCNC(=O)C 240690a_100000081888_100015343762 [1,1,0,0,0,0|0,0,2]=4 9694 B14R0.394 C=CCCCCCCCCCNC(=O)C 527a_100000081888_100103153847 [1,1,0,0,0,0|0,0,2]=4 9695 B14R0.394 C=CCCCCCCCCNCC(=O)O 269956a_100016091260_100011933949 [1,1,0,0,0,0|0,0,2]=4 9696 B14R0.394 C=CCCCCCCCCOCC(=O)C 34a_100000211253_100011933949 [1,1,0,0,0,0|0,0,2]=4 9697 B14R0.394 C=CCCCCCCCOCCC(=O)C 34a_100000759926_100012355270 [1,1,0,0,0,0|0,0,2]=4 9698 B14R0.394 C=CCCCCCCCOCCC(=O)C 7a_100000730831_100000053229 [1,1,0,0,0,0|0,0,2]=4 9699 B14R0.394 C=CCCCCCCCOCCC(=O)C 7a_100000759926_100012355270 [1,1,0,0,0,0|0,0,2]=4 9700 B14R0.394 C=CCCCCCCCSCCC(=O)C 62a_100000053229_100012355270 [1,1,0,0,0,0|0,0,2]=4 9701 B14R0.394 C=CCCCCCCCSCCC(=O)C 62a_100012355270_100000053229 [1,1,0,0,0,0|0,0,2]=4 9702 B14R0.394 C=CCCCCCCOCCCC(=O)C 34a_100000759063_100011215473 [1,1,0,0,0,0|0,0,2]=4 9703 B14R0.394 C=CCCCCCCOCCCC(=O)C 34a_200011216477_100000685027 [1,1,0,0,0,0|0,0,2]=4 9704 B14R0.394 C=CCCCCCCOCCCC(=O)C 7a_100000759063_100011215473 [1,1,0,0,0,0|0,0,2]=4 9705 B14R0.394 C=CCCCCCCOCCCC(=O)C 7a_200011216477_100011215641 [1,1,0,0,0,0|0,0,2]=4 9706 B14R0.394 C=CCCCCCCSCCCC(=O)C 62a_100011215473_100011215641 [1,1,0,0,0,0|0,0,2]=4 9707 B14R0.394 C=CCCCCCCSCCCC(=O)C 62a_100011215641_100011215473 [1,1,0,0,0,0|0,0,2]=4 9708 B14R0.394 C=CCCCCCOCCCCC(=O)C 34a_100011216702_100009817362 [1,1,0,0,0,0|0,0,2]=4 9709 B14R0.394 C=CCCCCCOCCCCC(=O)C 7a_100011216702_100000735457 [1,1,0,0,0,0|0,0,2]=4 9710 B14R0.394 C=CCCCCCSCCCCC(=O)C 62a_100000700193_100000735457 [1,1,0,0,0,0|0,0,2]=4 9711 B14R0.394 C=CCCCCCSCCCCC(=O)C 62a_100000735457_100000700193 [1,1,0,0,0,0|0,0,2]=4 9712 B14R0.394 CC(=O)CCCCCCCCCCCO 1458a_100000070787_100009812471 [1,1,0,0,0,0|0,0,0]=2 9713 B14R0.394 CC(=O)CCCCNCCCCCCO 34a_100000686447_100009817362 [1,1,0,0,0,0|1,0,0]=3 9714 B14R0.394 CC(=O)CCCCOCCCCCCBr 34a_100011215345_100009817362 [1,1,0,0,0,0|1,0,0]=3 9715 B14R0.394 CC(=O)CCCCOCCCCCCBr 7a_100011215345_100000735457 [1,1,0,0,0,0|1,0,0]=3 9716 B14R0.394 CC(=O)CCCCOCCCCCCCl 34a_100000766143_100009817362 [1,1,0,0,0,0|1,0,0]=3 9717 B14R0.394 CC(=O)CCCCOCCCCCCCl 7a_100000766143_100000735457 [1,1,0,0,0,0|1,0,0]=3 9718 B14R0.394 CC(=O)CCCCOCCCCCCF 34a_100000732779_100009817362 [1,1,0,0,0,0|1,0,0]=3 9719 B14R0.394 CC(=O)CCCCOCCCCCCF 7a_100000732779_100000735457 [1,1,0,0,0,0|1,0,0]=3 9720 B14R0.394 CC(=O)CCCCOCCCCCCN 34a_100000686447_100009817362 [1,1,0,0,0,0|1,0,0]=3 9721 B14R0.394 CC(=O)CCCCSCCCCCC#N 62a_100000735457_100009813376 [1,1,0,0,0,0|1,0,1]=4 9722 B14R0.394 CC(=O)CCCCSCCCCCC#N 62a_100009813376_100000735457 [1,1,0,0,0,0|1,0,1]=4 9723 B14R0.394 CC(=O)CCCCSCCCCCC=O 62a_100000139337_100000735457 [1,1,0,0,0,0|1,0,1]=4 9724 B14R0.394 CC(=O)CCCCSCCCCCC=O 62a_100000735457_100000139337 [1,1,0,0,0,0|1,0,1]=4 9725 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100000735457_100015922095 [1,1,0,0,0,0|1,0,0]=3 9726 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100015922095_100000735457 [1,1,0,0,0,0|1,0,0]=3 9727 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000735457_100000766143 [1,1,0,0,0,0|1,0,0]=3 9728 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000766143_100000735457 [1,1,0,0,0,0|1,0,0]=3 9729 B14R0.394 CC(=O)CCCNCCCCCCCO 34a_100011996573_100000685027 [1,1,0,0,0,0|1,0,0]=3 9730 B14R0.394 CC(=O)CCCNCCCOCCCO 34a_100011310245_100000685027 [1,1,0,0,0,0|2,0,0]=4 9731 B14R0.394 CC(=O)CCCOCCCCCCC#N 7a_100000759063_100009813337 [1,1,0,0,0,0|1,0,1]=4 9732 B14R0.394 CC(=O)CCCOCCCCCCCBr 34a_100000760002_100000685027 [1,1,0,0,0,0|1,0,0]=3 9733 B14R0.394 CC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215641 [1,1,0,0,0,0|1,0,0]=3 9734 B14R0.394 CC(=O)CCCOCCCCCCCN 34a_100011996573_100000685027 [1,1,0,0,0,0|1,0,0]=3 9735 B14R0.394 CC(=O)CCCOCCCCCCCO 34a_100000759063_100000760002 [1,1,0,0,0,0|1,0,0]=3 9736 B14R0.394 CC(=O)CCCOCCCCCCCO 7a_100000759063_100000760002 [1,1,0,0,0,0|1,0,0]=3 9737 B14R0.394 CC(=O)CCCOCCCOCCCN 34a_100011310245_100000685027 [1,1,0,0,0,0|2,0,0]=4 9738 B14R0.394 CC(=O)CCCSCCCCCCC#N 62a_100009813337_100011215641 [1,1,0,0,0,0|1,0,1]=4 9739 B14R0.394 CC(=O)CCCSCCCCCCC#N 62a_100011215641_100009813337 [1,1,0,0,0,0|1,0,1]=4 9740 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100000760002_100011215641 [1,1,0,0,0,0|1,0,0]=3 9741 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100011215641_100000760002 [1,1,0,0,0,0|1,0,0]=3 9742 B14R0.394 CC(=O)CCOCCCCCCCCBr 7a_100009813846_100000053229 [1,1,0,0,0,0|1,0,0]=3 9743 B14R0.394 CC(=O)CCOCCCCCCCCCl 7a_100000033203_100000053229 [1,1,0,0,0,0|1,0,0]=3 9744 B14R0.394 CC(=O)CCOCCCCCCCCO 34a_100000759926_100000033203 [1,1,0,0,0,0|1,0,0]=3 9745 B14R0.394 CC(=O)CCOCCCCCCCCO 7a_100000759926_100000033203 [1,1,0,0,0,0|1,0,0]=3 9746 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000033203_100000053229 [1,1,0,0,0,0|1,0,0]=3 9747 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000053229_100000033203 [1,1,0,0,0,0|1,0,0]=3 9748 B14R0.394 CC(=O)COCCCCCCCCCO 34a_100000211253_100009813782 [1,1,0,0,0,0|1,0,0]=3 9749 B14R0.394 CC(=O)NCCCCCCCCCCO 240690a_100000066964_100015343762 [1,1,0,0,0,0|1,0,0]=3 9750 B14R0.394 CC(=O)NCCCCCCNCCCF 2230a_200011996284_100011934791 [1,1,0,0,0,0|2,0,0]=4 9751 B14R0.394 CC(=O)NCCCCCCNCCCF 34a_200011996284_100011934791 [1,1,0,0,0,0|2,0,0]=4 9752 B14R0.394 CC(=O)NCCCCCCNCCCO 2230a_200011996284_100000230001 [1,1,0,0,0,0|2,0,0]=4 9753 B14R0.394 CC(=O)NCCCCCCNCCCO 34a_200011996284_100000230001 [1,1,0,0,0,0|2,0,0]=4 9754 B14R0.394 CC(=O)NCCCCCNCCCCF 2230a_200012022750_100000729493 [1,1,0,0,0,0|2,0,0]=4 9755 B14R0.394 CC(=O)NCCCCCNCCCCF 34a_200012022750_100000729493 [1,1,0,0,0,0|2,0,0]=4 9756 B14R0.394 CC(=O)NCCCCCNCCCCO 2230a_200012022750_100000210776 [1,1,0,0,0,0|2,0,0]=4 9757 B14R0.394 CC(=O)NCCCCCNCCCCO 34a_200012022750_100011216708 [1,1,0,0,0,0|2,0,0]=4 9758 B14R0.394 CC(=O)NCCCCNCCCCCF 2230a_200011368371_100000729378 [1,1,0,0,0,0|2,0,0]=4 9759 B14R0.394 CC(=O)NCCCCNCCCCCF 34a_200011368371_100000729378 [1,1,0,0,0,0|2,0,0]=4 9760 B14R0.394 CC(=O)NCCCCNCCCCCO 2230a_200011368371_100000746330 [1,1,0,0,0,0|2,0,0]=4 9761 B14R0.394 CC(=O)NCCCCNCCCCCO 34a_200011368371_100000746330 [1,1,0,0,0,0|2,0,0]=4 9762 B14R0.394 CC(=O)NCCCNCCCCCCF 34a_100000736810_100015922095 [1,1,0,0,0,0|2,0,0]=4 9763 B14R0.394 CC(=O)NCCCNCCCCCCO 34a_100000736810_100000766143 [1,1,0,0,0,0|2,0,0]=4 9764 B14R0.394 CC(=O)NCCCOCCCCCCF 34a_100000752032_100015922095 [1,1,0,0,0,0|2,0,0]=4 9765 B14R0.394 CC(=O)NCCCOCCCCCCO 34a_100000752032_100000766143 [1,1,0,0,0,0|2,0,0]=4 9766 B14R0.394 CC(=O)NCCNCCCCCCCO 2230a_100000209853_100000760002 [1,1,0,0,0,0|2,0,0]=4 9767 B14R0.394 CC(=O)NCCNCCCCCCCO 2230a_100011996573_100000189650 [1,1,0,0,0,0|2,0,0]=4 9768 B14R0.394 CC(=O)NCCOCCCCCCCBr 7a_100000760002_100000189650 [1,1,0,0,0,0|2,0,0]=4 9769 B14R0.394 CC(=O)NCCOCCCCCCCO 34a_100000158858_100000760002 [1,1,0,0,0,0|2,0,0]=4 9770 B14R0.394 CC(=O)NCCSCCCCCCCO 62a_100000189650_100000760002 [1,1,0,0,0,0|2,0,0]=4 9771 B14R0.394 CC(=O)NCCSCCCCCCCO 62a_100000760002_100000189650 [1,1,0,0,0,0|2,0,0]=4 9772 B14R0.394 CC(=O)OCCCCCNCCCCO 2230a_100000750430_100009813381 [1,1,0,0,0,0|2,0,0]=4 9773 B14R0.394 CC(=O)OCCCCCNCCCCO 34a_100000750430_100000033007 [1,1,0,0,0,0|2,0,0]=4 9774 B14R0.394 CC(=O)OCCCCCOCCCCBr 34a_100011216708_100000033007 [1,1,0,0,0,0|2,0,0]=4 9775 B14R0.394 CC(=O)OCCCCCOCCCCCl 34a_100000210776_100000033007 [1,1,0,0,0,0|2,0,0]=4 9776 B14R0.394 CC(=O)OCCCCCOCCCCCl 7a_100000210776_100000033007 [1,1,0,0,0,0|2,0,0]=4 9777 B14R0.394 CC(=O)OCCCCCOCCCCF 34a_100011995726_100000033007 [1,1,0,0,0,0|2,0,0]=4 9778 B14R0.394 CC(=O)OCCCCCOCCCCF 7a_100011995726_100000033007 [1,1,0,0,0,0|2,0,0]=4 9779 B14R0.394 CC(=O)OCCCCCOCCCCI 34a_200012148704_100000033007 [1,1,0,0,0,0|2,0,0]=4 9780 B14R0.394 CC(=O)OCCCCCOCCCCN 34a_100000750430_100000033007 [1,1,0,0,0,0|2,0,0]=4 9781 B14R0.394 CC(=O)OCCCCCSCCCCF 62a_100000033007_100000729493 [1,1,0,0,0,0|2,0,0]=4 9782 B14R0.394 CC(=O)OCCCCCSCCCCF 62a_100000729493_100000033007 [1,1,0,0,0,0|2,0,0]=4 9783 B14R0.394 CC(=O)OCCCCCSCCCCO 62a_100000033007_100000210776 [1,1,0,0,0,0|2,0,0]=4 9784 B14R0.394 CC(=O)OCCCCCSCCCCO 62a_100000210776_100000033007 [1,1,0,0,0,0|2,0,0]=4 9785 B14R0.394 CC(=O)OCCCCNCCCCCO 34a_100000762737_100000033659 [1,1,0,0,0,0|2,0,0]=4 9786 B14R0.394 CC(=O)OCCCCOCCCCCBr 34a_100000746331_100000033659 [1,1,0,0,0,0|2,0,0]=4 9787 B14R0.394 CC(=O)OCCCCOCCCCCBr 7a_100000746331_100000033659 [1,1,0,0,0,0|2,0,0]=4 9788 B14R0.394 CC(=O)OCCCCOCCCCCCl 34a_100000746330_100000033659 [1,1,0,0,0,0|2,0,0]=4 9789 B14R0.394 CC(=O)OCCCCOCCCCCCl 7a_100000746330_100000033659 [1,1,0,0,0,0|2,0,0]=4 9790 B14R0.394 CC(=O)OCCCCOCCCCCF 34a_100000073216_100000729378 [1,1,0,0,0,0|2,0,0]=4 9791 B14R0.394 CC(=O)OCCCCOCCCCCF 7a_100000073216_100000729378 [1,1,0,0,0,0|2,0,0]=4 9792 B14R0.394 CC(=O)OCCCCOCCCCCI 34a_200012148887_100000033659 [1,1,0,0,0,0|2,0,0]=4 9793 B14R0.394 CC(=O)OCCCCOCCCCCI 7a_200012148887_100000033659 [1,1,0,0,0,0|2,0,0]=4 9794 B14R0.394 CC(=O)OCCCCOCCCCCN 34a_100000762737_100000033659 [1,1,0,0,0,0|2,0,0]=4 9795 B14R0.394 CC(=O)OCCCCOCCCCCO 34a_100000073216_100000746330 [1,1,0,0,0,0|2,0,0]=4 9796 B14R0.394 CC(=O)OCCCCOCCCCCO 7a_100000073216_100000746330 [1,1,0,0,0,0|2,0,0]=4 9797 B14R0.394 CC(=O)OCCCCSCCCCCF 62a_100000033659_100000729378 [1,1,0,0,0,0|2,0,0]=4 9798 B14R0.394 CC(=O)OCCCCSCCCCCF 62a_100000729378_100000033659 [1,1,0,0,0,0|2,0,0]=4 9799 B14R0.394 CC(=O)OCCCCSCCCCCO 62a_100000033659_100000746330 [1,1,0,0,0,0|2,0,0]=4 9800 B14R0.394 CC(=O)OCCCCSCCCCCO 62a_100000746330_100000033659 [1,1,0,0,0,0|2,0,0]=4 9801 B14R0.394 CC(=O)OCCCNCCCCCCO 34a_100000686447_100000042594 [1,1,0,0,0,0|2,0,0]=4 9802 B14R0.394 CC(=O)OCCCOCCCCCCBr 34a_100011215345_100000042594 [1,1,0,0,0,0|2,0,0]=4 9803 B14R0.394 CC(=O)OCCCOCCCCCCBr 7a_100011215345_100000042594 [1,1,0,0,0,0|2,0,0]=4 9804 B14R0.394 CC(=O)OCCCOCCCCCCCl 34a_100000766143_100000042594 [1,1,0,0,0,0|2,0,0]=4 9805 B14R0.394 CC(=O)OCCCOCCCCCCCl 7a_100000766143_100000042594 [1,1,0,0,0,0|2,0,0]=4 9806 B14R0.394 CC(=O)OCCCOCCCCCCF 34a_100000732779_100000042594 [1,1,0,0,0,0|2,0,0]=4 9807 B14R0.394 CC(=O)OCCCOCCCCCCF 7a_100000732779_100000042594 [1,1,0,0,0,0|2,0,0]=4 9808 B14R0.394 CC(=O)OCCCOCCCCCCN 34a_100000686447_100000042594 [1,1,0,0,0,0|2,0,0]=4 9809 B14R0.394 CC(=O)OCCCSCCCCCCF 62a_100000042594_100015922095 [1,1,0,0,0,0|2,0,0]=4 9810 B14R0.394 CC(=O)OCCCSCCCCCCF 62a_100015922095_100000042594 [1,1,0,0,0,0|2,0,0]=4 9811 B14R0.394 CC(=O)OCCCSCCCCCCO 62a_100000042594_100000766143 [1,1,0,0,0,0|2,0,0]=4 9812 B14R0.394 CC(=O)OCCCSCCCCCCO 62a_100000766143_100000042594 [1,1,0,0,0,0|2,0,0]=4 9813 B14R0.394 CC(=O)OCCNCCCCCCCO 34a_100011996573_100009814007 [1,1,0,0,0,0|2,0,0]=4 9814 B14R0.394 CC(=O)OCCOCCCCCCCBr 34a_100000760002_100009814007 [1,1,0,0,0,0|2,0,0]=4 9815 B14R0.394 CC(=O)OCCOCCCCCCCBr 7a_100000760002_100009814007 [1,1,0,0,0,0|2,0,0]=4 9816 B14R0.394 CC(=O)OCCOCCCCCCCN 34a_100011996573_100009814007 [1,1,0,0,0,0|2,0,0]=4 9817 B14R0.394 CC(=O)OCCSCCCCCCCO 62a_100000760002_100009814007 [1,1,0,0,0,0|2,0,0]=4 9818 B14R0.394 CC(=O)OCCSCCCCCCCO 62a_100009814007_100000760002 [1,1,0,0,0,0|2,0,0]=4 9819 B14R0.394 CC(=O)OCNCCCCCCCCO 34a_102515433106_100009813279 [1,1,0,0,0,0|2,0,0]=4 9820 B14R0.394 CC(=O)OCOCCCCCCCCBr 34a_100009813846_100009813279 [1,1,0,0,0,0|2,0,0]=4 9821 B14R0.394 CC(=O)OCOCCCCCCCCCl 34a_100000033203_100009813279 [1,1,0,0,0,0|2,0,0]=4 9822 B14R0.394 CC(=O)OCOCCCCCCCCN 34a_102515433106_100009813279 [1,1,0,0,0,0|2,0,0]=4 9823 B14R0.394 CC(=O)OCSCCCCCCCCO 62a_100000033203_100000076356 [1,1,0,0,0,0|2,0,0]=4 9824 B14R0.394 CC(=O)OCSCCCCCCCCO 62a_100000076356_100000033203 [1,1,0,0,0,0|2,0,0]=4 9825 B14R0.394 CC(=O)SCCCCNCCCCCO 2230a_100000762737_200010402107 [1,1,0,0,0,0|2,0,0]=4 9826 B14R0.394 CC(=O)SCCCCNCCCCCO 34a_100000762737_200010402107 [1,1,0,0,0,0|2,0,0]=4 9827 B14R0.394 CC(=O)SCCCCOCCCCCBr 34a_100000746331_200010402107 [1,1,0,0,0,0|2,0,0]=4 9828 B14R0.394 CC(=O)SCCCCOCCCCCBr 7a_100000746331_200010402107 [1,1,0,0,0,0|2,0,0]=4 9829 B14R0.394 CC(=O)SCCCCOCCCCCCl 34a_100000746330_200010402107 [1,1,0,0,0,0|2,0,0]=4 9830 B14R0.394 CC(=O)SCCCCOCCCCCCl 7a_100000746330_200010402107 [1,1,0,0,0,0|2,0,0]=4 9831 B14R0.394 CC(=O)SCCCCOCCCCCI 34a_200012148887_200010402107 [1,1,0,0,0,0|2,0,0]=4 9832 B14R0.394 CC(=O)SCCCCOCCCCCI 7a_200012148887_200010402107 [1,1,0,0,0,0|2,0,0]=4 9833 B14R0.394 CC(=O)SCCCCOCCCCCN 34a_100000762737_200010402107 [1,1,0,0,0,0|2,0,0]=4 9834 B14R0.394 CC(=O)SCCCCSCCCCCF 62a_100000729378_200010402107 [1,1,0,0,0,0|2,0,0]=4 9835 B14R0.394 CC(=O)SCCCCSCCCCCF 62a_200010402107_100000729378 [1,1,0,0,0,0|2,0,0]=4 9836 B14R0.394 CC(=O)SCCCCSCCCCCO 62a_100000746330_200010402107 [1,1,0,0,0,0|2,0,0]=4 9837 B14R0.394 CC(=O)SCCCCSCCCCCO 62a_200010402107_100000746330 [1,1,0,0,0,0|2,0,0]=4 9838 B14R0.394 CC(=O)SCCCNCCCCCCO 2230a_100000686447_100000038929 [1,1,0,0,0,0|2,0,0]=4 9839 B14R0.394 CC(=O)SCCCNCCCCCCO 34a_100000686447_100000038929 [1,1,0,0,0,0|2,0,0]=4 9840 B14R0.394 CC(=O)SCCCOCCCCCCBr 34a_100011215345_100000038929 [1,1,0,0,0,0|2,0,0]=4 9841 B14R0.394 CC(=O)SCCCOCCCCCCBr 7a_100011215345_100000038929 [1,1,0,0,0,0|2,0,0]=4 9842 B14R0.394 CC(=O)SCCCOCCCCCCCl 34a_100000766143_100000038929 [1,1,0,0,0,0|2,0,0]=4 9843 B14R0.394 CC(=O)SCCCOCCCCCCCl 7a_100000766143_100000038929 [1,1,0,0,0,0|2,0,0]=4 9844 B14R0.394 CC(=O)SCCCOCCCCCCF 34a_100000732779_100000038929 [1,1,0,0,0,0|2,0,0]=4 9845 B14R0.394 CC(=O)SCCCOCCCCCCF 7a_100000732779_100000038929 [1,1,0,0,0,0|2,0,0]=4 9846 B14R0.394 CC(=O)SCCCOCCCCCCN 34a_100000686447_100000038929 [1,1,0,0,0,0|2,0,0]=4 9847 B14R0.394 CC(=O)SCCCSCCCCCCF 62a_100000038929_100015922095 [1,1,0,0,0,0|2,0,0]=4 9848 B14R0.394 CC(=O)SCCCSCCCCCCF 62a_100015922095_100000038929 [1,1,0,0,0,0|2,0,0]=4 9849 B14R0.394 CC(=O)SCCCSCCCCCCO 62a_100000038929_100000766143 [1,1,0,0,0,0|2,0,0]=4 9850 B14R0.394 CC(=O)SCCCSCCCCCCO 62a_100000766143_100000038929 [1,1,0,0,0,0|2,0,0]=4 9851 B14R0.394 CC/C=C/CCCOCCCCC(=O)C 34a_100016287902_100009817362 [1,1,0,0,0,0|0,0,2]=4 9852 B14R0.394 CC/C=C/CCCOCCCCC(=O)C 7a_100016287902_100000735457 [1,1,0,0,0,0|0,0,2]=4 9853 B14R0.394 CC/C=C\CCCCCOCCC(=O)C 7a_100016268722_100000053229 [1,1,0,0,0,0|0,0,2]=4 9854 B14R0.394 CC/C=C\CCCCOCCCC(=O)C 34a_100016287862_100000685027 [1,1,0,0,0,0|0,0,2]=4 9855 B14R0.394 CC/C=C\CCCCOCCCC(=O)C 7a_100016287862_100011215641 [1,1,0,0,0,0|0,0,2]=4 9856 B14R0.394 CCC#CCCCCCCNCC(=O)O 269956a_100016091260_200000036426 [1,1,0,0,0,0|0,0,2]=4 9857 B14R0.394 CCC#CCCCCCCOCC(=O)C 34a_100000211253_200000036426 [1,1,0,0,0,0|0,0,2]=4 9858 B14R0.394 CCCC#CCCOCCCCC(=O)C 34a_100000042726_100009817362 [1,1,0,0,0,0|0,0,2]=4 9859 B14R0.394 CCCC#CCCOCCCCC(=O)C 7a_100000042726_100000735457 [1,1,0,0,0,0|0,0,2]=4 9860 B14R0.394 CCCC/C=C/COCCCCC(=O)C 34a_200016272032_100009817362 [1,1,0,0,0,0|0,0,2]=4 9861 B14R0.394 CCCC/C=C/COCCCCC(=O)C 7a_200016272032_100000735457 [1,1,0,0,0,0|0,0,2]=4 9862 B14R0.394 CCCC/C=C\CCOCCCC(=O)C 34a_200016286491_100000685027 [1,1,0,0,0,0|0,0,2]=4 9863 B14R0.394 CCCC/C=C\CCOCCCC(=O)C 7a_200016286491_100011215641 [1,1,0,0,0,0|0,0,2]=4 9864 B14R0.394 CCCCC#CCCCCCCC(=O)C 1458a_100000070787_200000043322 [1,1,0,0,0,0|0,0,1]=3 9865 B14R0.394 CCCCC#CCCCOCCC(=O)C 34a_100000759926_200000047210 [1,1,0,0,0,0|0,0,2]=4 9866 B14R0.394 CCCCC#CCCCOCCC(=O)C 7a_100000759926_200000047210 [1,1,0,0,0,0|0,0,2]=4 9867 B14R0.394 CCCCC#CCCCSCCC(=O)C 62a_100000053229_200000047210 [1,1,0,0,0,0|0,0,2]=4 9868 B14R0.394 CCCCC#CCCCSCCC(=O)C 62a_200000047210_100000053229 [1,1,0,0,0,0|0,0,2]=4 9869 B14R0.394 CCCCC#CCCOCCCC(=O)C 34a_100000037610_100000685027 [1,1,0,0,0,0|0,0,2]=4 9870 B14R0.394 CCCCC#CCCOCCCC(=O)C 7a_100000037610_100011215641 [1,1,0,0,0,0|0,0,2]=4 9871 B14R0.394 CCCCC#CCOCCCCC(=O)C 34a_200000034558_100009817362 [1,1,0,0,0,0|0,0,2]=4 9872 B14R0.394 CCCCC#CCOCCCCC(=O)C 7a_200000034558_100000735457 [1,1,0,0,0,0|0,0,2]=4 9873 B14R0.394 CCCCC/C=C/COCCCC(=O)C 34a_100016258190_100000685027 [1,1,0,0,0,0|0,0,2]=4 9874 B14R0.394 CCCCC/C=C/COCCCC(=O)C 7a_100016258190_100011215641 [1,1,0,0,0,0|0,0,2]=4 9875 B14R0.394 CCCCC/C=C\CCOCCC(=O)C 7a_100016277358_100000053229 [1,1,0,0,0,0|0,0,2]=4 9876 B14R0.394 CCCCCC#CCCOCCC(=O)C 7a_200000042877_100000053229 [1,1,0,0,0,0|0,0,2]=4 9877 B14R0.394 CCCCCC#CCOCCCC(=O)C 34a_100000759063_100009816472 [1,1,0,0,0,0|0,0,2]=4 9878 B14R0.394 CCCCCC#CCOCCCC(=O)C 34a_200000033628_100000685027 [1,1,0,0,0,0|0,0,2]=4 9879 B14R0.394 CCCCCC#CCOCCCC(=O)C 7a_100000759063_100009816472 [1,1,0,0,0,0|0,0,2]=4 9880 B14R0.394 CCCCCC#CCOCCCC(=O)C 7a_200000033628_100011215641 [1,1,0,0,0,0|0,0,2]=4 9881 B14R0.394 CCCCCC#CCSCCCC(=O)C 62a_100009816472_100011215641 [1,1,0,0,0,0|0,0,2]=4 9882 B14R0.394 CCCCCC#CCSCCCC(=O)C 62a_100011215641_100009816472 [1,1,0,0,0,0|0,0,2]=4 9883 B14R0.394 CCCCCC/C=C/COCCC(=O)C 7a_200016276170_100000053229 [1,1,0,0,0,0|0,0,2]=4 9884 B14R0.394 CCCCCCC#CCOCCC(=O)C 7a_200000037284_100000053229 [1,1,0,0,0,0|0,0,2]=4 9885 B14R0.394 CCCCCCCCCC=NNC(=O)C 4a_100000189765_100000210895 [1,1,0,0,0,0|1,0,1]=4 9886 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100000070787_100000759014 [1,1,0,0,0,0|0,0,0]=2 9887 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100011215791_200000210301 [1,1,0,0,0,0|0,0,0]=2 9888 B14R0.394 CCCCCCCCCCCCC(=O)[13CH3] 1458a_100011215791_200025704644 [1,1,0,0,0,0|0,0,0]=2 9889 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100000227908_200000210301 [1,1,0,0,0,0|2,0,0]=4 9890 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100102631434_100011215052 [1,1,0,0,0,0|2,0,0]=4 9891 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100000227908_200000210301 [1,1,0,0,0,0|2,0,0]=4 9892 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100102631434_100000759014 [1,1,0,0,0,0|2,0,0]=4 9893 B14R0.394 CCCCCCCCCCCCN(C)C 270004a_100102631434_100011218549 [1,1,0,0,0,0|2,0,0]=4 9894 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 2230a_100000227908_200025704644 [1,1,0,0,0,0|2,0,0]=4 9895 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 269982a_100000227908_200025704644 [1,1,0,0,0,0|2,0,0]=4 9896 B14R0.394 CCCCCCCCCCCNC(=O)C 11a_200011215754_100015343762 [1,1,0,0,0,0|0,0,0]=2 9897 B14R0.394 CCCCCCCCCCCNC(=O)C 1626a_200011215754_100015343762 [1,1,0,0,0,0|0,0,0]=2 9898 B14R0.394 CCCCCCCCCCCNC(=O)C 240690a_200011215754_100015343762 [1,1,0,0,0,0|0,0,0]=2 9899 B14R0.394 CCCCCCCCCCCNC(=O)C 527a_200011215754_100103153847 [1,1,0,0,0,0|0,0,0]=2 9900 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_100138425928_100011215454 [1,1,0,0,0,0|1,0,1]=4 9901 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_200011215754_100000210206 [1,1,0,0,0,0|1,0,1]=4 9902 B14R0.394 CCCCCCCCCCCNC(C)C 34a_100138425928_100011215454 [1,1,0,0,0,0|1,0,1]=4 9903 B14R0.394 CCCCCCCCCCCNC(C)C 34a_200011215754_100000210206 [1,1,0,0,0,0|1,0,1]=4 9904 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000210809_100000210206 [1,1,0,0,0,0|1,0,1]=4 9905 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000212225_100011215454 [1,1,0,0,0,0|1,0,1]=4 9906 B14R0.394 CCCCCCCCCCCOC(C)C 7a_100000210809_100000210206 [1,1,0,0,0,0|1,0,1]=4 9907 B14R0.394 CCCCCCCCCCCSC(C)C 62a_100000210206_100011215454 [1,1,0,0,0,0|1,0,1]=4 9908 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000684558_100000747473 [1,1,0,0,0,0|1,0,0]=3 9909 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210320 [1,1,0,0,0,0|1,0,0]=3 9910 B14R0.394 CCCCCCCCCCNCC(=O)N 34a_100000684558_100000187820 [1,1,0,0,0,0|1,0,0]=3 9911 B14R0.394 CCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210320 [1,1,0,0,0,0|0,0,0]=2 9912 B14R0.394 CCCCCCCCCCNCC(=O)[O-] 34a_100000684558_100020667443 [1,1,0,0,0,0|0,0,1]=3 9913 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000210953_100000210320 [1,1,0,0,0,0|1,0,1]=4 9914 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000684558_100000210760 [1,1,0,0,0,0|1,0,1]=4 9915 B14R0.394 CCCCCCCCCCNCC(C)C 270004a_100000684558_100000210432 [1,1,0,0,0,0|1,0,1]=4 9916 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000210953_100000210320 [1,1,0,0,0,0|1,0,1]=4 9917 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000684558_100000210624 [1,1,0,0,0,0|1,0,1]=4 9918 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000210904_100000210320 [1,1,0,0,0,0|0,0,2]=4 9919 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000684558_100011218427 [1,1,0,0,0,0|0,0,2]=4 9920 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000210904_100000210320 [1,1,0,0,0,0|0,0,2]=4 9921 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000684558_100011218427 [1,1,0,0,0,0|0,0,2]=4 9922 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 2230a_100000684558_100009817552 [1,1,0,0,0,0|0,0,2]=4 9923 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 34a_100000684558_100009817552 [1,1,0,0,0,0|0,0,2]=4 9924 B14R0.394 CCCCCCCCCCNC[N+](=O)[O-] 34a_100000684558_100000761209 [1,1,0,0,0,0|1,0,1]=4 9925 B14R0.394 CCCCCCCCCCOCC(=O)C 34a_100000211253_100000210320 [1,1,0,0,0,0|0,0,0]=2 9926 B14R0.394 CCCCCCCCCCOCC(=O)N 34a_100000210711_100000187820 [1,1,0,0,0,0|1,0,0]=3 9927 B14R0.394 CCCCCCCCCCOCC(=O)N 7a_100000210711_100000187820 [1,1,0,0,0,0|1,0,0]=3 9928 B14R0.394 CCCCCCCCCCOCC(=O)[O-] 34a_100000210711_100020667443 [1,1,0,0,0,0|0,0,1]=3 9929 B14R0.394 CCCCCCCCCCOCC(C)Br 34a_100012180447_100000210320 [1,1,0,0,0,0|1,0,1]=4 9930 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210257_100000210320 [1,1,0,0,0,0|1,0,1]=4 9931 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210711_100000210624 [1,1,0,0,0,0|1,0,1]=4 9932 B14R0.394 CCCCCCCCCCOCC(C)C 7a_100000210711_100000210760 [1,1,0,0,0,0|1,0,1]=4 9933 B14R0.394 CCCCCCCCCCOCC(C)F 34a_100015925927_100000210320 [1,1,0,0,0,0|1,0,1]=4 9934 B14R0.394 CCCCCCCCCCOCC(C)O 34a_100000210711_100011218427 [1,1,0,0,0,0|0,0,2]=4 9935 B14R0.394 CCCCCCCCCCOCC(C)O 7a_100000210711_100011218427 [1,1,0,0,0,0|0,0,2]=4 9936 B14R0.394 CCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210320 [1,1,0,0,0,0|1,0,1]=4 9937 B14R0.394 CCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210320 [1,1,0,0,0,0|1,0,1]=4 9938 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 34a_100000210711_100009817552 [1,1,0,0,0,0|0,0,2]=4 9939 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 7a_100000210711_100009817552 [1,1,0,0,0,0|0,0,2]=4 9940 B14R0.394 CCCCCCCCCCOC[N+](=O)[O-] 34a_100000210711_100000761209 [1,1,0,0,0,0|1,0,1]=4 9941 B14R0.394 CCCCCCCCCCSCC(=O)N 62a_100000747473_100000210320 [1,1,0,0,0,0|1,0,0]=3 9942 B14R0.394 CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210320 [1,1,0,0,0,0|0,0,1]=3 9943 B14R0.394 CCCCCCCCCCSCC(C)C 62a_100000210624_100000210320 [1,1,0,0,0,0|1,0,1]=4 9944 B14R0.394 CCCCCCCCCCSCC(C)O 62a_100011218427_100000210320 [1,1,0,0,0,0|0,0,2]=4 9945 B14R0.394 CCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210320 [1,1,0,0,0,0|0,0,2]=4 9946 B14R0.394 CCCCCCCCCNCC=C(C)C 2230a_100000212291_100000761012 [1,1,0,0,0,0|1,0,1]=4 9947 B14R0.394 CCCCCCCCCNCC=C(C)C 34a_100000212291_100000761012 [1,1,0,0,0,0|1,0,1]=4 9948 B14R0.394 CCCCCCCCCNCC=C(C)C 34a_100000718196_100011214924 [1,1,0,0,0,0|1,0,1]=4 9949 B14R0.394 CCCCCCCCCNCCC(=O)N 2230a_100000212291_100000744528 [1,1,0,0,0,0|1,0,0]=3 9950 B14R0.394 CCCCCCCCCNCCC(=O)N 34a_100000212291_100000731001 [1,1,0,0,0,0|1,0,0]=3 9951 B14R0.394 CCCCCCCCCNCCC(C)C 2230a_100000212291_100000210312 [1,1,0,0,0,0|1,0,1]=4 9952 B14R0.394 CCCCCCCCCNCCC(C)C 269862a_100000212291_100000185833 [1,1,0,0,0,0|1,0,1]=4 9953 B14R0.394 CCCCCCCCCNCCC(C)C 34a_100000212291_100000210312 [1,1,0,0,0,0|1,0,1]=4 9954 B14R0.394 CCCCCCCCCNCCC(C)O 2230a_100000212291_100012276601 [1,1,0,0,0,0|0,0,2]=4 9955 B14R0.394 CCCCCCCCCNCCC(C)O 2230a_200000755665_100011214924 [1,1,0,0,0,0|0,0,2]=4 9956 B14R0.394 CCCCCCCCCNCCC(C)O 34a_100000212291_100012276601 [1,1,0,0,0,0|0,0,2]=4 9957 B14R0.394 CCCCCCCCCNCOC(=O)C 34a_100000212291_100009813279 [1,1,0,0,0,0|1,0,0]=3 9958 B14R0.394 CCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210670 [1,1,0,0,0,0|1,0,0]=3 9959 B14R0.394 CCCCCCCCCOCC=C(C)C 34a_100000210712_100000761012 [1,1,0,0,0,0|1,0,1]=4 9960 B14R0.394 CCCCCCCCCOCC=C(C)C 34a_100000753907_100011214924 [1,1,0,0,0,0|1,0,1]=4 9961 B14R0.394 CCCCCCCCCOCC=C(C)C 7a_100000210712_100000761012 [1,1,0,0,0,0|1,0,1]=4 9962 B14R0.394 CCCCCCCCCOCCC(=O)C 34a_100000759926_100011214924 [1,1,0,0,0,0|0,0,0]=2 9963 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000210712_100000053229 [1,1,0,0,0,0|0,0,0]=2 9964 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000759926_100000210328 [1,1,0,0,0,0|0,0,0]=2 9965 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000210712_100000731001 [1,1,0,0,0,0|1,0,0]=3 9966 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000757172_100011214924 [1,1,0,0,0,0|1,0,0]=3 9967 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000210712_100000744528 [1,1,0,0,0,0|1,0,0]=3 9968 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000757172_100000210328 [1,1,0,0,0,0|1,0,0]=3 9969 B14R0.394 CCCCCCCCCOCCC(C)Br 34a_100009893172_100011214924 [1,1,0,0,0,0|1,0,1]=4 9970 B14R0.394 CCCCCCCCCOCCC(C)C 34a_100000210254_100011214924 [1,1,0,0,0,0|1,0,1]=4 9971 B14R0.394 CCCCCCCCCOCCC(C)C 34a_100000210712_100000210312 [1,1,0,0,0,0|1,0,1]=4 9972 B14R0.394 CCCCCCCCCOCCC(C)C 7a_100000210254_100000210328 [1,1,0,0,0,0|1,0,1]=4 9973 B14R0.394 CCCCCCCCCOCCC(C)C 7a_100000210712_100000210626 [1,1,0,0,0,0|1,0,1]=4 9974 B14R0.394 CCCCCCCCCOCCC(C)O 34a_100000210712_100012276601 [1,1,0,0,0,0|0,0,2]=4 9975 B14R0.394 CCCCCCCCCOCCC(C)O 7a_100000210712_100012276601 [1,1,0,0,0,0|0,0,2]=4 9976 B14R0.394 CCCCCCCCCOCCN(C)C 7a_100000210712_100000755713 [1,1,0,0,0,0|2,0,0]=4 9977 B14R0.394 CCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100011214924 [1,1,0,0,0,0|1,0,1]=4 9978 B14R0.394 CCCCCCCCCOCOC(=O)C 34a_100000210712_100009813279 [1,1,0,0,0,0|1,0,0]=3 9979 B14R0.394 CCCCCCCCCSCC=C(C)C 62a_100000761012_100000210670 [1,1,0,0,0,0|1,0,1]=4 9980 B14R0.394 CCCCCCCCCSCCC(=O)C 62a_100000053229_100000210670 [1,1,0,0,0,0|0,0,0]=2 9981 B14R0.394 CCCCCCCCCSCCC(=O)N 62a_100000744528_100000210670 [1,1,0,0,0,0|1,0,0]=3 9982 B14R0.394 CCCCCCCCCSCCC(C)C 62a_100000210312_100000210670 [1,1,0,0,0,0|1,0,1]=4 9983 B14R0.394 CCCCCCCCCSCCC(C)O 62a_100012276601_100000210670 [1,1,0,0,0,0|0,0,2]=4 9984 B14R0.394 CCCCCCCCCSCOC(=O)C 62a_100000076356_100000210670 [1,1,0,0,0,0|1,0,0]=3 9985 B14R0.394 CCCCCCCCNCCC=C(C)C 2230a_100000229939_100011217483 [1,1,0,0,0,0|1,0,1]=4 9986 B14R0.394 CCCCCCCCNCCC=C(C)C 34a_100000229939_100011217483 [1,1,0,0,0,0|1,0,1]=4 9987 B14R0.394 CCCCCCCCNCCCC(=O)C 34a_100000229939_100000685027 [1,1,0,0,0,0|0,0,0]=2 9988 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000229939_100102525003 [1,1,0,0,0,0|1,0,0]=3 9989 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000739312_100000210759 [1,1,0,0,0,0|1,0,0]=3 9990 B14R0.394 CCCCCCCCNCCCC(C)C 2230a_100000229939_100011214892 [1,1,0,0,0,0|1,0,1]=4 9991 B14R0.394 CCCCCCCCNCCCC(C)C 2230a_200000737386_100000210759 [1,1,0,0,0,0|1,0,1]=4 9992 B14R0.394 CCCCCCCCNCCCC(C)C 34a_100000229939_100011214892 [1,1,0,0,0,0|1,0,1]=4 9993 B14R0.394 CCCCCCCCNCCCC(C)C 34a_200000737386_100000210759 [1,1,0,0,0,0|1,0,1]=4 9994 B14R0.394 CCCCCCCCNCCCC(C)O 2230a_100000229939_200000718107 [1,1,0,0,0,0|0,0,2]=4 9995 B14R0.394 CCCCCCCCNCCCC(C)O 34a_100000229939_200000718107 [1,1,0,0,0,0|0,0,2]=4 9996 B14R0.394 CCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210759 [1,1,0,0,0,0|1,0,0]=3 9997 B14R0.394 CCCCCCCCNCCNC(=O)C 2230a_100000209853_100000210759 [1,1,0,0,0,0|1,0,0]=3 9998 B14R0.394 CCCCCCCCNCCNC(=O)C 2230a_100000229939_100000189650 [1,1,0,0,0,0|1,0,0]=3 9999 B14R0.394 CCCCCCCCNCCNC(=O)N 2230a_100000229939_200000034859 [1,1,0,0,0,0|2,0,0]=4 10000 B14R0.394 CCCCCCCCNCCNC(=O)N 34a_100020590234_100000210759 [1,1,0,0,0,0|2,0,0]=4 10001 B14R0.394 CCCCCCCCNCCOC(=O)C 34a_100000229939_100009814007 [1,1,0,0,0,0|1,0,0]=3 10002 B14R0.394 CCCCCCCCNCCOC(=O)N 34a_100000229939_200011214921 [1,1,0,0,0,0|2,0,0]=4 10003 B14R0.394 CCCCCCCCOCCC=C(C)C 34a_100000210232_100011217483 [1,1,0,0,0,0|1,0,1]=4 10004 B14R0.394 CCCCCCCCOCCC=C(C)C 7a_100000210232_100011217483 [1,1,0,0,0,0|1,0,1]=4 10005 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000210232_100000685027 [1,1,0,0,0,0|0,0,0]=2 10006 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000759063_100000210759 [1,1,0,0,0,0|0,0,0]=2 10007 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000210232_100011215641 [1,1,0,0,0,0|0,0,0]=2 10008 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000759063_100000210759 [1,1,0,0,0,0|0,0,0]=2 10009 B14R0.394 CCCCCCCCOCCCC(=O)N 34a_100000210232_100102525003 [1,1,0,0,0,0|1,0,0]=3 10010 B14R0.394 CCCCCCCCOCCCC(=O)N 7a_100000210232_100102525003 [1,1,0,0,0,0|1,0,0]=3 10011 B14R0.394 CCCCCCCCOCCCC(C)C 34a_100000210232_100011214892 [1,1,0,0,0,0|1,0,1]=4 10012 B14R0.394 CCCCCCCCOCCCC(C)C 34a_100000210774_100000210759 [1,1,0,0,0,0|1,0,1]=4 10013 B14R0.394 CCCCCCCCOCCCC(C)C 7a_100000210232_100011214892 [1,1,0,0,0,0|1,0,1]=4 10014 B14R0.394 CCCCCCCCOCCCC(C)C 7a_100000210774_100000210759 [1,1,0,0,0,0|1,0,1]=4 10015 B14R0.394 CCCCCCCCOCCCC(C)O 34a_100000210232_200000718107 [1,1,0,0,0,0|0,0,2]=4 10016 B14R0.394 CCCCCCCCOCCCC(C)O 7a_100000210232_200000718107 [1,1,0,0,0,0|0,0,2]=4 10017 B14R0.394 CCCCCCCCOCCCN(C)C 7a_100000210232_100000757444 [1,1,0,0,0,0|2,0,0]=4 10018 B14R0.394 CCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210759 [1,1,0,0,0,0|1,0,1]=4 10019 B14R0.394 CCCCCCCCOCCNC(=O)C 34a_100000158858_100000210759 [1,1,0,0,0,0|1,0,0]=3 10020 B14R0.394 CCCCCCCCOCCNC(=O)C 7a_100000210232_100000189650 [1,1,0,0,0,0|1,0,0]=3 10021 B14R0.394 CCCCCCCCOCCNC(=O)N 34a_100000181757_100000210759 [1,1,0,0,0,0|2,0,0]=4 10022 B14R0.394 CCCCCCCCOCCNC(=O)N 7a_100000210232_200000034859 [1,1,0,0,0,0|2,0,0]=4 10023 B14R0.394 CCCCCCCCOCCOC(=O)C 34a_100000210232_100009814007 [1,1,0,0,0,0|1,0,0]=3 10024 B14R0.394 CCCCCCCCOCCOC(=O)C 7a_100000210232_100009814007 [1,1,0,0,0,0|1,0,0]=3 10025 B14R0.394 CCCCCCCCOCCOC(=O)N 34a_100000210232_200011214921 [1,1,0,0,0,0|2,0,0]=4 10026 B14R0.394 CCCCCCCCOCCOC(=O)N 7a_100000210232_200011214921 [1,1,0,0,0,0|2,0,0]=4 10027 B14R0.394 CCCCCCCCOCCOC(=O)N 7a_100000766696_100000210759 [1,1,0,0,0,0|2,0,0]=4 10028 B14R0.394 CCCCCCCCSCCC=C(C)C 62a_100000210759_100011217483 [1,1,0,0,0,0|1,0,1]=4 10029 B14R0.394 CCCCCCCCSCCC=C(C)C 62a_100011217483_100000210317 [1,1,0,0,0,0|1,0,1]=4 10030 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100000210759_100011215641 [1,1,0,0,0,0|0,0,0]=2 10031 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100011215641_100000210317 [1,1,0,0,0,0|0,0,0]=2 10032 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100000210759_100102525003 [1,1,0,0,0,0|1,0,0]=3 10033 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100102525003_100000210317 [1,1,0,0,0,0|1,0,0]=3 10034 B14R0.394 CCCCCCCCSCCCC(C)C 62a_100000210759_100011214892 [1,1,0,0,0,0|1,0,1]=4 10035 B14R0.394 CCCCCCCCSCCCC(C)C 62a_100011214892_100000210317 [1,1,0,0,0,0|1,0,1]=4 10036 B14R0.394 CCCCCCCCSCCCC(C)O 62a_100000210759_200000718107 [1,1,0,0,0,0|0,0,2]=4 10037 B14R0.394 CCCCCCCCSCCCC(C)O 62a_200000718107_100000210317 [1,1,0,0,0,0|0,0,2]=4 10038 B14R0.394 CCCCCCCCSCCCN(C)C 62a_100000210759_100000757444 [1,1,0,0,0,0|2,0,0]=4 10039 B14R0.394 CCCCCCCCSCCNC(=O)C 62a_100000189650_100000210317 [1,1,0,0,0,0|1,0,0]=3 10040 B14R0.394 CCCCCCCCSCCNC(=O)C 62a_100000210759_100000189650 [1,1,0,0,0,0|1,0,0]=3 10041 B14R0.394 CCCCCCCCSCCNC(=O)N 62a_100000210759_200000034859 [1,1,0,0,0,0|2,0,0]=4 10042 B14R0.394 CCCCCCCCSCCNC(=O)N 62a_200000034859_100000210317 [1,1,0,0,0,0|2,0,0]=4 10043 B14R0.394 CCCCCCCCSCCOC(=O)C 62a_100000210759_100009814007 [1,1,0,0,0,0|1,0,0]=3 10044 B14R0.394 CCCCCCCCSCCOC(=O)C 62a_100009814007_100000210317 [1,1,0,0,0,0|1,0,0]=3 10045 B14R0.394 CCCCCCCCSCCOC(=O)N 62a_100000210759_200011214921 [1,1,0,0,0,0|2,0,0]=4 10046 B14R0.394 CCCCCCCCSCCOC(=O)N 62a_200011214921_100000210317 [1,1,0,0,0,0|2,0,0]=4 10047 B14R0.394 CCCCCCCNCCCCB(O)O 2230a_100000229938_200009817182 [1,1,0,0,0,0|1,0,1]=4 10048 B14R0.394 CCCCCCCNCCCCC(=O)N 34a_100000696515_100000210614 [1,1,0,0,0,0|1,0,0]=3 10049 B14R0.394 CCCCCCCNCCCCC(C)C 2230a_100000229938_100011216152 [1,1,0,0,0,0|1,0,1]=4 10050 B14R0.394 CCCCCCCNCCCNC(=O)C 34a_100000736810_100000210614 [1,1,0,0,0,0|1,0,0]=3 10051 B14R0.394 CCCCCCCNCCCOC(=S)C 2230a_100000229938_200135323944 [1,1,0,0,0,0|1,1,0]=4 10052 B14R0.394 CCCCCCCNCCCSC(=O)C 2230a_100000229938_100000038929 [1,1,0,0,0,0|1,0,0]=3 10053 B14R0.394 CCCCCCCNCCOCC(=O)N 2230a_100000229938_100000076697 [1,1,0,0,0,0|2,0,0]=4 10054 B14R0.394 CCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210614 [1,1,0,0,0,0|1,0,0]=3 10055 B14R0.394 CCCCCCCOCCCCB(O)O 34a_100000210272_200009817182 [1,1,0,0,0,0|1,0,1]=4 10056 B14R0.394 CCCCCCCOCCCCB(O)O 7a_100000210272_200009817182 [1,1,0,0,0,0|1,0,1]=4 10057 B14R0.394 CCCCCCCOCCCCC(=O)C 34a_100000210272_100009817362 [1,1,0,0,0,0|0,0,0]=2 10058 B14R0.394 CCCCCCCOCCCCC(=O)C 7a_100000210272_100000735457 [1,1,0,0,0,0|0,0,0]=2 10059 B14R0.394 CCCCCCCOCCCCC(=O)N 34a_100012022536_100000210614 [1,1,0,0,0,0|1,0,0]=3 10060 B14R0.394 CCCCCCCOCCCCC(=O)N 7a_100012022536_100000210614 [1,1,0,0,0,0|1,0,0]=3 10061 B14R0.394 CCCCCCCOCCCCC(C)C 34a_100000210272_100011216152 [1,1,0,0,0,0|1,0,1]=4 10062 B14R0.394 CCCCCCCOCCCCC(C)C 34a_100011214890_100000210614 [1,1,0,0,0,0|1,0,1]=4 10063 B14R0.394 CCCCCCCOCCCCC(C)C 7a_100000210272_100011216152 [1,1,0,0,0,0|1,0,1]=4 10064 B14R0.394 CCCCCCCOCCCCC(C)C 7a_100011214890_100000210614 [1,1,0,0,0,0|1,0,1]=4 10065 B14R0.394 CCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210614 [1,1,0,0,0,0|1,0,1]=4 10066 B14R0.394 CCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210614 [1,1,0,0,0,0|1,0,1]=4 10067 B14R0.394 CCCCCCCOCCCNC(=O)C 34a_100000752032_100000210614 [1,1,0,0,0,0|1,0,0]=3 10068 B14R0.394 CCCCCCCOCCCOC(=O)C 34a_100000210272_100000042594 [1,1,0,0,0,0|1,0,0]=3 10069 B14R0.394 CCCCCCCOCCCOC(=O)C 7a_100000210272_100000042594 [1,1,0,0,0,0|1,0,0]=3 10070 B14R0.394 CCCCCCCOCCCOC(=S)C 34a_100000210272_200135323944 [1,1,0,0,0,0|1,1,0]=4 10071 B14R0.394 CCCCCCCOCCCOC(=S)C 7a_100000210272_200135323944 [1,1,0,0,0,0|1,1,0]=4 10072 B14R0.394 CCCCCCCOCCCSC(=O)C 34a_100000210272_100000038929 [1,1,0,0,0,0|1,0,0]=3 10073 B14R0.394 CCCCCCCOCCCSC(=O)C 7a_100000210272_100000038929 [1,1,0,0,0,0|1,0,0]=3 10074 B14R0.394 CCCCCCCOCCOCC(=O)N 34a_100000210272_100000076697 [1,1,0,0,0,0|2,0,0]=4 10075 B14R0.394 CCCCCCCOCCOCC(=O)N 7a_100000210272_100000076697 [1,1,0,0,0,0|2,0,0]=4 10076 B14R0.394 CCCCCCCSCCCCB(O)O 62a_100000210614_200009817182 [1,1,0,0,0,0|1,0,1]=4 10077 B14R0.394 CCCCCCCSCCCCB(O)O 62a_200009817182_100000210316 [1,1,0,0,0,0|1,0,1]=4 10078 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000210614_100000735457 [1,1,0,0,0,0|0,0,0]=2 10079 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000735457_100000210316 [1,1,0,0,0,0|0,0,0]=2 10080 B14R0.394 CCCCCCCSCCCCC(C)C 62a_100000210614_100011216152 [1,1,0,0,0,0|1,0,1]=4 10081 B14R0.394 CCCCCCCSCCCCC(C)C 62a_100011216152_100000210316 [1,1,0,0,0,0|1,0,1]=4 10082 B14R0.394 CCCCCCCSCCCCN(C)C 62a_100000210614_100000690147 [1,1,0,0,0,0|2,0,0]=4 10083 B14R0.394 CCCCCCCSCCCOC(=O)C 62a_100000042594_100000210316 [1,1,0,0,0,0|1,0,0]=3 10084 B14R0.394 CCCCCCCSCCCOC(=O)C 62a_100000210614_100000042594 [1,1,0,0,0,0|1,0,0]=3 10085 B14R0.394 CCCCCCCSCCCOC(=S)C 62a_100000210614_200135323944 [1,1,0,0,0,0|1,1,0]=4 10086 B14R0.394 CCCCCCCSCCCOC(=S)C 62a_200135323944_100000210316 [1,1,0,0,0,0|1,1,0]=4 10087 B14R0.394 CCCCCCCSCCCSC(=O)C 62a_100000038929_100000210316 [1,1,0,0,0,0|1,0,0]=3 10088 B14R0.394 CCCCCCCSCCCSC(=O)C 62a_100000210614_100000038929 [1,1,0,0,0,0|1,0,0]=3 10089 B14R0.394 CCCCCCCSCCOCC(=O)N 62a_100000076697_100000210316 [1,1,0,0,0,0|2,0,0]=4 10090 B14R0.394 CCCCCCCSCCOCC(=O)N 62a_100000210614_100000076697 [1,1,0,0,0,0|2,0,0]=4 10091 B14R0.394 CCCCCCNCCCCCB(O)O 2230a_100000210581_200009817188 [1,1,0,0,0,0|1,0,1]=4 10092 B14R0.394 CCCCCCNCCCCCC(=O)N 2230a_100000210581_100009817443 [1,1,0,0,0,0|1,0,0]=3 10093 B14R0.394 CCCCCCNCCCCCC(C)C 2230a_100000210581_100000210682 [1,1,0,0,0,0|1,0,1]=4 10094 B14R0.394 CCCCCCNCCCCCC(C)C 2230a_100011290863_100000210314 [1,1,0,0,0,0|1,0,1]=4 10095 B14R0.394 CCCCCCNCCCCCC(C)C 34a_100011290863_100000210314 [1,1,0,0,0,0|1,0,1]=4 10096 B14R0.394 CCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210314 [1,1,0,0,0,0|1,0,0]=3 10097 B14R0.394 CCCCCCNCCCCNC(=O)C 34a_200011368371_100000210314 [1,1,0,0,0,0|1,0,0]=3 10098 B14R0.394 CCCCCCNCCCCSC(=O)C 2230a_100000210581_200010402107 [1,1,0,0,0,0|1,0,0]=3 10099 B14R0.394 CCCCCCOCCCCCB(O)O 34a_100000210259_200009817188 [1,1,0,0,0,0|1,0,1]=4 10100 B14R0.394 CCCCCCOCCCCCB(O)O 7a_100000210259_200009817188 [1,1,0,0,0,0|1,0,1]=4 10101 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000123541_100000210314 [1,1,0,0,0,0|1,0,0]=3 10102 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000210259_100009817443 [1,1,0,0,0,0|1,0,0]=3 10103 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000123541_100000210314 [1,1,0,0,0,0|1,0,0]=3 10104 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000210259_100009817443 [1,1,0,0,0,0|1,0,0]=3 10105 B14R0.394 CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210314 [1,1,0,0,0,0|0,0,1]=3 10106 B14R0.394 CCCCCCOCCCCCC(C)C 34a_100000210259_100000210682 [1,1,0,0,0,0|1,0,1]=4 10107 B14R0.394 CCCCCCOCCCCCC(C)C 34a_100011995859_100000210314 [1,1,0,0,0,0|1,0,1]=4 10108 B14R0.394 CCCCCCOCCCCCC(C)C 7a_100000210259_100000210682 [1,1,0,0,0,0|1,0,1]=4 10109 B14R0.394 CCCCCCOCCCCCC(C)C 7a_100011995859_100000210314 [1,1,0,0,0,0|1,0,1]=4 10110 B14R0.394 CCCCCCOCCCCOC(=O)C 34a_100000073216_100000210314 [1,1,0,0,0,0|1,0,0]=3 10111 B14R0.394 CCCCCCOCCCCOC(=O)C 34a_100000210259_100000033659 [1,1,0,0,0,0|1,0,0]=3 10112 B14R0.394 CCCCCCOCCCCOC(=O)C 7a_100000073216_100000210314 [1,1,0,0,0,0|1,0,0]=3 10113 B14R0.394 CCCCCCOCCCCOC(=O)C 7a_100000210259_100000033659 [1,1,0,0,0,0|1,0,0]=3 10114 B14R0.394 CCCCCCOCCCCSC(=O)C 34a_100000210259_200010402107 [1,1,0,0,0,0|1,0,0]=3 10115 B14R0.394 CCCCCCOCCCCSC(=O)C 7a_100000210259_200010402107 [1,1,0,0,0,0|1,0,0]=3 10116 B14R0.394 CCCCCCOCCOCCC(=O)C 7a_100000691444_100000053229 [1,1,0,0,0,0|1,0,0]=3 10117 B14R0.394 CCCCCCOCCOCCC(=O)N 34a_100000691444_100000731001 [1,1,0,0,0,0|2,0,0]=4 10118 B14R0.394 CCCCCCOCCOCCC(=O)N 7a_100000691444_100000744528 [1,1,0,0,0,0|2,0,0]=4 10119 B14R0.394 CCCCCCOCCOCOC(=O)C 34a_100000691444_100009813279 [1,1,0,0,0,0|2,0,0]=4 10120 B14R0.394 CCCCCCOCOCCOC(=O)C 34a_100000210259_100000076355 [1,1,0,0,0,0|2,0,0]=4 10121 B14R0.394 CCCCCCSCCCCCB(O)O 62a_100000210314_200009817188 [1,1,0,0,0,0|1,0,1]=4 10122 B14R0.394 CCCCCCSCCCCCB(O)O 62a_200009817188_100000210757 [1,1,0,0,0,0|1,0,1]=4 10123 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100000210314_100009817443 [1,1,0,0,0,0|1,0,0]=3 10124 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100009817443_100000210757 [1,1,0,0,0,0|1,0,0]=3 10125 B14R0.394 CCCCCCSCCCCCC(C)C 62a_100000210314_100000210682 [1,1,0,0,0,0|1,0,1]=4 10126 B14R0.394 CCCCCCSCCCCCC(C)C 62a_100000210682_100000210757 [1,1,0,0,0,0|1,0,1]=4 10127 B14R0.394 CCCCCCSCCCCOC(=O)C 62a_100000033659_100000210757 [1,1,0,0,0,0|1,0,0]=3 10128 B14R0.394 CCCCCCSCCCCOC(=O)C 62a_100000210314_100000033659 [1,1,0,0,0,0|1,0,0]=3 10129 B14R0.394 CCCCCCSCCCCSC(=O)C 62a_100000210314_200010402107 [1,1,0,0,0,0|1,0,0]=3 10130 B14R0.394 CCCCCCSCCCCSC(=O)C 62a_200010402107_100000210757 [1,1,0,0,0,0|1,0,0]=3 10131 B14R0.394 CCCCCCSCOCCOC(=O)C 62a_100000076355_100000210757 [1,1,0,0,0,0|2,0,0]=4 10132 B14R0.394 CCCCCCSCOCCOC(=O)C 62a_100000210314_100000076355 [1,1,0,0,0,0|2,0,0]=4 10133 B14R0.394 CCCCCNCCCCCCB(O)O 2230a_100000209983_100009817187 [1,1,0,0,0,0|1,0,1]=4 10134 B14R0.394 CCCCCNCCCCCCC(C)C 2230a_100000211014_100000210326 [1,1,0,0,0,0|1,0,1]=4 10135 B14R0.394 CCCCCNCCCCCCC(C)C 34a_100000211014_100000718602 [1,1,0,0,0,0|1,0,1]=4 10136 B14R0.394 CCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210326 [1,1,0,0,0,0|1,0,0]=3 10137 B14R0.394 CCCCCNCCCCCNC(=O)C 34a_200012022750_100000718602 [1,1,0,0,0,0|1,0,0]=3 10138 B14R0.394 CCCCCNCCCCCOC(=O)C 2230a_100000209983_100009813381 [1,1,0,0,0,0|1,0,0]=3 10139 B14R0.394 CCCCCNCCOCCCC(=O)C 34a_100000224656_100000685027 [1,1,0,0,0,0|1,0,0]=3 10140 B14R0.394 CCCCCNCCOCCCC(=O)N 34a_100000224656_100102525003 [1,1,0,0,0,0|2,0,0]=4 10141 B14R0.394 CCCCCNCCOCCOC(=O)C 2230a_100000209983_200000083610 [1,1,0,0,0,0|2,0,0]=4 10142 B14R0.394 CCCCCNCCOCCOC(=O)C 34a_100000224656_100009814007 [1,1,0,0,0,0|2,0,0]=4 10143 B14R0.394 CCCCCOCCCCCCB(O)O 34a_100000210253_100009817187 [1,1,0,0,0,0|1,0,1]=4 10144 B14R0.394 CCCCCOCCCCCCB(O)O 7a_100000210253_100009817187 [1,1,0,0,0,0|1,0,1]=4 10145 B14R0.394 CCCCCOCCCCCOC(=O)C 34a_100000210253_100000033007 [1,1,0,0,0,0|1,0,0]=3 10146 B14R0.394 CCCCCOCCCCCOC(=O)C 7a_100000210253_100000033007 [1,1,0,0,0,0|1,0,0]=3 10147 B14R0.394 CCCCCOCCOCCCC(=O)C 34a_100011215259_100000685027 [1,1,0,0,0,0|1,0,0]=3 10148 B14R0.394 CCCCCOCCOCCCC(=O)C 7a_100011215259_100011215641 [1,1,0,0,0,0|1,0,0]=3 10149 B14R0.394 CCCCCOCCOCCCC(=O)N 34a_100011215259_100102525003 [1,1,0,0,0,0|2,0,0]=4 10150 B14R0.394 CCCCCOCCOCCCC(=O)N 7a_100011215259_100102525003 [1,1,0,0,0,0|2,0,0]=4 10151 B14R0.394 CCCCCOCCOCCNC(=O)C 7a_100011215259_100000189650 [1,1,0,0,0,0|2,0,0]=4 10152 B14R0.394 CCCCCOCCOCCOC(=O)C 34a_100000210253_200000083610 [1,1,0,0,0,0|2,0,0]=4 10153 B14R0.394 CCCCCOCCOCCOC(=O)C 34a_100011215259_100009814007 [1,1,0,0,0,0|2,0,0]=4 10154 B14R0.394 CCCCCOCCOCCOC(=O)C 7a_100000210253_200000083610 [1,1,0,0,0,0|2,0,0]=4 10155 B14R0.394 CCCCCOCCOCCOC(=O)C 7a_100011215259_100009814007 [1,1,0,0,0,0|2,0,0]=4 10156 B14R0.394 CCCCCSCCCCCCB(O)O 62a_100000210326_100009817187 [1,1,0,0,0,0|1,0,1]=4 10157 B14R0.394 CCCCCSCCCCCCB(O)O 62a_100009817187_100000210326 [1,1,0,0,0,0|1,0,1]=4 10158 B14R0.394 CCCCCSCCCCCOC(=O)C 62a_100000033007_100000210326 [1,1,0,0,0,0|1,0,0]=3 10159 B14R0.394 CCCCCSCCCCCOC(=O)C 62a_100000210326_100000033007 [1,1,0,0,0,0|1,0,0]=3 10160 B14R0.394 CCCCCSCCOCCOC(=O)C 62a_100000210326_200000083610 [1,1,0,0,0,0|2,0,0]=4 10161 B14R0.394 CCCCCSCCOCCOC(=O)C 62a_200000083610_100000210326 [1,1,0,0,0,0|2,0,0]=4 10162 B14R0.394 CCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210211 [1,1,0,0,0,0|1,0,0]=3 10163 B14R0.394 CCCCNCCCCCCNC(=O)C 34a_200011996284_100000210210 [1,1,0,0,0,0|1,0,0]=3 10164 B14R0.394 CCCCNCCCCOCCC(=O)N 34a_200011216965_100000731001 [1,1,0,0,0,0|2,0,0]=4 10165 B14R0.394 CCCCNCCCCOCOC(=O)C 34a_200011216965_100009813279 [1,1,0,0,0,0|2,0,0]=4 10166 B14R0.394 CCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210211 [1,1,0,0,0,0|2,0,0]=4 10167 B14R0.394 CCCCOCCCCCCCC(C)C 34a_200000210741_100000210210 [1,1,0,0,0,0|1,0,1]=4 10168 B14R0.394 CCCCOCCCCCCCC(C)C 7a_200000210741_100000210211 [1,1,0,0,0,0|1,0,1]=4 10169 B14R0.394 CCCCOCCCCOCCC(=O)C 7a_200000760531_100000053229 [1,1,0,0,0,0|1,0,0]=3 10170 B14R0.394 CCCCOCCCCOCCC(=O)N 34a_200000760531_100000731001 [1,1,0,0,0,0|2,0,0]=4 10171 B14R0.394 CCCCOCCCCOCCC(=O)N 7a_200000760531_100000744528 [1,1,0,0,0,0|2,0,0]=4 10172 B14R0.394 CCCCOCCCCOCOC(=O)C 34a_200000760531_100009813279 [1,1,0,0,0,0|2,0,0]=4 10173 B14R0.394 CCCCOCCCNCCCC(=O)C 34a_200000211371_100000685027 [1,1,0,0,0,0|1,0,0]=3 10174 B14R0.394 CCCCOCCCNCCCC(=O)N 34a_200000211371_100102525003 [1,1,0,0,0,0|2,0,0]=4 10175 B14R0.394 CCCCOCCCNCCNC(=O)C 2230a_200000211371_100000189650 [1,1,0,0,0,0|2,0,0]=4 10176 B14R0.394 CCCCOCCCNCCOC(=O)C 34a_200000211371_100009814007 [1,1,0,0,0,0|2,0,0]=4 10177 B14R0.394 CCCCOCCCOCCCC(=O)C 34a_200011215613_100000685027 [1,1,0,0,0,0|1,0,0]=3 10178 B14R0.394 CCCCOCCCOCCCC(=O)C 7a_200011215613_100011215641 [1,1,0,0,0,0|1,0,0]=3 10179 B14R0.394 CCCCOCCCOCCCC(=O)N 34a_200011215613_100102525003 [1,1,0,0,0,0|2,0,0]=4 10180 B14R0.394 CCCCOCCCOCCCC(=O)N 7a_200011215613_100102525003 [1,1,0,0,0,0|2,0,0]=4 10181 B14R0.394 CCCCOCCCOCCNC(=O)C 7a_200011215613_100000189650 [1,1,0,0,0,0|2,0,0]=4 10182 B14R0.394 CCCCOCCCOCCOC(=O)C 34a_200011215613_100009814007 [1,1,0,0,0,0|2,0,0]=4 10183 B14R0.394 CCCCOCCCOCCOC(=O)C 7a_200011215613_100009814007 [1,1,0,0,0,0|2,0,0]=4 10184 B14R0.394 CCCCOCCNCCCCC(=O)N 34a_100000696515_100000743108 [1,1,0,0,0,0|2,0,0]=4 10185 B14R0.394 CCCCOCCNCCCNC(=O)C 34a_100000736810_100000743108 [1,1,0,0,0,0|2,0,0]=4 10186 B14R0.394 CCCCOCCNCCOCC(=O)O 269956a_100000700818_100000743108 [1,1,0,0,0,0|2,0,0]=4 10187 B14R0.394 CCCCOCCOCCCCC(=O)C 34a_100000210238_100009817362 [1,1,0,0,0,0|1,0,0]=3 10188 B14R0.394 CCCCOCCOCCCCC(=O)C 7a_100000210238_100000735457 [1,1,0,0,0,0|1,0,0]=3 10189 B14R0.394 CCCCOCCOCCCCC(=O)N 34a_100012022536_100000743108 [1,1,0,0,0,0|2,0,0]=4 10190 B14R0.394 CCCCOCCOCCCCC(=O)N 7a_100012022536_100000743108 [1,1,0,0,0,0|2,0,0]=4 10191 B14R0.394 CCCCOCCOCCCNC(=O)C 34a_100000752032_100000743108 [1,1,0,0,0,0|2,0,0]=4 10192 B14R0.394 CCCCOCCOCCCOC(=O)C 34a_100000210238_100000042594 [1,1,0,0,0,0|2,0,0]=4 10193 B14R0.394 CCCCOCCOCCCOC(=O)C 7a_100000210238_100000042594 [1,1,0,0,0,0|2,0,0]=4 10194 B14R0.394 CCCCOCCOCCCSC(=O)C 34a_100000210238_100000038929 [1,1,0,0,0,0|2,0,0]=4 10195 B14R0.394 CCCCOCCOCCCSC(=O)C 7a_100000210238_100000038929 [1,1,0,0,0,0|2,0,0]=4 10196 B14R0.394 CCCCOCCSCCCCC(=O)C 62a_100000735457_100000743108 [1,1,0,0,0,0|1,0,0]=3 10197 B14R0.394 CCCCOCCSCCCCC(=O)C 62a_100000743108_100000735457 [1,1,0,0,0,0|1,0,0]=3 10198 B14R0.394 CCCCOCCSCCCOC(=O)C 62a_100000042594_100000743108 [1,1,0,0,0,0|2,0,0]=4 10199 B14R0.394 CCCCOCCSCCCOC(=O)C 62a_100000743108_100000042594 [1,1,0,0,0,0|2,0,0]=4 10200 B14R0.394 CCCCOCCSCCCSC(=O)C 62a_100000038929_100000743108 [1,1,0,0,0,0|2,0,0]=4 10201 B14R0.394 CCCCOCCSCCCSC(=O)C 62a_100000743108_100000038929 [1,1,0,0,0,0|2,0,0]=4 10202 B14R0.394 CCCCOCNCCCCNC(=O)C 2230a_200011368371_100011995733 [1,1,0,0,0,0|2,0,0]=4 10203 B14R0.394 CCCCOCNCCCCNC(=O)C 34a_200011368371_100011995733 [1,1,0,0,0,0|2,0,0]=4 10204 B14R0.394 CCCCOCOCCCCCC(=O)N 34a_100000123541_100011995733 [1,1,0,0,0,0|2,0,0]=4 10205 B14R0.394 CCCCOCOCCCCOC(=O)C 34a_100000073216_100011995733 [1,1,0,0,0,0|2,0,0]=4 10206 B14R0.394 CCCCOCSCCCCCC(=O)N 62a_100009817443_100011995733 [1,1,0,0,0,0|2,0,0]=4 10207 B14R0.394 CCCCOCSCCCCCC(=O)N 62a_100011995733_100009817443 [1,1,0,0,0,0|2,0,0]=4 10208 B14R0.394 CCCCOCSCCCCOC(=O)C 62a_100000033659_100011995733 [1,1,0,0,0,0|2,0,0]=4 10209 B14R0.394 CCCCOCSCCCCOC(=O)C 62a_100011995733_100000033659 [1,1,0,0,0,0|2,0,0]=4 10210 B14R0.394 CCCCOCSCCCCSC(=O)C 62a_100011995733_200010402107 [1,1,0,0,0,0|2,0,0]=4 10211 B14R0.394 CCCCOCSCCCCSC(=O)C 62a_200010402107_100011995733 [1,1,0,0,0,0|2,0,0]=4 10212 B14R0.394 CCCCSCCNCCCSC(=O)C 2230a_100025743550_100000038929 [1,1,0,0,0,0|2,0,0]=4 10213 B14R0.394 CCCCSCCOCCCCC(=O)C 34a_200000230436_100009817362 [1,1,0,0,0,0|1,0,0]=3 10214 B14R0.394 CCCCSCCOCCCCC(=O)C 7a_200000230436_100000735457 [1,1,0,0,0,0|1,0,0]=3 10215 B14R0.394 CCCCSCCOCCCOC(=O)C 34a_200000230436_100000042594 [1,1,0,0,0,0|2,0,0]=4 10216 B14R0.394 CCCCSCCOCCCOC(=O)C 7a_200000230436_100000042594 [1,1,0,0,0,0|2,0,0]=4 10217 B14R0.394 CCCCSCCOCCCSC(=O)C 34a_200000230436_100000038929 [1,1,0,0,0,0|2,0,0]=4 10218 B14R0.394 CCCCSCCOCCCSC(=O)C 7a_200000230436_100000038929 [1,1,0,0,0,0|2,0,0]=4 10219 B14R0.394 CCCOCCCNCCCCC(=O)C 34a_100011217757_100009817362 [1,1,0,0,0,0|1,0,0]=3 10220 B14R0.394 CCCOCCCNCCCOC(=O)C 34a_100011217757_100000042594 [1,1,0,0,0,0|2,0,0]=4 10221 B14R0.394 CCCOCCCNCCCSC(=O)C 2230a_100011217757_100000038929 [1,1,0,0,0,0|2,0,0]=4 10222 B14R0.394 CCCOCCCNCCCSC(=O)C 34a_100011217757_100000038929 [1,1,0,0,0,0|2,0,0]=4 10223 B14R0.394 CCCOCCNCCCCCC(=O)N 2230a_100161115042_100009817443 [1,1,0,0,0,0|2,0,0]=4 10224 B14R0.394 CCCOCCNCCCCCC(=O)N 34a_100161115042_100009817443 [1,1,0,0,0,0|2,0,0]=4 10225 B14R0.394 CCCOCCNCCCCNC(=O)C 2230a_200011368371_100011215938 [1,1,0,0,0,0|2,0,0]=4 10226 B14R0.394 CCCOCCNCCCCNC(=O)C 34a_200011368371_100011215938 [1,1,0,0,0,0|2,0,0]=4 10227 B14R0.394 CCCOCCNCCCCOC(=O)C 34a_100161115042_100000033659 [1,1,0,0,0,0|2,0,0]=4 10228 B14R0.394 CCCOCCNCCCCSC(=O)C 2230a_100161115042_200010402107 [1,1,0,0,0,0|2,0,0]=4 10229 B14R0.394 CCCOCCNCCCCSC(=O)C 34a_100161115042_200010402107 [1,1,0,0,0,0|2,0,0]=4 10230 B14R0.394 CCCOCCOCCCCCC(=O)N 34a_100000123541_100011215938 [1,1,0,0,0,0|2,0,0]=4 10231 B14R0.394 CCCOCCOCCCCCC(=O)N 34a_100000752267_100009817443 [1,1,0,0,0,0|2,0,0]=4 10232 B14R0.394 CCCOCCOCCCCCC(=O)N 7a_100000123541_100011215938 [1,1,0,0,0,0|2,0,0]=4 10233 B14R0.394 CCCOCCOCCCCCC(=O)N 7a_100000752267_100009817443 [1,1,0,0,0,0|2,0,0]=4 10234 B14R0.394 CCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100011215938 [1,1,0,0,0,0|1,0,1]=4 10235 B14R0.394 CCCOCCOCCCCOC(=O)C 34a_100000073216_100011215938 [1,1,0,0,0,0|2,0,0]=4 10236 B14R0.394 CCCOCCOCCCCOC(=O)C 34a_100000752267_100000033659 [1,1,0,0,0,0|2,0,0]=4 10237 B14R0.394 CCCOCCOCCCCOC(=O)C 7a_100000073216_100011215938 [1,1,0,0,0,0|2,0,0]=4 10238 B14R0.394 CCCOCCOCCCCOC(=O)C 7a_100000752267_100000033659 [1,1,0,0,0,0|2,0,0]=4 10239 B14R0.394 CCCOCCOCCCCSC(=O)C 34a_100000752267_200010402107 [1,1,0,0,0,0|2,0,0]=4 10240 B14R0.394 CCCOCCOCCCCSC(=O)C 7a_100000752267_200010402107 [1,1,0,0,0,0|2,0,0]=4 10241 B14R0.394 CCCOCCSCCCCCC(=O)N 62a_100009817443_100011215938 [1,1,0,0,0,0|2,0,0]=4 10242 B14R0.394 CCCOCCSCCCCCC(=O)N 62a_100011215938_100009817443 [1,1,0,0,0,0|2,0,0]=4 10243 B14R0.394 CCCOCCSCCCCOC(=O)C 62a_100000033659_100011215938 [1,1,0,0,0,0|2,0,0]=4 10244 B14R0.394 CCCOCCSCCCCOC(=O)C 62a_100011215938_100000033659 [1,1,0,0,0,0|2,0,0]=4 10245 B14R0.394 CCCOCCSCCCCSC(=O)C 62a_100011215938_200010402107 [1,1,0,0,0,0|2,0,0]=4 10246 B14R0.394 CCCOCCSCCCCSC(=O)C 62a_200010402107_100011215938 [1,1,0,0,0,0|2,0,0]=4 10247 B14R0.394 CCCSCCNCCCCCC(=O)N 2230a_100020603323_100009817443 [1,1,0,0,0,0|2,0,0]=4 10248 B14R0.394 CCCSCCNCCCCSC(=O)C 2230a_100020603323_200010402107 [1,1,0,0,0,0|2,0,0]=4 10249 B14R0.394 CCCSCCOCCCCCC(=O)N 34a_200000230433_100009817443 [1,1,0,0,0,0|2,0,0]=4 10250 B14R0.394 CCCSCCOCCCCCC(=O)N 7a_200000230433_100009817443 [1,1,0,0,0,0|2,0,0]=4 10251 B14R0.394 CCCSCCOCCCCOC(=O)C 34a_200000230433_100000033659 [1,1,0,0,0,0|2,0,0]=4 10252 B14R0.394 CCCSCCOCCCCOC(=O)C 7a_200000230433_100000033659 [1,1,0,0,0,0|2,0,0]=4 10253 B14R0.394 CCCSCCOCCCCSC(=O)C 34a_200000230433_200010402107 [1,1,0,0,0,0|2,0,0]=4 10254 B14R0.394 CCCSCCOCCCCSC(=O)C 7a_200000230433_200010402107 [1,1,0,0,0,0|2,0,0]=4 10255 B14R0.394 CCOCCCNCCCCCC(=O)N 2230a_100000210961_100009817443 [1,1,0,0,0,0|2,0,0]=4 10256 B14R0.394 CCOCCCNCCCCCC(=O)N 34a_100000210961_100009817443 [1,1,0,0,0,0|2,0,0]=4 10257 B14R0.394 CCOCCCNCCCCNC(=O)C 2230a_200011368371_100012232248 [1,1,0,0,0,0|2,0,0]=4 10258 B14R0.394 CCOCCCNCCCCNC(=O)C 34a_200011368371_100012232248 [1,1,0,0,0,0|2,0,0]=4 10259 B14R0.394 CCOCCCNCCCCOC(=O)C 34a_100000210961_100000033659 [1,1,0,0,0,0|2,0,0]=4 10260 B14R0.394 CCOCCCNCCCCSC(=O)C 2230a_100000210961_200010402107 [1,1,0,0,0,0|2,0,0]=4 10261 B14R0.394 CCOCCCNCCCCSC(=O)C 34a_100000210961_200010402107 [1,1,0,0,0,0|2,0,0]=4 10262 B14R0.394 CCOCCCOCCCCCC(=O)N 34a_100000123541_100012232248 [1,1,0,0,0,0|2,0,0]=4 10263 B14R0.394 CCOCCCOCCCCCC(=O)N 34a_100000757476_100009817443 [1,1,0,0,0,0|2,0,0]=4 10264 B14R0.394 CCOCCCOCCCCCC(=O)N 7a_100000123541_100012232248 [1,1,0,0,0,0|2,0,0]=4 10265 B14R0.394 CCOCCCOCCCCCC(=O)N 7a_100000757476_100009817443 [1,1,0,0,0,0|2,0,0]=4 10266 B14R0.394 CCOCCCOCCCCCC(=O)[O-] 7a_100102619762_100012232248 [1,1,0,0,0,0|1,0,1]=4 10267 B14R0.394 CCOCCCOCCCCOC(=O)C 34a_100000073216_100012232248 [1,1,0,0,0,0|2,0,0]=4 10268 B14R0.394 CCOCCCOCCCCOC(=O)C 34a_100000757476_100000033659 [1,1,0,0,0,0|2,0,0]=4 10269 B14R0.394 CCOCCCOCCCCOC(=O)C 7a_100000073216_100012232248 [1,1,0,0,0,0|2,0,0]=4 10270 B14R0.394 CCOCCCOCCCCOC(=O)C 7a_100000757476_100000033659 [1,1,0,0,0,0|2,0,0]=4 10271 B14R0.394 CCOCCCOCCCCSC(=O)C 34a_100000757476_200010402107 [1,1,0,0,0,0|2,0,0]=4 10272 B14R0.394 CCOCCCOCCCCSC(=O)C 7a_100000757476_200010402107 [1,1,0,0,0,0|2,0,0]=4 10273 B14R0.394 CCOCCCSCCCCCC(=O)N 62a_100009817443_100012232248 [1,1,0,0,0,0|2,0,0]=4 10274 B14R0.394 CCOCCCSCCCCCC(=O)N 62a_100012232248_100009817443 [1,1,0,0,0,0|2,0,0]=4 10275 B14R0.394 CCOCCCSCCCCOC(=O)C 62a_100000033659_100012232248 [1,1,0,0,0,0|2,0,0]=4 10276 B14R0.394 CCOCCCSCCCCOC(=O)C 62a_100012232248_100000033659 [1,1,0,0,0,0|2,0,0]=4 10277 B14R0.394 CCOCCCSCCCCSC(=O)C 62a_100012232248_200010402107 [1,1,0,0,0,0|2,0,0]=4 10278 B14R0.394 CCOCCCSCCCCSC(=O)C 62a_200010402107_100012232248 [1,1,0,0,0,0|2,0,0]=4 10279 B14R0.394 CCOCCNCCCCCNC(=O)C 2230a_200012022750_100011215890 [1,1,0,0,0,0|2,0,0]=4 10280 B14R0.394 CCOCCNCCCCCNC(=O)C 34a_200012022750_100000210147 [1,1,0,0,0,0|2,0,0]=4 10281 B14R0.394 CCOCCNCCCCCOC(=O)C 2230a_102516460346_100009813381 [1,1,0,0,0,0|2,0,0]=4 10282 B14R0.394 CCOCCNCCCCCOC(=O)C 34a_102516460346_100000033007 [1,1,0,0,0,0|2,0,0]=4 10283 B14R0.394 CCOCCOCCCCCOC(=O)C 34a_100000210136_100000033007 [1,1,0,0,0,0|2,0,0]=4 10284 B14R0.394 CCOCCOCCCCCOC(=O)C 7a_100000210136_100000033007 [1,1,0,0,0,0|2,0,0]=4 10285 B14R0.394 CCOCCOCCNCCCC(=O)C 34a_100102712874_100000685027 [1,1,0,0,0,0|2,0,0]=4 10286 B14R0.394 CCOCCOCCOCCCC(=O)C 34a_100000210240_100000685027 [1,1,0,0,0,0|2,0,0]=4 10287 B14R0.394 CCOCCOCCOCCCC(=O)C 34a_100000759063_100011211534 [1,1,0,0,0,0|2,0,0]=4 10288 B14R0.394 CCOCCOCCOCCCC(=O)C 7a_100000210240_100011215641 [1,1,0,0,0,0|2,0,0]=4 10289 B14R0.394 CCOCCOCCOCCCC(=O)C 7a_100000759063_100011211534 [1,1,0,0,0,0|2,0,0]=4 10290 B14R0.394 CCOCCOCCSCCCC(=O)C 62a_100011211534_100011215641 [1,1,0,0,0,0|2,0,0]=4 10291 B14R0.394 CCOCCOCCSCCCC(=O)C 62a_100011215641_100011211534 [1,1,0,0,0,0|2,0,0]=4 10292 B14R0.394 CCOCCSCCCCCOC(=O)C 62a_100000033007_100011215890 [1,1,0,0,0,0|2,0,0]=4 10293 B14R0.394 CCOCCSCCCCCOC(=O)C 62a_100000210147_100000033007 [1,1,0,0,0,0|2,0,0]=4 10294 B14R0.394 CCSCCCOCCCCCC(=O)N 34a_100011216438_100009817443 [1,1,0,0,0,0|2,0,0]=4 10295 B14R0.394 CCSCCCOCCCCCC(=O)N 7a_100011216438_100009817443 [1,1,0,0,0,0|2,0,0]=4 10296 B14R0.394 CCSCCCOCCCCOC(=O)C 34a_100011216438_100000033659 [1,1,0,0,0,0|2,0,0]=4 10297 B14R0.394 CCSCCCOCCCCOC(=O)C 7a_100011216438_100000033659 [1,1,0,0,0,0|2,0,0]=4 10298 B14R0.394 CCSCCCOCCCCSC(=O)C 34a_100011216438_200010402107 [1,1,0,0,0,0|2,0,0]=4 10299 B14R0.394 CCSCCCOCCCCSC(=O)C 7a_100011216438_200010402107 [1,1,0,0,0,0|2,0,0]=4 10300 B14R0.394 CCSCCNCCCCCNC(=O)C 2230a_200012022750_100000757381 [1,1,0,0,0,0|2,0,0]=4 10301 B14R0.394 CCSCCNCCCCCNC(=O)C 34a_200012022750_100000757381 [1,1,0,0,0,0|2,0,0]=4 10302 B14R0.394 CCSCCNCCCCCOC(=O)C 2230a_100000106463_100009813381 [1,1,0,0,0,0|2,0,0]=4 10303 B14R0.394 CCSCCOCCCCCOC(=O)C 34a_100000212035_100000033007 [1,1,0,0,0,0|2,0,0]=4 10304 B14R0.394 CCSCCOCCCCCOC(=O)C 7a_100000212035_100000033007 [1,1,0,0,0,0|2,0,0]=4 10305 B14R0.394 CCSCCSCCCCCOC(=O)C 62a_100000033007_100000757381 [1,1,0,0,0,0|2,0,0]=4 10306 B14R0.394 CCSCCSCCCCCOC(=O)C 62a_100000757381_100000033007 [1,1,0,0,0,0|2,0,0]=4 10307 B14R0.394 CN(C)CCCCCCCCCCCO 2230a_100102631434_100009812471 [1,1,0,0,0,0|2,0,0]=4 10308 B14R0.394 CN(C)CCCCCCCCCCCO 269982a_100102631434_100009812471 [1,1,0,0,0,0|2,0,0]=4 10309 B14R0.394 CNCCCCCCCCCCC(=O)N 2230a_106832991635_200010167045 [1,1,0,0,0,0|1,0,0]=3 10310 B14R0.394 CNCCCCCCCCCCC(=O)N 34a_100102657272_200010167045 [1,1,0,0,0,0|1,0,0]=3 10311 B14R0.394 CNCCCCCCCCCCC(=O)N 7a_106832991635_200010167045 [1,1,0,0,0,0|1,0,0]=3 10312 B14R0.394 CNCCCCCOCCCCC(=O)C 34a_100000722520_100009817362 [1,1,0,0,0,0|1,0,0]=3 10313 B14R0.394 CNCCCCCOCCCOC(=O)C 34a_100000722520_100000042594 [1,1,0,0,0,0|2,0,0]=4 10314 B14R0.394 CNCCCCCOCCCSC(=O)C 34a_100000722520_100000038929 [1,1,0,0,0,0|2,0,0]=4 10315 B14R0.394 CNCCCOCCCCCOC(=O)C 34a_100000213112_100000033007 [1,1,0,0,0,0|2,0,0]=4 10316 B14R0.394 CNCCOCCOCCCCC(=O)C 34a_100000228057_100009817362 [1,1,0,0,0,0|2,0,0]=4 10317 B14R0.394 COCCCCCCCCCCC(=O)N 34a_100138415774_200010167045 [1,1,0,0,0,0|1,0,0]=3 10318 B14R0.394 COCCCCCCNCCCC(=O)N 34a_100000739312_100011998445 [1,1,0,0,0,0|2,0,0]=4 10319 B14R0.394 COCCCCCCNCCCS(=O)C 2230a_200000753449_100011998445 [1,1,0,0,0,0|2,0,0]=4 10320 B14R0.394 COCCCCCCNCCNC(=O)C 2230a_100000209853_100011998445 [1,1,0,0,0,0|2,0,0]=4 10321 B14R0.394 COCCCCCCOCCCC(=O)C 34a_100000759063_100011998445 [1,1,0,0,0,0|1,0,0]=3 10322 B14R0.394 COCCCCCCOCCCC(=O)C 34a_200012092642_100000685027 [1,1,0,0,0,0|1,0,0]=3 10323 B14R0.394 COCCCCCCOCCCC(=O)C 7a_100000759063_100011998445 [1,1,0,0,0,0|1,0,0]=3 10324 B14R0.394 COCCCCCCOCCCC(=O)C 7a_200012092642_100011215641 [1,1,0,0,0,0|1,0,0]=3 10325 B14R0.394 COCCCCCCOCCCC(=O)N 34a_200012092642_100102525003 [1,1,0,0,0,0|2,0,0]=4 10326 B14R0.394 COCCCCCCOCCCC(=O)N 7a_200012092642_100102525003 [1,1,0,0,0,0|2,0,0]=4 10327 B14R0.394 COCCCCCCOCCNC(=O)C 34a_100000158858_100011998445 [1,1,0,0,0,0|2,0,0]=4 10328 B14R0.394 COCCCCCCOCCNC(=O)C 7a_200012092642_100000189650 [1,1,0,0,0,0|2,0,0]=4 10329 B14R0.394 COCCCCCCOCCOC(=O)C 34a_200012092642_100009814007 [1,1,0,0,0,0|2,0,0]=4 10330 B14R0.394 COCCCCCCOCCOC(=O)C 7a_200012092642_100009814007 [1,1,0,0,0,0|2,0,0]=4 10331 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011215641_100011998445 [1,1,0,0,0,0|1,0,0]=3 10332 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011998445_100011215641 [1,1,0,0,0,0|1,0,0]=3 10333 B14R0.394 COCCCCCCSCCCC(=O)N 62a_100011998445_100102525003 [1,1,0,0,0,0|2,0,0]=4 10334 B14R0.394 COCCCCCCSCCCC(=O)N 62a_100102525003_100011998445 [1,1,0,0,0,0|2,0,0]=4 10335 B14R0.394 COCCCCCCSCCNC(=O)C 62a_100000189650_100011998445 [1,1,0,0,0,0|2,0,0]=4 10336 B14R0.394 COCCCCCCSCCNC(=O)C 62a_100011998445_100000189650 [1,1,0,0,0,0|2,0,0]=4 10337 B14R0.394 COCCCCCCSCCOC(=O)C 62a_100009814007_100011998445 [1,1,0,0,0,0|2,0,0]=4 10338 B14R0.394 COCCCCCCSCCOC(=O)C 62a_100011998445_100009814007 [1,1,0,0,0,0|2,0,0]=4 10339 B14R0.394 COCCCCCNCCCCC(=O)C 34a_100000747528_100009817362 [1,1,0,0,0,0|1,0,0]=3 10340 B14R0.394 COCCCCCNCCCOC(=O)C 34a_100000747528_100000042594 [1,1,0,0,0,0|2,0,0]=4 10341 B14R0.394 COCCCCCNCCCSC(=O)C 2230a_100000747528_100000038929 [1,1,0,0,0,0|2,0,0]=4 10342 B14R0.394 COCCCCCNCCCSC(=O)C 34a_100000747528_100000038929 [1,1,0,0,0,0|2,0,0]=4 10343 B14R0.394 COCCCCNCCCCNC(=O)C 2230a_200011368371_100000730899 [1,1,0,0,0,0|2,0,0]=4 10344 B14R0.394 COCCCCNCCCCNC(=O)C 34a_200011368371_100000755781 [1,1,0,0,0,0|2,0,0]=4 10345 B14R0.394 COCCCCOCCCCCC(=O)N 34a_100000123541_100000755781 [1,1,0,0,0,0|2,0,0]=4 10346 B14R0.394 COCCCCOCCCCCC(=O)N 34a_100000740925_100009817443 [1,1,0,0,0,0|2,0,0]=4 10347 B14R0.394 COCCCCOCCCCCC(=O)N 7a_100000123541_100000730899 [1,1,0,0,0,0|2,0,0]=4 10348 B14R0.394 COCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000730899 [1,1,0,0,0,0|1,0,1]=4 10349 B14R0.394 COCCCCOCCCCOC(=O)C 34a_100000073216_100000755781 [1,1,0,0,0,0|2,0,0]=4 10350 B14R0.394 COCCCCOCCCCOC(=O)C 34a_100000740925_100000033659 [1,1,0,0,0,0|2,0,0]=4 10351 B14R0.394 COCCCCOCCCCOC(=O)C 7a_100000073216_100000730899 [1,1,0,0,0,0|2,0,0]=4 10352 B14R0.394 COCCCCOCCCCSC(=O)C 34a_100000740925_200010402107 [1,1,0,0,0,0|2,0,0]=4 10353 B14R0.394 COCCCCSCCCCCC(=O)N 62a_100000730899_100009817443 [1,1,0,0,0,0|2,0,0]=4 10354 B14R0.394 COCCCCSCCCCCC(=O)N 62a_100009817443_100000730899 [1,1,0,0,0,0|2,0,0]=4 10355 B14R0.394 COCCCCSCCCCOC(=O)C 62a_100000033659_100000730899 [1,1,0,0,0,0|2,0,0]=4 10356 B14R0.394 COCCCCSCCCCOC(=O)C 62a_100000730899_100000033659 [1,1,0,0,0,0|2,0,0]=4 10357 B14R0.394 COCCCCSCCCCSC(=O)C 62a_100000730899_200010402107 [1,1,0,0,0,0|2,0,0]=4 10358 B14R0.394 COCCCCSCCCCSC(=O)C 62a_200010402107_100000730899 [1,1,0,0,0,0|2,0,0]=4 10359 B14R0.394 COCCCNCCCCCNC(=O)C 2230a_200012022750_100000740836 [1,1,0,0,0,0|2,0,0]=4 10360 B14R0.394 COCCCNCCCCCNC(=O)C 34a_200012022750_100000740836 [1,1,0,0,0,0|2,0,0]=4 10361 B14R0.394 COCCCNCCCCCOC(=O)C 34a_100150723488_100000033007 [1,1,0,0,0,0|2,0,0]=4 10362 B14R0.394 COCCCOCCCCCOC(=O)C 34a_100000740835_100000033007 [1,1,0,0,0,0|2,0,0]=4 10363 B14R0.394 COCCCOCCCOCCC(=O)C 7a_200011215475_100000053229 [1,1,0,0,0,0|2,0,0]=4 10364 B14R0.394 COCCCSCCCCCOC(=O)C 62a_100000033007_100000709357 [1,1,0,0,0,0|2,0,0]=4 10365 B14R0.394 COCCCSCCCCCOC(=O)C 62a_100000709357_100000033007 [1,1,0,0,0,0|2,0,0]=4 10366 B14R0.394 COCCNCCCCCCNC(=O)C 2230a_200011996284_100011201679 [1,1,0,0,0,0|2,0,0]=4 10367 B14R0.394 COCCNCCCCCCNC(=O)C 34a_200011996284_100011201679 [1,1,0,0,0,0|2,0,0]=4 10368 B14R0.394 COCCOCCCNCCCC(=O)C 34a_100000206027_100000685027 [1,1,0,0,0,0|2,0,0]=4 10369 B14R0.394 COCCOCCCOCCCC(=O)C 34a_100000759063_100011216529 [1,1,0,0,0,0|2,0,0]=4 10370 B14R0.394 COCCOCCCOCCCC(=O)C 7a_100000759063_100011216529 [1,1,0,0,0,0|2,0,0]=4 10371 B14R0.394 COCCOCCCSCCCC(=O)C 62a_100011215641_100011216529 [1,1,0,0,0,0|2,0,0]=4 10372 B14R0.394 COCCOCCCSCCCC(=O)C 62a_100011216529_100011215641 [1,1,0,0,0,0|2,0,0]=4 10373 B14R0.394 COCCOCCNCCCCC(=O)C 34a_100000745349_100009817362 [1,1,0,0,0,0|2,0,0]=4 10374 B14R0.394 COCCOCCOCCCCC(=O)C 34a_100011215163_100009817362 [1,1,0,0,0,0|2,0,0]=4 10375 B14R0.394 COCCOCCOCCCCC(=O)C 7a_100011215163_100000735457 [1,1,0,0,0,0|2,0,0]=4 10376 B14R0.394 COCCOCCSCCCCC(=O)C 62a_100000695917_100000735457 [1,1,0,0,0,0|2,0,0]=4 10377 B14R0.394 COCCOCCSCCCCC(=O)C 62a_100000735457_100000695917 [1,1,0,0,0,0|2,0,0]=4 10378 B14R0.394 CS(=O)CCCNCCCCCCCO 2230a_200000753449_100000760002 [1,1,0,0,0,0|2,0,0]=4 10379 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200000210301_200010167045 [1,1,0,0,0,0|1,0,0]=3 10380 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200010167045_200000210301 [1,1,0,0,0,0|1,0,0]=3 10381 B14R0.394 CSCCCCOCCCCCC(=O)N 34a_100011217163_100009817443 [1,1,0,0,0,0|2,0,0]=4 10382 B14R0.394 CSCCCCOCCCCCC(=O)N 7a_100011217163_100009817443 [1,1,0,0,0,0|2,0,0]=4 10383 B14R0.394 CSCCCCOCCCCOC(=O)C 34a_100011217163_100000033659 [1,1,0,0,0,0|2,0,0]=4 10384 B14R0.394 CSCCCCOCCCCOC(=O)C 7a_100011217163_100000033659 [1,1,0,0,0,0|2,0,0]=4 10385 B14R0.394 CSCCCCOCCCCSC(=O)C 34a_100011217163_200010402107 [1,1,0,0,0,0|2,0,0]=4 10386 B14R0.394 CSCCCCOCCCCSC(=O)C 7a_100011217163_200010402107 [1,1,0,0,0,0|2,0,0]=4 10387 B14R0.394 CSCCCNCCCCCOC(=O)C 2230a_100000749238_100009813381 [1,1,0,0,0,0|2,0,0]=4 10388 B14R0.394 CSCCCOCCCCCOC(=O)C 34a_100000690336_100000033007 [1,1,0,0,0,0|2,0,0]=4 10389 B14R0.394 CSCCCOCCCCCOC(=O)C 7a_100000690336_100000033007 [1,1,0,0,0,0|2,0,0]=4 10390 B14R0.394 CSCCNCCCCCCNC(=O)C 2230a_200011996284_100000751147 [1,1,0,0,0,0|2,0,0]=4 10391 B14R0.394 CSCCNCCCCCCNC(=O)C 34a_200011996284_100000212216 [1,1,0,0,0,0|2,0,0]=4 10392 B14R0.394 NC(=O)CCCCCNCCCCCO 2230a_100000762737_100009817443 [1,1,0,0,0,0|2,0,0]=4 10393 B14R0.394 NC(=O)CCCCCNCCCCCO 34a_100000762737_100009817443 [1,1,0,0,0,0|2,0,0]=4 10394 B14R0.394 NC(=O)CCCCCOCCCCCBr 34a_100000746331_100009817443 [1,1,0,0,0,0|2,0,0]=4 10395 B14R0.394 NC(=O)CCCCCOCCCCCBr 7a_100000746331_100009817443 [1,1,0,0,0,0|2,0,0]=4 10396 B14R0.394 NC(=O)CCCCCOCCCCCCl 34a_100000746330_100009817443 [1,1,0,0,0,0|2,0,0]=4 10397 B14R0.394 NC(=O)CCCCCOCCCCCCl 7a_100000746330_100009817443 [1,1,0,0,0,0|2,0,0]=4 10398 B14R0.394 NC(=O)CCCCCOCCCCCF 34a_100000123541_100000729378 [1,1,0,0,0,0|2,0,0]=4 10399 B14R0.394 NC(=O)CCCCCOCCCCCF 7a_100000123541_100000729378 [1,1,0,0,0,0|2,0,0]=4 10400 B14R0.394 NC(=O)CCCCCOCCCCCI 34a_200012148887_100009817443 [1,1,0,0,0,0|2,0,0]=4 10401 B14R0.394 NC(=O)CCCCCOCCCCCI 7a_200012148887_100009817443 [1,1,0,0,0,0|2,0,0]=4 10402 B14R0.394 NC(=O)CCCCCOCCCCCO 34a_100000123541_100000746330 [1,1,0,0,0,0|2,0,0]=4 10403 B14R0.394 NC(=O)CCCCCOCCCCCO 7a_100000123541_100000746330 [1,1,0,0,0,0|2,0,0]=4 10404 B14R0.394 NC(=O)CCCCCSCCCCCF 62a_100000729378_100009817443 [1,1,0,0,0,0|2,0,0]=4 10405 B14R0.394 NC(=O)CCCCCSCCCCCF 62a_100009817443_100000729378 [1,1,0,0,0,0|2,0,0]=4 10406 B14R0.394 NC(=O)CCCCCSCCCCCO 62a_100000746330_100009817443 [1,1,0,0,0,0|2,0,0]=4 10407 B14R0.394 NC(=O)CCCCCSCCCCCO 62a_100009817443_100000746330 [1,1,0,0,0,0|2,0,0]=4 10408 B14R0.394 NC(=O)CCCCNCCCCCCF 34a_100000696515_100015922095 [1,1,0,0,0,0|2,0,0]=4 10409 B14R0.394 NC(=O)CCCCNCCCCCCO 34a_100000696515_100000766143 [1,1,0,0,0,0|2,0,0]=4 10410 B14R0.394 NC(=O)CCCCOCCCCCCF 34a_100012022536_100015922095 [1,1,0,0,0,0|2,0,0]=4 10411 B14R0.394 NC(=O)CCCCOCCCCCCF 7a_100012022536_100015922095 [1,1,0,0,0,0|2,0,0]=4 10412 B14R0.394 NC(=O)CCCCOCCCCCCO 34a_100012022536_100000766143 [1,1,0,0,0,0|2,0,0]=4 10413 B14R0.394 NC(=O)CCCCOCCCCCCO 7a_100012022536_100000766143 [1,1,0,0,0,0|2,0,0]=4 10414 B14R0.394 NC(=O)CCCNCCCCCCCO 34a_100000739312_100000760002 [1,1,0,0,0,0|2,0,0]=4 10415 B14R0.394 NC(=O)CCCNCCCCCCCO 34a_100011996573_100102525003 [1,1,0,0,0,0|2,0,0]=4 10416 B14R0.394 NC(=O)CCCOCCCCCCCBr 34a_100000760002_100102525003 [1,1,0,0,0,0|2,0,0]=4 10417 B14R0.394 NC(=O)CCCOCCCCCCCBr 7a_100000760002_100102525003 [1,1,0,0,0,0|2,0,0]=4 10418 B14R0.394 NC(=O)CCCSCCCCCCCO 62a_100000760002_100102525003 [1,1,0,0,0,0|2,0,0]=4 10419 B14R0.394 NC(=O)CCCSCCCCCCCO 62a_100102525003_100000760002 [1,1,0,0,0,0|2,0,0]=4 10420 B14R0.394 NC(=O)CCNCCCCCCCCO 2230a_102515433106_100000744528 [1,1,0,0,0,0|2,0,0]=4 10421 B14R0.394 NC(=O)CCNCCCCCCCCO 34a_102515433106_100000731001 [1,1,0,0,0,0|2,0,0]=4 10422 B14R0.394 NC(=O)CCOCCCCCCCCBr 34a_100009813846_100000731001 [1,1,0,0,0,0|2,0,0]=4 10423 B14R0.394 NC(=O)CCOCCCCCCCCBr 7a_100009813846_100000744528 [1,1,0,0,0,0|2,0,0]=4 10424 B14R0.394 NC(=O)CCOCCCCCCCCCl 34a_100000033203_100000731001 [1,1,0,0,0,0|2,0,0]=4 10425 B14R0.394 NC(=O)CCOCCCCCCCCCl 7a_100000033203_100000744528 [1,1,0,0,0,0|2,0,0]=4 10426 B14R0.394 NC(=O)CCOCCCCCCCCO 34a_100000757172_100000033203 [1,1,0,0,0,0|2,0,0]=4 10427 B14R0.394 NC(=O)CCOCCCCCCCCO 7a_100000757172_100000033203 [1,1,0,0,0,0|2,0,0]=4 10428 B14R0.394 NC(=O)CCSCCCCCCCCO 62a_100000033203_100000744528 [1,1,0,0,0,0|2,0,0]=4 10429 B14R0.394 NC(=O)CCSCCCCCCCCO 62a_100000744528_100000033203 [1,1,0,0,0,0|2,0,0]=4 10430 B14R0.394 NC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747473 [1,1,0,0,0,0|2,0,0]=4 10431 B14R0.394 NC(=O)CNCCCCCCCCCO 2230a_100000711301_100009813782 [1,1,0,0,0,0|2,0,0]=4 10432 B14R0.394 NC(=O)CNCCCCCCCCCO 34a_100000078944_100000187820 [1,1,0,0,0,0|2,0,0]=4 10433 B14R0.394 NC(=O)COCCCCCCCCCBr 34a_100009813782_100000187820 [1,1,0,0,0,0|2,0,0]=4 10434 B14R0.394 NC(=O)COCCCCCCCCCBr 7a_100009813782_100000187820 [1,1,0,0,0,0|2,0,0]=4 10435 B14R0.394 NC(=O)COCCCCCCCCCCl 34a_100009868337_100000187820 [1,1,0,0,0,0|2,0,0]=4 10436 B14R0.394 NC(=O)COCCCCCCCCCCl 7a_100009868337_100000187820 [1,1,0,0,0,0|2,0,0]=4 10437 B14R0.394 NC(=O)CSCCCCCCCCCO 62a_100000747473_100009813782 [1,1,0,0,0,0|2,0,0]=4 10438 B14R0.394 NC(=O)CSCCCCCCCCCO 62a_100009813782_100000747473 [1,1,0,0,0,0|2,0,0]=4 10439 B14R0.394 NCCCCCCCCCOCC(=O)N 34a_100000078944_100000187820 [1,1,0,0,0,0|2,0,0]=4 10440 B14R0.394 NCCCCCCCCCOCC(=O)[O-] 34a_100000078944_100020667443 [1,1,0,0,0,0|1,0,1]=4 10441 B14R0.394 NCCCCCCCCOCCC(=O)N 34a_102515433106_100000731001 [1,1,0,0,0,0|2,0,0]=4 10442 B14R0.394 NCCCCCCCOCCCC(=O)N 34a_100011996573_100102525003 [1,1,0,0,0,0|2,0,0]=4 10443 B14R0.394 NCCCCCOCCCCCC(=O)N 34a_100000762737_100009817443 [1,1,0,0,0,0|2,0,0]=4 10444 B14R0.394 O=C(O)CNCCCCCCCCCO 269956a_100016091260_100009813782 [1,1,0,0,0,0|1,0,0]=3 10445 B14R0.394 O=C(O)COCCNCCCCCCF 269956a_100000700818_100015922095 [1,1,0,0,0,0|2,0,0]=4 10446 B14R0.394 O=C(O)COCCNCCCCCCO 269956a_100000700818_100000766143 [1,1,0,0,0,0|2,0,0]=4 10447 B14R0.394 O=C(O)CONCCCCCCCCO 269956a_100000106656_100000033203 [1,1,0,0,0,0|2,0,0]=4 10448 B14R0.394 O=C([O-])CCCCCOCCCCCF 7a_100102619762_100000729378 [1,1,0,0,0,0|1,0,1]=4 10449 B14R0.394 O=C([O-])CCCCCOCCCCCO 7a_100102619762_100000746330 [1,1,0,0,0,0|1,0,1]=4 10450 B14R0.394 O=C([O-])CNCCCCCCCCCO 34a_100000078944_100020667443 [1,1,0,0,0,0|1,0,1]=4 10451 B14R0.394 O=C([O-])COCCCCCCCCCBr 34a_100009813782_100020667443 [1,1,0,0,0,0|1,0,1]=4 10452 B14R0.394 O=C([O-])COCCCCCCCCCCl 34a_100009868337_100020667443 [1,1,0,0,0,0|1,0,1]=4 10453 B14R0.394 O=C([O-])CSCCCCCCCCCO 62a_100009813782_100020667443 [1,1,0,0,0,0|1,0,1]=4 10454 B14R0.394 O=C([O-])CSCCCCCCCCCO 62a_100020667443_100009813782 [1,1,0,0,0,0|1,0,1]=4 10455 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200010167045_200025704644 [1,1,0,0,0,0|1,0,0]=3 10456 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200025704644_200010167045 [1,1,0,0,0,0|1,0,0]=3 10457 B14R0.432 CCCC(C)CCCOCCCC(=O)C 34a_100011713154_100000685027 [1,1,0,0,0,0|1,0,0]=3 10458 B14R0.432 CCCC(C)CCCOCCCC(=O)C 7a_100011713154_100011215641 [1,1,0,0,0,0|1,0,0]=3 10459 B14R0.432 CCCC(C)CCCOCCCC(=O)N 34a_100011713154_100102525003 [1,1,0,0,0,0|2,0,0]=4 10460 B14R0.432 CCCC(C)CCCOCCCC(=O)N 7a_100011713154_100102525003 [1,1,0,0,0,0|2,0,0]=4 10461 B14R0.432 CCCC(C)CCCOCCNC(=O)C 7a_100011713154_100000189650 [1,1,0,0,0,0|2,0,0]=4 10462 B14R0.432 CCCC(C)CCCOCCOC(=O)C 34a_100011713154_100009814007 [1,1,0,0,0,0|2,0,0]=4 10463 B14R0.432 CCCC(C)CCCOCCOC(=O)C 7a_100011713154_100009814007 [1,1,0,0,0,0|2,0,0]=4 10464 B14R0.432 CCCC(C)CCOCCCCC(=O)C 34a_100011217855_100009817362 [1,1,0,0,0,0|1,0,0]=3 10465 B14R0.432 CCCC(C)CCOCCCCC(=O)C 7a_100011217855_100000735457 [1,1,0,0,0,0|1,0,0]=3 10466 B14R0.432 CCCC(C)CCOCCCOC(=O)C 34a_100011217855_100000042594 [1,1,0,0,0,0|2,0,0]=4 10467 B14R0.432 CCCC(C)CCOCCCOC(=O)C 7a_100011217855_100000042594 [1,1,0,0,0,0|2,0,0]=4 10468 B14R0.432 CCCC(C)CCOCCCSC(=O)C 34a_100011217855_100000038929 [1,1,0,0,0,0|2,0,0]=4 10469 B14R0.432 CCCC(C)CCOCCCSC(=O)C 7a_100011217855_100000038929 [1,1,0,0,0,0|2,0,0]=4 10470 B14R0.432 CCCC(C)CNCCCCNC(=O)C 2230a_200011368371_100011216630 [1,1,0,0,0,0|2,0,0]=4 10471 B14R0.432 CCCC(C)CNCCCCNC(=O)C 270004a_200011368371_100000243154 [1,1,0,0,0,0|2,0,0]=4 10472 B14R0.432 CCCC(C)CNCCCCNC(=O)C 34a_200011368371_100011216630 [1,1,0,0,0,0|2,0,0]=4 10473 B14R0.432 CCCC(C)COCCCCCC(=O)N 34a_100000123541_100011216630 [1,1,0,0,0,0|2,0,0]=4 10474 B14R0.432 CCCC(C)COCCCCCC(=O)N 34a_100000688023_100009817443 [1,1,0,0,0,0|2,0,0]=4 10475 B14R0.432 CCCC(C)COCCCCCC(=O)N 7a_100000123541_100011216630 [1,1,0,0,0,0|2,0,0]=4 10476 B14R0.432 CCCC(C)COCCCCCC(=O)N 7a_100000688023_100009817443 [1,1,0,0,0,0|2,0,0]=4 10477 B14R0.432 CCCC(C)COCCCCCC(=O)[O-] 7a_100102619762_100011216630 [1,1,0,0,0,0|1,0,1]=4 10478 B14R0.432 CCCC(C)COCCCCOC(=O)C 34a_100000073216_100011216630 [1,1,0,0,0,0|2,0,0]=4 10479 B14R0.432 CCCC(C)COCCCCOC(=O)C 34a_100000688023_100000033659 [1,1,0,0,0,0|2,0,0]=4 10480 B14R0.432 CCCC(C)COCCCCOC(=O)C 7a_100000073216_100011216630 [1,1,0,0,0,0|2,0,0]=4 10481 B14R0.432 CCCC(C)COCCCCOC(=O)C 7a_100000688023_100000033659 [1,1,0,0,0,0|2,0,0]=4 10482 B14R0.432 CCCC(C)COCCCCSC(=O)C 34a_100000688023_200010402107 [1,1,0,0,0,0|2,0,0]=4 10483 B14R0.432 CCCC(C)COCCCCSC(=O)C 7a_100000688023_200010402107 [1,1,0,0,0,0|2,0,0]=4 10484 B14R0.432 CCCC(C)CSCCCCCC(=O)N 62a_100009817443_100011216630 [1,1,0,0,0,0|2,0,0]=4 10485 B14R0.432 CCCC(C)CSCCCCCC(=O)N 62a_100011216630_100009817443 [1,1,0,0,0,0|2,0,0]=4 10486 B14R0.432 CCCC(C)CSCCCCOC(=O)C 62a_100000033659_100011216630 [1,1,0,0,0,0|2,0,0]=4 10487 B14R0.432 CCCC(C)CSCCCCOC(=O)C 62a_100011216630_100000033659 [1,1,0,0,0,0|2,0,0]=4 10488 B14R0.432 CCCC(C)CSCCCCSC(=O)C 62a_100011216630_200010402107 [1,1,0,0,0,0|2,0,0]=4 10489 B14R0.432 CCCC(C)CSCCCCSC(=O)C 62a_200010402107_100011216630 [1,1,0,0,0,0|2,0,0]=4 10490 B14R0.432 CCCC(C)NCCCCCNC(=O)C 2230a_200012022750_100000766640 [1,1,0,0,0,0|2,0,0]=4 10491 B14R0.432 CCCC(C)NCCCCCNC(=O)C 270004a_200012022750_100000211909 [1,1,0,0,0,0|2,0,0]=4 10492 B14R0.432 CCCC(C)NCCCCCNC(=O)C 34a_200012022750_100000766640 [1,1,0,0,0,0|2,0,0]=4 10493 B14R0.432 CCCC(C)NCCCCCOC(=O)C 2230a_100000741246_100009813381 [1,1,0,0,0,0|2,0,0]=4 10494 B14R0.432 CCCC(C)OCCCCCOC(=O)C 34a_100000764384_100000033007 [1,1,0,0,0,0|2,0,0]=4 10495 B14R0.432 CCCC(C)OCCCCCOC(=O)C 7a_100000764384_100000033007 [1,1,0,0,0,0|2,0,0]=4 10496 B14R0.432 CCCC(C)SCCCCCOC(=O)C 62a_100000033007_100000766640 [1,1,0,0,0,0|2,0,0]=4 10497 B14R0.432 CCCC(C)SCCCCCOC(=O)C 62a_100000766640_100000033007 [1,1,0,0,0,0|2,0,0]=4 10498 B14R0.432 CCC[C@H](N)CCOCCCCC(=O)C 34a_100015193777_100009817362 [1,1,0,0,0,0|1,0,0]=3 10499 B14R0.432 CCC[C@H](N)CCOCCCOC(=O)C 34a_100015193777_100000042594 [1,1,0,0,0,0|2,0,0]=4 10500 B14R0.432 CCC[C@H](N)CCOCCCSC(=O)C 34a_100015193777_100000038929 [1,1,0,0,0,0|2,0,0]=4 10501 B14R0.432 CCC[C@H](N)COCCCCCC(=O)N 34a_100000732646_100009817443 [1,1,0,0,0,0|2,0,0]=4 10502 B14R0.432 CCC[C@H](N)COCCCCOC(=O)C 34a_100000732646_100000033659 [1,1,0,0,0,0|2,0,0]=4 10503 B14R0.432 CCC[C@H](N)COCCCCSC(=O)C 34a_100000732646_200010402107 [1,1,0,0,0,0|2,0,0]=4 10504 B14R0.432 CCOC(=O)CCCCCCCC(=O)C 1458a_100000070787_100009991516 [1,1,0,0,0,0|1,0,1]=4 10505 B14R0.2224 C=C(C)COCCC(C)CCCCCC 34a_200011024964_100000748629 [1,1,0,0,0,0|2,0,0]=4 10506 B14R0.2224 C=C(C)COCCC(C)CCCCCC 7a_200011024964_100000748629 [1,1,0,0,0,0|2,0,0]=4 10507 B14R0.2224 CC(=O)CCCCC(=O)CCCCCO 1458a_100102619762_100000735457 [1,1,0,0,0,0|1,0,1]=4 10508 B14R0.2224 CC(=O)CCCCN(C)CCCCCO 269982a_100000722520_100000735457 [1,1,0,0,0,0|2,0,0]=4 10509 B14R0.2224 CCCCCCC(=O)CCCCC(=O)C 1458a_100102632555_100000735457 [1,1,0,0,0,0|0,0,1]=3 10510 B14R0.2224 CCCCCCC(=O)CCCNC(=O)C 1458a_100000194741_100000210757 [1,1,0,0,0,0|1,0,1]=4 10511 B14R0.2224 CCCCCCC(=O)CCCOC(=O)C 1458a_100102632555_100000042594 [1,1,0,0,0,0|1,0,1]=4 10512 B14R0.2224 CCCCCCC(=O)CCCSC(=O)C 1458a_100102632555_100000038929 [1,1,0,0,0,0|1,0,1]=4 10513 B14R0.2224 CCCCCCC(C)CCOCC(=O)N 34a_200011024964_100000187820 [1,1,0,0,0,0|2,0,0]=4 10514 B14R0.2224 CCCCCCC(C)CCOCC(=O)N 7a_200011024964_100000187820 [1,1,0,0,0,0|2,0,0]=4 10515 B14R0.2224 CCCCCCC(C)CCOCC(=O)[O-] 34a_200011024964_100020667443 [1,1,0,0,0,0|1,0,1]=4 10516 B14R0.2224 CCCCCCC(C)NCCCC(=O)C 34a_100000210919_100000685027 [1,1,0,0,0,0|1,0,0]=3 10517 B14R0.2224 CCCCCCC(C)NCCCC(=O)N 34a_100000210919_100102525003 [1,1,0,0,0,0|2,0,0]=4 10518 B14R0.2224 CCCCCCC(C)NCCCC(=O)N 34a_100000739312_100011215978 [1,1,0,0,0,0|2,0,0]=4 10519 B14R0.2224 CCCCCCC(C)NCCCS(=O)C 2230a_200000753449_100011215978 [1,1,0,0,0,0|2,0,0]=4 10520 B14R0.2224 CCCCCCC(C)NCCCS(=O)C 270004a_200000753449_100000210826 [1,1,0,0,0,0|2,0,0]=4 10521 B14R0.2224 CCCCCCC(C)NCCNC(=O)C 2230a_100000209853_100011215978 [1,1,0,0,0,0|2,0,0]=4 10522 B14R0.2224 CCCCCCC(C)NCCNC(=O)C 2230a_100000210919_100000189650 [1,1,0,0,0,0|2,0,0]=4 10523 B14R0.2224 CCCCCCC(C)NCCOC(=O)C 34a_100000210919_100009814007 [1,1,0,0,0,0|2,0,0]=4 10524 B14R0.2224 CCCCCCC(C)OCCCC(=O)C 34a_100000210265_100000685027 [1,1,0,0,0,0|1,0,0]=3 10525 B14R0.2224 CCCCCCC(C)OCCCC(=O)C 34a_100000759063_100011215978 [1,1,0,0,0,0|1,0,0]=3 10526 B14R0.2224 CCCCCCC(C)OCCCC(=O)C 7a_100000210265_100011215641 [1,1,0,0,0,0|1,0,0]=3 10527 B14R0.2224 CCCCCCC(C)OCCCC(=O)C 7a_100000759063_100011215978 [1,1,0,0,0,0|1,0,0]=3 10528 B14R0.2224 CCCCCCC(C)OCCCC(=O)N 34a_100000210265_100102525003 [1,1,0,0,0,0|2,0,0]=4 10529 B14R0.2224 CCCCCCC(C)OCCCC(=O)N 7a_100000210265_100102525003 [1,1,0,0,0,0|2,0,0]=4 10530 B14R0.2224 CCCCCCC(C)OCCNC(=O)C 34a_100000158858_100011215978 [1,1,0,0,0,0|2,0,0]=4 10531 B14R0.2224 CCCCCCC(C)OCCNC(=O)C 7a_100000210265_100000189650 [1,1,0,0,0,0|2,0,0]=4 10532 B14R0.2224 CCCCCCC(C)OCCOC(=O)C 34a_100000210265_100009814007 [1,1,0,0,0,0|2,0,0]=4 10533 B14R0.2224 CCCCCCC(C)OCCOC(=O)C 7a_100000210265_100009814007 [1,1,0,0,0,0|2,0,0]=4 10534 B14R0.2224 CCCCCCC(C)SCCCC(=O)C 62a_100011215641_100011215978 [1,1,0,0,0,0|1,0,0]=3 10535 B14R0.2224 CCCCCCC(C)SCCCC(=O)C 62a_100011215978_100011215641 [1,1,0,0,0,0|1,0,0]=3 10536 B14R0.2224 CCCCCCC(C)SCCCC(=O)N 62a_100011215978_100102525003 [1,1,0,0,0,0|2,0,0]=4 10537 B14R0.2224 CCCCCCC(C)SCCCC(=O)N 62a_100102525003_100011215978 [1,1,0,0,0,0|2,0,0]=4 10538 B14R0.2224 CCCCCCC(C)SCCNC(=O)C 62a_100000189650_100011215978 [1,1,0,0,0,0|2,0,0]=4 10539 B14R0.2224 CCCCCCC(C)SCCNC(=O)C 62a_100011215978_100000189650 [1,1,0,0,0,0|2,0,0]=4 10540 B14R0.2224 CCCCCCC(C)SCCOC(=O)C 62a_100009814007_100011215978 [1,1,0,0,0,0|2,0,0]=4 10541 B14R0.2224 CCCCCCC(C)SCCOC(=O)C 62a_100011215978_100009814007 [1,1,0,0,0,0|2,0,0]=4 10542 B14R0.2224 CCCCCCN(C)CCCCC(=O)C 269982a_106256046315_100000735457 [1,1,0,0,0,0|1,0,0]=3 10543 B14R0.2224 CCCCCCN(C)CCCOC(=O)C 269982a_106256046315_100000042594 [1,1,0,0,0,0|2,0,0]=4 10544 B14R0.2224 CCCCCCN(C)CCCSC(=O)C 2230a_106256046315_100000038929 [1,1,0,0,0,0|2,0,0]=4 10545 B14R0.2224 CCCCCCN(C)CCCSC(=O)C 269982a_106256046315_100000038929 [1,1,0,0,0,0|2,0,0]=4 10546 B14R0.2224 CCCCOCC(=O)CCCCC(=O)C 1458a_100000757543_100000735457 [1,1,0,0,0,0|1,0,1]=4 10547 B14R0.2224 CCCCOCC(C)OCCCC(=O)C 34a_100011217071_100000685027 [1,1,0,0,0,0|2,0,0]=4 10548 B14R0.2224 CCCCOCC(C)OCCCC(=O)C 7a_100011217071_100011215641 [1,1,0,0,0,0|2,0,0]=4 10549 B14R0.2224 CCCCSCC(=O)CCCCC(=O)C 1458a_100000191162_100000735457 [1,1,0,0,0,0|1,0,1]=4 10550 B14R0.12 CCCCCCC(=O)CCCC(=O)NC 1458a_100102632555_100000741757 [1,1,0,0,0,0|1,0,1]=4 10551 B14R0.12 CCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210757 [1,1,0,0,0,0|0,0,1]=3 10552 B14R0.12 CCCCCCC(=O)CCCC(=O)OC 1458a_100102632555_100011218270 [1,1,0,0,0,0|0,0,1]=3 10553 B14R0.12 CCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210757 [1,1,0,0,0,0|1,0,1]=4 10554 B14R0.12 CCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100102632555 [1,1,0,0,0,0|1,0,1]=4 10555 B14R0.12 CCCCCCC(C)NCCC(=O)NC 2230a_100000210919_100000737683 [1,1,0,0,0,0|2,0,0]=4 10556 B14R0.12 CCCCCCC(C)NCCC(=O)NC 2230a_100000738227_100011215978 [1,1,0,0,0,0|2,0,0]=4 10557 B14R0.12 CCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100000210826 [1,1,0,0,0,0|2,0,0]=4 10558 B14R0.12 CCCCCCC(C)NCCC(=O)NC 34a_100000210919_100012179268 [1,1,0,0,0,0|2,0,0]=4 10559 B14R0.12 CCCCCCC(C)NCCC(=O)NC 34a_100000738227_100011215978 [1,1,0,0,0,0|2,0,0]=4 10560 B14R0.12 CCCCCCC(C)NCCC(=O)OC 2230a_100000210919_100000204255 [1,1,0,0,0,0|1,0,0]=3 10561 B14R0.12 CCCCCCC(C)NCCC(=O)OC 34a_100000210919_100000742370 [1,1,0,0,0,0|1,0,0]=3 10562 B14R0.12 CCCCCCC(C)OCCC(=O)NC 34a_100000210265_100012179268 [1,1,0,0,0,0|2,0,0]=4 10563 B14R0.12 CCCCCCC(C)OCCC(=O)NC 34a_100000754576_100011215978 [1,1,0,0,0,0|2,0,0]=4 10564 B14R0.12 CCCCCCC(C)OCCC(=O)NC 7a_100000210265_100000737683 [1,1,0,0,0,0|2,0,0]=4 10565 B14R0.12 CCCCCCC(C)OCCC(=O)OC 34a_100000210265_100000742370 [1,1,0,0,0,0|1,0,0]=3 10566 B14R0.12 CCCCCCC(C)OCCC(=O)OC 7a_100000210265_100000204255 [1,1,0,0,0,0|1,0,0]=3 10567 B14R0.12 CCCCCCC(C)SCCC(=O)NC 62a_100000737683_100011215978 [1,1,0,0,0,0|2,0,0]=4 10568 B14R0.12 CCCCCCC(C)SCCC(=O)NC 62a_100011215978_100000737683 [1,1,0,0,0,0|2,0,0]=4 10569 B14R0.12 CCCCCCC(C)SCCC(=O)OC 62a_100000204255_100011215978 [1,1,0,0,0,0|1,0,0]=3 10570 B14R0.12 CCCCCCC(C)SCCC(=O)OC 62a_100011215978_100000204255 [1,1,0,0,0,0|1,0,0]=3 10571 B14R0.12 CCCCCCC(C)SCOC(=O)OC 62a_100011215978_100000139417 [1,1,0,0,0,0|2,0,0]=4 10572 B14R0.12 CCCCCCN(C)CCCC(=O)NC 2230a_106256046315_100000741757 [1,1,0,0,0,0|2,0,0]=4 10573 B14R0.12 CCCCCCN(C)CCCC(=O)NC 269982a_106256046315_100000741757 [1,1,0,0,0,0|2,0,0]=4 10574 B14R0.12 CCCCCCN(C)CCCC(=O)OC 2230a_106256046315_100011218270 [1,1,0,0,0,0|1,0,0]=3 10575 B14R0.12 CCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210757 [1,1,0,0,0,0|1,0,0]=3 10576 B14R0.12 CCCCCCN(C)CCCC(=O)OC 269982a_106256046315_100011218270 [1,1,0,0,0,0|1,0,0]=3 10577 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 11a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 10578 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 1626a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 10579 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 240690a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 10580 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 527a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 10581 B14R0.12 CCCCOCC(=O)CCCC(=O)OC 1458a_100000239890_100011995733 [1,1,0,0,0,0|1,0,1]=4 10582 B14R0.12 CCCCOCC(=O)CCCC(=O)OC 1458a_100000757543_100011218270 [1,1,0,0,0,0|1,0,1]=4 10583 B14R0.12 CCCCOCC(C)OCCC(=O)OC 34a_100011217071_100000742370 [1,1,0,0,0,0|2,0,0]=4 10584 B14R0.12 CCCCOCC(C)OCCC(=O)OC 7a_100011217071_100000204255 [1,1,0,0,0,0|2,0,0]=4 10585 B14R0.12 CCCCOCN(C)CCCC(=O)OC 269982a_100000739225_100011995733 [1,1,0,0,0,0|2,0,0]=4 10586 B14R0.12 CCCCSCC(=O)CCCC(=O)OC 1458a_100000191162_100011218270 [1,1,0,0,0,0|1,0,1]=4 10587 B14R0.12 CCCOCCC(=O)CCCC(=O)OC 1458a_100000239890_100011215938 [1,1,0,0,0,0|1,0,1]=4 10588 B14R0.12 CCCOCCN(C)CCCC(=O)OC 269982a_100000739225_100011215938 [1,1,0,0,0,0|2,0,0]=4 10589 B14R0.12 CCOCCCC(=O)CCCC(=O)OC 1458a_100000239890_100012232248 [1,1,0,0,0,0|1,0,1]=4 10590 B14R0.12 CCOCCCN(C)CCCC(=O)OC 269982a_100000739225_100012232248 [1,1,0,0,0,0|2,0,0]=4 10591 B14R0.12 COC(=O)CCCC(=O)CCCCCF 1458a_100000239890_100000729378 [1,1,0,0,0,0|1,0,1]=4 10592 B14R0.12 COC(=O)CCCC(=O)CCCCCO 1458a_100000239890_100000746330 [1,1,0,0,0,0|1,0,1]=4 10593 B14R0.12 COC(=O)CCCC(=O)CCCCCO 1458a_100102619762_100011218270 [1,1,0,0,0,0|1,0,1]=4 10594 B14R0.12 COC(=O)CCCN(C)CCCCCF 269982a_100000739225_100000729378 [1,1,0,0,0,0|2,0,0]=4 10595 B14R0.12 COC(=O)CCCN(C)CCCCCO 2230a_100000722520_100011218270 [1,1,0,0,0,0|2,0,0]=4 10596 B14R0.12 COC(=O)CCCN(C)CCCCCO 269982a_100000722520_100011218270 [1,1,0,0,0,0|2,0,0]=4 10597 B14R0.12 COC(=O)CCCN(C)CCCCCO 269982a_100000739225_100000746330 [1,1,0,0,0,0|2,0,0]=4 10598 B14R0.12 COCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000755781 [1,1,0,0,0,0|1,0,1]=4 10599 B14R0.12 COCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000730899 [1,1,0,0,0,0|2,0,0]=4 10600 B14R0.32 CCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210303 [1,1,0,0,0,0|0,0,1]=3 10601 B14R0.32 CCCC(=O)CCCCCCC(=O)OC 1458a_100000211992_100009815986 [1,1,0,0,0,0|0,0,1]=3 10602 B14R0.32 CCCC(=O)COCCCCC(=O)OC 7a_100000059025_100000747444 [1,1,0,0,0,0|1,0,1]=4 10603 B14R0.32 CCCC(=O)CSCCCCC(=O)OC 62a_100000204269_100000747444 [1,1,0,0,0,0|1,0,1]=4 10604 B14R0.32 CCCC(=O)CSCCCCC(=O)OC 62a_100000747444_100000204269 [1,1,0,0,0,0|1,0,1]=4 10605 B14R0.32 CCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000211992 [1,1,0,0,0,0|1,0,1]=4 10606 B14R0.32 CCCC(C)CCCOCCC(=O)NC 34a_100011713154_100012179268 [1,1,0,0,0,0|2,0,0]=4 10607 B14R0.32 CCCC(C)CCCOCCC(=O)NC 7a_100011713154_100000737683 [1,1,0,0,0,0|2,0,0]=4 10608 B14R0.32 CCCC(C)CCCOCCC(=O)OC 34a_100011713154_100000742370 [1,1,0,0,0,0|1,0,0]=3 10609 B14R0.32 CCCC(C)CCCOCCC(=O)OC 7a_100011713154_100000204255 [1,1,0,0,0,0|1,0,0]=3 10610 B14R0.32 CCCC(C)CCOCCCC(=O)NC 34a_100011217855_100000741757 [1,1,0,0,0,0|2,0,0]=4 10611 B14R0.32 CCCC(C)CCOCCCC(=O)NC 7a_100011217855_100000741757 [1,1,0,0,0,0|2,0,0]=4 10612 B14R0.32 CCCC(C)CCOCCCC(=O)OC 34a_100011217855_100000742333 [1,1,0,0,0,0|1,0,0]=3 10613 B14R0.32 CCCC(C)CCOCCCC(=O)OC 7a_100011217855_100011218270 [1,1,0,0,0,0|1,0,0]=3 10614 B14R0.32 CCCC(C)COCCCCC(=O)OC 34a_100000059025_100011216630 [1,1,0,0,0,0|1,0,0]=3 10615 B14R0.32 CCCC(C)COCCCCC(=O)OC 34a_100000688023_100000204269 [1,1,0,0,0,0|1,0,0]=3 10616 B14R0.32 CCCC(C)COCCCCC(=O)OC 7a_100000059025_100011216630 [1,1,0,0,0,0|1,0,0]=3 10617 B14R0.32 CCCC(C)COCCCCC(=O)OC 7a_100000688023_100000204269 [1,1,0,0,0,0|1,0,0]=3 10618 B14R0.32 CCCC(C)COCCOCC(=O)OC 34a_100000688023_100000090808 [1,1,0,0,0,0|2,0,0]=4 10619 B14R0.32 CCCC(C)COCCOCC(=O)OC 7a_100000688023_100000090808 [1,1,0,0,0,0|2,0,0]=4 10620 B14R0.32 CCCC(C)CSCCCCC(=O)OC 62a_100000204269_100011216630 [1,1,0,0,0,0|1,0,0]=3 10621 B14R0.32 CCCC(C)CSCCCCC(=O)OC 62a_100011216630_100000204269 [1,1,0,0,0,0|1,0,0]=3 10622 B14R0.32 CCCC(C)CSCCOCC(=O)OC 62a_100000090808_100011216630 [1,1,0,0,0,0|2,0,0]=4 10623 B14R0.32 CCCC(C)CSCCOCC(=O)OC 62a_100011216630_100000090808 [1,1,0,0,0,0|2,0,0]=4 10624 B14R0.32 CCCC(C)NCCCCCC(=O)OC 2230a_100000741246_100009816466 [1,1,0,0,0,0|1,0,0]=3 10625 B14R0.32 CCCC(C)OCCCCCC(=O)OC 34a_100000074720_100000766640 [1,1,0,0,0,0|1,0,0]=3 10626 B14R0.32 CCCC(C)OCCCCCC(=O)OC 34a_100000764384_100009816466 [1,1,0,0,0,0|1,0,0]=3 10627 B14R0.32 CCCC(C)OCCCCCC(=O)OC 7a_100000074720_100000766640 [1,1,0,0,0,0|1,0,0]=3 10628 B14R0.32 CCCC(C)OCCCCCC(=O)OC 7a_100000764384_100009816466 [1,1,0,0,0,0|1,0,0]=3 10629 B14R0.32 CCCC(C)SCCCCCC(=O)OC 62a_100000766640_100009816466 [1,1,0,0,0,0|1,0,0]=3 10630 B14R0.32 CCCC(C)SCCCCCC(=O)OC 62a_100009816466_100000766640 [1,1,0,0,0,0|1,0,0]=3 10631 B14R0.32 CCCN(C)CCCCCCC(=O)OC 2230a_100000747261_100009815986 [1,1,0,0,0,0|1,0,0]=3 10632 B14R0.32 CCCN(C)CCCCCCC(=O)OC 269982a_100000747261_100009815986 [1,1,0,0,0,0|1,0,0]=3 10633 B14R0.32 CCC[C@H](N)CCOCCCC(=O)NC 34a_100015193777_100000741757 [1,1,0,0,0,0|2,0,0]=4 10634 B14R0.32 CCC[C@H](N)CCOCCCC(=O)OC 34a_100015193777_100000742333 [1,1,0,0,0,0|1,0,0]=3 10635 B14R0.32 CCC[C@H](N)COCCCCC(=O)OC 34a_100000732646_100000204269 [1,1,0,0,0,0|1,0,0]=3 10636 B14R0.32 CCC[C@H](N)COCCOCC(=O)OC 34a_100000732646_100000090808 [1,1,0,0,0,0|2,0,0]=4 10637 B14R0.32 CCNC(=O)CCCCCCC(=O)OC 11a_100015525214_100000036694 [1,1,0,0,0,0|1,0,1]=4 10638 B14R0.32 CCNC(=O)CCCCCCC(=O)OC 240690a_100015525214_100000036694 [1,1,0,0,0,0|1,0,1]=4 10639 B14R0.32 COC(=O)CCCCCCC(=O)CCF 1458a_100000036694_100011217306 [1,1,0,0,0,0|1,0,1]=4 10640 B14R0.32 COC(=O)CCCCCCC(=O)CCO 1458a_100000036694_100000211926 [1,1,0,0,0,0|1,0,1]=4 10641 B14R0.32 COC(=O)CCCCCCC(=O)CCO 1458a_100011216618_100009815986 [1,1,0,0,0,0|1,0,1]=4 10642 B14R0.32 COC(=O)CCCCCCC(=O)CSC 1458a_100000184570_100009815986 [1,1,0,0,0,0|1,0,1]=4 10643 B14R0.32 COC(=O)CCCCCCN(C)CCO 2230a_100000210263_100009815986 [1,1,0,0,0,0|2,0,0]=4 10644 B14R0.32 COC(=O)CCCCCCN(C)CCO 269982a_100000210263_100009815986 [1,1,0,0,0,0|2,0,0]=4 10645 B14R0.32 COC(=O)CCCCCN[C@H](C)CCO 2230a_100000706166_100009816466 [1,1,0,0,0,0|2,0,0]=4 10646 B14R0.32 COC(=O)CCCCCN[C@H](C)CCO 34a_100000706166_100009816466 [1,1,0,0,0,0|2,0,0]=4 10647 B14R0.32 COC(=O)CCCCCOC(C)CCBr 34a_100012276601_100009816466 [1,1,0,0,0,0|2,0,0]=4 10648 B14R0.32 COC(=O)CCCCCOC(C)CCO 34a_100000074720_100009893172 [1,1,0,0,0,0|2,0,0]=4 10649 B14R0.32 COC(=O)CCCCCOC(C)CCO 7a_100000074720_100009893172 [1,1,0,0,0,0|2,0,0]=4 10650 B14R0.32 COC(=O)CCCCCSC(C)CCO 62a_100009816466_100009893172 [1,1,0,0,0,0|2,0,0]=4 10651 B14R0.32 COC(=O)CCCCCSC(C)CCO 62a_100009893172_100009816466 [1,1,0,0,0,0|2,0,0]=4 10652 B14R0.32 COC(=O)CCCCOCC(C)CCN 34a_106354213184_100000204269 [1,1,0,0,0,0|2,0,0]=4 10653 B14R0.32 COCC(=O)CCCCCCC(=O)OC 1458a_100000210968_100009815986 [1,1,0,0,0,0|1,0,1]=4 10654 B14R0.32 COCC(C)OCCCCCC(=O)OC 34a_100000074720_100000765312 [1,1,0,0,0,0|2,0,0]=4 10655 B14R0.32 COCC(C)OCCCCCC(=O)OC 7a_100000074720_100000765312 [1,1,0,0,0,0|2,0,0]=4 10656 B14R0.32 COCC(C)SCCCCCC(=O)OC 62a_100000765312_100009816466 [1,1,0,0,0,0|2,0,0]=4 10657 B14R0.32 COCC(C)SCCCCCC(=O)OC 62a_100009816466_100000765312 [1,1,0,0,0,0|2,0,0]=4 10658 B14R0.32 COCC(N)COCCCCC(=O)OC 34a_100000724102_100000204269 [1,1,0,0,0,0|2,0,0]=4 10659 B14R0.32 COCC(O)CNCCCCC(=O)OC 2230a_100000756049_100000204269 [1,1,0,0,0,0|2,0,0]=4 10660 B14R0.32 COCC(O)CNCCCCC(=O)OC 34a_100000756049_100000204269 [1,1,0,0,0,0|2,0,0]=4 10661 B14R0.32 COCC(O)COCCCCC(=O)OC 34a_100000059025_100011215053 [1,1,0,0,0,0|2,0,0]=4 10662 B14R0.32 COCC(O)COCCCCC(=O)OC 7a_100000059025_100011215053 [1,1,0,0,0,0|2,0,0]=4 10663 B14R0.32 COCC(O)CSCCCCC(=O)OC 62a_100000204269_100011215053 [1,1,0,0,0,0|2,0,0]=4 10664 B14R0.32 COCC(O)CSCCCCC(=O)OC 62a_100011215053_100000204269 [1,1,0,0,0,0|2,0,0]=4 10665 B14R0.32 COC[C@@H](C)NCCCCCC(=O)OC 2230a_100000764878_100009816466 [1,1,0,0,0,0|2,0,0]=4 10666 B14R0.32 COC[C@@H](C)OCCCCCC(=O)OC 34a_100011934205_100009816466 [1,1,0,0,0,0|2,0,0]=4 10667 B14R0.82 CCCCCCCCC(=O)CC(=O)CC 1458a_100000210188_100000747405 [1,1,0,0,0,0|1,0,1]=4 10668 B14R0.82 CCCCCCCCC(=O)CC(=O)NC 1458a_100000210188_100000183359 [1,1,0,0,0,0|1,0,1]=4 10669 B14R0.82 CCCCCCCCC(=O)CC(=O)OC 1458a_100000210188_100000747449 [1,1,0,0,0,0|0,0,1]=3 10670 B14R0.82 CCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210759 [1,1,0,0,0,0|0,0,1]=3 10671 B14R0.82 CCCCCCCCN(C)CC(=O)CC 269982a_100000207567_100000747405 [1,1,0,0,0,0|2,0,0]=4 10672 B14R0.82 CCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100000210759 [1,1,0,0,0,0|2,0,0]=4 10673 B14R0.82 CCCCCCCCN(C)CC(=O)NC 2230a_100000207567_100000183359 [1,1,0,0,0,0|2,0,0]=4 10674 B14R0.82 CCCCCCCCN(C)CC(=O)NC 269982a_100000207567_100000183359 [1,1,0,0,0,0|2,0,0]=4 10675 B14R0.82 CCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210759 [1,1,0,0,0,0|1,0,0]=3 10676 B14R0.82 CCCCCCCCN(C)CC(=O)OC 2230a_100000207567_100000747449 [1,1,0,0,0,0|1,0,0]=3 10677 B14R0.82 CCCCCCCCN(C)CC(=O)OC 269982a_100000207567_100000747449 [1,1,0,0,0,0|1,0,0]=3 10678 B14R0.82 CCCCCCCNC(=O)CC(=O)OC 240690a_100000229938_100000211351 [1,1,0,0,0,0|1,0,1]=4 10679 B14R0.82 CCCCCCCNC(C)CC(=O)OC 2230a_100000229938_100009817358 [1,1,0,0,0,0|1,0,0]=3 10680 B14R0.82 CCCCCCCOC(C)CC(=O)OC 34a_100000210272_100009817358 [1,1,0,0,0,0|1,0,0]=3 10681 B14R0.82 CCCCCCCOC(C)CC(=O)OC 7a_100000210272_100009817358 [1,1,0,0,0,0|1,0,0]=3 10682 B14R0.82 CCCCCCCSC(C)CC(=O)OC 62a_100000210614_100009817358 [1,1,0,0,0,0|1,0,0]=3 10683 B14R0.82 CCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210316 [1,1,0,0,0,0|1,0,0]=3 10684 B14R0.82 CCCCCCOC[C@H](O)CC(=O)OC 34a_100000210259_100000754131 [1,1,0,0,0,0|1,0,0]=3 10685 B14R0.82 CCCCCCOC[C@H](O)CC(=O)OC 7a_100000210259_100000754131 [1,1,0,0,0,0|1,0,0]=3 10686 B14R0.82 CCCCCCSCC(=O)CC(=O)OC 62a_100000210314_100000210525 [1,1,0,0,0,0|1,0,1]=4 10687 B14R0.82 CCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210757 [1,1,0,0,0,0|1,0,1]=4 10688 B14R0.82 CCCCCCSC[C@H](O)CC(=O)OC 62a_100000210314_100000754131 [1,1,0,0,0,0|1,0,0]=3 10689 B14R0.82 CCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210757 [1,1,0,0,0,0|1,0,0]=3 10690 B14R0.82 CCCCOCCOC(C)CC(=O)OC 34a_100000210238_100009817358 [1,1,0,0,0,0|2,0,0]=4 10691 B14R0.82 CCCCOCCOC(C)CC(=O)OC 7a_100000210238_100009817358 [1,1,0,0,0,0|2,0,0]=4 10692 B14R0.82 CCCCOCCSC(C)CC(=O)OC 62a_100000743108_100009817358 [1,1,0,0,0,0|2,0,0]=4 10693 B14R0.82 CCCCOCCSC(C)CC(=O)OC 62a_100009817358_100000743108 [1,1,0,0,0,0|2,0,0]=4 10694 B14R0.82 CCCCOCSC[C@H](O)CC(=O)OC 62a_100000754131_100011995733 [1,1,0,0,0,0|2,0,0]=4 10695 B14R0.82 CCCCOCSC[C@H](O)CC(=O)OC 62a_100011995733_100000754131 [1,1,0,0,0,0|2,0,0]=4 10696 B14R0.82 CCCCSCCNC(C)CC(=O)OC 2230a_100025743550_100009817358 [1,1,0,0,0,0|2,0,0]=4 10697 B14R0.82 CCCCSCCOC(C)CC(=O)OC 34a_200000230436_100009817358 [1,1,0,0,0,0|2,0,0]=4 10698 B14R0.82 CCCCSCCOC(C)CC(=O)OC 7a_200000230436_100009817358 [1,1,0,0,0,0|2,0,0]=4 10699 B14R0.82 CCCOCCCNC(C)CC(=O)OC 2230a_100011217757_100009817358 [1,1,0,0,0,0|2,0,0]=4 10700 B14R0.82 CCCOCCCNC(C)CC(=O)OC 34a_100011217757_100009817358 [1,1,0,0,0,0|2,0,0]=4 10701 B14R0.82 CCCOCCNC[C@H](O)CC(=O)OC 34a_100161115042_100000754131 [1,1,0,0,0,0|2,0,0]=4 10702 B14R0.82 CCCOCCOC[C@H](O)CC(=O)OC 34a_100000752267_100000754131 [1,1,0,0,0,0|2,0,0]=4 10703 B14R0.82 CCCOCCOC[C@H](O)CC(=O)OC 7a_100000752267_100000754131 [1,1,0,0,0,0|2,0,0]=4 10704 B14R0.82 CCCOCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011215938 [1,1,0,0,0,0|2,0,0]=4 10705 B14R0.82 CCCOCCSC[C@H](O)CC(=O)OC 62a_100011215938_100000754131 [1,1,0,0,0,0|2,0,0]=4 10706 B14R0.82 CCCSCCOC[C@H](O)CC(=O)OC 34a_200000230433_100000754131 [1,1,0,0,0,0|2,0,0]=4 10707 B14R0.82 CCCSCCOC[C@H](O)CC(=O)OC 7a_200000230433_100000754131 [1,1,0,0,0,0|2,0,0]=4 10708 B14R0.82 CCOCCCNC[C@H](O)CC(=O)OC 34a_100000210961_100000754131 [1,1,0,0,0,0|2,0,0]=4 10709 B14R0.82 CCOCCCOC[C@H](O)CC(=O)OC 34a_100000757476_100000754131 [1,1,0,0,0,0|2,0,0]=4 10710 B14R0.82 CCOCCCOC[C@H](O)CC(=O)OC 7a_100000757476_100000754131 [1,1,0,0,0,0|2,0,0]=4 10711 B14R0.82 CCOCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100012232248 [1,1,0,0,0,0|2,0,0]=4 10712 B14R0.82 CCOCCCSC[C@H](O)CC(=O)OC 62a_100012232248_100000754131 [1,1,0,0,0,0|2,0,0]=4 10713 B14R0.82 CCSCCCOC[C@H](O)CC(=O)OC 34a_100011216438_100000754131 [1,1,0,0,0,0|2,0,0]=4 10714 B14R0.82 CCSCCCOC[C@H](O)CC(=O)OC 7a_100011216438_100000754131 [1,1,0,0,0,0|2,0,0]=4 10715 B14R0.82 CNCCCCCOC(C)CC(=O)OC 34a_100000722520_100009817358 [1,1,0,0,0,0|2,0,0]=4 10716 B14R0.82 COC(=O)CC(=O)CCCCCCCO 1458a_100000211351_100000760002 [1,1,0,0,0,0|1,0,1]=4 10717 B14R0.82 COC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000747449 [1,1,0,0,0,0|1,0,1]=4 10718 B14R0.82 COC(=O)CC(C)NCCCCCCO 2230a_100000686447_100009817358 [1,1,0,0,0,0|2,0,0]=4 10719 B14R0.82 COC(=O)CC(C)NCCCCCCO 34a_100000686447_100009817358 [1,1,0,0,0,0|2,0,0]=4 10720 B14R0.82 COC(=O)CC(C)OCCCCCCBr 34a_100011215345_100009817358 [1,1,0,0,0,0|2,0,0]=4 10721 B14R0.82 COC(=O)CC(C)OCCCCCCBr 7a_100011215345_100009817358 [1,1,0,0,0,0|2,0,0]=4 10722 B14R0.82 COC(=O)CC(C)OCCCCCCCl 34a_100000766143_100009817358 [1,1,0,0,0,0|2,0,0]=4 10723 B14R0.82 COC(=O)CC(C)OCCCCCCCl 7a_100000766143_100009817358 [1,1,0,0,0,0|2,0,0]=4 10724 B14R0.82 COC(=O)CC(C)OCCCCCCF 34a_100000732779_100009817358 [1,1,0,0,0,0|2,0,0]=4 10725 B14R0.82 COC(=O)CC(C)OCCCCCCF 7a_100000732779_100009817358 [1,1,0,0,0,0|2,0,0]=4 10726 B14R0.82 COC(=O)CC(C)OCCCCCCN 34a_100000686447_100009817358 [1,1,0,0,0,0|2,0,0]=4 10727 B14R0.82 COC(=O)CC(C)SCCCCCCF 62a_100009817358_100015922095 [1,1,0,0,0,0|2,0,0]=4 10728 B14R0.82 COC(=O)CC(C)SCCCCCCF 62a_100015922095_100009817358 [1,1,0,0,0,0|2,0,0]=4 10729 B14R0.82 COC(=O)CC(C)SCCCCCCO 62a_100000766143_100009817358 [1,1,0,0,0,0|2,0,0]=4 10730 B14R0.82 COC(=O)CC(C)SCCCCCCO 62a_100009817358_100000766143 [1,1,0,0,0,0|2,0,0]=4 10731 B14R0.82 COC(=O)CN(C)CCCCCCCO 2230a_100000198492_100000760002 [1,1,0,0,0,0|2,0,0]=4 10732 B14R0.82 COC(=O)C[C@@H](O)CNCCCCCO 34a_100000762737_100000754131 [1,1,0,0,0,0|2,0,0]=4 10733 B14R0.82 COC(=O)C[C@@H](O)COCCCCCBr 34a_100000746331_100000754131 [1,1,0,0,0,0|2,0,0]=4 10734 B14R0.82 COC(=O)C[C@@H](O)COCCCCCBr 7a_100000746331_100000754131 [1,1,0,0,0,0|2,0,0]=4 10735 B14R0.82 COC(=O)C[C@@H](O)COCCCCCCl 34a_100000746330_100000754131 [1,1,0,0,0,0|2,0,0]=4 10736 B14R0.82 COC(=O)C[C@@H](O)COCCCCCCl 7a_100000746330_100000754131 [1,1,0,0,0,0|2,0,0]=4 10737 B14R0.82 COC(=O)C[C@@H](O)COCCCCCI 34a_200012148887_100000754131 [1,1,0,0,0,0|2,0,0]=4 10738 B14R0.82 COC(=O)C[C@@H](O)COCCCCCI 7a_200012148887_100000754131 [1,1,0,0,0,0|2,0,0]=4 10739 B14R0.82 COC(=O)C[C@@H](O)COCCCCCN 34a_100000762737_100000754131 [1,1,0,0,0,0|2,0,0]=4 10740 B14R0.82 COC(=O)C[C@@H](O)COCCCCSC 34a_100011217163_100000754131 [1,1,0,0,0,0|2,0,0]=4 10741 B14R0.82 COC(=O)C[C@@H](O)COCCCCSC 7a_100011217163_100000754131 [1,1,0,0,0,0|2,0,0]=4 10742 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCF 62a_100000729378_100000754131 [1,1,0,0,0,0|2,0,0]=4 10743 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCF 62a_100000754131_100000729378 [1,1,0,0,0,0|2,0,0]=4 10744 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCO 62a_100000746330_100000754131 [1,1,0,0,0,0|2,0,0]=4 10745 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCO 62a_100000754131_100000746330 [1,1,0,0,0,0|2,0,0]=4 10746 B14R0.82 COCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100011998445 [1,1,0,0,0,0|1,0,1]=4 10747 B14R0.82 COCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011998445 [1,1,0,0,0,0|2,0,0]=4 10748 B14R0.82 COCCCCCNC(C)CC(=O)OC 2230a_100000747528_100009817358 [1,1,0,0,0,0|2,0,0]=4 10749 B14R0.82 COCCCCCNC(C)CC(=O)OC 34a_100000747528_100009817358 [1,1,0,0,0,0|2,0,0]=4 10750 B14R0.82 COCCCCOC[C@H](O)CC(=O)OC 34a_100000740925_100000754131 [1,1,0,0,0,0|2,0,0]=4 10751 B14R0.82 COCCCCSC[C@H](O)CC(=O)OC 62a_100000730899_100000754131 [1,1,0,0,0,0|2,0,0]=4 10752 B14R0.82 COCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000730899 [1,1,0,0,0,0|2,0,0]=4 10753 B14R0.140 CCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210614 [1,1,0,0,0,0|1,0,1]=4 10754 B14R0.140 CCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210614 [1,1,0,0,0,0|0,0,1]=3 10755 B14R0.140 CCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210614 [1,1,0,0,0,0|1,0,1]=4 10756 B14R0.140 CCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000211969 [1,1,0,0,0,0|1,0,1]=4 10757 B14R0.140 CCCCCCCC(C)NCC(=O)NC 2230a_100000693194_200011218727 [1,1,0,0,0,0|2,0,0]=4 10758 B14R0.140 CCCCCCCC(C)NCC(=O)NC 270004a_100000693194_100000210596 [1,1,0,0,0,0|2,0,0]=4 10759 B14R0.140 CCCCCCCC(C)OCC(=O)CC 34a_100000725409_200011218727 [1,1,0,0,0,0|2,0,0]=4 10760 B14R0.140 CCCCCCCC(C)OCC(=O)CC 7a_200011215852_100000747405 [1,1,0,0,0,0|2,0,0]=4 10761 B14R0.140 CCCCCCCC(C)OCC(=O)NC 34a_100000750040_200011218727 [1,1,0,0,0,0|2,0,0]=4 10762 B14R0.140 CCCCCCCC(C)OCC(=O)NC 34a_200011215852_100000183359 [1,1,0,0,0,0|2,0,0]=4 10763 B14R0.140 CCCCCCCC(C)OCC(=O)NC 7a_200011215852_100000183359 [1,1,0,0,0,0|2,0,0]=4 10764 B14R0.140 CCCCCCCC(C)OCC(=O)OC 34a_200011215852_100000747449 [1,1,0,0,0,0|1,0,0]=3 10765 B14R0.140 CCCCCCCC(C)OCC(=O)OC 7a_200011215852_100000747449 [1,1,0,0,0,0|1,0,0]=3 10766 B14R0.140 CCCCCCCC(C)SCC(=O)CC 62a_100000747405_200011218727 [1,1,0,0,0,0|2,0,0]=4 10767 B14R0.140 CCCCCCCC(C)SCC(=O)CC 62a_200011218727_100000747405 [1,1,0,0,0,0|2,0,0]=4 10768 B14R0.140 CCCCCCCC(C)SCC(=O)NC 62a_100000183359_200011218727 [1,1,0,0,0,0|2,0,0]=4 10769 B14R0.140 CCCCCCCC(C)SCC(=O)NC 62a_200011218727_100000183359 [1,1,0,0,0,0|2,0,0]=4 10770 B14R0.140 CCCCCCCC(C)SCC(=O)OC 62a_100000747449_200011218727 [1,1,0,0,0,0|1,0,0]=3 10771 B14R0.140 CCCCCCCC(C)SCC(=O)OC 62a_200011218727_100000747449 [1,1,0,0,0,0|1,0,0]=3 10772 B14R0.140 CCCCCCCN(C)CCC(=O)NC 2230a_100000228206_100000737683 [1,1,0,0,0,0|2,0,0]=4 10773 B14R0.140 CCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100000210681 [1,1,0,0,0,0|2,0,0]=4 10774 B14R0.140 CCCCCCCN(C)CCC(=O)NC 269982a_100000228206_100000737683 [1,1,0,0,0,0|2,0,0]=4 10775 B14R0.140 CCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100000210681 [1,1,0,0,0,0|2,0,0]=4 10776 B14R0.140 CCCCCCCN(C)CCC(=O)OC 2230a_100000228206_100000204255 [1,1,0,0,0,0|1,0,0]=3 10777 B14R0.140 CCCCCCCN(C)CCC(=O)OC 269982a_100000228206_100000204255 [1,1,0,0,0,0|1,0,0]=3 10778 B14R0.140 CCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210681 [1,1,0,0,0,0|1,0,0]=3 10779 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 11a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 10780 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 1626a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 10781 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 240690a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 10782 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 527a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 10783 B14R0.140 CCCCCNCC(=O)CCC(=O)OC 2230a_100000209983_100000691467 [1,1,0,0,0,0|1,0,1]=4 10784 B14R0.140 CCCCCOCC(=O)CCC(=O)OC 34a_100000210253_100000691467 [1,1,0,0,0,0|1,0,1]=4 10785 B14R0.140 CCCCCOCC(=O)CCC(=O)OC 7a_100000210253_100000691467 [1,1,0,0,0,0|1,0,1]=4 10786 B14R0.140 CCCCCSCC(=O)CCC(=O)OC 62a_100000210326_100000691467 [1,1,0,0,0,0|1,0,1]=4 10787 B14R0.140 CCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210326 [1,1,0,0,0,0|1,0,1]=4 10788 B14R0.140 CCCCOCCC(=O)CCC(=O)OC 1458a_100000187943_100000743108 [1,1,0,0,0,0|1,0,1]=4 10789 B14R0.140 CCCCOCCN(C)CCC(=O)OC 269982a_100025711912_100000743108 [1,1,0,0,0,0|2,0,0]=4 10790 B14R0.140 COC(=O)CCC(=O)CCCCCCF 1458a_100000187943_100015922095 [1,1,0,0,0,0|1,0,1]=4 10791 B14R0.140 COC(=O)CCC(=O)CCCCCCO 1458a_100000187943_100000766143 [1,1,0,0,0,0|1,0,1]=4 10792 B14R0.140 COC(=O)CCN(C)CCCCCCF 269982a_100025711912_100015922095 [1,1,0,0,0,0|2,0,0]=4 10793 B14R0.140 COC(=O)CCN(C)CCCCCCO 269982a_100025711912_100000766143 [1,1,0,0,0,0|2,0,0]=4 10794 B14R0.152 CCCCC(=O)CCCCCC(=O)OC 1458a_100000210183_100009816466 [1,1,0,0,0,0|0,0,1]=3 10795 B14R0.152 CCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210211 [1,1,0,0,0,0|0,0,1]=3 10796 B14R0.152 CCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000210183 [1,1,0,0,0,0|1,0,1]=4 10797 B14R0.152 CCCCC(C)COCCCC(=O)NC 34a_100011995851_100000741757 [1,1,0,0,0,0|2,0,0]=4 10798 B14R0.152 CCCCC(C)COCCCC(=O)NC 7a_100011995851_100000741757 [1,1,0,0,0,0|2,0,0]=4 10799 B14R0.152 CCCCC(C)COCCCC(=O)OC 34a_100011995851_100000742333 [1,1,0,0,0,0|1,0,0]=3 10800 B14R0.152 CCCCC(C)COCCCC(=O)OC 7a_100011995851_100011218270 [1,1,0,0,0,0|1,0,0]=3 10801 B14R0.152 CCCCC(C)NCCCCC(=O)OC 2230a_100000126638_100000204269 [1,1,0,0,0,0|1,0,0]=3 10802 B14R0.152 CCCCC(C)NCCOCC(=O)OC 2230a_100000126638_100000090808 [1,1,0,0,0,0|2,0,0]=4 10803 B14R0.152 CCCCC(C)OCCCCC(=O)OC 34a_100000059025_200011215066 [1,1,0,0,0,0|1,0,0]=3 10804 B14R0.152 CCCCC(C)OCCCCC(=O)OC 34a_100000687866_100000204269 [1,1,0,0,0,0|1,0,0]=3 10805 B14R0.152 CCCCC(C)OCCCCC(=O)OC 7a_100000059025_200011215066 [1,1,0,0,0,0|1,0,0]=3 10806 B14R0.152 CCCCC(C)OCCCCC(=O)OC 7a_100000687866_100000204269 [1,1,0,0,0,0|1,0,0]=3 10807 B14R0.152 CCCCC(C)OCCOCC(=O)OC 34a_100000687866_100000090808 [1,1,0,0,0,0|2,0,0]=4 10808 B14R0.152 CCCCC(C)OCCOCC(=O)OC 7a_100000687866_100000090808 [1,1,0,0,0,0|2,0,0]=4 10809 B14R0.152 CCCCC(C)SCCCCC(=O)OC 62a_100000204269_200011215066 [1,1,0,0,0,0|1,0,0]=3 10810 B14R0.152 CCCCC(C)SCCCCC(=O)OC 62a_200011215066_100000204269 [1,1,0,0,0,0|1,0,0]=3 10811 B14R0.152 CCCCC(C)SCCOCC(=O)OC 62a_100000090808_200011215066 [1,1,0,0,0,0|2,0,0]=4 10812 B14R0.152 CCCCC(C)SCCOCC(=O)OC 62a_200011215066_100000090808 [1,1,0,0,0,0|2,0,0]=4 10813 B14R0.152 CCCCN(C)CCCCCC(=O)OC 2230a_100000207549_100009816466 [1,1,0,0,0,0|1,0,0]=3 10814 B14R0.152 CCCCN(C)CCCCCC(=O)OC 269982a_100000207549_100009816466 [1,1,0,0,0,0|1,0,0]=3 10815 B14R0.152 CCCC[C@H](N)COCCCC(=O)NC 34a_100011934283_100000741757 [1,1,0,0,0,0|2,0,0]=4 10816 B14R0.152 CCCC[C@H](N)COCCCC(=O)OC 34a_100011934283_100000742333 [1,1,0,0,0,0|1,0,0]=3 10817 B14R0.152 CCCNC(=O)CCCCCC(=O)OC 11a_100020643023_100009848860 [1,1,0,0,0,0|1,0,1]=4 10818 B14R0.152 CCCNC(=O)CCCCCC(=O)OC 1626a_100020643023_100009848860 [1,1,0,0,0,0|1,0,1]=4 10819 B14R0.152 CCCNC(=O)CCCCCC(=O)OC 240690a_100020643023_100009848860 [1,1,0,0,0,0|1,0,1]=4 10820 B14R0.152 CCCOC(C)CNCCCC(=O)OC 2230a_100015185124_100011218270 [1,1,0,0,0,0|2,0,0]=4 10821 B14R0.152 CCCOC(C)CNCCCC(=O)OC 34a_100015185124_100000742333 [1,1,0,0,0,0|2,0,0]=4 10822 B14R0.152 CCOCC(=O)CCCCCC(=O)OC 1458a_100000211967_100009816466 [1,1,0,0,0,0|1,0,1]=4 10823 B14R0.152 CCOCC(C)OCCCCC(=O)OC 34a_100000718985_100000204269 [1,1,0,0,0,0|2,0,0]=4 10824 B14R0.152 CCOCC(C)OCCCCC(=O)OC 7a_100000718985_100000204269 [1,1,0,0,0,0|2,0,0]=4 10825 B14R0.152 CCOCC(O)CNCCCC(=O)OC 2230a_102515437182_100011218270 [1,1,0,0,0,0|2,0,0]=4 10826 B14R0.152 CCOCC(O)CNCCCC(=O)OC 34a_102515437182_100000742333 [1,1,0,0,0,0|2,0,0]=4 10827 B14R0.152 CCSCC(=O)CCCCCC(=O)OC 1458a_100000230394_100009816466 [1,1,0,0,0,0|1,0,1]=4 10828 B14R0.152 COC(=O)CCCCCC(=O)CCCF 1458a_100009848860_100011934791 [1,1,0,0,0,0|1,0,1]=4 10829 B14R0.152 COC(=O)CCCCCC(=O)CCCO 1458a_100009848860_100011215043 [1,1,0,0,0,0|1,0,1]=4 10830 B14R0.152 COC(=O)CCCCCC(=O)CCSC 1458a_100000174002_100009816466 [1,1,0,0,0,0|1,0,1]=4 10831 B14R0.152 COC(=O)CCCCCC(=O)CCSC 1458a_100009848860_100000751147 [1,1,0,0,0,0|1,0,1]=4 10832 B14R0.152 COC(=O)CCCCCN(C)CCCO 2230a_100000213112_100009816466 [1,1,0,0,0,0|2,0,0]=4 10833 B14R0.152 COC(=O)CCCCCN(C)CCCO 269982a_100000213112_100009816466 [1,1,0,0,0,0|2,0,0]=4 10834 B14R0.152 COC(=O)CCCCCN(C)CCSC 2230a_100000686725_100009816466 [1,1,0,0,0,0|2,0,0]=4 10835 B14R0.152 COC(=O)CCCCCN(C)CCSC 269982a_100000686725_100009816466 [1,1,0,0,0,0|2,0,0]=4 10836 B14R0.152 COC(=O)CCCCOC(C)CCCCl 34a_200000718107_100000204269 [1,1,0,0,0,0|2,0,0]=4 10837 B14R0.152 COC(=O)CCCCOC(C)CCCCl 7a_200000718107_100000204269 [1,1,0,0,0,0|2,0,0]=4 10838 B14R0.152 COC(=O)CCCNC[C@H](C)CCCO 2230a_100160569302_100011218270 [1,1,0,0,0,0|2,0,0]=4 10839 B14R0.152 COC(=O)CCCNC[C@H](C)CCCO 34a_100160569302_100000742333 [1,1,0,0,0,0|2,0,0]=4 10840 B14R0.152 COC(=O)CCCOC[C@@H](N)CCSC 34a_100011827619_100000742333 [1,1,0,0,0,0|2,0,0]=4 10841 B14R0.152 COCCC(=O)CCCCCC(=O)OC 1458a_100000749529_100009816466 [1,1,0,0,0,0|1,0,1]=4 10842 B14R0.152 COCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000233755 [1,1,0,0,0,0|1,0,1]=4 10843 B14R0.152 COCCN(C)CCCCCC(=O)OC 2230a_100000743101_100009816466 [1,1,0,0,0,0|2,0,0]=4 10844 B14R0.152 COCCN(C)CCCCCC(=O)OC 269982a_100000743101_100009816466 [1,1,0,0,0,0|2,0,0]=4 10845 B14R0.181 C=C(COCCCCCCC)C(=O)OC 34a_100000210272_100009813391 [1,1,0,0,0,0|1,0,1]=4 10846 B14R0.181 C=C(CSCCCCCCC)C(=O)OC 62a_100000210614_100009813391 [1,1,0,0,0,0|1,0,1]=4 10847 B14R0.181 C=C(CSCCCCCCC)C(=O)OC 62a_100009813391_100000210316 [1,1,0,0,0,0|1,0,1]=4 10848 B14R0.181 CCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210670 [1,1,0,0,0,0|1,0,1]=4 10849 B14R0.181 CCCCCCCCCN(C)C(=O)CC 11a_100000232482_100000210414 [1,1,0,0,0,0|2,0,0]=4 10850 B14R0.181 CCCCCCCCCN(C)C(=O)CC 1626a_100000232482_100000210414 [1,1,0,0,0,0|2,0,0]=4 10851 B14R0.181 CCCCCCCCCN(C)C(=O)CC 240690a_100000232482_100000210414 [1,1,0,0,0,0|2,0,0]=4 10852 B14R0.181 CCCCCCCCCN(C)C(=O)CC 527a_100000232482_100000210414 [1,1,0,0,0,0|2,0,0]=4 10853 B14R0.181 CCCCCCCCCN(C)C(=O)NC 2708a_100102657272_100000232482 [1,1,0,0,0,0|2,0,0]=4 10854 B14R0.181 CCCCCCCCCN(C)C(=O)NC 273464a_100102657272_100000232482 [1,1,0,0,0,0|2,0,0]=4 10855 B14R0.181 CCCCCCCCNC(=O)C(=O)OC 11a_100000229939_100000024059 [1,1,0,0,0,0|1,0,1]=4 10856 B14R0.181 CCCCCCCCNC(=O)C(=O)OC 1626a_100000229939_100000024059 [1,1,0,0,0,0|1,0,1]=4 10857 B14R0.181 CCCCCCCCNC(=O)C(=O)OC 240690a_100000229939_100000024059 [1,1,0,0,0,0|1,0,1]=4 10858 B14R0.181 CCCCCCCCNC(=O)C(=O)OC 527a_100000229939_100000024059 [1,1,0,0,0,0|1,0,1]=4 10859 B14R0.181 CCCCCCCCNC(C)C(=O)CC 2230a_100000229939_100000742827 [1,1,0,0,0,0|2,0,0]=4 10860 B14R0.181 CCCCCCCCNC(C)C(=O)NC 2230a_100000229939_100000731044 [1,1,0,0,0,0|2,0,0]=4 10861 B14R0.181 CCCCCCCCNC(C)C(=O)NC 34a_100000229939_100000731044 [1,1,0,0,0,0|2,0,0]=4 10862 B14R0.181 CCCCCCCCNC(C)C(=O)OC 2230a_100000229939_100000211248 [1,1,0,0,0,0|1,0,0]=3 10863 B14R0.181 CCCCCCCCNC(C)C(=O)OC 34a_100000229939_100000211248 [1,1,0,0,0,0|1,0,0]=3 10864 B14R0.181 CCCCCCCCNC(F)C(=O)NC 2230a_100000229939_100009813575 [1,1,0,0,0,0|2,0,0]=4 10865 B14R0.181 CCCCCCCCNC(F)C(=O)NC 34a_100000229939_100009813575 [1,1,0,0,0,0|2,0,0]=4 10866 B14R0.181 CCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210759 [1,1,0,0,0,0|2,0,0]=4 10867 B14R0.181 CCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100000210759 [1,1,0,0,0,0|2,0,0]=4 10868 B14R0.181 CCCCCCCCOC(C)C(=O)CC 7a_100000210232_100000742827 [1,1,0,0,0,0|2,0,0]=4 10869 B14R0.181 CCCCCCCCOC(C)C(=O)NC 34a_100000210232_100000731044 [1,1,0,0,0,0|2,0,0]=4 10870 B14R0.181 CCCCCCCCOC(C)C(=O)NC 7a_100000210232_100000209862 [1,1,0,0,0,0|2,0,0]=4 10871 B14R0.181 CCCCCCCCOC(C)C(=O)OC 34a_100000210232_100000211248 [1,1,0,0,0,0|1,0,0]=3 10872 B14R0.181 CCCCCCCCOC(C)C(=O)OC 34a_100011215400_100000210759 [1,1,0,0,0,0|1,0,0]=3 10873 B14R0.181 CCCCCCCCOC(C)C(=O)OC 7a_100000210232_100000211248 [1,1,0,0,0,0|1,0,0]=3 10874 B14R0.181 CCCCCCCCOC(F)C(=O)NC 34a_100000210232_100009813575 [1,1,0,0,0,0|2,0,0]=4 10875 B14R0.181 CCCCCCCCOC(F)C(=O)NC 7a_100000210232_100009813575 [1,1,0,0,0,0|2,0,0]=4 10876 B14R0.181 CCCCCCCCSC(C)C(=O)CC 62a_100000210759_100000742827 [1,1,0,0,0,0|2,0,0]=4 10877 B14R0.181 CCCCCCCCSC(C)C(=O)CC 62a_100000742827_100000210317 [1,1,0,0,0,0|2,0,0]=4 10878 B14R0.181 CCCCCCCCSC(C)C(=O)NC 62a_100000209862_100000210317 [1,1,0,0,0,0|2,0,0]=4 10879 B14R0.181 CCCCCCCCSC(C)C(=O)NC 62a_100000210759_100000731044 [1,1,0,0,0,0|2,0,0]=4 10880 B14R0.181 CCCCCCCCSC(C)C(=O)OC 62a_100000210759_100000211248 [1,1,0,0,0,0|1,0,0]=3 10881 B14R0.181 CCCCCCCCSC(C)C(=O)OC 62a_100000211248_100000210317 [1,1,0,0,0,0|1,0,0]=3 10882 B14R0.181 CCCCCCCCSC(F)C(=O)NC 62a_100000210759_100009813575 [1,1,0,0,0,0|2,0,0]=4 10883 B14R0.181 CCCCCCCCSC(F)C(=O)NC 62a_100009813575_100000210317 [1,1,0,0,0,0|2,0,0]=4 10884 B14R0.181 CCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100000210681 [1,1,0,0,0,0|2,0,0]=4 10885 B14R0.181 CCCCCCCNCC(C)C(=O)NC 34a_100015187722_100000210614 [1,1,0,0,0,0|2,0,0]=4 10886 B14R0.181 CCCCCCCOCC(=O)C(=O)OC 34a_100000210272_100011610305 [1,1,0,0,0,0|1,0,1]=4 10887 B14R0.181 CCCCCCCOCC(C)C(=O)OC 34a_100000210272_100000698445 [1,1,0,0,0,0|1,0,0]=3 10888 B14R0.181 CCCCCCCOCC(C)C(=O)OC 34a_100000749362_100000210614 [1,1,0,0,0,0|1,0,0]=3 10889 B14R0.181 CCCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210614 [1,1,0,0,0,0|1,0,0]=3 10890 B14R0.181 CCCCCCCOCC(F)C(=O)OC 34a_200009849844_100000210614 [1,1,0,0,0,0|1,0,0]=3 10891 B14R0.181 CCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210614 [1,1,0,0,0,0|1,0,0]=3 10892 B14R0.181 CCCCCCCSCC(=O)C(=O)OC 62a_100000210614_100011610305 [1,1,0,0,0,0|1,0,1]=4 10893 B14R0.181 CCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210316 [1,1,0,0,0,0|1,0,1]=4 10894 B14R0.181 CCCCCCCSCC(C)C(=O)OC 62a_100000210614_100000698445 [1,1,0,0,0,0|1,0,0]=3 10895 B14R0.181 CCCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210316 [1,1,0,0,0,0|1,0,0]=3 10896 B14R0.181 CCCCCCNCCC(C)C(=O)OC 2230a_100000210581_100000034942 [1,1,0,0,0,0|1,0,0]=3 10897 B14R0.181 CCCCCCOCCC(C)C(=O)OC 34a_100000210259_100000034942 [1,1,0,0,0,0|1,0,0]=3 10898 B14R0.181 CCCCCCOCCC(C)C(=O)OC 7a_100000210259_100000034942 [1,1,0,0,0,0|1,0,0]=3 10899 B14R0.181 CCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210757 [1,1,0,0,0,0|1,0,0]=3 10900 B14R0.181 CCCCCCSCCC(C)C(=O)OC 62a_100000210314_100000034942 [1,1,0,0,0,0|1,0,0]=3 10901 B14R0.181 CCCCCNCCOC(C)C(=O)OC 34a_100000224656_100000211248 [1,1,0,0,0,0|2,0,0]=4 10902 B14R0.181 CCCCCOCCOC(C)C(=O)OC 34a_100011215259_100000211248 [1,1,0,0,0,0|2,0,0]=4 10903 B14R0.181 CCCCCOCCOC(C)C(=O)OC 7a_100011215259_100000211248 [1,1,0,0,0,0|2,0,0]=4 10904 B14R0.181 CCCCOCCCNC(C)C(=O)OC 2230a_200000211371_100000211248 [1,1,0,0,0,0|2,0,0]=4 10905 B14R0.181 CCCCOCCCNC(C)C(=O)OC 34a_200000211371_100000211248 [1,1,0,0,0,0|2,0,0]=4 10906 B14R0.181 CCCCOCCCOC(C)C(=O)OC 34a_200011215613_100000211248 [1,1,0,0,0,0|2,0,0]=4 10907 B14R0.181 CCCCOCCCOC(C)C(=O)OC 7a_200011215613_100000211248 [1,1,0,0,0,0|2,0,0]=4 10908 B14R0.181 CCCCOCCOCC(C)C(=O)OC 34a_100000210238_100000698445 [1,1,0,0,0,0|2,0,0]=4 10909 B14R0.181 CCCCOCCOCC(C)C(=O)OC 34a_100000749362_100000743108 [1,1,0,0,0,0|2,0,0]=4 10910 B14R0.181 CCCCOCCOCC(C)C(=O)OC 7a_100000749362_100000743108 [1,1,0,0,0,0|2,0,0]=4 10911 B14R0.181 CCCCOCCOCC(F)C(=O)OC 34a_200009849844_100000743108 [1,1,0,0,0,0|2,0,0]=4 10912 B14R0.181 CCCCOCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000743108 [1,1,0,0,0,0|2,0,0]=4 10913 B14R0.181 CCCCOCCSCC(C)C(=O)OC 62a_100000698445_100000743108 [1,1,0,0,0,0|2,0,0]=4 10914 B14R0.181 CCCCOCCSCC(C)C(=O)OC 62a_100000743108_100000698445 [1,1,0,0,0,0|2,0,0]=4 10915 B14R0.181 CCCCOCSCCC(C)C(=O)OC 62a_100000034942_100011995733 [1,1,0,0,0,0|2,0,0]=4 10916 B14R0.181 CCCCOCSCCC(C)C(=O)OC 62a_100011995733_100000034942 [1,1,0,0,0,0|2,0,0]=4 10917 B14R0.181 CCCCSCCOCC(C)C(=O)OC 34a_200000230436_100000698445 [1,1,0,0,0,0|2,0,0]=4 10918 B14R0.181 CCCOCCCNCC(C)C(=O)OC 34a_100011217757_100000698445 [1,1,0,0,0,0|2,0,0]=4 10919 B14R0.181 CCCOCCNCCC(C)C(=O)OC 2230a_100161115042_100000034942 [1,1,0,0,0,0|2,0,0]=4 10920 B14R0.181 CCCOCCNCCC(C)C(=O)OC 34a_100161115042_100000034942 [1,1,0,0,0,0|2,0,0]=4 10921 B14R0.181 CCCOCCOCCC(C)C(=O)OC 34a_100000752267_100000034942 [1,1,0,0,0,0|2,0,0]=4 10922 B14R0.181 CCCOCCOCCC(C)C(=O)OC 7a_100000752267_100000034942 [1,1,0,0,0,0|2,0,0]=4 10923 B14R0.181 CCCOCCSCCC(C)C(=O)OC 62a_100000034942_100011215938 [1,1,0,0,0,0|2,0,0]=4 10924 B14R0.181 CCCOCCSCCC(C)C(=O)OC 62a_100011215938_100000034942 [1,1,0,0,0,0|2,0,0]=4 10925 B14R0.181 CCCSCCNCCC(C)C(=O)OC 2230a_100020603323_100000034942 [1,1,0,0,0,0|2,0,0]=4 10926 B14R0.181 CCCSCCOCCC(C)C(=O)OC 34a_200000230433_100000034942 [1,1,0,0,0,0|2,0,0]=4 10927 B14R0.181 CCCSCCOCCC(C)C(=O)OC 7a_200000230433_100000034942 [1,1,0,0,0,0|2,0,0]=4 10928 B14R0.181 CCOCCCNCCC(C)C(=O)OC 2230a_100000210961_100000034942 [1,1,0,0,0,0|2,0,0]=4 10929 B14R0.181 CCOCCCNCCC(C)C(=O)OC 34a_100000210961_100000034942 [1,1,0,0,0,0|2,0,0]=4 10930 B14R0.181 CCOCCCOCCC(C)C(=O)OC 34a_100000757476_100000034942 [1,1,0,0,0,0|2,0,0]=4 10931 B14R0.181 CCOCCCOCCC(C)C(=O)OC 7a_100000757476_100000034942 [1,1,0,0,0,0|2,0,0]=4 10932 B14R0.181 CCOCCCSCCC(C)C(=O)OC 62a_100000034942_100012232248 [1,1,0,0,0,0|2,0,0]=4 10933 B14R0.181 CCOCCCSCCC(C)C(=O)OC 62a_100012232248_100000034942 [1,1,0,0,0,0|2,0,0]=4 10934 B14R0.181 CCSCCCOCCC(C)C(=O)OC 34a_100011216438_100000034942 [1,1,0,0,0,0|2,0,0]=4 10935 B14R0.181 CCSCCCOCCC(C)C(=O)OC 7a_100011216438_100000034942 [1,1,0,0,0,0|2,0,0]=4 10936 B14R0.181 CNCCCCCOCC(C)C(=O)OC 34a_100000722520_100000698445 [1,1,0,0,0,0|2,0,0]=4 10937 B14R0.181 COC(=O)C(C)CCNCCCCCO 2230a_100000762737_100000034942 [1,1,0,0,0,0|2,0,0]=4 10938 B14R0.181 COC(=O)C(C)CCNCCCCCO 34a_100000762737_100000034942 [1,1,0,0,0,0|2,0,0]=4 10939 B14R0.181 COC(=O)C(C)CCOCCCCCBr 34a_100000746331_100000034942 [1,1,0,0,0,0|2,0,0]=4 10940 B14R0.181 COC(=O)C(C)CCOCCCCCBr 7a_100000746331_100000034942 [1,1,0,0,0,0|2,0,0]=4 10941 B14R0.181 COC(=O)C(C)CCOCCCCCCl 34a_100000746330_100000034942 [1,1,0,0,0,0|2,0,0]=4 10942 B14R0.181 COC(=O)C(C)CCOCCCCCCl 7a_100000746330_100000034942 [1,1,0,0,0,0|2,0,0]=4 10943 B14R0.181 COC(=O)C(C)CCOCCCCCI 34a_200012148887_100000034942 [1,1,0,0,0,0|2,0,0]=4 10944 B14R0.181 COC(=O)C(C)CCOCCCCCI 7a_200012148887_100000034942 [1,1,0,0,0,0|2,0,0]=4 10945 B14R0.181 COC(=O)C(C)CCOCCCCCN 34a_100000762737_100000034942 [1,1,0,0,0,0|2,0,0]=4 10946 B14R0.181 COC(=O)C(C)CCOCCCCSC 34a_100011217163_100000034942 [1,1,0,0,0,0|2,0,0]=4 10947 B14R0.181 COC(=O)C(C)CCOCCCCSC 7a_100011217163_100000034942 [1,1,0,0,0,0|2,0,0]=4 10948 B14R0.181 COC(=O)C(C)CCSCCCCCF 62a_100000034942_100000729378 [1,1,0,0,0,0|2,0,0]=4 10949 B14R0.181 COC(=O)C(C)CCSCCCCCF 62a_100000729378_100000034942 [1,1,0,0,0,0|2,0,0]=4 10950 B14R0.181 COC(=O)C(C)CCSCCCCCO 62a_100000034942_100000746330 [1,1,0,0,0,0|2,0,0]=4 10951 B14R0.181 COC(=O)C(C)CCSCCCCCO 62a_100000746330_100000034942 [1,1,0,0,0,0|2,0,0]=4 10952 B14R0.181 COC(=O)C(C)CNCCCCCCO 34a_100000686447_100000698445 [1,1,0,0,0,0|2,0,0]=4 10953 B14R0.181 COC(=O)C(C)COCCCCCCBr 34a_100011215345_100000698445 [1,1,0,0,0,0|2,0,0]=4 10954 B14R0.181 COC(=O)C(C)COCCCCCCCl 34a_100000766143_100000698445 [1,1,0,0,0,0|2,0,0]=4 10955 B14R0.181 COC(=O)C(C)COCCCCCCF 34a_100000732779_100000698445 [1,1,0,0,0,0|2,0,0]=4 10956 B14R0.181 COC(=O)C(C)COCCCCCCF 34a_100000749362_100015922095 [1,1,0,0,0,0|2,0,0]=4 10957 B14R0.181 COC(=O)C(C)COCCCCCCF 7a_100000749362_100015922095 [1,1,0,0,0,0|2,0,0]=4 10958 B14R0.181 COC(=O)C(C)COCCCCCCN 34a_100000686447_100000698445 [1,1,0,0,0,0|2,0,0]=4 10959 B14R0.181 COC(=O)C(C)COCCCCCCO 34a_100000749362_100000766143 [1,1,0,0,0,0|2,0,0]=4 10960 B14R0.181 COC(=O)C(C)COCCCCCCO 7a_100000749362_100000766143 [1,1,0,0,0,0|2,0,0]=4 10961 B14R0.181 COC(=O)C(C)CSCCCCCCF 62a_100000698445_100015922095 [1,1,0,0,0,0|2,0,0]=4 10962 B14R0.181 COC(=O)C(C)CSCCCCCCF 62a_100015922095_100000698445 [1,1,0,0,0,0|2,0,0]=4 10963 B14R0.181 COC(=O)C(C)CSCCCCCCO 62a_100000698445_100000766143 [1,1,0,0,0,0|2,0,0]=4 10964 B14R0.181 COC(=O)C(C)CSCCCCCCO 62a_100000766143_100000698445 [1,1,0,0,0,0|2,0,0]=4 10965 B14R0.181 COC(=O)C(C)NCCCCCCCO 2230a_100011996573_100000211248 [1,1,0,0,0,0|2,0,0]=4 10966 B14R0.181 COC(=O)C(C)NCCCCCCCO 34a_100011996573_100000211248 [1,1,0,0,0,0|2,0,0]=4 10967 B14R0.181 COC(=O)C(C)OCCCCCCCBr 34a_100000760002_100000211248 [1,1,0,0,0,0|2,0,0]=4 10968 B14R0.181 COC(=O)C(C)OCCCCCCCBr 7a_100000760002_100000211248 [1,1,0,0,0,0|2,0,0]=4 10969 B14R0.181 COC(=O)C(C)OCCCCCCCN 34a_100011996573_100000211248 [1,1,0,0,0,0|2,0,0]=4 10970 B14R0.181 COC(=O)C(C)OCCCCCCCO 34a_100011215400_100000760002 [1,1,0,0,0,0|2,0,0]=4 10971 B14R0.181 COC(=O)C(C)SCCCCCCCO 62a_100000211248_100000760002 [1,1,0,0,0,0|2,0,0]=4 10972 B14R0.181 COC(=O)C(C)SCCCCCCCO 62a_100000760002_100000211248 [1,1,0,0,0,0|2,0,0]=4 10973 B14R0.181 COC(=O)C(F)COCCCCCCF 34a_200009849844_100015922095 [1,1,0,0,0,0|2,0,0]=4 10974 B14R0.181 COC(=O)C(F)COCCCCCCO 34a_200009849844_100000766143 [1,1,0,0,0,0|2,0,0]=4 10975 B14R0.181 COC(=O)[C@H](N)COCCCCCCF 34a_100000003586_100015922095 [1,1,0,0,0,0|2,0,0]=4 10976 B14R0.181 COC(=O)[C@H](N)COCCCCCCO 34a_100000003586_100000766143 [1,1,0,0,0,0|2,0,0]=4 10977 B14R0.181 COCCCCCCOC(C)C(=O)OC 34a_100011215400_100011998445 [1,1,0,0,0,0|2,0,0]=4 10978 B14R0.181 COCCCCCCOC(C)C(=O)OC 34a_200012092642_100000211248 [1,1,0,0,0,0|2,0,0]=4 10979 B14R0.181 COCCCCCCOC(C)C(=O)OC 7a_200012092642_100000211248 [1,1,0,0,0,0|2,0,0]=4 10980 B14R0.181 COCCCCCCSC(C)C(=O)OC 62a_100000211248_100011998445 [1,1,0,0,0,0|2,0,0]=4 10981 B14R0.181 COCCCCCCSC(C)C(=O)OC 62a_100011998445_100000211248 [1,1,0,0,0,0|2,0,0]=4 10982 B14R0.181 COCCCCCNCC(C)C(=O)OC 34a_100000747528_100000698445 [1,1,0,0,0,0|2,0,0]=4 10983 B14R0.181 COCCCCOCCC(C)C(=O)OC 34a_100000740925_100000034942 [1,1,0,0,0,0|2,0,0]=4 10984 B14R0.181 COCCCCSCCC(C)C(=O)OC 62a_100000034942_100000730899 [1,1,0,0,0,0|2,0,0]=4 10985 B14R0.181 COCCCCSCCC(C)C(=O)OC 62a_100000730899_100000034942 [1,1,0,0,0,0|2,0,0]=4 10986 B14R0.197 CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210202 [1,1,0,0,0,0|0,0,1]=3 10987 B14R0.197 CCC(=O)CCCCCCCC(=O)OC 1458a_100000210414_100010004213 [1,1,0,0,0,0|0,0,1]=3 10988 B14R0.197 CCC(=O)COCCCCCC(=O)OC 34a_100000725409_100009816466 [1,1,0,0,0,0|1,0,1]=4 10989 B14R0.197 CCC(=O)COCCCCCC(=O)OC 7a_100000074720_100000747405 [1,1,0,0,0,0|1,0,1]=4 10990 B14R0.197 CCC(=O)COCCCCCC(C)CC 7a_200000035636_100000747405 [1,1,0,0,0,0|2,0,0]=4 10991 B14R0.197 CCC(=O)CSCCCCCC(=O)OC 62a_100000747405_100009816466 [1,1,0,0,0,0|1,0,1]=4 10992 B14R0.197 CCC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000747405 [1,1,0,0,0,0|1,0,1]=4 10993 B14R0.197 CCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000210414 [1,1,0,0,0,0|1,0,1]=4 10994 B14R0.197 CCC(C)CCCCCOCC(=O)NC 7a_200000035636_100000183359 [1,1,0,0,0,0|2,0,0]=4 10995 B14R0.197 CCC(C)CCCCCOCC(=O)OC 7a_200000035636_100000747449 [1,1,0,0,0,0|1,0,0]=3 10996 B14R0.197 CCC(C)CCCOCCCC(=O)NC 7a_100011216074_100000741757 [1,1,0,0,0,0|2,0,0]=4 10997 B14R0.197 CCC(C)CCCOCCCC(=O)OC 7a_100011216074_100011218270 [1,1,0,0,0,0|1,0,0]=3 10998 B14R0.197 CCC(C)CCNCCCCC(=O)OC 2230a_100020591266_100000204269 [1,1,0,0,0,0|1,0,0]=3 10999 B14R0.197 CCC(C)CCNCCOCC(=O)OC 2230a_100020591266_100000090808 [1,1,0,0,0,0|2,0,0]=4 11000 B14R0.197 CCC(C)CCOCCCCC(=O)OC 7a_100011215188_100000204269 [1,1,0,0,0,0|1,0,0]=3 11001 B14R0.197 CCC(C)CCOCCOCC(=O)OC 7a_100011215188_100000090808 [1,1,0,0,0,0|2,0,0]=4 11002 B14R0.197 CCC(C)CNCCCCCC(=O)OC 2230a_100020588543_100009816466 [1,1,0,0,0,0|1,0,0]=3 11003 B14R0.197 CCC(C)COCCCCCC(=O)OC 34a_100000074720_100000748023 [1,1,0,0,0,0|1,0,0]=3 11004 B14R0.197 CCC(C)COCCCCCC(=O)OC 7a_100000074720_100000748023 [1,1,0,0,0,0|1,0,0]=3 11005 B14R0.197 CCC(C)CSCCCCCC(=O)OC 62a_100000748023_100009816466 [1,1,0,0,0,0|1,0,0]=3 11006 B14R0.197 CCC(C)CSCCCCCC(=O)OC 62a_100009816466_100000748023 [1,1,0,0,0,0|1,0,0]=3 11007 B14R0.197 CCC(C)NCCCCCCC(=O)OC 2230a_100000209981_100009815986 [1,1,0,0,0,0|1,0,0]=3 11008 B14R0.197 CCC(C)OCCCCCCC(=O)OC 34a_100009863599_100011215416 [1,1,0,0,0,0|1,0,0]=3 11009 B14R0.197 CCC(C)OCCCCCCC(=O)OC 7a_100000210228_100009815986 [1,1,0,0,0,0|1,0,0]=3 11010 B14R0.197 CCC(C)OCCCCCCC(=O)OC 7a_100009863599_100000758301 [1,1,0,0,0,0|1,0,0]=3 11011 B14R0.197 CCC(C)SCCCCCCC(=O)OC 62a_100000758301_100009815986 [1,1,0,0,0,0|1,0,0]=3 11012 B14R0.197 CCC(C)SCCCCCCC(=O)OC 62a_100009815986_100000758301 [1,1,0,0,0,0|1,0,0]=3 11013 B14R0.197 CCC(O)CNCCCCCC(=O)OC 2230a_100011218483_100009816466 [1,1,0,0,0,0|1,0,0]=3 11014 B14R0.197 CCC(O)COCCCCCC(=O)OC 34a_100000074720_100011218378 [1,1,0,0,0,0|1,0,0]=3 11015 B14R0.197 CCC(O)COCCCCCC(=O)OC 7a_100000074720_100011218378 [1,1,0,0,0,0|1,0,0]=3 11016 B14R0.197 CCC(O)CSCCCCCC(=O)OC 62a_100009816466_100011218378 [1,1,0,0,0,0|1,0,0]=3 11017 B14R0.197 CCC(O)CSCCCCCC(=O)OC 62a_100011218378_100009816466 [1,1,0,0,0,0|1,0,0]=3 11018 B14R0.197 CCN(C)CCCCCCCC(=O)OC 2230a_100000225621_100010004213 [1,1,0,0,0,0|1,0,0]=3 11019 B14R0.197 CCN(C)CCCCCCCC(=O)OC 269982a_100000225621_100010004213 [1,1,0,0,0,0|1,0,0]=3 11020 B14R0.197 CCN(C)CCCSCCCC(=O)OC 62a_100011218270_100015186262 [1,1,0,0,0,0|2,0,0]=4 11021 B14R0.197 CC[C@H](C)COCCCCCC(=O)OC 34a_100000074720_100009816398 [1,1,0,0,0,0|1,0,0]=3 11022 B14R0.197 CC[C@H](C)COCCCCCC(=O)OC 7a_100000074720_100009816398 [1,1,0,0,0,0|1,0,0]=3 11023 B14R0.197 CC[C@H](C)COCCCCCC(=O)OC 7a_100009816381_100009816466 [1,1,0,0,0,0|1,0,0]=3 11024 B14R0.197 CC[C@H](C)CSCCCCCC(=O)OC 62a_100009816398_100009816466 [1,1,0,0,0,0|1,0,0]=3 11025 B14R0.197 CC[C@H](C)CSCCCCCC(=O)OC 62a_100009816466_100009816398 [1,1,0,0,0,0|1,0,0]=3 11026 B14R0.197 CNC(=O)CCCCCCCC(=O)OC 11a_106832991635_100000033222 [1,1,0,0,0,0|1,0,1]=4 11027 B14R0.197 CNC(=O)CCCCCCCC(=O)OC 1626a_100102657272_100000033222 [1,1,0,0,0,0|1,0,1]=4 11028 B14R0.197 CNC(=O)CCCCCCCC(=O)OC 240690a_100102657272_100000033222 [1,1,0,0,0,0|1,0,1]=4 11029 B14R0.197 COC(=O)CCCCCCCC(=O)CF 1458a_100000033222_100015361967 [1,1,0,0,0,0|1,0,1]=4 11030 B14R0.197 COC(=O)CCCCCCCC(=O)CO 1458a_100000210174_100010004213 [1,1,0,0,0,0|1,0,1]=4 11031 B14R0.197 COC(=O)CCCCCCN[C@H](C)CO 2230a_100000737577_100009815986 [1,1,0,0,0,0|2,0,0]=4 11032 B14R0.197 COC(=O)CCCCCCOC(C)CF 34a_100016041109_100009815986 [1,1,0,0,0,0|2,0,0]=4 11033 B14R0.197 COC(=O)CCCCCCOC(C)CF 7a_100016041109_100009815986 [1,1,0,0,0,0|2,0,0]=4 11034 B14R0.197 COC(=O)CCCCCCOC(C)CN 34a_100000210904_100009815986 [1,1,0,0,0,0|2,0,0]=4 11035 B14R0.197 COC(=O)CCCCCCOC(C)CO 34a_100009863599_100012180447 [1,1,0,0,0,0|2,0,0]=4 11036 B14R0.197 COC(=O)CCCCCCOC(C)CO 7a_100009863599_100012180447 [1,1,0,0,0,0|2,0,0]=4 11037 B14R0.197 COC(=O)CCCCCCSC(C)CO 62a_100012180447_100009815986 [1,1,0,0,0,0|2,0,0]=4 11038 B14R0.197 COC(=O)CCCCCCSC(C)OC 62a_100009815986_100009879195 [1,1,0,0,0,0|2,0,0]=4 11039 B14R0.197 COC(=O)CCCCCCSC(C)OC 62a_100009879195_100009815986 [1,1,0,0,0,0|2,0,0]=4 11040 B14R0.197 COC(=O)CCCCCCS[C@H](C)CO 62a_100009815986_100016084084 [1,1,0,0,0,0|2,0,0]=4 11041 B14R0.197 COC(=O)CCCCCCS[C@H](C)CO 62a_100016084084_100009815986 [1,1,0,0,0,0|2,0,0]=4 11042 B14R0.197 COC(=O)CCCCCNCC(C)CO 34a_100000744482_100009816466 [1,1,0,0,0,0|2,0,0]=4 11043 B14R0.197 COC(=O)CCCCCNC[C@@H](C)OC 2230a_100020591295_100009816466 [1,1,0,0,0,0|2,0,0]=4 11044 B14R0.197 COC(=O)CCCCCNC[C@@H](F)CO 34a_100015665980_100009816466 [1,1,0,0,0,0|2,0,0]=4 11045 B14R0.197 COC(=O)CCCCCNC[C@H](O)CO 2230a_100020644852_100009816466 [1,1,0,0,0,0|2,0,0]=4 11046 B14R0.197 COC(=O)CCCCCOCC(C)CN 34a_100000744482_100009816466 [1,1,0,0,0,0|2,0,0]=4 11047 B14R0.197 COC(=O)CCCCCOCC(C)OC 34a_100000690652_100009816466 [1,1,0,0,0,0|2,0,0]=4 11048 B14R0.197 COC(=O)CCCCCOCC(Cl)CCl 34a_100000033668_100009816466 [1,1,0,0,0,0|2,0,0]=4 11049 B14R0.197 COC(=O)CCCCCOCC(O)CO 34a_100000074720_100011219619 [1,1,0,0,0,0|2,0,0]=4 11050 B14R0.197 COC(=O)CCCCCOCC(O)CO 7a_100000074720_100011219619 [1,1,0,0,0,0|2,0,0]=4 11051 B14R0.197 COC(=O)CCCCCOC[C@@H](C)CO 34a_100000074720_100000059175 [1,1,0,0,0,0|2,0,0]=4 11052 B14R0.197 COC(=O)CCCCCOC[C@@H](C)CO 7a_100000074720_100000059175 [1,1,0,0,0,0|2,0,0]=4 11053 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CF 34a_100000074720_100015614560 [1,1,0,0,0,0|2,0,0]=4 11054 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CF 7a_100000074720_100015614560 [1,1,0,0,0,0|2,0,0]=4 11055 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CO 34a_100000074720_100009815848 [1,1,0,0,0,0|2,0,0]=4 11056 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CO 7a_100000074720_100009815848 [1,1,0,0,0,0|2,0,0]=4 11057 B14R0.197 COC(=O)CCCCCOC[C@H](F)CN 34a_100015665980_100009816466 [1,1,0,0,0,0|2,0,0]=4 11058 B14R0.197 COC(=O)CCCCCSCC(O)CO 62a_100009816466_100011219619 [1,1,0,0,0,0|2,0,0]=4 11059 B14R0.197 COC(=O)CCCCCSCC(O)CO 62a_100011219619_100009816466 [1,1,0,0,0,0|2,0,0]=4 11060 B14R0.197 COC(=O)CCCCCSC[C@@H](C)CO 62a_100000059175_100009816466 [1,1,0,0,0,0|2,0,0]=4 11061 B14R0.197 COC(=O)CCCCCSC[C@@H](C)CO 62a_100009816466_100000059175 [1,1,0,0,0,0|2,0,0]=4 11062 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CF 62a_100009816466_100015614560 [1,1,0,0,0,0|2,0,0]=4 11063 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CF 62a_100015614560_100009816466 [1,1,0,0,0,0|2,0,0]=4 11064 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CO 62a_100009815848_100009816466 [1,1,0,0,0,0|2,0,0]=4 11065 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CO 62a_100009816466_100009815848 [1,1,0,0,0,0|2,0,0]=4 11066 B14R0.197 COC(=O)CCCCNCCC(C)CO 2230a_106354213184_100000204269 [1,1,0,0,0,0|2,0,0]=4 11067 B14R0.197 COC(=O)CCCCNCCC(C)CO 34a_106354213184_100000204269 [1,1,0,0,0,0|2,0,0]=4 11068 B14R0.197 COC(=O)CCCCOCCC(C)OC 7a_100000764861_100000204269 [1,1,0,0,0,0|2,0,0]=4 11069 B14R0.197 COC(=O)CCCOCCC[C@@H](C)CN 34a_100160569302_100000742333 [1,1,0,0,0,0|2,0,0]=4 11070 B14R0.226 CCCCCC(=O)CCCCC(=O)OC 1458a_100000212188_100000204269 [1,1,0,0,0,0|0,0,1]=3 11071 B14R0.226 CCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210326 [1,1,0,0,0,0|0,0,1]=3 11072 B14R0.226 CCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210326 [1,1,0,0,0,0|1,0,1]=4 11073 B14R0.226 CCCCCC(=O)CCOCC(=O)OC 1458a_100000212188_100000090808 [1,1,0,0,0,0|1,0,1]=4 11074 B14R0.226 CCCCCC(=O)CSCCC(=O)OC 62a_100000204255_200012276598 [1,1,0,0,0,0|1,0,1]=4 11075 B14R0.226 CCCCCC(=O)CSCCC(=O)OC 62a_200012276598_100000204255 [1,1,0,0,0,0|1,0,1]=4 11076 B14R0.226 CCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100000212188 [1,1,0,0,0,0|1,0,1]=4 11077 B14R0.226 CCCCCC(C)NCCCC(=O)NC 2230a_100000211957_100000741757 [1,1,0,0,0,0|2,0,0]=4 11078 B14R0.226 CCCCCC(C)NCCCC(=O)NC 2230a_100000740002_200011218191 [1,1,0,0,0,0|2,0,0]=4 11079 B14R0.226 CCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100000211708 [1,1,0,0,0,0|2,0,0]=4 11080 B14R0.226 CCCCCC(C)NCCCC(=O)NC 34a_100000740002_200011218191 [1,1,0,0,0,0|2,0,0]=4 11081 B14R0.226 CCCCCC(C)NCCCC(=O)OC 2230a_100000211957_100011218270 [1,1,0,0,0,0|1,0,0]=3 11082 B14R0.226 CCCCCC(C)OCCCC(=O)NC 34a_100011215632_100000741757 [1,1,0,0,0,0|2,0,0]=4 11083 B14R0.226 CCCCCC(C)OCCCC(=O)NC 7a_100011215632_100000741757 [1,1,0,0,0,0|2,0,0]=4 11084 B14R0.226 CCCCCC(C)OCCCC(=O)OC 34a_100011215632_100000742333 [1,1,0,0,0,0|1,0,0]=3 11085 B14R0.226 CCCCCC(C)OCCCC(=O)OC 7a_100011215632_100011218270 [1,1,0,0,0,0|1,0,0]=3 11086 B14R0.226 CCCCCC(C)OCCNC(=O)OC 34a_100000757965_200011218191 [1,1,0,0,0,0|2,0,0]=4 11087 B14R0.226 CCCCCC(C)OCCOC(=O)OC 34a_100010262106_200011218191 [1,1,0,0,0,0|2,0,0]=4 11088 B14R0.226 CCCCCC(C)SCCCC(=O)NC 62a_100000741757_200011218191 [1,1,0,0,0,0|2,0,0]=4 11089 B14R0.226 CCCCCC(C)SCCCC(=O)NC 62a_200011218191_100000741757 [1,1,0,0,0,0|2,0,0]=4 11090 B14R0.226 CCCCCC(C)SCCCC(=O)OC 62a_100011218270_200011218191 [1,1,0,0,0,0|1,0,0]=3 11091 B14R0.226 CCCCCC(C)SCCCC(=O)OC 62a_200011218191_100011218270 [1,1,0,0,0,0|1,0,0]=3 11092 B14R0.226 CCCCCN(C)CCCCC(=O)OC 2230a_100000223495_100000204269 [1,1,0,0,0,0|1,0,0]=3 11093 B14R0.226 CCCCCN(C)CCCCC(=O)OC 269982a_100000223495_100000204269 [1,1,0,0,0,0|1,0,0]=3 11094 B14R0.226 CCCCCN(C)CCOCC(=O)OC 2230a_100000223495_100000090808 [1,1,0,0,0,0|2,0,0]=4 11095 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 11a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 11096 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 1626a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 11097 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 240690a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 11098 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 527a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 11099 B14R0.226 CCCOCC(=O)CCCCC(=O)OC 1458a_100000745993_100000204269 [1,1,0,0,0,0|1,0,1]=4 11100 B14R0.226 CCCSCC(=O)CCCCC(=O)OC 1458a_100000217233_100000204269 [1,1,0,0,0,0|1,0,1]=4 11101 B14R0.226 CCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011215890 [1,1,0,0,0,0|1,0,1]=4 11102 B14R0.226 CCOCCC(=O)CCCCC(=O)OC 1458a_100000749530_100000204269 [1,1,0,0,0,0|1,0,1]=4 11103 B14R0.226 CCSCCC(=O)CCCCC(=O)OC 1458a_100000230768_100000204269 [1,1,0,0,0,0|1,0,1]=4 11104 B14R0.226 CCSCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000757381 [1,1,0,0,0,0|1,0,1]=4 11105 B14R0.226 COC(=O)CCCCC(=O)CCCCF 1458a_100000695723_100000729493 [1,1,0,0,0,0|1,0,1]=4 11106 B14R0.226 COC(=O)CCCCC(=O)CCCCO 1458a_100000695505_100000204269 [1,1,0,0,0,0|1,0,1]=4 11107 B14R0.226 COC(=O)CCCCC(=O)CCCCO 1458a_100000695723_100000210776 [1,1,0,0,0,0|1,0,1]=4 11108 B14R0.226 COC(=O)CCCCC(=O)CCCSC 1458a_100000173376_100000204269 [1,1,0,0,0,0|1,0,1]=4 11109 B14R0.226 COC(=O)CCCCN(C)CCCCO 2230a_100000717598_100000204269 [1,1,0,0,0,0|2,0,0]=4 11110 B14R0.226 COC(=O)CCCCN(C)CCCCO 269982a_100000717598_100000204269 [1,1,0,0,0,0|2,0,0]=4 11111 B14R0.226 COC(=O)CCOC[C@@H](N)CCCCN 34a_100016993712_100000742370 [1,1,0,0,0,0|2,0,0]=4 11112 B14R0.226 COCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000740836 [1,1,0,0,0,0|1,0,1]=4 11113 B14R0.226 COCCCC(=O)CCCCC(=O)OC 1458a_100000741012_100000204269 [1,1,0,0,0,0|1,0,1]=4 11114 B14R0.226 COCCCC(C)OCCCC(=O)OC 34a_200011539412_100000742333 [1,1,0,0,0,0|2,0,0]=4 11115 B14R0.226 COCCCC(C)OCCCC(=O)OC 7a_200011539412_100011218270 [1,1,0,0,0,0|2,0,0]=4 11116 B14R0.226 COCCCN(C)CCCCC(=O)OC 2230a_100000224831_100000204269 [1,1,0,0,0,0|2,0,0]=4 11117 B14R0.226 COCCCN(C)CCCCC(=O)OC 269982a_100000224831_100000204269 [1,1,0,0,0,0|2,0,0]=4 11118 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100000210375_100000184674 [1,1,0,0,0,0|1,0,1]=4 11119 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100011220946_100000210319 [1,1,0,0,0,0|1,0,1]=4 11120 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210193_100000210319 [1,1,0,0,0,0|1,0,1]=4 11121 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000210623 [1,1,0,0,0,0|1,0,1]=4 11122 B14R0.393 C=CCCCCCCCCC(=O)COC 1458a_100000210968_100011933949 [1,1,0,0,0,0|0,0,2]=4 11123 B14R0.393 C=COC(=O)CNCCCCCCCC 2230a_100000229939_100000036128 [1,1,0,0,0,0|1,0,1]=4 11124 B14R0.393 C=COC(=O)CNCCCCCCCC 34a_100000229939_100000036128 [1,1,0,0,0,0|1,0,1]=4 11125 B14R0.393 C=COC(=O)COCCCCCCCC 34a_100000210232_100000036128 [1,1,0,0,0,0|1,0,1]=4 11126 B14R0.393 C=COC(=O)CSCCCCCCCC 62a_100000036128_100000210317 [1,1,0,0,0,0|1,0,1]=4 11127 B14R0.393 C=COC(=O)CSCCCCCCCC 62a_100000210759_100000036128 [1,1,0,0,0,0|1,0,1]=4 11128 B14R0.393 CC#CC(=O)CCCCCCCCCC 1458a_100000763181_100000210319 [1,1,0,0,0,0|1,0,0]=3 11129 B14R0.393 CC#CC(=O)CCCCCCCCCO 1458a_100000763181_100009813782 [1,1,0,0,0,0|2,0,0]=4 11130 B14R0.393 CC=CC(=O)CCCCCCCCCC 1458a_100000210699_100000210319 [1,1,0,0,0,0|1,0,0]=3 11131 B14R0.393 CC=CC(=O)CCCCCCCCCO 1458a_100000210699_100009813782 [1,1,0,0,0,0|2,0,0]=4 11132 B14R0.393 CC=CC(=O)NCCCCCCCCC 11a_100000212291_100000210699 [1,1,0,0,0,0|2,0,0]=4 11133 B14R0.393 CC=CC(=O)NCCCCCCCCC 1626a_100000212291_100000210699 [1,1,0,0,0,0|2,0,0]=4 11134 B14R0.393 CC=CC(=O)NCCCCCCCCC 240690a_100000212291_100000210699 [1,1,0,0,0,0|2,0,0]=4 11135 B14R0.393 CCC#CCCCCCCC(=O)COC 1458a_100000210968_200000036426 [1,1,0,0,0,0|0,0,2]=4 11136 B14R0.393 CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210303 [1,1,0,0,0,0|2,0,0]=4 11137 B14R0.393 CCCC(=O)CCCCCCCCCO 1458a_100000211992_100009813782 [1,1,0,0,0,0|2,0,0]=4 11138 B14R0.393 CCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000210319 [1,1,0,0,0,0|1,0,1]=4 11139 B14R0.393 CCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000210319 [1,1,0,0,0,0|1,0,1]=4 11140 B14R0.393 CCCCCCCCCCC(=O)C=CI 1458a_100016256311_100000210319 [1,1,0,0,0,0|1,0,1]=4 11141 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100000210375_100011214920 [1,1,0,0,0,0|1,0,1]=4 11142 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210319 [1,1,0,0,0,0|1,0,1]=4 11143 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000210375_100000210303 [1,1,0,0,0,0|1,0,0]=3 11144 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000211992_100000210319 [1,1,0,0,0,0|1,0,0]=3 11145 B14R0.393 CCCCCCCCCCC(=O)CCF 1458a_100000210375_100011217306 [1,1,0,0,0,0|1,0,0]=3 11146 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100000210375_100000211926 [1,1,0,0,0,0|1,0,0]=3 11147 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210319 [1,1,0,0,0,0|1,0,0]=3 11148 B14R0.393 CCCCCCCCCCC(=O)COC 1458a_100000210968_100000210319 [1,1,0,0,0,0|0,0,0]=2 11149 B14R0.393 CCCCCCCCCCC(=O)CSC 1458a_100000184570_100000210319 [1,1,0,0,0,0|0,1,0]=3 11150 B14R0.393 CCCCCCCCCCC(=O)NCC 11a_100015525214_100000210375 [1,1,0,0,0,0|1,0,0]=3 11151 B14R0.393 CCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210375 [1,1,0,0,0,0|1,0,0]=3 11152 B14R0.393 CCCCCCCCCCC(=O)NNC 22a_100016993582_100000210375 [1,1,0,0,0,0|1,0,0]=3 11153 B14R0.393 CCCCCCCCCCC(C)OCC 34a_100011215000_100000210202 [1,1,0,0,0,0|1,0,1]=4 11154 B14R0.393 CCCCCCCCCCC(C)OCC 7a_100011215000_100000210202 [1,1,0,0,0,0|1,0,1]=4 11155 B14R0.393 CCCCCCCCCCC(C)OCF 34a_100011215000_100015361967 [1,1,0,0,0,0|1,0,1]=4 11156 B14R0.393 CCCCCCCCCCC(C)OCF 7a_100011215000_100015361967 [1,1,0,0,0,0|1,0,1]=4 11157 B14R0.393 CCCCCCCCCCN(C)COC 2230a_100000207566_100000766300 [1,1,0,0,0,0|2,0,0]=4 11158 B14R0.393 CCCCCCCCCCN(C)COC 269982a_100000207566_100000766300 [1,1,0,0,0,0|2,0,0]=4 11159 B14R0.393 CCCCCCCCCNC(=O)CCC 11a_100000212291_100000211992 [1,1,0,0,0,0|2,0,0]=4 11160 B14R0.393 CCCCCCCCCNC(=O)CCC 1626a_100000212291_100000211992 [1,1,0,0,0,0|2,0,0]=4 11161 B14R0.393 CCCCCCCCCNC(=O)CCC 240690a_100000212291_100000211992 [1,1,0,0,0,0|2,0,0]=4 11162 B14R0.393 CCCCCCCCCNC(=O)CCC 527a_100000212291_100000211992 [1,1,0,0,0,0|2,0,0]=4 11163 B14R0.393 CCCCCCCCCNC(=O)CCO 240690a_100000212291_100011216618 [1,1,0,0,0,0|2,0,0]=4 11164 B14R0.393 CCCCCCCCCNC(=O)COC 11a_100000212291_100000210968 [1,1,0,0,0,0|1,0,0]=3 11165 B14R0.393 CCCCCCCCCNC(=O)COC 1626a_100000212291_100000210968 [1,1,0,0,0,0|1,0,0]=3 11166 B14R0.393 CCCCCCCCCNC(=O)COC 240690a_100000212291_100000210968 [1,1,0,0,0,0|1,0,0]=3 11167 B14R0.393 CCCCCCCCCNC(=O)COC 527a_100000212291_100000210968 [1,1,0,0,0,0|1,0,0]=3 11168 B14R0.393 CCCCCCCCCNC(=O)CSC 11a_100000212291_100000184570 [1,1,0,0,0,0|1,1,0]=4 11169 B14R0.393 CCCCCCCCCNC(=O)CSC 1626a_100000212291_100000184570 [1,1,0,0,0,0|1,1,0]=4 11170 B14R0.393 CCCCCCCCCNC(=O)CSC 240690a_100000212291_100000184570 [1,1,0,0,0,0|1,1,0]=4 11171 B14R0.393 CCCCCCCCCNC(=O)CSC 527a_100000212291_100000184570 [1,1,0,0,0,0|1,1,0]=4 11172 B14R0.393 CCCCCCCCCNC(=O)NCC 2708a_100000212291_100015525214 [1,1,0,0,0,0|2,0,0]=4 11173 B14R0.393 CCCCCCCCCNC(=O)NCC 2708a_100015525214_100000212291 [1,1,0,0,0,0|2,0,0]=4 11174 B14R0.393 CCCCCCCCCNC(=O)NCC 273464a_100000212291_100015525214 [1,1,0,0,0,0|2,0,0]=4 11175 B14R0.393 CCCCCCCCCNC(=O)NCC 273464a_100015525214_100000212291 [1,1,0,0,0,0|2,0,0]=4 11176 B14R0.393 CCCCCCCCCNC(=O)NCC 512a_100000212291_100015525214 [1,1,0,0,0,0|2,0,0]=4 11177 B14R0.393 CCCCCCCCCNC(=O)NCC 512a_100015525214_100000212291 [1,1,0,0,0,0|2,0,0]=4 11178 B14R0.393 CCCCCCCCCNC(=O)NNC 273464a_100000212291_100016993582 [1,1,0,0,0,0|2,0,0]=4 11179 B14R0.393 CCCCCCCCCNC(=O)NNC 512a_100000212291_100016993582 [1,1,0,0,0,0|2,0,0]=4 11180 B14R0.393 CCCCCCCCCNC(=O)NNC 512a_100016993582_100000212291 [1,1,0,0,0,0|2,0,0]=4 11181 B14R0.393 CCCCCCCCNCC(=O)CCC 2230a_100000229939_100000747444 [1,1,0,0,0,0|2,0,0]=4 11182 B14R0.393 CCCCCCCCNCC(=O)NCC 2230a_100000229939_100000183381 [1,1,0,0,0,0|2,0,0]=4 11183 B14R0.393 CCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210759 [1,1,0,0,0,0|2,0,0]=4 11184 B14R0.393 CCCCCCCCNCC(=O)NCC 34a_100000229939_100000183381 [1,1,0,0,0,0|2,0,0]=4 11185 B14R0.393 CCCCCCCCNCC(=O)NCO 2230a_100000229939_100000185155 [1,1,0,0,0,0|2,0,0]=4 11186 B14R0.393 CCCCCCCCNCC(=O)NCO 34a_100000229939_100000185155 [1,1,0,0,0,0|2,0,0]=4 11187 B14R0.393 CCCCCCCCNCC(=O)OCC 2230a_100000229939_100000188475 [1,1,0,0,0,0|1,0,0]=3 11188 B14R0.393 CCCCCCCCNCC(=O)OCC 34a_100000229939_100000188475 [1,1,0,0,0,0|1,0,0]=3 11189 B14R0.393 CCCCCCCCOCC(=O)CCC 1458a_100000759886_100000210303 [1,1,0,0,0,0|2,0,0]=4 11190 B14R0.393 CCCCCCCCOCC(=O)CCC 7a_100000210232_100000747444 [1,1,0,0,0,0|2,0,0]=4 11191 B14R0.393 CCCCCCCCOCC(=O)CCF 1458a_100000759886_100011217306 [1,1,0,0,0,0|2,0,0]=4 11192 B14R0.393 CCCCCCCCOCC(=O)CCO 1458a_100000759886_100000211926 [1,1,0,0,0,0|2,0,0]=4 11193 B14R0.393 CCCCCCCCOCC(=O)NCC 11a_100015525214_100000759886 [1,1,0,0,0,0|2,0,0]=4 11194 B14R0.393 CCCCCCCCOCC(=O)NCC 240690a_100015525214_100000759886 [1,1,0,0,0,0|2,0,0]=4 11195 B14R0.393 CCCCCCCCOCC(=O)NCC 34a_100000210232_100000183381 [1,1,0,0,0,0|2,0,0]=4 11196 B14R0.393 CCCCCCCCOCC(=O)NCC 527a_100015525214_100000759886 [1,1,0,0,0,0|2,0,0]=4 11197 B14R0.393 CCCCCCCCOCC(=O)NCC 7a_100000210232_100000183381 [1,1,0,0,0,0|2,0,0]=4 11198 B14R0.393 CCCCCCCCOCC(=O)NCO 34a_100000210232_100000185155 [1,1,0,0,0,0|2,0,0]=4 11199 B14R0.393 CCCCCCCCOCC(=O)NCO 7a_100000210232_100000185155 [1,1,0,0,0,0|2,0,0]=4 11200 B14R0.393 CCCCCCCCOCC(=O)NNC 22a_100016993582_100000759886 [1,1,0,0,0,0|2,0,0]=4 11201 B14R0.393 CCCCCCCCOCC(=O)OCC 34a_100000210232_100000188475 [1,1,0,0,0,0|1,0,0]=3 11202 B14R0.393 CCCCCCCCOCC(=O)OCC 7a_100000210232_100000188475 [1,1,0,0,0,0|1,0,0]=3 11203 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000210759_100000747444 [1,1,0,0,0,0|2,0,0]=4 11204 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000747444_100000210317 [1,1,0,0,0,0|2,0,0]=4 11205 B14R0.393 CCCCCCCCSCC(=O)NCC 62a_100000183381_100000210317 [1,1,0,0,0,0|2,0,0]=4 11206 B14R0.393 CCCCCCCCSCC(=O)NCC 62a_100000210759_100000183381 [1,1,0,0,0,0|2,0,0]=4 11207 B14R0.393 CCCCCCCCSCC(=O)NCO 62a_100000185155_100000210317 [1,1,0,0,0,0|2,0,0]=4 11208 B14R0.393 CCCCCCCCSCC(=O)NCO 62a_100000210759_100000185155 [1,1,0,0,0,0|2,0,0]=4 11209 B14R0.393 CCCCCCCCSCC(=O)OCC 62a_100000188475_100000210317 [1,1,0,0,0,0|1,0,0]=3 11210 B14R0.393 CCCCCCCCSCC(=O)OCC 62a_100000210759_100000188475 [1,1,0,0,0,0|1,0,0]=3 11211 B14R0.393 CCCCCCCNCCC(=O)NCC 2230a_100000229938_100000737597 [1,1,0,0,0,0|2,0,0]=4 11212 B14R0.393 CCCCCCCNCCC(=O)NCC 34a_100025743525_100000210614 [1,1,0,0,0,0|2,0,0]=4 11213 B14R0.393 CCCCCCCNCCC(=O)OCC 2230a_100000229938_100011206558 [1,1,0,0,0,0|1,0,0]=3 11214 B14R0.393 CCCCCCCOCCC(=O)NCC 7a_100000210272_100000737597 [1,1,0,0,0,0|2,0,0]=4 11215 B14R0.393 CCCCCCCOCCC(=O)OCC 34a_100000210272_100000765890 [1,1,0,0,0,0|1,0,0]=3 11216 B14R0.393 CCCCCCCOCCC(=O)OCC 7a_100000210272_100011206558 [1,1,0,0,0,0|1,0,0]=3 11217 B14R0.393 CCCCCCCSCCC(=O)NCC 62a_100000210614_100000737597 [1,1,0,0,0,0|2,0,0]=4 11218 B14R0.393 CCCCCCCSCCC(=O)NCC 62a_100000737597_100000210316 [1,1,0,0,0,0|2,0,0]=4 11219 B14R0.393 CCCCCCCSCCC(=O)OCC 62a_100000210614_100000765890 [1,1,0,0,0,0|1,0,0]=3 11220 B14R0.393 CCCCCCCSCCC(=O)OCC 62a_100000765890_100000210316 [1,1,0,0,0,0|1,0,0]=3 11221 B14R0.393 CCCCCCCSCOC(=O)OCC 62a_100000210614_100000075025 [1,1,0,0,0,0|2,0,0]=4 11222 B14R0.393 CCCCCCNCCCC(=O)OCC 2230a_100000210581_100009991533 [1,1,0,0,0,0|1,0,0]=3 11223 B14R0.393 CCCCCCOCCCC(=O)OCC 34a_100000210259_100009991533 [1,1,0,0,0,0|1,0,0]=3 11224 B14R0.393 CCCCCCOCCCC(=O)OCC 7a_100000210259_100011215271 [1,1,0,0,0,0|1,0,0]=3 11225 B14R0.393 CCCCCCOCCCC(=O)OCC 7a_100012001163_100000210314 [1,1,0,0,0,0|1,0,0]=3 11226 B14R0.393 CCCCCCOCCNC(=O)OCC 34a_100000158857_100000210314 [1,1,0,0,0,0|2,0,0]=4 11227 B14R0.393 CCCCCCOCCNC(=O)OCC 7a_100000210259_200011445536 [1,1,0,0,0,0|2,0,0]=4 11228 B14R0.393 CCCCCCSCCCC(=O)OCC 62a_100000210314_100009991533 [1,1,0,0,0,0|1,0,0]=3 11229 B14R0.393 CCCCCCSCCCC(=O)OCC 62a_100009991533_100000210757 [1,1,0,0,0,0|1,0,0]=3 11230 B14R0.393 CCCCCCSCCNC(=O)OCC 62a_100000210314_200011445536 [1,1,0,0,0,0|2,0,0]=4 11231 B14R0.393 CCCCCNCCCCC(=O)OCC 2230a_100000209983_100000750268 [1,1,0,0,0,0|1,0,0]=3 11232 B14R0.393 CCCCCNCCOCC(=O)OCC 2230a_100000209983_100000088970 [1,1,0,0,0,0|2,0,0]=4 11233 B14R0.393 CCCCCNCCOCC(=O)OCC 34a_100000224656_100000188475 [1,1,0,0,0,0|2,0,0]=4 11234 B14R0.393 CCCCCOCCCCC(=O)OCC 34a_100000210253_100000750268 [1,1,0,0,0,0|1,0,0]=3 11235 B14R0.393 CCCCCOCCCCC(=O)OCC 7a_100000210253_100000750268 [1,1,0,0,0,0|1,0,0]=3 11236 B14R0.393 CCCCCOCCOCC(=O)OCC 34a_100000210253_100000088970 [1,1,0,0,0,0|2,0,0]=4 11237 B14R0.393 CCCCCOCCOCC(=O)OCC 34a_100011215259_100000188475 [1,1,0,0,0,0|2,0,0]=4 11238 B14R0.393 CCCCCOCCOCC(=O)OCC 7a_100000210253_100000088970 [1,1,0,0,0,0|2,0,0]=4 11239 B14R0.393 CCCCCOCCOCC(=O)OCC 7a_100011215259_100000188475 [1,1,0,0,0,0|2,0,0]=4 11240 B14R0.393 CCCCCOCCSCC(=O)OCC 7a_200000230590_100000210326 [1,1,0,0,0,0|2,0,0]=4 11241 B14R0.393 CCCCCSCCCCC(=O)OCC 62a_100000210326_100000750268 [1,1,0,0,0,0|1,0,0]=3 11242 B14R0.393 CCCCCSCCCCC(=O)OCC 62a_100000750268_100000210326 [1,1,0,0,0,0|1,0,0]=3 11243 B14R0.393 CCCCCSCCOCC(=O)OCC 62a_100000088970_100000210326 [1,1,0,0,0,0|2,0,0]=4 11244 B14R0.393 CCCCCSCCOCC(=O)OCC 62a_100000210326_100000088970 [1,1,0,0,0,0|2,0,0]=4 11245 B14R0.393 CCCCNCCCCCC(=O)OCC 2230a_100000102301_100000755133 [1,1,0,0,0,0|1,0,0]=3 11246 B14R0.393 CCCCNCCCCCC(=O)OCC 7a_106832991798_100000755133 [1,1,0,0,0,0|1,0,0]=3 11247 B14R0.393 CCCCNCCCOCC(=O)OCC 2230a_100000102301_100009893628 [1,1,0,0,0,0|2,0,0]=4 11248 B14R0.393 CCCCNCCCOCC(=O)OCC 7a_106832991798_100009893628 [1,1,0,0,0,0|2,0,0]=4 11249 B14R0.393 CCCCOCCCCCC(=O)OCC 34a_100000210227_100000755133 [1,1,0,0,0,0|1,0,0]=3 11250 B14R0.393 CCCCOCCCCCC(=O)OCC 7a_100000210227_100000755133 [1,1,0,0,0,0|1,0,0]=3 11251 B14R0.393 CCCCOCCCCCC(=O)OCC 7a_100011214988_100000210211 [1,1,0,0,0,0|1,0,0]=3 11252 B14R0.393 CCCCOCCCNCC(=O)OCC 2230a_200000211371_100000188475 [1,1,0,0,0,0|2,0,0]=4 11253 B14R0.393 CCCCOCCCNCC(=O)OCC 34a_200000211371_100000188475 [1,1,0,0,0,0|2,0,0]=4 11254 B14R0.393 CCCCOCCCOCC(=O)OCC 34a_100000210227_100009893628 [1,1,0,0,0,0|2,0,0]=4 11255 B14R0.393 CCCCOCCCOCC(=O)OCC 34a_200011215613_100000188475 [1,1,0,0,0,0|2,0,0]=4 11256 B14R0.393 CCCCOCCCOCC(=O)OCC 7a_100000210227_100009893628 [1,1,0,0,0,0|2,0,0]=4 11257 B14R0.393 CCCCOCCCOCC(=O)OCC 7a_200011215613_100000188475 [1,1,0,0,0,0|2,0,0]=4 11258 B14R0.393 CCCCOCCOCCC(=O)OCC 34a_100000210238_100000765890 [1,1,0,0,0,0|2,0,0]=4 11259 B14R0.393 CCCCOCCOCCC(=O)OCC 7a_100000210238_100011206558 [1,1,0,0,0,0|2,0,0]=4 11260 B14R0.393 CCCCOCCSCCC(=O)OCC 62a_100000743108_100000765890 [1,1,0,0,0,0|2,0,0]=4 11261 B14R0.393 CCCCOCCSCCC(=O)OCC 62a_100000765890_100000743108 [1,1,0,0,0,0|2,0,0]=4 11262 B14R0.393 CCCCOCSCCCC(=O)OCC 62a_100009991533_100011995733 [1,1,0,0,0,0|2,0,0]=4 11263 B14R0.393 CCCCOCSCCCC(=O)OCC 62a_100011995733_100009991533 [1,1,0,0,0,0|2,0,0]=4 11264 B14R0.393 CCCCSCCCCCC(=O)OCC 62a_100000210211_100000755133 [1,1,0,0,0,0|1,0,0]=3 11265 B14R0.393 CCCCSCCCCCC(=O)OCC 62a_100000755133_100000210210 [1,1,0,0,0,0|1,0,0]=3 11266 B14R0.393 CCCCSCCCOCC(=O)OCC 62a_100000210211_100009893628 [1,1,0,0,0,0|2,0,0]=4 11267 B14R0.393 CCCCSCCCOCC(=O)OCC 62a_100009893628_100000210210 [1,1,0,0,0,0|2,0,0]=4 11268 B14R0.393 CCCCSCCNCCC(=O)OCC 2230a_100025743550_100011206558 [1,1,0,0,0,0|2,0,0]=4 11269 B14R0.393 CCCCSCCOCCC(=O)OCC 34a_200000230436_100000765890 [1,1,0,0,0,0|2,0,0]=4 11270 B14R0.393 CCCCSCCOCCC(=O)OCC 7a_200000230436_100011206558 [1,1,0,0,0,0|2,0,0]=4 11271 B14R0.393 CCCOCCCCCCC(=O)OCC 34a_100000210258_100009814379 [1,1,0,0,0,0|1,0,0]=3 11272 B14R0.393 CCCOCCCNCCC(=O)OCC 2230a_100011217757_100011206558 [1,1,0,0,0,0|2,0,0]=4 11273 B14R0.393 CCCOCCCNCCC(=O)OCC 34a_100011217757_100000765890 [1,1,0,0,0,0|2,0,0]=4 11274 B14R0.393 CCCOCCNCCCC(=O)OCC 2230a_100161115042_100009991533 [1,1,0,0,0,0|2,0,0]=4 11275 B14R0.393 CCCOCCNCCCC(=O)OCC 34a_100161115042_100009991533 [1,1,0,0,0,0|2,0,0]=4 11276 B14R0.393 CCCOCCOCCCC(=O)OCC 34a_100000752267_100009991533 [1,1,0,0,0,0|2,0,0]=4 11277 B14R0.393 CCCOCCOCCCC(=O)OCC 7a_100000752267_100011215271 [1,1,0,0,0,0|2,0,0]=4 11278 B14R0.393 CCCOCCOCCCC(=O)OCC 7a_100012001163_100011215938 [1,1,0,0,0,0|2,0,0]=4 11279 B14R0.393 CCCOCCSCCCC(=O)OCC 62a_100009991533_100011215938 [1,1,0,0,0,0|2,0,0]=4 11280 B14R0.393 CCCOCCSCCCC(=O)OCC 62a_100011215938_100009991533 [1,1,0,0,0,0|2,0,0]=4 11281 B14R0.393 CCCSCCCCCCC(=O)OCC 62a_100000210303_100009814379 [1,1,0,0,0,0|1,0,0]=3 11282 B14R0.393 CCCSCCNCCCC(=O)OCC 2230a_100020603323_100009991533 [1,1,0,0,0,0|2,0,0]=4 11283 B14R0.393 CCCSCCOCCCC(=O)OCC 34a_200000230433_100009991533 [1,1,0,0,0,0|2,0,0]=4 11284 B14R0.393 CCCSCCOCCCC(=O)OCC 7a_200000230433_100011215271 [1,1,0,0,0,0|2,0,0]=4 11285 B14R0.393 CCNC(=O)CCCCCCCCCF 11a_100015525214_200009909015 [1,1,0,0,0,0|2,0,0]=4 11286 B14R0.393 CCNC(=O)CCCCCCCCCF 240690a_100015525214_200009909015 [1,1,0,0,0,0|2,0,0]=4 11287 B14R0.393 CCNC(=O)CCCCCCCCCF 527a_100015525214_200009909015 [1,1,0,0,0,0|2,0,0]=4 11288 B14R0.393 CCNC(=O)CCCCCCCCCO 240690a_100015525214_100000032657 [1,1,0,0,0,0|2,0,0]=4 11289 B14R0.393 CCNCCCCCCCC(=O)OCC 2230a_100015525214_100009991516 [1,1,0,0,0,0|1,0,0]=3 11290 B14R0.393 CCOC(=O)CCCCCCCCNC 2230a_106832991635_100010175975 [1,1,0,0,0,0|1,0,0]=3 11291 B14R0.393 CCOC(=O)CCCCCCCCNC 34a_100102657272_100010175975 [1,1,0,0,0,0|1,0,0]=3 11292 B14R0.393 CCOC(=O)CCCCCCCCNC 7a_106832991635_100010175975 [1,1,0,0,0,0|1,0,0]=3 11293 B14R0.393 CCOC(=O)CCCCCCCCOC 34a_100138415774_100010175975 [1,1,0,0,0,0|1,0,0]=3 11294 B14R0.393 CCOC(=O)CCCCCCCCSC 62a_200000210301_100010175975 [1,1,0,0,0,0|1,0,0]=3 11295 B14R0.393 CCOC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100010175975 [1,1,0,0,0,0|1,0,0]=3 11296 B14R0.393 CCOC(=O)CCCCCCCSCC 62a_100000210202_100009991516 [1,1,0,0,0,0|1,0,0]=3 11297 B14R0.393 CCOC(=O)CCCCCCCSCF 62a_100015361967_100009991516 [1,1,0,0,0,0|2,0,0]=4 11298 B14R0.393 CCOC(=O)CCCCCCNCCF 34a_100000724931_100009814379 [1,1,0,0,0,0|2,0,0]=4 11299 B14R0.393 CCOC(=O)CCCCCCNCCO 2230a_100016997473_100009814379 [1,1,0,0,0,0|2,0,0]=4 11300 B14R0.393 CCOC(=O)CCCCCCNCCO 34a_100016990907_100009814379 [1,1,0,0,0,0|2,0,0]=4 11301 B14R0.393 CCOC(=O)CCCCCCOCCBr 34a_100000211926_100009814379 [1,1,0,0,0,0|2,0,0]=4 11302 B14R0.393 CCOC(=O)CCCCCCOCCN 34a_100000210304_100009814379 [1,1,0,0,0,0|2,0,0]=4 11303 B14R0.393 CCOC(=O)CCCCCCSCCF 62a_100011217306_100009814379 [1,1,0,0,0,0|2,0,0]=4 11304 B14R0.393 CCOC(=O)CCCCCCSCCO 62a_100000211926_100009814379 [1,1,0,0,0,0|2,0,0]=4 11305 B14R0.393 CCOC(=O)CCCCCCSCOC 62a_100000766300_100009814379 [1,1,0,0,0,0|2,0,0]=4 11306 B14R0.393 CCOC(=O)CCCCCCSCSC 62a_100011218213_100009814379 [1,1,0,0,0,0|2,0,0]=4 11307 B14R0.393 CCOC(=O)CCCCCNCCCF 2230a_100015189416_100000755133 [1,1,0,0,0,0|2,0,0]=4 11308 B14R0.393 CCOC(=O)CCCCCNCCCF 34a_100015189416_100000755133 [1,1,0,0,0,0|2,0,0]=4 11309 B14R0.393 CCOC(=O)CCCCCNCCOC 2230a_100000209980_100000755133 [1,1,0,0,0,0|2,0,0]=4 11310 B14R0.393 CCOC(=O)CCCCCNCCSC 2230a_100020590264_100000755133 [1,1,0,0,0,0|2,0,0]=4 11311 B14R0.393 CCOC(=O)CCCCCOCCCBr 34a_100011217188_100000755133 [1,1,0,0,0,0|2,0,0]=4 11312 B14R0.393 CCOC(=O)CCCCCOCCCCl 34a_100000230001_100000755133 [1,1,0,0,0,0|2,0,0]=4 11313 B14R0.393 CCOC(=O)CCCCCOCCCF 34a_100000759539_100000755133 [1,1,0,0,0,0|2,0,0]=4 11314 B14R0.393 CCOC(=O)CCCCCOCCCF 7a_100011214988_100011934791 [1,1,0,0,0,0|2,0,0]=4 11315 B14R0.393 CCOC(=O)CCCCCOCCCN 34a_100000182051_100000755133 [1,1,0,0,0,0|2,0,0]=4 11316 B14R0.393 CCOC(=O)CCCCCOCCCO 7a_100011214988_100011215043 [1,1,0,0,0,0|2,0,0]=4 11317 B14R0.393 CCOC(=O)CCCCCOCCOC 34a_100000210237_100000755133 [1,1,0,0,0,0|2,0,0]=4 11318 B14R0.393 CCOC(=O)CCCCCOCCOC 7a_100011214988_100000233755 [1,1,0,0,0,0|2,0,0]=4 11319 B14R0.393 CCOC(=O)CCCCCOCCSC 34a_100000230434_100000755133 [1,1,0,0,0,0|2,0,0]=4 11320 B14R0.393 CCOC(=O)CCCCCOCCSC 7a_100000230434_100000755133 [1,1,0,0,0,0|2,0,0]=4 11321 B14R0.393 CCOC(=O)CCCCCOCCSC 7a_100011214988_100000212216 [1,1,0,0,0,0|2,0,0]=4 11322 B14R0.393 CCOC(=O)CCCCCSCCCF 62a_100000755133_100011934791 [1,1,0,0,0,0|2,0,0]=4 11323 B14R0.393 CCOC(=O)CCCCCSCCCF 62a_100011934791_100000755133 [1,1,0,0,0,0|2,0,0]=4 11324 B14R0.393 CCOC(=O)CCCCCSCCCO 62a_100000755133_100011215043 [1,1,0,0,0,0|2,0,0]=4 11325 B14R0.393 CCOC(=O)CCCCCSCCCO 62a_100011215043_100000755133 [1,1,0,0,0,0|2,0,0]=4 11326 B14R0.393 CCOC(=O)CCCCCSCCOC 62a_100000233755_100000755133 [1,1,0,0,0,0|2,0,0]=4 11327 B14R0.393 CCOC(=O)CCCCCSCCOC 62a_100000755133_100000233755 [1,1,0,0,0,0|2,0,0]=4 11328 B14R0.393 CCOC(=O)CCCCCSCCSC 62a_100000212216_100000755133 [1,1,0,0,0,0|2,0,0]=4 11329 B14R0.393 CCOC(=O)CCCCCSCCSC 62a_100000755133_100000751147 [1,1,0,0,0,0|2,0,0]=4 11330 B14R0.393 CCOC(=O)CCCCNCCCCO 2230a_100000750430_100000750268 [1,1,0,0,0,0|2,0,0]=4 11331 B14R0.393 CCOC(=O)CCCCNCCCCO 34a_100000750430_100000750268 [1,1,0,0,0,0|2,0,0]=4 11332 B14R0.393 CCOC(=O)CCCCNCCCOC 34a_100150723488_100000750268 [1,1,0,0,0,0|2,0,0]=4 11333 B14R0.393 CCOC(=O)CCCCNCCCSC 2230a_100000749238_100000750268 [1,1,0,0,0,0|2,0,0]=4 11334 B14R0.393 CCOC(=O)CCCCNCCSCC 2230a_100000106463_100000750268 [1,1,0,0,0,0|2,0,0]=4 11335 B14R0.393 CCOC(=O)CCCCOCCCCBr 34a_100011216708_100000750268 [1,1,0,0,0,0|2,0,0]=4 11336 B14R0.393 CCOC(=O)CCCCOCCCCCl 34a_100000210776_100000750268 [1,1,0,0,0,0|2,0,0]=4 11337 B14R0.393 CCOC(=O)CCCCOCCCCCl 7a_100000210776_100000750268 [1,1,0,0,0,0|2,0,0]=4 11338 B14R0.393 CCOC(=O)CCCCOCCCCF 34a_100011995726_100000750268 [1,1,0,0,0,0|2,0,0]=4 11339 B14R0.393 CCOC(=O)CCCCOCCCCF 7a_100011995726_100000750268 [1,1,0,0,0,0|2,0,0]=4 11340 B14R0.393 CCOC(=O)CCCCOCCCCI 34a_200012148704_100000750268 [1,1,0,0,0,0|2,0,0]=4 11341 B14R0.393 CCOC(=O)CCCCOCCCCN 34a_100000750430_100000750268 [1,1,0,0,0,0|2,0,0]=4 11342 B14R0.393 CCOC(=O)CCCCOCCCNC 34a_100000213112_100000750268 [1,1,0,0,0,0|2,0,0]=4 11343 B14R0.393 CCOC(=O)CCCCOCCCOC 34a_100000740835_100000750268 [1,1,0,0,0,0|2,0,0]=4 11344 B14R0.393 CCOC(=O)CCCCOCCCSC 34a_100000690336_100000750268 [1,1,0,0,0,0|2,0,0]=4 11345 B14R0.393 CCOC(=O)CCCCOCCCSC 7a_100000690336_100000750268 [1,1,0,0,0,0|2,0,0]=4 11346 B14R0.393 CCOC(=O)CCCCOCCSCC 34a_100000212035_100000750268 [1,1,0,0,0,0|2,0,0]=4 11347 B14R0.393 CCOC(=O)CCCCOCCSCC 7a_100000212035_100000750268 [1,1,0,0,0,0|2,0,0]=4 11348 B14R0.393 CCOC(=O)CCCCSCCCCF 62a_100000729493_100000750268 [1,1,0,0,0,0|2,0,0]=4 11349 B14R0.393 CCOC(=O)CCCCSCCCCF 62a_100000750268_100000729493 [1,1,0,0,0,0|2,0,0]=4 11350 B14R0.393 CCOC(=O)CCCCSCCCCO 62a_100000210776_100000750268 [1,1,0,0,0,0|2,0,0]=4 11351 B14R0.393 CCOC(=O)CCCCSCCCCO 62a_100000750268_100000210776 [1,1,0,0,0,0|2,0,0]=4 11352 B14R0.393 CCOC(=O)CCCCSCCCOC 62a_100000709357_100000750268 [1,1,0,0,0,0|2,0,0]=4 11353 B14R0.393 CCOC(=O)CCCCSCCCOC 62a_100000750268_100000709357 [1,1,0,0,0,0|2,0,0]=4 11354 B14R0.393 CCOC(=O)CCCCSCCSCC 62a_100000750268_100000757381 [1,1,0,0,0,0|2,0,0]=4 11355 B14R0.393 CCOC(=O)CCCCSCCSCC 62a_100000757381_100000750268 [1,1,0,0,0,0|2,0,0]=4 11356 B14R0.393 CCOC(=O)CCCNCCCCCO 2230a_100000762737_100009991533 [1,1,0,0,0,0|2,0,0]=4 11357 B14R0.393 CCOC(=O)CCCNCCCCCO 34a_100000762737_100009991533 [1,1,0,0,0,0|2,0,0]=4 11358 B14R0.393 CCOC(=O)CCCOCCCCCBr 34a_100000746331_100009991533 [1,1,0,0,0,0|2,0,0]=4 11359 B14R0.393 CCOC(=O)CCCOCCCCCBr 7a_100000746331_100011215271 [1,1,0,0,0,0|2,0,0]=4 11360 B14R0.393 CCOC(=O)CCCOCCCCCCl 34a_100000746330_100009991533 [1,1,0,0,0,0|2,0,0]=4 11361 B14R0.393 CCOC(=O)CCCOCCCCCCl 7a_100000746330_100011215271 [1,1,0,0,0,0|2,0,0]=4 11362 B14R0.393 CCOC(=O)CCCOCCCCCF 7a_100012001163_100000729378 [1,1,0,0,0,0|2,0,0]=4 11363 B14R0.393 CCOC(=O)CCCOCCCCCI 34a_200012148887_100009991533 [1,1,0,0,0,0|2,0,0]=4 11364 B14R0.393 CCOC(=O)CCCOCCCCCI 7a_200012148887_100011215271 [1,1,0,0,0,0|2,0,0]=4 11365 B14R0.393 CCOC(=O)CCCOCCCCCN 34a_100000762737_100009991533 [1,1,0,0,0,0|2,0,0]=4 11366 B14R0.393 CCOC(=O)CCCOCCCCCO 7a_100012001163_100000746330 [1,1,0,0,0,0|2,0,0]=4 11367 B14R0.393 CCOC(=O)CCCOCCCCOC 34a_100000740925_100009991533 [1,1,0,0,0,0|2,0,0]=4 11368 B14R0.393 CCOC(=O)CCCOCCCCOC 7a_100012001163_100000730899 [1,1,0,0,0,0|2,0,0]=4 11369 B14R0.393 CCOC(=O)CCCOCCCCSC 34a_100011217163_100009991533 [1,1,0,0,0,0|2,0,0]=4 11370 B14R0.393 CCOC(=O)CCCOCCCCSC 7a_100011217163_100011215271 [1,1,0,0,0,0|2,0,0]=4 11371 B14R0.393 CCOC(=O)CCCOCCCSCC 34a_100011216438_100009991533 [1,1,0,0,0,0|2,0,0]=4 11372 B14R0.393 CCOC(=O)CCCOCCCSCC 7a_100011216438_100011215271 [1,1,0,0,0,0|2,0,0]=4 11373 B14R0.393 CCOC(=O)CCCSCCCCCF 62a_100000729378_100009991533 [1,1,0,0,0,0|2,0,0]=4 11374 B14R0.393 CCOC(=O)CCCSCCCCCF 62a_100009991533_100000729378 [1,1,0,0,0,0|2,0,0]=4 11375 B14R0.393 CCOC(=O)CCCSCCCCCO 62a_100000746330_100009991533 [1,1,0,0,0,0|2,0,0]=4 11376 B14R0.393 CCOC(=O)CCCSCCCCCO 62a_100009991533_100000746330 [1,1,0,0,0,0|2,0,0]=4 11377 B14R0.393 CCOC(=O)CCCSCCCCOC 62a_100000730899_100009991533 [1,1,0,0,0,0|2,0,0]=4 11378 B14R0.393 CCOC(=O)CCCSCCCCOC 62a_100009991533_100000730899 [1,1,0,0,0,0|2,0,0]=4 11379 B14R0.393 CCOC(=O)CCNCCCCCCO 2230a_100000686447_100011206558 [1,1,0,0,0,0|2,0,0]=4 11380 B14R0.393 CCOC(=O)CCNCCCCCCO 34a_100000686447_100000765890 [1,1,0,0,0,0|2,0,0]=4 11381 B14R0.393 CCOC(=O)CCNCCCCCOC 2230a_100000747528_100011206558 [1,1,0,0,0,0|2,0,0]=4 11382 B14R0.393 CCOC(=O)CCNCCCCCOC 34a_100000747528_100000765890 [1,1,0,0,0,0|2,0,0]=4 11383 B14R0.393 CCOC(=O)CCOCCCCCCBr 34a_100011215345_100000765890 [1,1,0,0,0,0|2,0,0]=4 11384 B14R0.393 CCOC(=O)CCOCCCCCCBr 7a_100011215345_100011206558 [1,1,0,0,0,0|2,0,0]=4 11385 B14R0.393 CCOC(=O)CCOCCCCCCCl 34a_100000766143_100000765890 [1,1,0,0,0,0|2,0,0]=4 11386 B14R0.393 CCOC(=O)CCOCCCCCCCl 7a_100000766143_100011206558 [1,1,0,0,0,0|2,0,0]=4 11387 B14R0.393 CCOC(=O)CCOCCCCCCF 34a_100000732779_100000765890 [1,1,0,0,0,0|2,0,0]=4 11388 B14R0.393 CCOC(=O)CCOCCCCCCF 7a_100000732779_100011206558 [1,1,0,0,0,0|2,0,0]=4 11389 B14R0.393 CCOC(=O)CCOCCCCCCN 34a_100000686447_100000765890 [1,1,0,0,0,0|2,0,0]=4 11390 B14R0.393 CCOC(=O)CCOCCCCCNC 34a_100000722520_100000765890 [1,1,0,0,0,0|2,0,0]=4 11391 B14R0.393 CCOC(=O)CCSCCCCCCF 62a_100000765890_100015922095 [1,1,0,0,0,0|2,0,0]=4 11392 B14R0.393 CCOC(=O)CCSCCCCCCF 62a_100015922095_100000765890 [1,1,0,0,0,0|2,0,0]=4 11393 B14R0.393 CCOC(=O)CCSCCCCCCO 62a_100000765890_100000766143 [1,1,0,0,0,0|2,0,0]=4 11394 B14R0.393 CCOC(=O)CCSCCCCCCO 62a_100000766143_100000765890 [1,1,0,0,0,0|2,0,0]=4 11395 B14R0.393 CCOC(=O)CNCCCCCCCO 2230a_100011996573_100000188475 [1,1,0,0,0,0|2,0,0]=4 11396 B14R0.393 CCOC(=O)CNCCCCCCCO 34a_100011996573_100000188475 [1,1,0,0,0,0|2,0,0]=4 11397 B14R0.393 CCOC(=O)COCCCCCCCBr 34a_100000760002_100000188475 [1,1,0,0,0,0|2,0,0]=4 11398 B14R0.393 CCOC(=O)COCCCCCCCBr 7a_100000760002_100000188475 [1,1,0,0,0,0|2,0,0]=4 11399 B14R0.393 CCOC(=O)COCCCCCCCN 34a_100011996573_100000188475 [1,1,0,0,0,0|2,0,0]=4 11400 B14R0.393 CCOC(=O)COCCCCCCOC 34a_200012092642_100000188475 [1,1,0,0,0,0|2,0,0]=4 11401 B14R0.393 CCOC(=O)COCCCCCCOC 7a_200012092642_100000188475 [1,1,0,0,0,0|2,0,0]=4 11402 B14R0.393 CCOC(=O)CSCCCCCCCO 62a_100000188475_100000760002 [1,1,0,0,0,0|2,0,0]=4 11403 B14R0.393 CCOC(=O)CSCCCCCCCO 62a_100000760002_100000188475 [1,1,0,0,0,0|2,0,0]=4 11404 B14R0.393 CCOC(=O)CSCCCCCCOC 62a_100000188475_100011998445 [1,1,0,0,0,0|2,0,0]=4 11405 B14R0.393 CCOC(=O)CSCCCCCCOC 62a_100011998445_100000188475 [1,1,0,0,0,0|2,0,0]=4 11406 B14R0.393 CCOCCCCCCCC(=O)OCC 34a_100121572206_100009991516 [1,1,0,0,0,0|1,0,0]=3 11407 B14R0.393 CCOCCCNCCCC(=O)OCC 2230a_100000210961_100009991533 [1,1,0,0,0,0|2,0,0]=4 11408 B14R0.393 CCOCCCNCCCC(=O)OCC 34a_100000210961_100009991533 [1,1,0,0,0,0|2,0,0]=4 11409 B14R0.393 CCOCCCOCCCC(=O)OCC 34a_100000757476_100009991533 [1,1,0,0,0,0|2,0,0]=4 11410 B14R0.393 CCOCCCOCCCC(=O)OCC 7a_100000757476_100011215271 [1,1,0,0,0,0|2,0,0]=4 11411 B14R0.393 CCOCCCOCCCC(=O)OCC 7a_100012001163_100012232248 [1,1,0,0,0,0|2,0,0]=4 11412 B14R0.393 CCOCCCSCCCC(=O)OCC 62a_100009991533_100012232248 [1,1,0,0,0,0|2,0,0]=4 11413 B14R0.393 CCOCCCSCCCC(=O)OCC 62a_100012232248_100009991533 [1,1,0,0,0,0|2,0,0]=4 11414 B14R0.393 CCOCCNCCCCC(=O)OCC 2230a_102516460346_100000750268 [1,1,0,0,0,0|2,0,0]=4 11415 B14R0.393 CCOCCNCCCCC(=O)OCC 34a_102516460346_100000750268 [1,1,0,0,0,0|2,0,0]=4 11416 B14R0.393 CCOCCOCCCCC(=O)OCC 34a_100000210136_100000750268 [1,1,0,0,0,0|2,0,0]=4 11417 B14R0.393 CCOCCOCCCCC(=O)OCC 7a_100000210136_100000750268 [1,1,0,0,0,0|2,0,0]=4 11418 B14R0.393 CCOCCSCCCCC(=O)OCC 62a_100000210147_100000750268 [1,1,0,0,0,0|2,0,0]=4 11419 B14R0.393 CCOCCSCCCCC(=O)OCC 62a_100000750268_100011215890 [1,1,0,0,0,0|2,0,0]=4 11420 B14R0.393 CCOCSCCCCCC(=O)OCC 62a_100000739092_100000755133 [1,1,0,0,0,0|2,0,0]=4 11421 B14R0.393 CCOCSCCCCCC(=O)OCC 62a_100000755133_100000739092 [1,1,0,0,0,0|2,0,0]=4 11422 B14R0.393 CNNC(=O)CCCCCCCCCF 22a_100016993582_200009909015 [1,1,0,0,0,0|2,0,0]=4 11423 B14R0.393 CNNC(=O)CCCCCCCCCO 22a_100016993582_100000032657 [1,1,0,0,0,0|2,0,0]=4 11424 B14R0.393 COCC(=O)CCCCCCCCCO 1458a_100000210968_100009813782 [1,1,0,0,0,0|1,0,0]=3 11425 B14R0.393 COCC(=O)NCCCCCCCCO 240690a_102515433106_100000210968 [1,1,0,0,0,0|2,0,0]=4 11426 B14R0.393 CSCC(=O)CCCCCCCCCO 1458a_100000184570_100009813782 [1,1,0,0,0,0|1,1,0]=4 11427 B14R0.393 O=C(CCF)CCCCCCCCCF 1458a_200009909015_100011217306 [1,1,0,0,0,0|2,0,0]=4 11428 B14R0.393 O=C(CCO)CCCCCCCCCF 1458a_200009909015_100000211926 [1,1,0,0,0,0|2,0,0]=4 11429 B14R0.393 O=C(CCO)CCCCCCCCCO 1458a_100011216618_100009813782 [1,1,0,0,0,0|2,0,0]=4 11430 B14R0.2056 CCCCCCCCCCS(=O)(=O)NC 270084a_100102657272_200011217601 [1,1,0,0,0,0|2,0,0]=4 11431 B14R0.2056 CCCCCCCCCCS(=O)(=O)NC 274078a_100102657272_200011217601 [1,1,0,0,0,0|2,0,0]=4 11432 B14R0.145 C/C=C/CCOC(C)CCCCCCC 34a_100016278192_200011218727 [1,1,0,0,0,0|2,0,0]=4 11433 B14R0.145 C/C=C/COCCC(C)CCCCCC 34a_200011024964_100102629194 [1,1,0,0,0,0|2,0,0]=4 11434 B14R0.145 C/C=C/COCCC(C)CCCCCC 7a_200011024964_100102629194 [1,1,0,0,0,0|2,0,0]=4 11435 B14R0.145 CC=CCCCOC(C)CCCCCC 34a_100020645299_100011215978 [1,1,0,0,0,0|2,0,0]=4 11436 B14R0.145 CC=CCOCCC(C)CCCCCC 34a_200011024964_100000070051 [1,1,0,0,0,0|2,0,0]=4 11437 B14R0.145 CC=CCOCCC(C)CCCCCC 7a_200011024964_100000070051 [1,1,0,0,0,0|2,0,0]=4 11438 B14R0.145 CCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210757 [1,1,0,0,0,0|0,0,2]=4 11439 B14R0.145 CCCCCCC(C)CCOCCOC 34a_200011024964_100011201679 [1,1,0,0,0,0|1,0,1]=4 11440 B14R0.145 CCCCCCC(C)CCOCCOC 7a_200011024964_100000233755 [1,1,0,0,0,0|1,0,1]=4 11441 B14R0.145 CCCCCCC(C)NCCCCOC 2230a_100000210919_100000730899 [1,1,0,0,0,0|1,0,1]=4 11442 B14R0.145 CCCCCCC(C)NCCCCOC 34a_100000210919_100000755781 [1,1,0,0,0,0|1,0,1]=4 11443 B14R0.145 CCCCCCC(C)OCCCCOC 34a_100000210265_100000755781 [1,1,0,0,0,0|1,0,1]=4 11444 B14R0.145 CCCCCCC(C)OCCCCOC 34a_100000740925_100011215978 [1,1,0,0,0,0|1,0,1]=4 11445 B14R0.145 CCCCCCC(C)OCCCCOC 7a_100000210265_100000730899 [1,1,0,0,0,0|1,0,1]=4 11446 B14R0.145 CCCCCCC(C)SCCCCOC 62a_100000730899_100011215978 [1,1,0,0,0,0|1,0,1]=4 11447 B14R0.145 CCCCCCC(C)SCCCCOC 62a_100011215978_100000730899 [1,1,0,0,0,0|1,0,1]=4 11448 B14R0.145 CCCCCCCC(=O)CCCCOC 1458a_100000211969_100000755781 [1,1,0,0,0,0|0,0,2]=4 11449 B14R0.145 CCCCCCCC(C)NCCCOC 270004a_100150723488_100000210596 [1,1,0,0,0,0|1,0,1]=4 11450 B14R0.145 CCCCCCCC(C)NCCCOC 34a_100150723488_200011218727 [1,1,0,0,0,0|1,0,1]=4 11451 B14R0.145 CCCCCCCC(C)OCCCOC 34a_100000740835_200011218727 [1,1,0,0,0,0|1,0,1]=4 11452 B14R0.145 CCCCCCCC(C)OCCCOC 34a_200011215852_100000740836 [1,1,0,0,0,0|1,0,1]=4 11453 B14R0.145 CCCCCCCC(C)OCCCOC 7a_200011215852_100000740836 [1,1,0,0,0,0|1,0,1]=4 11454 B14R0.145 CCCCCCCC(C)SCCCOC 62a_100000709357_200011218727 [1,1,0,0,0,0|1,0,1]=4 11455 B14R0.145 CCCCCCCC(C)SCCCOC 62a_200011218727_100000709357 [1,1,0,0,0,0|1,0,1]=4 11456 B14R0.145 CCCCCCCN(C)CCCCOC 2230a_100000228206_100000730899 [1,1,0,0,0,0|1,0,1]=4 11457 B14R0.145 CCCCCCCN(C)CCCCOC 269982a_100000228206_100000730899 [1,1,0,0,0,0|1,0,1]=4 11458 B14R0.179 C/C=C/COC(C)CCCCCCCC 34a_100000210740_100102629194 [1,1,0,0,0,0|2,0,0]=4 11459 B14R0.179 C/C=C/COC(C)CCCCCCCC 7a_100000210740_100102629194 [1,1,0,0,0,0|2,0,0]=4 11460 B14R0.179 CC=CCOC(C)CCCCCCCC 34a_100000210740_100000070051 [1,1,0,0,0,0|2,0,0]=4 11461 B14R0.179 CC=CCOC(C)CCCCCCCC 7a_100000210740_100000070051 [1,1,0,0,0,0|2,0,0]=4 11462 B14R0.179 CCCCCC(=O)CCCCCCOC 1458a_100000212188_100011998445 [1,1,0,0,0,0|0,0,2]=4 11463 B14R0.179 CCCCCC(C)NCCCCCOC 2230a_100000747528_200011218191 [1,1,0,0,0,0|1,0,1]=4 11464 B14R0.179 CCCCCC(C)NCCCCCOC 270004a_100000747528_100000211708 [1,1,0,0,0,0|1,0,1]=4 11465 B14R0.179 CCCCCC(C)NCCCCCOC 34a_100000747528_200011218191 [1,1,0,0,0,0|1,0,1]=4 11466 B14R0.179 CCCCCCCCC(=O)CCCOC 1458a_100000210188_100000740836 [1,1,0,0,0,0|0,0,2]=4 11467 B14R0.179 CCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210759 [1,1,0,0,0,0|0,0,2]=4 11468 B14R0.179 CCCCCCCCC(C)NCCOC 270004a_100000209980_100011216694 [1,1,0,0,0,0|1,0,1]=4 11469 B14R0.179 CCCCCCCCC(C)OCCOC 34a_100000210740_100011201679 [1,1,0,0,0,0|1,0,1]=4 11470 B14R0.179 CCCCCCCCC(C)OCCOC 7a_100000210740_100000233755 [1,1,0,0,0,0|1,0,1]=4 11471 B14R0.179 CCCCCCCCN(C)CCCOC 2230a_100000207567_100000740836 [1,1,0,0,0,0|1,0,1]=4 11472 B14R0.179 CCCCCCCCN(C)CCCOC 2230a_100000224831_100000210759 [1,1,0,0,0,0|1,0,1]=4 11473 B14R0.179 CCCCCCCCN(C)CCCOC 269982a_100000207567_100000740836 [1,1,0,0,0,0|1,0,1]=4 11474 B14R0.179 CCCCCCCCN(C)CCCOC 269982a_100000224831_100000210759 [1,1,0,0,0,0|1,0,1]=4 11475 B14R0.179 CCCCCCCOC(C)CCCOC 34a_200011539412_100000210614 [1,1,0,0,0,0|1,0,1]=4 11476 B14R0.179 CCCCCCCOC(C)CCCOC 7a_200011539412_100000210614 [1,1,0,0,0,0|1,0,1]=4 11477 B14R0.179 CCCCCN(C)CCCCCCOC 2230a_100000223495_100011998445 [1,1,0,0,0,0|1,0,1]=4 11478 B14R0.179 CCCCCN(C)CCCCCCOC 269982a_100000223495_100011998445 [1,1,0,0,0,0|1,0,1]=4 11479 B14R0.392 C/C=C/CCOCCCCCCCCC 34a_100016278192_100011214924 [1,1,0,0,0,0|1,0,0]=3 11480 B14R0.392 C/C=C/CCOCCCCCCCCO 34a_100016278192_100000033203 [1,1,0,0,0,0|2,0,0]=4 11481 B14R0.392 C/C=C/CNCCCCCCCCCC 34a_100000684558_100102629194 [1,1,0,0,0,0|1,0,0]=3 11482 B14R0.392 C/C=C/CNCCCCCCCCCO 34a_100000078944_100102629194 [1,1,0,0,0,0|2,0,0]=4 11483 B14R0.392 C/C=C/COCCCCCCCCCBr 34a_100009813782_100102629194 [1,1,0,0,0,0|2,0,0]=4 11484 B14R0.392 C/C=C/COCCCCCCCCCBr 7a_100009813782_100102629194 [1,1,0,0,0,0|2,0,0]=4 11485 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100000210711_100102629194 [1,1,0,0,0,0|1,0,0]=3 11486 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100016270725_100000210320 [1,1,0,0,0,0|1,0,0]=3 11487 B14R0.392 C/C=C/COCCCCCCCCCC 7a_100000210711_100102629194 [1,1,0,0,0,0|1,0,0]=3 11488 B14R0.392 C/C=C/COCCCCCCCCCCl 34a_100009868337_100102629194 [1,1,0,0,0,0|2,0,0]=4 11489 B14R0.392 C/C=C/COCCCCCCCCCCl 7a_100009868337_100102629194 [1,1,0,0,0,0|2,0,0]=4 11490 B14R0.392 C/C=C/COCCCCCCCCCN 34a_100000078944_100102629194 [1,1,0,0,0,0|2,0,0]=4 11491 B14R0.392 C/C=C/COCCCCCCCCCO 34a_100016270725_100009813782 [1,1,0,0,0,0|2,0,0]=4 11492 B14R0.392 C/C=C/CSCCCCCCCCCC 62a_100102629194_100000210320 [1,1,0,0,0,0|1,0,0]=3 11493 B14R0.392 C/C=C/CSCCCCCCCCCO 62a_100009813782_100102629194 [1,1,0,0,0,0|2,0,0]=4 11494 B14R0.392 C/C=C/CSCCCCCCCCCO 62a_100102629194_100009813782 [1,1,0,0,0,0|2,0,0]=4 11495 B14R0.392 C=CCCCCCCCCCCCOC 34a_100138415774_102130925996 [1,1,0,0,0,0|0,0,2]=4 11496 B14R0.392 CC#CCCOCCCCCCCCC 34a_100000750427_100011214924 [1,1,0,0,0,0|1,0,1]=4 11497 B14R0.392 CC#CCNCCCCCCCCCC 2230a_100000684558_100000748600 [1,1,0,0,0,0|1,0,1]=4 11498 B14R0.392 CC#CCNCCCCCCCCCC 2230a_100000685387_100000210320 [1,1,0,0,0,0|1,0,1]=4 11499 B14R0.392 CC#CCNCCCCCCCCCC 34a_100000684558_100000748600 [1,1,0,0,0,0|1,0,1]=4 11500 B14R0.392 CC#CCNCCCCCCCCCC 34a_100000685387_100000210320 [1,1,0,0,0,0|1,0,1]=4 11501 B14R0.392 CC#CCOCCCCCCCCCC 34a_100000210711_100000748600 [1,1,0,0,0,0|1,0,1]=4 11502 B14R0.392 CC#CCOCCCCCCCCCC 34a_100000761923_100000210320 [1,1,0,0,0,0|1,0,1]=4 11503 B14R0.392 CC#CCOCCCCCCCCCC 7a_100000210711_100000748600 [1,1,0,0,0,0|1,0,1]=4 11504 B14R0.392 CC#CCSCCCCCCCCCC 62a_100000748600_100000210320 [1,1,0,0,0,0|1,0,1]=4 11505 B14R0.392 CC/C=C/CCCOCCCCCCC 34a_100016287902_100000210614 [1,1,0,0,0,0|1,0,1]=4 11506 B14R0.392 CC/C=C/CCCOCCCCCCC 7a_100016287902_100000210614 [1,1,0,0,0,0|1,0,1]=4 11507 B14R0.392 CC/C=C\CCCCCCCNCCC 269862a_100020643023_200025770492 [1,1,0,0,0,0|1,0,1]=4 11508 B14R0.392 CC/C=C\CCCCCNCCCCC 269862a_100000209983_100016288537 [1,1,0,0,0,0|1,0,1]=4 11509 B14R0.392 CC/C=C\CCCCCOCCCCC 34a_100016268722_100000718602 [1,1,0,0,0,0|1,0,1]=4 11510 B14R0.392 CC/C=C\CCCCCOCCCCC 7a_100016268722_100000210326 [1,1,0,0,0,0|1,0,1]=4 11511 B14R0.392 CC/C=C\CCCCOCCCCCC 34a_100016287862_100000210314 [1,1,0,0,0,0|1,0,1]=4 11512 B14R0.392 CC/C=C\CCCCOCCCCCC 7a_100016287862_100000210314 [1,1,0,0,0,0|1,0,1]=4 11513 B14R0.392 CC/C=C\CCNCCCCCCCC 2230a_100000229939_100015370543 [1,1,0,0,0,0|1,0,1]=4 11514 B14R0.392 CC/C=C\CCNCCCCCCCC 34a_100000229939_100015370543 [1,1,0,0,0,0|1,0,1]=4 11515 B14R0.392 CC/C=C\CCOCCCCCCCC 34a_100000210232_100015370543 [1,1,0,0,0,0|1,0,1]=4 11516 B14R0.392 CC/C=C\CCOCCCCCCCC 34a_100016288707_100000210759 [1,1,0,0,0,0|1,0,1]=4 11517 B14R0.392 CC/C=C\CCOCCCCCCCC 7a_100000210232_100015370543 [1,1,0,0,0,0|1,0,1]=4 11518 B14R0.392 CC/C=C\CCOCCCCCCCC 7a_100016288707_100000210759 [1,1,0,0,0,0|1,0,1]=4 11519 B14R0.392 CC/C=C\CCSCCCCCCCC 62a_100000210759_100015370543 [1,1,0,0,0,0|1,0,1]=4 11520 B14R0.392 CC/C=C\CCSCCCCCCCC 62a_100015370543_100000210317 [1,1,0,0,0,0|1,0,1]=4 11521 B14R0.392 CC/C=C\CNCCCCCCCCC 2230a_100000212291_100103147603 [1,1,0,0,0,0|1,0,1]=4 11522 B14R0.392 CC/C=C\CNCCCCCCCCC 34a_100000212291_100103147603 [1,1,0,0,0,0|1,0,1]=4 11523 B14R0.392 CC/C=C\COCCCCCCCCC 34a_100000210712_100103147603 [1,1,0,0,0,0|1,0,1]=4 11524 B14R0.392 CC/C=C\COCCCCCCCCC 34a_100016268518_100011214924 [1,1,0,0,0,0|1,0,1]=4 11525 B14R0.392 CC/C=C\COCCCCCCCCC 7a_100000210712_100103147603 [1,1,0,0,0,0|1,0,1]=4 11526 B14R0.392 CC/C=C\CSCCCCCCCCC 62a_100103147603_100000210670 [1,1,0,0,0,0|1,0,1]=4 11527 B14R0.392 CC=C=CCCOCCCCCCCC 34a_100011020354_100000210759 [1,1,0,0,0,0|2,0,0]=4 11528 B14R0.392 CC=CCCCOCCCCCCCC 34a_100020645299_100000210759 [1,1,0,0,0,0|1,0,0]=3 11529 B14R0.392 CC=CCCCOCCCCCCCO 34a_100020645299_100000760002 [1,1,0,0,0,0|2,0,0]=4 11530 B14R0.392 CC=CCCCOCCCCCCOC 34a_100020645299_100011998445 [1,1,0,0,0,0|2,0,0]=4 11531 B14R0.392 CC=CCNCCCCCCCCCC 2230a_100000684558_100000070051 [1,1,0,0,0,0|1,0,0]=3 11532 B14R0.392 CC=CCNCCCCCCCCCC 34a_100000684558_100000070051 [1,1,0,0,0,0|1,0,0]=3 11533 B14R0.392 CC=CCNCCCCCCCCCO 2230a_100000078944_100000070051 [1,1,0,0,0,0|2,0,0]=4 11534 B14R0.392 CC=CCNCCCCCCCCCO 34a_100000078944_100000070051 [1,1,0,0,0,0|2,0,0]=4 11535 B14R0.392 CC=CCOCCCCCCCCCBr 34a_100009813782_100000070051 [1,1,0,0,0,0|2,0,0]=4 11536 B14R0.392 CC=CCOCCCCCCCCCBr 7a_100009813782_100000070051 [1,1,0,0,0,0|2,0,0]=4 11537 B14R0.392 CC=CCOCCCCCCCCCC 34a_100000210711_100000070051 [1,1,0,0,0,0|1,0,0]=3 11538 B14R0.392 CC=CCOCCCCCCCCCC 7a_100000210711_100000070051 [1,1,0,0,0,0|1,0,0]=3 11539 B14R0.392 CC=CCOCCCCCCCCCCl 34a_100009868337_100000070051 [1,1,0,0,0,0|2,0,0]=4 11540 B14R0.392 CC=CCOCCCCCCCCCCl 7a_100009868337_100000070051 [1,1,0,0,0,0|2,0,0]=4 11541 B14R0.392 CC=CCOCCCCCCCCCN 34a_100000078944_100000070051 [1,1,0,0,0,0|2,0,0]=4 11542 B14R0.392 CC=CCSCCCCCCCCCC 62a_100000070051_100000210320 [1,1,0,0,0,0|1,0,0]=3 11543 B14R0.392 CC=CCSCCCCCCCCCO 62a_100000070051_100009813782 [1,1,0,0,0,0|2,0,0]=4 11544 B14R0.392 CC=CCSCCCCCCCCCO 62a_100009813782_100000070051 [1,1,0,0,0,0|2,0,0]=4 11545 B14R0.392 CCCCCCCCCC/C=C/COC 34a_200025761149_200000210301 [1,1,0,0,0,0|0,0,1]=3 11546 B14R0.392 CCCCCCCCCC/C=C/COC 7a_200025761149_200000210301 [1,1,0,0,0,0|0,0,1]=3 11547 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 34a_200025761149_200025704644 [1,1,0,0,0,0|0,0,1]=3 11548 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 7a_200025761149_200025704644 [1,1,0,0,0,0|0,0,1]=3 11549 B14R0.392 CCCCCCCCCCCCCNC 2230a_100011215765_200000210301 [1,1,0,0,0,0|1,0,1]=4 11550 B14R0.392 CCCCCCCCCCCCCNC 2230a_106832991635_100000210684 [1,1,0,0,0,0|1,0,1]=4 11551 B14R0.392 CCCCCCCCCCCCCNC 270004a_106832991635_200011215488 [1,1,0,0,0,0|1,0,1]=4 11552 B14R0.392 CCCCCCCCCCCCCNC 34a_100011215765_200000210301 [1,1,0,0,0,0|1,0,1]=4 11553 B14R0.392 CCCCCCCCCCCCCNC 34a_100102657272_100000210684 [1,1,0,0,0,0|1,0,1]=4 11554 B14R0.392 CCCCCCCCCCCCCNC 7a_106832991635_100000210684 [1,1,0,0,0,0|1,0,1]=4 11555 B14R0.392 CCCCCCCCCCCCCN[13CH3] 2230a_100011215765_200025704644 [1,1,0,0,0,0|1,0,1]=4 11556 B14R0.392 CCCCCCCCCCCCCN[13CH3] 34a_100011215765_200025704644 [1,1,0,0,0,0|1,0,1]=4 11557 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [1,1,0,0,0,0|0,0,1]=3 11558 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [1,1,0,0,0,0|0,0,1]=3 11559 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [1,1,0,0,0,0|0,0,1]=3 11560 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [1,1,0,0,0,0|0,0,1]=3 11561 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [1,1,0,0,0,0|0,0,1]=3 11562 B14R0.392 CCCCCCCCCCCCCSC 62a_200000210301_100011934334 [1,1,0,0,0,0|0,1,1]=4 11563 B14R0.392 CCCCCCCCCCCCCS[13CH3] 62a_200025704644_100011934334 [1,1,0,0,0,0|0,1,1]=4 11564 B14R0.392 CCCCCCCCCCCCNCC 2230a_100000210451_100000210202 [1,1,0,0,0,0|1,0,1]=4 11565 B14R0.392 CCCCCCCCCCCCNCC 2230a_100015525214_100011215052 [1,1,0,0,0,0|1,0,1]=4 11566 B14R0.392 CCCCCCCCCCCCNCC 270004a_100015525214_100011218549 [1,1,0,0,0,0|1,0,1]=4 11567 B14R0.392 CCCCCCCCCCCCNCC 34a_100000210451_100000210202 [1,1,0,0,0,0|1,0,1]=4 11568 B14R0.392 CCCCCCCCCCCCNCF 34a_100000210451_100015361967 [1,1,0,0,0,0|1,0,1]=4 11569 B14R0.392 CCCCCCCCCCCCOCC 34a_100000210810_100000210202 [1,1,0,0,0,0|0,0,1]=3 11570 B14R0.392 CCCCCCCCCCCCOCC 34a_100121572206_100000759014 [1,1,0,0,0,0|0,0,1]=3 11571 B14R0.392 CCCCCCCCCCCCOCC 7a_100000210810_100000210202 [1,1,0,0,0,0|0,0,1]=3 11572 B14R0.392 CCCCCCCCCCCCOCF 34a_100000210810_100015361967 [1,1,0,0,0,0|0,0,1]=3 11573 B14R0.392 CCCCCCCCCCCCOCF 7a_100000210810_100015361967 [1,1,0,0,0,0|0,0,1]=3 11574 B14R0.392 CCCCCCCCCCCCSCC 62a_100000210202_100000759014 [1,1,0,0,0,0|0,1,1]=4 11575 B14R0.392 CCCCCCCCCCCCSCF 62a_100015361967_100000759014 [1,1,0,0,0,0|0,1,1]=4 11576 B14R0.392 CCCCCCCCCCCNCCC 2230a_200011215754_100000210303 [1,1,0,0,0,0|1,0,1]=4 11577 B14R0.392 CCCCCCCCCCCNCCC 34a_200011215754_100000210303 [1,1,0,0,0,0|1,0,1]=4 11578 B14R0.392 CCCCCCCCCCCNCCF 2230a_200011215754_100011217306 [1,1,0,0,0,0|2,0,0]=4 11579 B14R0.392 CCCCCCCCCCCNCCF 34a_100000724931_100011215454 [1,1,0,0,0,0|2,0,0]=4 11580 B14R0.392 CCCCCCCCCCCNCCF 34a_200011215754_100011217306 [1,1,0,0,0,0|2,0,0]=4 11581 B14R0.392 CCCCCCCCCCCNCCO 2230a_100016997473_100011215454 [1,1,0,0,0,0|2,0,0]=4 11582 B14R0.392 CCCCCCCCCCCNCCO 2230a_200011215754_100000211926 [1,1,0,0,0,0|2,0,0]=4 11583 B14R0.392 CCCCCCCCCCCNCCO 34a_100016990907_100011215454 [1,1,0,0,0,0|2,0,0]=4 11584 B14R0.392 CCCCCCCCCCCNCCO 34a_200011215754_100000211926 [1,1,0,0,0,0|2,0,0]=4 11585 B14R0.392 CCCCCCCCCCCNCOC 2230a_200011215754_100000766300 [1,1,0,0,0,0|0,0,1]=3 11586 B14R0.392 CCCCCCCCCCCNCSC 2230a_200011215754_100011218213 [1,1,0,0,0,0|0,1,1]=4 11587 B14R0.392 CCCCCCCCCCCNCSC 34a_200011215754_100011218213 [1,1,0,0,0,0|0,1,1]=4 11588 B14R0.392 CCCCCCCCCCCOCCBr 34a_100000211926_100011215454 [1,1,0,0,0,0|2,0,0]=4 11589 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210258_100011215454 [1,1,0,0,0,0|1,0,1]=4 11590 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210809_100000210303 [1,1,0,0,0,0|1,0,1]=4 11591 B14R0.392 CCCCCCCCCCCOCCC 7a_100000210809_100000210303 [1,1,0,0,0,0|1,0,1]=4 11592 B14R0.392 CCCCCCCCCCCOCCF 34a_100000210809_100011217306 [1,1,0,0,0,0|2,0,0]=4 11593 B14R0.392 CCCCCCCCCCCOCCF 7a_100000210809_100011217306 [1,1,0,0,0,0|2,0,0]=4 11594 B14R0.392 CCCCCCCCCCCOCCN 34a_100000210304_100011215454 [1,1,0,0,0,0|2,0,0]=4 11595 B14R0.392 CCCCCCCCCCCOCCO 34a_100000210809_100000211926 [1,1,0,0,0,0|2,0,0]=4 11596 B14R0.392 CCCCCCCCCCCOCCO 7a_100000210809_100000211926 [1,1,0,0,0,0|2,0,0]=4 11597 B14R0.392 CCCCCCCCCCCOCSC 34a_100000210809_100011218213 [1,1,0,0,0,0|0,1,1]=4 11598 B14R0.392 CCCCCCCCCCCSCCC 62a_100000210303_100011215454 [1,1,0,0,0,0|1,0,1]=4 11599 B14R0.392 CCCCCCCCCCCSCCF 62a_100011217306_100011215454 [1,1,0,0,0,0|2,0,0]=4 11600 B14R0.392 CCCCCCCCCCCSCCO 62a_100000211926_100011215454 [1,1,0,0,0,0|2,0,0]=4 11601 B14R0.392 CCCCCCCCCCCSCOC 62a_100000766300_100011215454 [1,1,0,0,0,0|0,0,1]=3 11602 B14R0.392 CCCCCCCCCCCSCSC 62a_100011218213_100011215454 [1,1,0,0,0,0|0,1,1]=4 11603 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000102301_100000210320 [1,1,0,0,0,0|1,0,1]=4 11604 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000684558_100000210211 [1,1,0,0,0,0|1,0,1]=4 11605 B14R0.392 CCCCCCCCCCNCCCC 34a_100000684558_100000210210 [1,1,0,0,0,0|1,0,1]=4 11606 B14R0.392 CCCCCCCCCCNCCCC 7a_106832991798_100000210320 [1,1,0,0,0,0|1,0,1]=4 11607 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000209980_100000210320 [1,1,0,0,0,0|0,0,1]=3 11608 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000684558_100011201679 [1,1,0,0,0,0|0,0,1]=3 11609 B14R0.392 CCCCCCCCCCNCCOC 34a_100000684558_100011201679 [1,1,0,0,0,0|0,0,1]=3 11610 B14R0.392 CCCCCCCCCCNCCSC 2230a_100000684558_100000751147 [1,1,0,0,0,0|0,1,1]=4 11611 B14R0.392 CCCCCCCCCCNCCSC 2230a_100020590264_100000210320 [1,1,0,0,0,0|0,1,1]=4 11612 B14R0.392 CCCCCCCCCCNCCSC 34a_100000684558_100000212216 [1,1,0,0,0,0|0,1,1]=4 11613 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [1,1,0,0,0,0|1,0,1]=4 11614 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [1,1,0,0,0,0|1,0,1]=4 11615 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [1,1,0,0,0,0|1,0,1]=4 11616 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [1,1,0,0,0,0|1,0,1]=4 11617 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [1,1,0,0,0,0|0,0,1]=3 11618 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [1,1,0,0,0,0|0,0,1]=3 11619 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [1,1,0,0,0,0|0,0,1]=3 11620 B14R0.392 CCCCCCCCCCOCCON 34a_100000700252_100000210320 [1,1,0,0,0,0|1,0,1]=4 11621 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [1,1,0,0,0,0|0,1,1]=4 11622 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [1,1,0,0,0,0|0,1,1]=4 11623 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [1,1,0,0,0,0|0,1,1]=4 11624 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [1,1,0,0,0,0|0,1,1]=4 11625 B14R0.392 CCCCCCCCCCSCCCC 62a_100000210211_100000210320 [1,1,0,0,0,0|1,0,1]=4 11626 B14R0.392 CCCCCCCCCCSCCOC 34a_100011628728_200000210301 [1,1,0,0,0,0|0,0,1]=3 11627 B14R0.392 CCCCCCCCCCSCCOC 62a_100000233755_100000210320 [1,1,0,0,0,0|0,0,1]=3 11628 B14R0.392 CCCCCCCCCCSCCOC 7a_100011628728_200000210301 [1,1,0,0,0,0|0,0,1]=3 11629 B14R0.392 CCCCCCCCCCSCCO[13CH3] 34a_100011628728_200025704644 [1,1,0,0,0,0|0,0,1]=3 11630 B14R0.392 CCCCCCCCCCSCCO[13CH3] 7a_100011628728_200025704644 [1,1,0,0,0,0|0,0,1]=3 11631 B14R0.392 CCCCCCCCCCSCCSC 62a_100000212216_100000210320 [1,1,0,0,0,0|0,1,1]=4 11632 B14R0.392 CCCCCCCCCCSCOCC 62a_100000739092_100000210320 [1,1,0,0,0,0|1,0,1]=4 11633 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000209983_100011214924 [1,1,0,0,0,0|1,0,1]=4 11634 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000212291_100000210326 [1,1,0,0,0,0|1,0,1]=4 11635 B14R0.392 CCCCCCCCCNCCCCC 34a_100000212291_100000718602 [1,1,0,0,0,0|1,0,1]=4 11636 B14R0.392 CCCCCCCCCNCCCOC 2230a_100000212291_100000740836 [1,1,0,0,0,0|0,0,1]=3 11637 B14R0.392 CCCCCCCCCNCCCOC 34a_100000212291_100000740836 [1,1,0,0,0,0|0,0,1]=3 11638 B14R0.392 CCCCCCCCCNCCCOC 34a_100150723488_100011214924 [1,1,0,0,0,0|0,0,1]=3 11639 B14R0.392 CCCCCCCCCNCCCSC 2230a_100000749238_100011214924 [1,1,0,0,0,0|0,1,1]=4 11640 B14R0.392 CCCCCCCCCNCCOCC 2230a_100000212291_100011215890 [1,1,0,0,0,0|1,0,1]=4 11641 B14R0.392 CCCCCCCCCNCCOCC 2230a_102516460346_100011214924 [1,1,0,0,0,0|1,0,1]=4 11642 B14R0.392 CCCCCCCCCNCCOCC 34a_100000212291_100000210147 [1,1,0,0,0,0|1,0,1]=4 11643 B14R0.392 CCCCCCCCCNCCOCC 34a_102516460346_100011214924 [1,1,0,0,0,0|1,0,1]=4 11644 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000106463_100011214924 [1,1,0,0,0,0|2,0,0]=4 11645 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000212291_100000757381 [1,1,0,0,0,0|2,0,0]=4 11646 B14R0.392 CCCCCCCCCNCCSCC 34a_100000212291_100000757381 [1,1,0,0,0,0|2,0,0]=4 11647 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210253_100011214924 [1,1,0,0,0,0|1,0,1]=4 11648 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210712_100000718602 [1,1,0,0,0,0|1,0,1]=4 11649 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210253_100000210328 [1,1,0,0,0,0|1,0,1]=4 11650 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210712_100000210326 [1,1,0,0,0,0|1,0,1]=4 11651 B14R0.392 CCCCCCCCCOCCCNC 34a_100000213112_100011214924 [1,1,0,0,0,0|1,0,1]=4 11652 B14R0.392 CCCCCCCCCOCCCOC 34a_100000210712_100000740836 [1,1,0,0,0,0|0,0,1]=3 11653 B14R0.392 CCCCCCCCCOCCCOC 34a_100000740835_100011214924 [1,1,0,0,0,0|0,0,1]=3 11654 B14R0.392 CCCCCCCCCOCCCOC 7a_100000210712_100000740836 [1,1,0,0,0,0|0,0,1]=3 11655 B14R0.392 CCCCCCCCCOCCCSC 34a_100000690336_100011214924 [1,1,0,0,0,0|0,1,1]=4 11656 B14R0.392 CCCCCCCCCOCCCSC 7a_100000690336_100000210328 [1,1,0,0,0,0|0,1,1]=4 11657 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210136_100011214924 [1,1,0,0,0,0|1,0,1]=4 11658 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210712_100000210147 [1,1,0,0,0,0|1,0,1]=4 11659 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210136_100000210328 [1,1,0,0,0,0|1,0,1]=4 11660 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210712_100011215890 [1,1,0,0,0,0|1,0,1]=4 11661 B14R0.392 CCCCCCCCCOCCSCC 34a_100000210712_100000757381 [1,1,0,0,0,0|2,0,0]=4 11662 B14R0.392 CCCCCCCCCOCCSCC 34a_100000212035_100011214924 [1,1,0,0,0,0|2,0,0]=4 11663 B14R0.392 CCCCCCCCCOCCSCC 7a_100000210712_100000757381 [1,1,0,0,0,0|2,0,0]=4 11664 B14R0.392 CCCCCCCCCOCCSCC 7a_100000212035_100000210328 [1,1,0,0,0,0|2,0,0]=4 11665 B14R0.392 CCCCCCCCCSCCCCC 62a_100000210326_100000210670 [1,1,0,0,0,0|1,0,1]=4 11666 B14R0.392 CCCCCCCCCSCCCOC 62a_100000709357_100000210670 [1,1,0,0,0,0|0,0,1]=3 11667 B14R0.392 CCCCCCCCCSCCOCC 62a_100000210147_100000210670 [1,1,0,0,0,0|1,0,1]=4 11668 B14R0.392 CCCCCCCCCSCCSCC 62a_100000757381_100000210670 [1,1,0,0,0,0|2,0,0]=4 11669 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000210581_100000210759 [1,1,0,0,0,0|1,0,1]=4 11670 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000229939_100000210314 [1,1,0,0,0,0|1,0,1]=4 11671 B14R0.392 CCCCCCCCNCCCCCC 34a_100000229939_100000210314 [1,1,0,0,0,0|1,0,1]=4 11672 B14R0.392 CCCCCCCCNCCCCOC 2230a_100000229939_100000730899 [1,1,0,0,0,0|0,0,1]=3 11673 B14R0.392 CCCCCCCCNCCCCOC 34a_100000229939_100000755781 [1,1,0,0,0,0|0,0,1]=3 11674 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000210961_100000210759 [1,1,0,0,0,0|1,0,1]=4 11675 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000229939_100012232248 [1,1,0,0,0,0|1,0,1]=4 11676 B14R0.392 CCCCCCCCNCCCOCC 34a_100000210961_100000210759 [1,1,0,0,0,0|1,0,1]=4 11677 B14R0.392 CCCCCCCCNCCCOCC 34a_100000229939_100012232248 [1,1,0,0,0,0|1,0,1]=4 11678 B14R0.392 CCCCCCCCNCOCCOC 2230a_100000229939_100000231047 [1,1,0,0,0,0|1,0,1]=4 11679 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210232_100000210314 [1,1,0,0,0,0|1,0,1]=4 11680 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210259_100000210759 [1,1,0,0,0,0|1,0,1]=4 11681 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210232_100000210314 [1,1,0,0,0,0|1,0,1]=4 11682 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210259_100000210759 [1,1,0,0,0,0|1,0,1]=4 11683 B14R0.392 CCCCCCCCOCCCCOC 34a_100000210232_100000755781 [1,1,0,0,0,0|0,0,1]=3 11684 B14R0.392 CCCCCCCCOCCCCOC 34a_100000740925_100000210759 [1,1,0,0,0,0|0,0,1]=3 11685 B14R0.392 CCCCCCCCOCCCCOC 7a_100000210232_100000730899 [1,1,0,0,0,0|0,0,1]=3 11686 B14R0.392 CCCCCCCCOCCCCSC 34a_100011217163_100000210759 [1,1,0,0,0,0|0,1,1]=4 11687 B14R0.392 CCCCCCCCOCCCCSC 7a_100011217163_100000210759 [1,1,0,0,0,0|0,1,1]=4 11688 B14R0.392 CCCCCCCCOCCCOCC 34a_100000210232_100012232248 [1,1,0,0,0,0|1,0,1]=4 11689 B14R0.392 CCCCCCCCOCCCOCC 34a_100000757476_100000210759 [1,1,0,0,0,0|1,0,1]=4 11690 B14R0.392 CCCCCCCCOCCCOCC 7a_100000210232_100012232248 [1,1,0,0,0,0|1,0,1]=4 11691 B14R0.392 CCCCCCCCOCCCOCC 7a_100000757476_100000210759 [1,1,0,0,0,0|1,0,1]=4 11692 B14R0.392 CCCCCCCCOCCCSCC 34a_100011216438_100000210759 [1,1,0,0,0,0|2,0,0]=4 11693 B14R0.392 CCCCCCCCOCCCSCC 7a_100011216438_100000210759 [1,1,0,0,0,0|2,0,0]=4 11694 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210314_100000210317 [1,1,0,0,0,0|1,0,1]=4 11695 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210759_100000210757 [1,1,0,0,0,0|1,0,1]=4 11696 B14R0.392 CCCCCCCCSCCCCOC 62a_100000210759_100000730899 [1,1,0,0,0,0|0,0,1]=3 11697 B14R0.392 CCCCCCCCSCCCCOC 62a_100000730899_100000210317 [1,1,0,0,0,0|0,0,1]=3 11698 B14R0.392 CCCCCCCCSCCCOCC 62a_100000210759_100012232248 [1,1,0,0,0,0|1,0,1]=4 11699 B14R0.392 CCCCCCCCSCCCOCC 62a_100012232248_100000210317 [1,1,0,0,0,0|1,0,1]=4 11700 B14R0.392 CCCCCCCCSCOCCOC 62a_100000210759_100000231047 [1,1,0,0,0,0|1,0,1]=4 11701 B14R0.392 CCCCCCCCSCOCCOC 62a_100000231047_100000210317 [1,1,0,0,0,0|1,0,1]=4 11702 B14R0.392 CCCCCCCNCCCCCCC 2230a_100000229938_100000210681 [1,1,0,0,0,0|1,0,1]=4 11703 B14R0.392 CCCCCCCNCCCCCOC 2230a_100000747528_100000210681 [1,1,0,0,0,0|0,0,1]=3 11704 B14R0.392 CCCCCCCNCCCCCOC 34a_100000747528_100000210614 [1,1,0,0,0,0|0,0,1]=3 11705 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000229938_100000695917 [1,1,0,0,0,0|1,0,1]=4 11706 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000745349_100000210681 [1,1,0,0,0,0|1,0,1]=4 11707 B14R0.392 CCCCCCCNCCOCCOC 34a_100000745349_100000210614 [1,1,0,0,0,0|1,0,1]=4 11708 B14R0.392 CCCCCCCOCCCCCCC 34a_100000210272_100000210614 [1,1,0,0,0,0|1,0,1]=4 11709 B14R0.392 CCCCCCCOCCCCCCC 7a_100000210272_100000210614 [1,1,0,0,0,0|1,0,1]=4 11710 B14R0.392 CCCCCCCOCCCCCNC 34a_100000722520_100000210614 [1,1,0,0,0,0|1,0,1]=4 11711 B14R0.392 CCCCCCCOCCOCCOC 34a_100000210272_100000695917 [1,1,0,0,0,0|1,0,1]=4 11712 B14R0.392 CCCCCCCOCCOCCOC 34a_100011215163_100000210614 [1,1,0,0,0,0|1,0,1]=4 11713 B14R0.392 CCCCCCCOCCOCCOC 7a_100000210272_100000695917 [1,1,0,0,0,0|1,0,1]=4 11714 B14R0.392 CCCCCCCOCCOCCOC 7a_100011215163_100000210614 [1,1,0,0,0,0|1,0,1]=4 11715 B14R0.392 CCCCCCCSCCCCCCC 62a_100000210614_100000210316 [1,1,0,0,0,0|1,0,1]=4 11716 B14R0.392 CCCCCCCSCCOCCOC 62a_100000210614_100000695917 [1,1,0,0,0,0|1,0,1]=4 11717 B14R0.392 CCCCCCCSCCOCCOC 62a_100000695917_100000210316 [1,1,0,0,0,0|1,0,1]=4 11718 B14R0.392 CCCCCCNCCCCCCOC 2230a_100000210581_100011998445 [1,1,0,0,0,0|0,0,1]=3 11719 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000206027_100000210314 [1,1,0,0,0,0|1,0,1]=4 11720 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000210581_100011216529 [1,1,0,0,0,0|1,0,1]=4 11721 B14R0.392 CCCCCCNCCCOCCOC 34a_100000206027_100000210314 [1,1,0,0,0,0|1,0,1]=4 11722 B14R0.392 CCCCCCOCCCCCCOC 34a_100000210259_100011998445 [1,1,0,0,0,0|0,0,1]=3 11723 B14R0.392 CCCCCCOCCCCCCOC 34a_200012092642_100000210314 [1,1,0,0,0,0|0,0,1]=3 11724 B14R0.392 CCCCCCOCCCCCCOC 7a_100000210259_100011998445 [1,1,0,0,0,0|0,0,1]=3 11725 B14R0.392 CCCCCCOCCCCCCOC 7a_200012092642_100000210314 [1,1,0,0,0,0|0,0,1]=3 11726 B14R0.392 CCCCCCOCCCOCCOC 34a_100000210259_100011216529 [1,1,0,0,0,0|1,0,1]=4 11727 B14R0.392 CCCCCCOCCCOCCOC 7a_100000210259_100011216529 [1,1,0,0,0,0|1,0,1]=4 11728 B14R0.392 CCCCCCOCCOCCCOC 34a_100000691444_100000740836 [1,1,0,0,0,0|1,0,1]=4 11729 B14R0.392 CCCCCCOCCOCCCOC 7a_100000691444_100000740836 [1,1,0,0,0,0|1,0,1]=4 11730 B14R0.392 CCCCCCSCCCCCCOC 62a_100000210314_100011998445 [1,1,0,0,0,0|0,0,1]=3 11731 B14R0.392 CCCCCCSCCCCCCOC 62a_100011998445_100000210757 [1,1,0,0,0,0|0,0,1]=3 11732 B14R0.392 CCCCCCSCCCOCCOC 62a_100000210314_100011216529 [1,1,0,0,0,0|1,0,1]=4 11733 B14R0.392 CCCCCCSCCCOCCOC 62a_100011216529_100000210757 [1,1,0,0,0,0|1,0,1]=4 11734 B14R0.392 CCCCCNCCOCCCCOC 34a_100000224656_100000755781 [1,1,0,0,0,0|1,0,1]=4 11735 B14R0.392 CCCCCOCCCOCCCOC 34a_200011215475_100000718602 [1,1,0,0,0,0|1,0,1]=4 11736 B14R0.392 CCCCCOCCCOCCCOC 7a_200011215475_100000210326 [1,1,0,0,0,0|1,0,1]=4 11737 B14R0.392 CCCCCOCCOCCCCOC 34a_100011215259_100000755781 [1,1,0,0,0,0|1,0,1]=4 11738 B14R0.392 CCCCCOCCOCCCCOC 7a_100011215259_100000730899 [1,1,0,0,0,0|1,0,1]=4 11739 B14R0.392 CCCCNCCCCOCCCOC 34a_200011216965_100000740836 [1,1,0,0,0,0|1,0,1]=4 11740 B14R0.392 CCCCOCCCCOCCCOC 34a_200000760531_100000740836 [1,1,0,0,0,0|1,0,1]=4 11741 B14R0.392 CCCCOCCCCOCCCOC 7a_200000760531_100000740836 [1,1,0,0,0,0|1,0,1]=4 11742 B14R0.392 CCCCOCCCNCCCCOC 2230a_200000211371_100000730899 [1,1,0,0,0,0|1,0,1]=4 11743 B14R0.392 CCCCOCCCNCCCCOC 34a_200000211371_100000755781 [1,1,0,0,0,0|1,0,1]=4 11744 B14R0.392 CCCCOCCCOCCCCOC 34a_200011215613_100000755781 [1,1,0,0,0,0|1,0,1]=4 11745 B14R0.392 CCCCOCCCOCCCCOC 7a_200011215613_100000730899 [1,1,0,0,0,0|1,0,1]=4 11746 B14R0.392 CCCCOCCNCCCCCOC 2230a_100000747528_100000743108 [1,1,0,0,0,0|1,0,1]=4 11747 B14R0.392 CCCCOCCNCCCCCOC 34a_100000747528_100000743108 [1,1,0,0,0,0|1,0,1]=4 11748 B14R0.392 CCCCOCOCCCCCCOC 34a_200012092642_100011995733 [1,1,0,0,0,0|1,0,1]=4 11749 B14R0.392 CCCCOCSCCCCCCOC 62a_100011995733_100011998445 [1,1,0,0,0,0|1,0,1]=4 11750 B14R0.392 CCCCOCSCCCCCCOC 62a_100011998445_100011995733 [1,1,0,0,0,0|1,0,1]=4 11751 B14R0.392 CCCOCCNCCCCCCOC 2230a_100161115042_100011998445 [1,1,0,0,0,0|1,0,1]=4 11752 B14R0.392 CCCOCCNCCCCCCOC 34a_100161115042_100011998445 [1,1,0,0,0,0|1,0,1]=4 11753 B14R0.392 CCCOCCOCCCCCCOC 34a_100000752267_100011998445 [1,1,0,0,0,0|1,0,1]=4 11754 B14R0.392 CCCOCCOCCCCCCOC 34a_200012092642_100011215938 [1,1,0,0,0,0|1,0,1]=4 11755 B14R0.392 CCCOCCOCCCCCCOC 7a_100000752267_100011998445 [1,1,0,0,0,0|1,0,1]=4 11756 B14R0.392 CCCOCCOCCCCCCOC 7a_200012092642_100011215938 [1,1,0,0,0,0|1,0,1]=4 11757 B14R0.392 CCCOCCSCCCCCCOC 62a_100011215938_100011998445 [1,1,0,0,0,0|1,0,1]=4 11758 B14R0.392 CCCOCCSCCCCCCOC 62a_100011998445_100011215938 [1,1,0,0,0,0|1,0,1]=4 11759 B14R0.392 CCCSCCNCCCCCCOC 2230a_100020603323_100011998445 [1,1,0,0,0,0|1,0,1]=4 11760 B14R0.392 CCCSCCOCCCCCCOC 34a_200000230433_100011998445 [1,1,0,0,0,0|1,0,1]=4 11761 B14R0.392 CCCSCCOCCCCCCOC 7a_200000230433_100011998445 [1,1,0,0,0,0|1,0,1]=4 11762 B14R0.392 CCNCCCCCCCCCCCO 2230a_100015525214_100009812471 [1,1,0,0,0,0|2,0,0]=4 11763 B14R0.392 CCOCCCCCCCCCCCBr 34a_100009812471_100000210202 [1,1,0,0,0,0|1,0,1]=4 11764 B14R0.392 CCOCCCCCCCCCCCBr 7a_100009812471_100000210202 [1,1,0,0,0,0|1,0,1]=4 11765 B14R0.392 CCOCCCCCCCCCCCO 34a_100121572206_100009812471 [1,1,0,0,0,0|1,0,1]=4 11766 B14R0.392 CCOCCCCCCCCCOCC 34a_100009875440_100000210202 [1,1,0,0,0,0|1,0,1]=4 11767 B14R0.392 CCOCCCCCCCCCOCC 7a_100009875440_100000210202 [1,1,0,0,0,0|1,0,1]=4 11768 B14R0.392 CCOCCCCCCCCCOCF 34a_100009875440_100015361967 [1,1,0,0,0,0|1,0,1]=4 11769 B14R0.392 CCOCCCCCCCCCOCF 7a_100009875440_100015361967 [1,1,0,0,0,0|1,0,1]=4 11770 B14R0.392 CCOCCCNCCCCCCOC 2230a_100000210961_100011998445 [1,1,0,0,0,0|1,0,1]=4 11771 B14R0.392 CCOCCCNCCCCCCOC 34a_100000210961_100011998445 [1,1,0,0,0,0|1,0,1]=4 11772 B14R0.392 CCOCCCOCCCCCCOC 34a_100000757476_100011998445 [1,1,0,0,0,0|1,0,1]=4 11773 B14R0.392 CCOCCCOCCCCCCOC 34a_200012092642_100012232248 [1,1,0,0,0,0|1,0,1]=4 11774 B14R0.392 CCOCCCOCCCCCCOC 7a_100000757476_100011998445 [1,1,0,0,0,0|1,0,1]=4 11775 B14R0.392 CCOCCCOCCCCCCOC 7a_200012092642_100012232248 [1,1,0,0,0,0|1,0,1]=4 11776 B14R0.392 CCOCCCSCCCCCCOC 62a_100011998445_100012232248 [1,1,0,0,0,0|1,0,1]=4 11777 B14R0.392 CCOCCCSCCCCCCOC 62a_100012232248_100011998445 [1,1,0,0,0,0|1,0,1]=4 11778 B14R0.392 CCSCCCCCCCCCCCO 62a_100009812471_100000210202 [1,1,0,0,0,0|2,0,0]=4 11779 B14R0.392 CCSCCCOCCCCCCOC 34a_100011216438_100011998445 [1,1,0,0,0,0|1,0,1]=4 11780 B14R0.392 CCSCCCOCCCCCCOC 7a_100011216438_100011998445 [1,1,0,0,0,0|1,0,1]=4 11781 B14R0.392 CNCCCCCCCCCCCCO 2230a_100000066677_200000210301 [1,1,0,0,0,0|1,0,1]=4 11782 B14R0.392 CNCCCCCCCCCCCCO 2230a_106832991635_100009813331 [1,1,0,0,0,0|1,0,1]=4 11783 B14R0.392 CNCCCCCCCCCCCCO 34a_100000066677_200000210301 [1,1,0,0,0,0|1,0,1]=4 11784 B14R0.392 CNCCCCCCCCCCCCO 34a_100102657272_100009813331 [1,1,0,0,0,0|1,0,1]=4 11785 B14R0.392 CNCCCCCCCCCCCCO 7a_106832991635_100009813331 [1,1,0,0,0,0|1,0,1]=4 11786 B14R0.392 COCCCCCCCCCCCCBr 34a_100009813331_200000210301 [1,1,0,0,0,0|0,0,1]=3 11787 B14R0.392 COCCCCCCCCCCCCBr 7a_100009813331_200000210301 [1,1,0,0,0,0|0,0,1]=3 11788 B14R0.392 COCCCCCCCCCCCCN 34a_100000066677_200000210301 [1,1,0,0,0,0|0,0,1]=3 11789 B14R0.392 COCCCCCCCCCCCCO 34a_100138415774_100009813331 [1,1,0,0,0,0|0,0,1]=3 11790 B14R0.392 COCCCCCCNCCCCCO 2230a_100000762737_100011998445 [1,1,0,0,0,0|1,0,1]=4 11791 B14R0.392 COCCCCCCNCCCCCO 34a_100000762737_100011998445 [1,1,0,0,0,0|1,0,1]=4 11792 B14R0.392 COCCCCCCOCCCCCBr 34a_100000746331_100011998445 [1,1,0,0,0,0|1,0,1]=4 11793 B14R0.392 COCCCCCCOCCCCCBr 7a_100000746331_100011998445 [1,1,0,0,0,0|1,0,1]=4 11794 B14R0.392 COCCCCCCOCCCCCCl 34a_100000746330_100011998445 [1,1,0,0,0,0|1,0,1]=4 11795 B14R0.392 COCCCCCCOCCCCCCl 7a_100000746330_100011998445 [1,1,0,0,0,0|1,0,1]=4 11796 B14R0.392 COCCCCCCOCCCCCF 34a_200012092642_100000729378 [1,1,0,0,0,0|1,0,1]=4 11797 B14R0.392 COCCCCCCOCCCCCF 7a_200012092642_100000729378 [1,1,0,0,0,0|1,0,1]=4 11798 B14R0.392 COCCCCCCOCCCCCI 34a_200012148887_100011998445 [1,1,0,0,0,0|1,0,1]=4 11799 B14R0.392 COCCCCCCOCCCCCI 7a_200012148887_100011998445 [1,1,0,0,0,0|1,0,1]=4 11800 B14R0.392 COCCCCCCOCCCCCN 34a_100000762737_100011998445 [1,1,0,0,0,0|1,0,1]=4 11801 B14R0.392 COCCCCCCOCCCCCO 34a_100138415774_200132310570 [1,1,0,0,0,0|1,0,1]=4 11802 B14R0.392 COCCCCCCOCCCCCO 34a_200012092642_100000746330 [1,1,0,0,0,0|1,0,1]=4 11803 B14R0.392 COCCCCCCOCCCCCO 7a_200012092642_100000746330 [1,1,0,0,0,0|1,0,1]=4 11804 B14R0.392 COCCCCCCOCCCCOC 34a_100000740925_100011998445 [1,1,0,0,0,0|1,0,1]=4 11805 B14R0.392 COCCCCCCOCCCCOC 34a_200012092642_100000755781 [1,1,0,0,0,0|1,0,1]=4 11806 B14R0.392 COCCCCCCOCCCCOC 7a_200012092642_100000730899 [1,1,0,0,0,0|1,0,1]=4 11807 B14R0.392 COCCCCCCOCCCCSC 34a_100011217163_100011998445 [1,1,0,0,0,0|1,0,1]=4 11808 B14R0.392 COCCCCCCOCCCCSC 7a_100011217163_100011998445 [1,1,0,0,0,0|1,0,1]=4 11809 B14R0.392 COCCCCCCSCCCCCF 62a_100000729378_100011998445 [1,1,0,0,0,0|1,0,1]=4 11810 B14R0.392 COCCCCCCSCCCCCF 62a_100011998445_100000729378 [1,1,0,0,0,0|1,0,1]=4 11811 B14R0.392 COCCCCCCSCCCCCO 62a_100000746330_100011998445 [1,1,0,0,0,0|1,0,1]=4 11812 B14R0.392 COCCCCCCSCCCCCO 62a_100011998445_100000746330 [1,1,0,0,0,0|1,0,1]=4 11813 B14R0.392 COCCCCCCSCCCCOC 62a_100000730899_100011998445 [1,1,0,0,0,0|1,0,1]=4 11814 B14R0.392 COCCCCCCSCCCCOC 62a_100011998445_100000730899 [1,1,0,0,0,0|1,0,1]=4 11815 B14R0.392 COCCCCCNCCCCCCF 2230a_100000747528_100015922095 [1,1,0,0,0,0|1,0,1]=4 11816 B14R0.392 COCCCCCNCCCCCCF 34a_100000747528_100015922095 [1,1,0,0,0,0|1,0,1]=4 11817 B14R0.392 COCCCCCNCCCCCCO 2230a_100000747528_100000766143 [1,1,0,0,0,0|1,0,1]=4 11818 B14R0.392 COCCCCCNCCCCCCO 34a_100000747528_100000766143 [1,1,0,0,0,0|1,0,1]=4 11819 B14R0.392 COCCCCCOCCCCCCCl 34a_200132310570_200000210301 [1,1,0,0,0,0|1,0,1]=4 11820 B14R0.392 COCCCCCOCCCCCCCl 7a_200132310570_200000210301 [1,1,0,0,0,0|1,0,1]=4 11821 B14R0.392 COCCCCNCCCCCCCO 2230a_100011996573_100000730899 [1,1,0,0,0,0|1,0,1]=4 11822 B14R0.392 COCCCCNCCCCCCCO 34a_100011996573_100000755781 [1,1,0,0,0,0|1,0,1]=4 11823 B14R0.392 COCCCCOCCCCCCCBr 34a_100000760002_100000755781 [1,1,0,0,0,0|1,0,1]=4 11824 B14R0.392 COCCCCOCCCCCCCBr 7a_100000760002_100000730899 [1,1,0,0,0,0|1,0,1]=4 11825 B14R0.392 COCCCCOCCCCCCCN 34a_100011996573_100000755781 [1,1,0,0,0,0|1,0,1]=4 11826 B14R0.392 COCCCCOCCCCCCCO 34a_100000740925_100000760002 [1,1,0,0,0,0|1,0,1]=4 11827 B14R0.392 COCCCCSCCCCCCCO 62a_100000730899_100000760002 [1,1,0,0,0,0|1,0,1]=4 11828 B14R0.392 COCCCCSCCCCCCCO 62a_100000760002_100000730899 [1,1,0,0,0,0|1,0,1]=4 11829 B14R0.392 COCCCNCCCCCCCCO 2230a_102515433106_100000740836 [1,1,0,0,0,0|1,0,1]=4 11830 B14R0.392 COCCCNCCCCCCCCO 34a_100150723488_100000033203 [1,1,0,0,0,0|1,0,1]=4 11831 B14R0.392 COCCCNCCCCCCCCO 34a_102515433106_100000740836 [1,1,0,0,0,0|1,0,1]=4 11832 B14R0.392 COCCCOCCCCCCCCBr 34a_100009813846_100000740836 [1,1,0,0,0,0|1,0,1]=4 11833 B14R0.392 COCCCOCCCCCCCCBr 7a_100009813846_100000740836 [1,1,0,0,0,0|1,0,1]=4 11834 B14R0.392 COCCCOCCCCCCCCCl 34a_100000033203_100000740836 [1,1,0,0,0,0|1,0,1]=4 11835 B14R0.392 COCCCOCCCCCCCCCl 7a_100000033203_100000740836 [1,1,0,0,0,0|1,0,1]=4 11836 B14R0.392 COCCCOCCCCCCCCN 34a_102515433106_100000740836 [1,1,0,0,0,0|1,0,1]=4 11837 B14R0.392 COCCCOCCCCCCCCO 34a_100000740835_100000033203 [1,1,0,0,0,0|1,0,1]=4 11838 B14R0.392 COCCCSCCCCCCCCO 62a_100000033203_100000709357 [1,1,0,0,0,0|1,0,1]=4 11839 B14R0.392 COCCCSCCCCCCCCO 62a_100000709357_100000033203 [1,1,0,0,0,0|1,0,1]=4 11840 B14R0.392 COCCNCCCCCCCCCO 2230a_100000078944_100011201679 [1,1,0,0,0,0|1,0,1]=4 11841 B14R0.392 COCCNCCCCCCCCCO 2230a_100000209980_100009813782 [1,1,0,0,0,0|1,0,1]=4 11842 B14R0.392 COCCNCCCCCCCCCO 34a_100000078944_100011201679 [1,1,0,0,0,0|1,0,1]=4 11843 B14R0.392 COCCOCCCCCCCCCBr 34a_100009813782_100011201679 [1,1,0,0,0,0|1,0,1]=4 11844 B14R0.392 COCCOCCCCCCCCCBr 7a_100009813782_100000233755 [1,1,0,0,0,0|1,0,1]=4 11845 B14R0.392 COCCOCCCCCCCCCCl 34a_100009868337_100011201679 [1,1,0,0,0,0|1,0,1]=4 11846 B14R0.392 COCCOCCCCCCCCCCl 7a_100009868337_100000233755 [1,1,0,0,0,0|1,0,1]=4 11847 B14R0.392 COCCOCCCCCCCCCN 34a_100000078944_100011201679 [1,1,0,0,0,0|1,0,1]=4 11848 B14R0.392 COCCOCCCCCCCCCO 34a_100000210237_100009813782 [1,1,0,0,0,0|1,0,1]=4 11849 B14R0.392 COCCSCCCCCCCCCO 62a_100000233755_100009813782 [1,1,0,0,0,0|1,0,1]=4 11850 B14R0.392 COCCSCCCCCCCCCO 62a_100009813782_100000233755 [1,1,0,0,0,0|1,0,1]=4 11851 B14R0.392 COCNCCCCCCCCCCO 2230a_100000066964_100000766300 [1,1,0,0,0,0|1,0,1]=4 11852 B14R0.392 COCSCCCCCCCCCCO 62a_100000766300_200000033068 [1,1,0,0,0,0|1,0,1]=4 11853 B14R0.392 COCSCCCCCCCCCCO 62a_100009813290_100000766300 [1,1,0,0,0,0|1,0,1]=4 11854 B14R0.392 CSCCCCCCCCCCCCO 62a_100009813331_200000210301 [1,1,0,0,0,0|0,1,1]=4 11855 B14R0.392 FCOCCCCCCCCCCCBr 34a_100009812471_100015361967 [1,1,0,0,0,0|1,0,1]=4 11856 B14R0.392 FCOCCCCCCCCCCCBr 7a_100009812471_100015361967 [1,1,0,0,0,0|1,0,1]=4 11857 B14R0.392 [13CH3]NCCCCCCCCCCCCO 2230a_100000066677_200025704644 [1,1,0,0,0,0|1,0,1]=4 11858 B14R0.392 [13CH3]NCCCCCCCCCCCCO 34a_100000066677_200025704644 [1,1,0,0,0,0|1,0,1]=4 11859 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 34a_100009813331_200025704644 [1,1,0,0,0,0|0,0,1]=3 11860 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 7a_100009813331_200025704644 [1,1,0,0,0,0|0,0,1]=3 11861 B14R0.392 [13CH3]OCCCCCCCCCCCCN 34a_100000066677_200025704644 [1,1,0,0,0,0|0,0,1]=3 11862 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 34a_200132310570_200025704644 [1,1,0,0,0,0|1,0,1]=4 11863 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 7a_200132310570_200025704644 [1,1,0,0,0,0|1,0,1]=4 11864 B14R0.392 [13CH3]SCCCCCCCCCCCCO 62a_100009813331_200025704644 [1,1,0,0,0,0|0,1,1]=4 11865 B14R0.493 C/C=C/CC(=O)CCCCCCCCC 1458a_100000210558_100102629194 [1,1,0,0,0,0|1,0,1]=4 11866 B14R0.493 C/C=C/CN(C)CCCCCCCCC 269982a_100000232482_100102629194 [1,1,0,0,0,0|2,0,0]=4 11867 B14R0.493 C/C=C/COCCCCC(C)CCCC 34a_200011021034_100102629194 [1,1,0,0,0,0|2,0,0]=4 11868 B14R0.493 C/C=C/COCCCCC(C)CCCC 7a_200011021034_100102629194 [1,1,0,0,0,0|2,0,0]=4 11869 B14R0.493 CC=CCC(=O)CCCCCCCCC 1458a_100000210558_100000070051 [1,1,0,0,0,0|1,0,1]=4 11870 B14R0.493 CC=CCC(=O)CCCCCCCCC 1458a_100121576822_100000210670 [1,1,0,0,0,0|1,0,1]=4 11871 B14R0.493 CC=CCN(C)CCCCCCCCC 2230a_100000232482_100000070051 [1,1,0,0,0,0|2,0,0]=4 11872 B14R0.493 CC=CCOCCCCC(C)CCCC 34a_200011021034_100000070051 [1,1,0,0,0,0|2,0,0]=4 11873 B14R0.493 CC=CCOCCCCC(C)CCCC 7a_200011021034_100000070051 [1,1,0,0,0,0|2,0,0]=4 11874 B14R0.493 CCCCC(C)CCCCOCCOC 34a_200011021034_100011201679 [1,1,0,0,0,0|1,0,1]=4 11875 B14R0.493 CCCCC(C)CCCCOCCOC 7a_200011021034_100000233755 [1,1,0,0,0,0|1,0,1]=4 11876 B14R0.493 CCCCC(C)NCCCCCCOC 2230a_100000126638_100011998445 [1,1,0,0,0,0|1,0,1]=4 11877 B14R0.493 CCCCC(C)OCCCCCCOC 34a_100000687866_100011998445 [1,1,0,0,0,0|1,0,1]=4 11878 B14R0.493 CCCCC(C)OCCCCCCOC 34a_200012092642_200011215066 [1,1,0,0,0,0|1,0,1]=4 11879 B14R0.493 CCCCC(C)OCCCCCCOC 7a_100000687866_100011998445 [1,1,0,0,0,0|1,0,1]=4 11880 B14R0.493 CCCCC(C)OCCCCCCOC 7a_200012092642_200011215066 [1,1,0,0,0,0|1,0,1]=4 11881 B14R0.493 CCCCC(C)SCCCCCCOC 62a_100011998445_200011215066 [1,1,0,0,0,0|1,0,1]=4 11882 B14R0.493 CCCCC(C)SCCCCCCOC 62a_200011215066_100011998445 [1,1,0,0,0,0|1,0,1]=4 11883 B14R0.493 CCCCCCCCCC(=O)C=COC 1458a_100016268678_100000210670 [1,1,0,0,0,0|0,0,2]=4 11884 B14R0.493 CCCCCCCCCC(=O)CCOC 1458a_100000210558_100000233755 [1,1,0,0,0,0|0,0,2]=4 11885 B14R0.493 CCCCCCCCCC(=O)CCOC 1458a_100000749529_100000210670 [1,1,0,0,0,0|0,0,2]=4 11886 B14R0.493 CCCCCCCCCC(C)CNCC 270004a_100015525214_200011218516 [1,1,0,0,0,0|2,0,0]=4 11887 B14R0.493 CCCCCCCCCN(C)CCOC 2230a_100000232482_100011201679 [1,1,0,0,0,0|1,0,1]=4 11888 B14R0.493 CCCCCCCCCN(C)CCOC 2230a_100000743101_100011214924 [1,1,0,0,0,0|1,0,1]=4 11889 B14R0.493 CCCCCCCCCN(C)CCOC 269982a_100000232482_100000233755 [1,1,0,0,0,0|1,0,1]=4 11890 B14R0.493 CCCCCCCCCN(C)CCOC 269982a_100000743101_100000210670 [1,1,0,0,0,0|1,0,1]=4 11891 B14R0.493 CCCCCCCCNC(C)CCOC 270004a_100000229939_100000742357 [1,1,0,0,0,0|1,0,1]=4 11892 B16R0.7 C#CCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000753159 [0,2,0,0,0,0|0,0,2]=4 11893 B16R0.7 C#CCCC(=O)CCCCCCCC(=O)OC 1458a_100000692101_100010004213 [0,2,0,0,0,0|0,0,2]=4 11894 B16R0.7 C/C=C/CC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100102629194 [0,2,0,0,0,0|0,0,2]=4 11895 B16R0.7 C=CCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000754431 [0,2,0,0,0,0|0,0,2]=4 11896 B16R0.7 C=CCCC(=O)CCCCCCCC(=O)OC 1458a_100000749702_100010004213 [0,2,0,0,0,0|0,0,2]=4 11897 B16R0.7 C=CCCC(C)OCCCCCCC(=O)OC 34a_100000765329_100009815986 [0,2,0,0,0,0|0,0,2]=4 11898 B16R0.7 C=CCCC(C)OCCCCCCC(=O)OC 7a_100000765329_100009815986 [0,2,0,0,0,0|0,0,2]=4 11899 B16R0.7 C=CCCN(C)CCCCCCCC(=O)OC 2230a_100020639649_100010004213 [0,2,0,0,0,0|0,0,2]=4 11900 B16R0.7 C=CCCN(C)CCCCCCCC(=O)OC 269982a_100020639649_100010004213 [0,2,0,0,0,0|0,0,2]=4 11901 B16R0.7 CC#CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000748600 [0,2,0,0,0,0|0,0,2]=4 11902 B16R0.7 CC=CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000070051 [0,2,0,0,0,0|0,0,2]=4 11903 B16R0.7 CC=CCC(=O)CCCCCCCC(=O)OC 1458a_100121576822_100010004213 [0,2,0,0,0,0|0,0,2]=4 11904 B16R0.7 CCC#CC(=O)CCCCCCCC(=O)OC 1458a_100011827653_100010004213 [0,2,0,0,0,0|0,0,2]=4 11905 B16R0.7 CCC#CC(C)OCCCCCCC(=O)OC 34a_100000033903_100009815986 [0,2,0,0,0,0|0,0,2]=4 11906 B16R0.7 CCC#CC(C)OCCCCCCC(=O)OC 7a_100000033903_100009815986 [0,2,0,0,0,0|0,0,2]=4 11907 B16R0.7 CCC=CC(=O)CCCCCCCC(=O)OC 1458a_100000212282_100010004213 [0,2,0,0,0,0|0,0,2]=4 11908 B16R0.7 CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210211 [0,2,0,0,0,0|0,0,0]=2 11909 B16R0.7 CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000210183_100010004213 [0,2,0,0,0,0|0,0,0]=2 11910 B16R0.7 CCCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000210183 [0,2,0,0,0,0|0,0,1]=3 11911 B16R0.7 CCCCC(C)CCCCOCCC(=O)NC 34a_200011021034_100012179268 [0,2,0,0,0,0|1,0,0]=3 11912 B16R0.7 CCCCC(C)CCCCOCCC(=O)NC 7a_200011021034_100000737683 [0,2,0,0,0,0|1,0,0]=3 11913 B16R0.7 CCCCC(C)CCCCOCCC(=O)OC 34a_200011021034_100000742370 [0,2,0,0,0,0|0,0,0]=2 11914 B16R0.7 CCCCC(C)CCCCOCCC(=O)OC 7a_200011021034_100000204255 [0,2,0,0,0,0|0,0,0]=2 11915 B16R0.7 CCCCC(C)COCCCCCC(=O)OC 34a_100011995851_100009816466 [0,2,0,0,0,0|0,0,0]=2 11916 B16R0.7 CCCCC(C)COCCCCCC(=O)OC 7a_100011995851_100009816466 [0,2,0,0,0,0|0,0,0]=2 11917 B16R0.7 CCCCC(C)NCCCCCCC(=O)OC 2230a_100000126638_100009815986 [0,2,0,0,0,0|0,0,0]=2 11918 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 34a_100000687866_100009815986 [0,2,0,0,0,0|0,0,0]=2 11919 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 34a_100009863599_200011215066 [0,2,0,0,0,0|0,0,0]=2 11920 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 7a_100000687866_100009815986 [0,2,0,0,0,0|0,0,0]=2 11921 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 7a_100009863599_200011215066 [0,2,0,0,0,0|0,0,0]=2 11922 B16R0.7 CCCCC(C)SCCCCCCC(=O)OC 62a_100009815986_200011215066 [0,2,0,0,0,0|0,0,0]=2 11923 B16R0.7 CCCCC(C)SCCCCCCC(=O)OC 62a_200011215066_100009815986 [0,2,0,0,0,0|0,0,0]=2 11924 B16R0.7 CCCCN(C)CCCCCCCC(=O)OC 2230a_100000207549_100010004213 [0,2,0,0,0,0|0,0,0]=2 11925 B16R0.7 CCCCN(C)CCCCCCCC(=O)OC 269982a_100000207549_100010004213 [0,2,0,0,0,0|0,0,0]=2 11926 B16R0.7 CCCC[C@H](N)COCCCCCC(=O)OC 34a_100011934283_100009816466 [0,2,0,0,0,0|0,0,0]=2 11927 B16R0.7 CCCNC(=O)CCCCCCCC(=O)OC 11a_100020643023_100000033222 [0,2,0,0,0,0|0,0,1]=3 11928 B16R0.7 CCCNC(=O)CCCCCCCC(=O)OC 1626a_100020643023_100000033222 [0,2,0,0,0,0|0,0,1]=3 11929 B16R0.7 CCCNC(=O)CCCCCCCC(=O)OC 240690a_100020643023_100000033222 [0,2,0,0,0,0|0,0,1]=3 11930 B16R0.7 CCCNC(=O)CCCSCCCC(=O)OC 62a_100011194427_100011218270 [0,2,0,0,0,0|1,0,1]=4 11931 B16R0.7 CCCNC(=O)CCCSCCCC(=O)OC 62a_100011218270_100011194427 [0,2,0,0,0,0|1,0,1]=4 11932 B16R0.7 CCCNC(=O)CNCCCCCC(=O)OC 2230a_100000174927_100009816466 [0,2,0,0,0,0|1,0,1]=4 11933 B16R0.7 CCCNC(=O)COCCCCCC(=O)OC 34a_100000074720_100000183358 [0,2,0,0,0,0|1,0,1]=4 11934 B16R0.7 CCCNC(=O)COCCCCCC(=O)OC 7a_100000074720_100000183358 [0,2,0,0,0,0|1,0,1]=4 11935 B16R0.7 CCCNC(=O)CSCCCCCC(=O)OC 62a_100000183358_100009816466 [0,2,0,0,0,0|1,0,1]=4 11936 B16R0.7 CCCNC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000183358 [0,2,0,0,0,0|1,0,1]=4 11937 B16R0.7 CCCOC(=O)COCCCCCC(=O)OC 34a_100000074720_200011215008 [0,2,0,0,0,0|1,0,1]=4 11938 B16R0.7 CCCOC(=O)COCCCCCC(=O)OC 7a_100000074720_200011215008 [0,2,0,0,0,0|1,0,1]=4 11939 B16R0.7 CCCOC(=O)CSCCCCCC(=O)OC 62a_100009816466_200011215008 [0,2,0,0,0,0|1,0,1]=4 11940 B16R0.7 CCCOC(=O)CSCCCCCC(=O)OC 62a_200011215008_100009816466 [0,2,0,0,0,0|1,0,1]=4 11941 B16R0.7 CCCOC(C)CNCCCCCC(=O)OC 2230a_100015185124_100009816466 [0,2,0,0,0,0|1,0,0]=3 11942 B16R0.7 CCCOC(C)CNCCCCCC(=O)OC 34a_100015185124_100009816466 [0,2,0,0,0,0|1,0,0]=3 11943 B16R0.7 CCOCC(=O)CCCCCCCC(=O)OC 1458a_100000211967_100010004213 [0,2,0,0,0,0|0,0,1]=3 11944 B16R0.7 CCOCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000211967 [0,2,0,0,0,0|1,0,1]=4 11945 B16R0.7 CCOCC(C)OCCCCCCC(=O)OC 34a_100000718985_100009815986 [0,2,0,0,0,0|1,0,0]=3 11946 B16R0.7 CCOCC(C)OCCCCCCC(=O)OC 7a_100000718985_100009815986 [0,2,0,0,0,0|1,0,0]=3 11947 B16R0.7 CCOCC(O)CNCCCCCC(=O)OC 2230a_102515437182_100009816466 [0,2,0,0,0,0|1,0,0]=3 11948 B16R0.7 CCOCC(O)CNCCCCCC(=O)OC 34a_102515437182_100009816466 [0,2,0,0,0,0|1,0,0]=3 11949 B16R0.7 CCSCC(=O)CCCCCCCC(=O)OC 1458a_100000230394_100010004213 [0,2,0,0,0,0|0,0,1]=3 11950 B16R0.7 CCSCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000230394 [0,2,0,0,0,0|1,0,1]=4 11951 B16R0.7 COC(=O)CCCCCCCC(=O)CCC#N 1458a_100000033222_100011215226 [0,2,0,0,0,0|0,0,2]=4 11952 B16R0.7 COC(=O)CCCCCCCC(=O)CCC#N 1458a_100011934036_100010004213 [0,2,0,0,0,0|0,0,2]=4 11953 B16R0.7 COC(=O)CCCCCCCC(=O)CCCF 1458a_100000033222_100011934791 [0,2,0,0,0,0|0,0,1]=3 11954 B16R0.7 COC(=O)CCCCCCCC(=O)CCCO 1458a_100000033222_100011215043 [0,2,0,0,0,0|0,0,1]=3 11955 B16R0.7 COC(=O)CCCCCCCC(=O)CCSC 1458a_100000033222_100000751147 [0,2,0,0,0,0|0,0,1]=3 11956 B16R0.7 COC(=O)CCCCCCCC(=O)CCSC 1458a_100000174002_100010004213 [0,2,0,0,0,0|0,0,1]=3 11957 B16R0.7 COC(=O)CCCCCCCC(=O)NCCF 11a_100000724931_100000033222 [0,2,0,0,0,0|1,0,1]=4 11958 B16R0.7 COC(=O)CCCCCCCC(=O)NCCF 1626a_100000724931_100000033222 [0,2,0,0,0,0|1,0,1]=4 11959 B16R0.7 COC(=O)CCCCCCCC(=O)NCCF 240690a_100000724931_100000033222 [0,2,0,0,0,0|1,0,1]=4 11960 B16R0.7 COC(=O)CCCCCCCC(=O)NCCO 240690a_100000210304_100000033222 [0,2,0,0,0,0|1,0,1]=4 11961 B16R0.7 COC(=O)CCCCCCCN(C)CCC#N 2230a_100000184479_100010004213 [0,2,0,0,0,0|1,0,1]=4 11962 B16R0.7 COC(=O)CCCCCCCN(C)CCCO 2230a_100000213112_100010004213 [0,2,0,0,0,0|1,0,0]=3 11963 B16R0.7 COC(=O)CCCCCCCN(C)CCCO 269982a_100000213112_100010004213 [0,2,0,0,0,0|1,0,0]=3 11964 B16R0.7 COC(=O)CCCCCCCN(C)CCSC 2230a_100000686725_100010004213 [0,2,0,0,0,0|1,0,0]=3 11965 B16R0.7 COC(=O)CCCCCCCN(C)CCSC 269982a_100000686725_100010004213 [0,2,0,0,0,0|1,0,0]=3 11966 B16R0.7 COC(=O)CCCCCCNC(=O)CCSC 188690a_100000739044_100000174002 [0,2,0,0,0,0|1,0,1]=4 11967 B16R0.7 COC(=O)CCCCCCOC(C)CCCCl 34a_200000718107_100009815986 [0,2,0,0,0,0|1,0,0]=3 11968 B16R0.7 COC(=O)CCCCCCOC(C)CCCCl 7a_200000718107_100009815986 [0,2,0,0,0,0|1,0,0]=3 11969 B16R0.7 COC(=O)CCCCCNC[C@H](C)CCCO 2230a_100160569302_100009816466 [0,2,0,0,0,0|1,0,0]=3 11970 B16R0.7 COC(=O)CCCCCNC[C@H](C)CCCO 34a_100160569302_100009816466 [0,2,0,0,0,0|1,0,0]=3 11971 B16R0.7 COC(=O)CCCCCOC[C@@H](N)CCSC 34a_100011827619_100009816466 [0,2,0,0,0,0|1,0,0]=3 11972 B16R0.7 COCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000233755 [0,2,0,0,0,0|0,0,1]=3 11973 B16R0.7 COCCC(=O)CCCCCCCC(=O)OC 1458a_100000749529_100010004213 [0,2,0,0,0,0|0,0,1]=3 11974 B16R0.7 COCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000749529 [0,2,0,0,0,0|1,0,1]=4 11975 B16R0.7 COCCN(C)CCCCCCCC(=O)OC 2230a_100000743101_100010004213 [0,2,0,0,0,0|1,0,0]=3 11976 B16R0.7 COCCN(C)CCCCCCCC(=O)OC 269982a_100000743101_100010004213 [0,2,0,0,0,0|1,0,0]=3 11977 B16R0.7 COCO[C@H](C)COCCCCCC(=O)OC 34a_100016172286_100009816466 [0,2,0,0,0,0|2,0,0]=4 11978 B16R0.7 COCO[C@H](C)COCCCCCC(=O)OC 7a_100016172286_100009816466 [0,2,0,0,0,0|2,0,0]=4 11979 B16R0.61 C#CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000184674 [0,2,0,0,0,0|1,0,1]=4 11980 B16R0.61 C#CCC(=O)CCCCCCCCCCCC 1458a_100011220946_100000759014 [0,2,0,0,0,0|1,0,1]=4 11981 B16R0.61 C#CCC(=O)CCCCCCCCCCCO 1458a_100011220946_100009812471 [0,2,0,0,0,0|1,0,1]=4 11982 B16R0.61 C#CCC(=O)NCCCCCCCCCCC 1626a_200011215754_100011220946 [0,2,0,0,0,0|1,0,1]=4 11983 B16R0.61 C#CCC(=O)NCCCCCCCCCCC 527a_200011215754_100011220946 [0,2,0,0,0,0|1,0,1]=4 11984 B16R0.61 C#CCCCCCCCCOCC(=O)OCC 34a_100000065265_100000188475 [0,2,0,0,0,0|0,0,2]=4 11985 B16R0.61 C#CCCCCCCCCOCC(=O)OCC 7a_100000065265_100000188475 [0,2,0,0,0,0|0,0,2]=4 11986 B16R0.61 C#CCCCCCCCOCCC(=O)OCC 34a_100000054614_100000765890 [0,2,0,0,0,0|0,0,2]=4 11987 B16R0.61 C#CCCCCCCCOCCC(=O)OCC 7a_100000054614_100011206558 [0,2,0,0,0,0|0,0,2]=4 11988 B16R0.61 C#CCCCCCCCSCCC(=O)OCC 62a_100000765890_100153394163 [0,2,0,0,0,0|0,0,2]=4 11989 B16R0.61 C#CCCCCCCCSCCC(=O)OCC 62a_100153394163_100000765890 [0,2,0,0,0,0|0,0,2]=4 11990 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 34a_100011217361_100009991533 [0,2,0,0,0,0|0,0,2]=4 11991 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 7a_100011217361_100011215271 [0,2,0,0,0,0|0,0,2]=4 11992 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 7a_100012001163_100012276617 [0,2,0,0,0,0|0,0,2]=4 11993 B16R0.61 C#CCCCCCCSCCCC(=O)OCC 62a_100009991533_100012276617 [0,2,0,0,0,0|0,0,2]=4 11994 B16R0.61 C#CCCCCCCSCCCC(=O)OCC 62a_100012276617_100009991533 [0,2,0,0,0,0|0,0,2]=4 11995 B16R0.61 C#CCCCCCOCCCCC(=O)OCC 34a_100000766912_100000750268 [0,2,0,0,0,0|0,0,2]=4 11996 B16R0.61 C#CCCCCCOCCCCC(=O)OCC 7a_100000766912_100000750268 [0,2,0,0,0,0|0,0,2]=4 11997 B16R0.61 C#CCCCCCSCCCCC(=O)OCC 62a_100000750268_100012094781 [0,2,0,0,0,0|0,0,2]=4 11998 B16R0.61 C#CCCCCCSCCCCC(=O)OCC 62a_100012094781_100000750268 [0,2,0,0,0,0|0,0,2]=4 11999 B16R0.61 C#CCCCCNCCCCCC(=O)OCC 2230a_100000706060_100000755133 [0,2,0,0,0,0|0,0,2]=4 12000 B16R0.61 C#CCCCCNCCCCCC(=O)OCC 34a_100000706060_100000755133 [0,2,0,0,0,0|0,0,2]=4 12001 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 34a_100000766709_100000755133 [0,2,0,0,0,0|0,0,2]=4 12002 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 7a_100000766709_100000755133 [0,2,0,0,0,0|0,0,2]=4 12003 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 7a_100011214988_100010269958 [0,2,0,0,0,0|0,0,2]=4 12004 B16R0.61 C#CCCCCSCCCCCC(=O)OCC 62a_100000755133_100010269958 [0,2,0,0,0,0|0,0,2]=4 12005 B16R0.61 C#CCCCCSCCCCCC(=O)OCC 62a_100010269958_100000755133 [0,2,0,0,0,0|0,0,2]=4 12006 B16R0.61 C#CCCCNCCCCCCC(=O)OCC 34a_100000718082_100009814379 [0,2,0,0,0,0|0,0,2]=4 12007 B16R0.61 C#CCCCOCCCCCCC(=O)OCC 34a_100000215630_100009814379 [0,2,0,0,0,0|0,0,2]=4 12008 B16R0.61 C#CCCCOCCCCCCC(=O)OCC 7a_100000215630_100009814379 [0,2,0,0,0,0|0,0,2]=4 12009 B16R0.61 C#CCCCSCCCCCCC(=O)OCC 62a_100011215417_100009814379 [0,2,0,0,0,0|0,0,2]=4 12010 B16R0.61 C#CCCNCCCCCCCC(=O)OCC 34a_100000755551_100009991516 [0,2,0,0,0,0|0,0,2]=4 12011 B16R0.61 C#CCCOCCCCCCCC(=O)OCC 34a_100011215631_100009991516 [0,2,0,0,0,0|0,0,2]=4 12012 B16R0.61 C#CCCSCCCCCCCC(=O)OCC 62a_100000688953_100009991516 [0,2,0,0,0,0|0,0,2]=4 12013 B16R0.61 C#CCNCCCCCCCCC(=O)OCC 34a_100000212058_100010175975 [0,2,0,0,0,0|0,0,2]=4 12014 B16R0.61 C#CCOCCCCCCCCC(=O)OCC 34a_100000210247_100010175975 [0,2,0,0,0,0|0,0,2]=4 12015 B16R0.61 C#CCSCCCCCCCCC(=O)OCC 62a_100000038162_100010175975 [0,2,0,0,0,0|0,0,2]=4 12016 B16R0.61 C/C=C/CCOCCCCCCC(=O)OCC 34a_100016278192_100009814379 [0,2,0,0,0,0|0,0,2]=4 12017 B16R0.61 C/C=C/COCCCCCCCC(=O)OCC 34a_100016270725_100009991516 [0,2,0,0,0,0|0,0,2]=4 12018 B16R0.61 C/C=C/CSCCCCCCCC(=O)OCC 62a_100102629194_100009991516 [0,2,0,0,0,0|0,0,2]=4 12019 B16R0.61 C=CCC(=O)CCCCCCCCCCCC 1458a_100000210193_100000759014 [0,2,0,0,0,0|1,0,1]=4 12020 B16R0.61 C=CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000210623 [0,2,0,0,0,0|1,0,1]=4 12021 B16R0.61 C=CCC(=O)CCCCCCCCCCCO 1458a_100000210193_100009812471 [0,2,0,0,0,0|1,0,1]=4 12022 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 11a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 12023 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 1626a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 12024 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 240690a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 12025 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 527a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 12026 B16R0.61 C=CCCCCCCCCCCC(=O)C#CC 1458a_100000763181_100011093070 [0,2,0,0,0,0|1,0,1]=4 12027 B16R0.61 C=CCCCCCCCCCCC(=O)C=CC 1458a_100000210699_100011093070 [0,2,0,0,0,0|1,0,1]=4 12028 B16R0.61 C=CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011093070 [0,2,0,0,0,0|1,0,1]=4 12029 B16R0.61 C=CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011093070 [0,2,0,0,0,0|1,0,1]=4 12030 B16R0.61 C=CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011093070 [0,2,0,0,0,0|0,0,1]=3 12031 B16R0.61 C=CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011093070 [0,2,0,0,0,0|0,1,1]=4 12032 B16R0.61 C=CCCCCCCCCCNC(=O)COC 11a_100000081888_100000210968 [0,2,0,0,0,0|0,0,2]=4 12033 B16R0.61 C=CCCCCCCCCCNC(=O)COC 1626a_100000081888_100000210968 [0,2,0,0,0,0|0,0,2]=4 12034 B16R0.61 C=CCCCCCCCCCNC(=O)COC 240690a_100000081888_100000210968 [0,2,0,0,0,0|0,0,2]=4 12035 B16R0.61 C=CCCCCCCCCCNC(=O)COC 527a_100000081888_100000210968 [0,2,0,0,0,0|0,0,2]=4 12036 B16R0.61 C=CCCCCCCCCOCC(=O)OCC 34a_100011215194_100000188475 [0,2,0,0,0,0|0,0,2]=4 12037 B16R0.61 C=CCCCCCCCCOCC(=O)OCC 7a_100011215194_100000188475 [0,2,0,0,0,0|0,0,2]=4 12038 B16R0.61 C=CCCCCCCCCSCC(=O)OCC 62a_100000188475_100011933949 [0,2,0,0,0,0|0,0,2]=4 12039 B16R0.61 C=CCCCCCCCCSCC(=O)OCC 62a_100011933949_100000188475 [0,2,0,0,0,0|0,0,2]=4 12040 B16R0.61 C=CCCCCCCCOCCC(=O)OCC 34a_100000730831_100000765890 [0,2,0,0,0,0|0,0,2]=4 12041 B16R0.61 C=CCCCCCCCOCCC(=O)OCC 7a_100000730831_100011206558 [0,2,0,0,0,0|0,0,2]=4 12042 B16R0.61 C=CCCCCCCCSCCC(=O)OCC 62a_100000765890_100012355270 [0,2,0,0,0,0|0,0,2]=4 12043 B16R0.61 C=CCCCCCCCSCCC(=O)OCC 62a_100012355270_100000765890 [0,2,0,0,0,0|0,0,2]=4 12044 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 34a_200011216477_100009991533 [0,2,0,0,0,0|0,0,2]=4 12045 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 7a_100012001163_100011215473 [0,2,0,0,0,0|0,0,2]=4 12046 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 7a_200011216477_100011215271 [0,2,0,0,0,0|0,0,2]=4 12047 B16R0.61 C=CCCCCCCSCCCC(=O)OCC 62a_100009991533_100011215473 [0,2,0,0,0,0|0,0,2]=4 12048 B16R0.61 C=CCCCCCCSCCCC(=O)OCC 62a_100011215473_100009991533 [0,2,0,0,0,0|0,0,2]=4 12049 B16R0.61 C=CCCCCCOCCCCC(=O)OCC 34a_100011216702_100000750268 [0,2,0,0,0,0|0,0,2]=4 12050 B16R0.61 C=CCCCCCOCCCCC(=O)OCC 7a_100011216702_100000750268 [0,2,0,0,0,0|0,0,2]=4 12051 B16R0.61 C=CCCCCCSCCCCC(=O)OCC 62a_100000700193_100000750268 [0,2,0,0,0,0|0,0,2]=4 12052 B16R0.61 C=CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000700193 [0,2,0,0,0,0|0,0,2]=4 12053 B16R0.61 C=CCCCCNCCCCCC(=O)OCC 2230a_100000703577_100000755133 [0,2,0,0,0,0|0,0,2]=4 12054 B16R0.61 C=CCCCCNCCCCCC(=O)OCC 34a_100000703577_100000755133 [0,2,0,0,0,0|0,0,2]=4 12055 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 34a_100000766645_100000755133 [0,2,0,0,0,0|0,0,2]=4 12056 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 7a_100000766645_100000755133 [0,2,0,0,0,0|0,0,2]=4 12057 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 7a_100011214988_100011215482 [0,2,0,0,0,0|0,0,2]=4 12058 B16R0.61 C=CCCCCSCCCCCC(=O)OCC 62a_100000755133_100011215482 [0,2,0,0,0,0|0,0,2]=4 12059 B16R0.61 C=CCCCCSCCCCCC(=O)OCC 62a_100011215482_100000755133 [0,2,0,0,0,0|0,0,2]=4 12060 B16R0.61 C=CCCCNCCCCCCC(=O)OCC 2230a_100000700776_100009814379 [0,2,0,0,0,0|0,0,2]=4 12061 B16R0.61 C=CCCCNCCCCCCC(=O)OCC 34a_100000700776_100009814379 [0,2,0,0,0,0|0,0,2]=4 12062 B16R0.61 C=CCCCOCCCCCCC(=O)OCC 34a_100000758997_100009814379 [0,2,0,0,0,0|0,0,2]=4 12063 B16R0.61 C=CCCCOCCCCCCC(=O)OCC 7a_100000758997_100009814379 [0,2,0,0,0,0|0,0,2]=4 12064 B16R0.61 C=CCCCSCCCCCCC(=O)OCC 62a_100011713584_100009814379 [0,2,0,0,0,0|0,0,2]=4 12065 B16R0.61 C=CCCNCCCCCCCC(=O)OCC 2230a_100015191253_100009991516 [0,2,0,0,0,0|0,0,2]=4 12066 B16R0.61 C=CCCOCCCCCCCC(=O)OCC 34a_100011205117_100009991516 [0,2,0,0,0,0|0,0,2]=4 12067 B16R0.61 C=CCCSCCCCCCCC(=O)OCC 62a_100000754431_100009991516 [0,2,0,0,0,0|0,0,2]=4 12068 B16R0.61 C=CCNCCCCCCCCC(=O)OCC 2230a_100020586998_100010175975 [0,2,0,0,0,0|0,0,2]=4 12069 B16R0.61 C=CCOCCCCCCCCC(=O)OCC 34a_200000210373_100010175975 [0,2,0,0,0,0|0,0,2]=4 12070 B16R0.61 C=CCSCCCCCCCCC(=O)OCC 62a_100000210623_100010175975 [0,2,0,0,0,0|0,0,2]=4 12071 B16R0.61 C=COC(=O)CNCCCCCCCCCC 2230a_100000684558_100000036128 [0,2,0,0,0,0|0,0,1]=3 12072 B16R0.61 C=COC(=O)CNCCCCCCCCCC 34a_100000684558_100000036128 [0,2,0,0,0,0|0,0,1]=3 12073 B16R0.61 C=COC(=O)CNCCCCCCCCCO 2230a_100000078944_100000036128 [0,2,0,0,0,0|1,0,1]=4 12074 B16R0.61 C=COC(=O)CNCCCCCCCCCO 34a_100000078944_100000036128 [0,2,0,0,0,0|1,0,1]=4 12075 B16R0.61 C=COC(=O)COCCCCCCCCCBr 34a_100009813782_100000036128 [0,2,0,0,0,0|1,0,1]=4 12076 B16R0.61 C=COC(=O)COCCCCCCCCCC 34a_100000210711_100000036128 [0,2,0,0,0,0|0,0,1]=3 12077 B16R0.61 C=COC(=O)COCCCCCCCCCCl 34a_100009868337_100000036128 [0,2,0,0,0,0|1,0,1]=4 12078 B16R0.61 C=COC(=O)COCCCCCCCCCN 34a_100000078944_100000036128 [0,2,0,0,0,0|1,0,1]=4 12079 B16R0.61 C=COC(=O)CSCCCCCCCCCC 62a_100000036128_100000210320 [0,2,0,0,0,0|0,0,1]=3 12080 B16R0.61 C=COC(=O)CSCCCCCCCCCO 62a_100000036128_100009813782 [0,2,0,0,0,0|1,0,1]=4 12081 B16R0.61 C=COC(=O)CSCCCCCCCCCO 62a_100009813782_100000036128 [0,2,0,0,0,0|1,0,1]=4 12082 B16R0.61 CC#CC(=O)CCCCCCC#CCCCC 1458a_100000763181_200000043322 [0,2,0,0,0,0|1,0,1]=4 12083 B16R0.61 CC#CC(=O)CCCCCCCCCCCC 1458a_100000763181_100000759014 [0,2,0,0,0,0|1,0,0]=3 12084 B16R0.61 CC#CC(=O)CCCCCCCCCCCO 1458a_100000763181_100009812471 [0,2,0,0,0,0|1,0,0]=3 12085 B16R0.61 CC#CCCOCCCCCCC(=O)OCC 34a_100000750427_100009814379 [0,2,0,0,0,0|0,0,2]=4 12086 B16R0.61 CC#CCNCCCCCCCC(=O)OCC 2230a_100000685387_100009991516 [0,2,0,0,0,0|0,0,2]=4 12087 B16R0.61 CC#CCNCCCCCCCC(=O)OCC 34a_100000685387_100009991516 [0,2,0,0,0,0|0,0,2]=4 12088 B16R0.61 CC#CCOCCCCCCCC(=O)OCC 34a_100000761923_100009991516 [0,2,0,0,0,0|0,0,2]=4 12089 B16R0.61 CC#CCSCCCCCCCC(=O)OCC 62a_100000748600_100009991516 [0,2,0,0,0,0|0,0,2]=4 12090 B16R0.61 CC/C=C/CCCOCCCCC(=O)OCC 34a_100016287902_100000750268 [0,2,0,0,0,0|0,0,2]=4 12091 B16R0.61 CC/C=C/CCCOCCCCC(=O)OCC 7a_100016287902_100000750268 [0,2,0,0,0,0|0,0,2]=4 12092 B16R0.61 CC/C=C\CCCCCOCCC(=O)OCC 34a_100016268722_100000765890 [0,2,0,0,0,0|0,0,2]=4 12093 B16R0.61 CC/C=C\CCCCCOCCC(=O)OCC 7a_100016268722_100011206558 [0,2,0,0,0,0|0,0,2]=4 12094 B16R0.61 CC/C=C\CCCCOCCCC(=O)OCC 34a_100016287862_100009991533 [0,2,0,0,0,0|0,0,2]=4 12095 B16R0.61 CC/C=C\CCCCOCCCC(=O)OCC 7a_100016287862_100011215271 [0,2,0,0,0,0|0,0,2]=4 12096 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 34a_100016288707_100000755133 [0,2,0,0,0,0|0,0,2]=4 12097 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 7a_100011214988_100015370543 [0,2,0,0,0,0|0,0,2]=4 12098 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 7a_100016288707_100000755133 [0,2,0,0,0,0|0,0,2]=4 12099 B16R0.61 CC/C=C\CCSCCCCCC(=O)OCC 62a_100000755133_100015370543 [0,2,0,0,0,0|0,0,2]=4 12100 B16R0.61 CC/C=C\CCSCCCCCC(=O)OCC 62a_100015370543_100000755133 [0,2,0,0,0,0|0,0,2]=4 12101 B16R0.61 CC/C=C\COCCCCCCC(=O)OCC 34a_100016268518_100009814379 [0,2,0,0,0,0|0,0,2]=4 12102 B16R0.61 CC/C=C\CSCCCCCCC(=O)OCC 62a_100103147603_100009814379 [0,2,0,0,0,0|0,0,2]=4 12103 B16R0.61 CC=CC(=O)CCCCCCC#CCCCC 1458a_100000210699_200000043322 [0,2,0,0,0,0|1,0,1]=4 12104 B16R0.61 CC=CC(=O)CCCCCCCCCCCC 1458a_100000210699_100000759014 [0,2,0,0,0,0|1,0,0]=3 12105 B16R0.61 CC=CC(=O)CCCCCCCCCCCO 1458a_100000210699_100009812471 [0,2,0,0,0,0|1,0,0]=3 12106 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 11a_200011215754_100000210699 [0,2,0,0,0,0|1,0,0]=3 12107 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000210699 [0,2,0,0,0,0|1,0,0]=3 12108 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 240690a_200011215754_100000210699 [0,2,0,0,0,0|1,0,0]=3 12109 B16R0.61 CC=CC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210699 [0,2,0,0,0,0|2,0,0]=4 12110 B16R0.61 CC=CCCCOCCCCCC(=O)OCC 34a_100020645299_100000755133 [0,2,0,0,0,0|0,0,2]=4 12111 B16R0.61 CC=CCSCCCCCCCC(=O)OCC 62a_100000070051_100009991516 [0,2,0,0,0,0|0,0,2]=4 12112 B16R0.61 CCC#CCCCCCCSCC(=O)OCC 62a_100000188475_200000036426 [0,2,0,0,0,0|0,0,2]=4 12113 B16R0.61 CCC#CCCCCCCSCC(=O)OCC 62a_200000036426_100000188475 [0,2,0,0,0,0|0,0,2]=4 12114 B16R0.61 CCC#CCCOCCCCCC(=O)OCC 34a_100000036655_100000755133 [0,2,0,0,0,0|0,0,2]=4 12115 B16R0.61 CCC#CCCOCCCCCC(=O)OCC 7a_100000036655_100000755133 [0,2,0,0,0,0|0,0,2]=4 12116 B16R0.61 CCC#CCOCCCCCCC(=O)OCC 34a_100000032950_100009814379 [0,2,0,0,0,0|0,0,2]=4 12117 B16R0.61 CCC#CCSCCCCCCC(=O)OCC 62a_100009813939_100009814379 [0,2,0,0,0,0|0,0,2]=4 12118 B16R0.61 CCC/C=C/COCCCCCC(=O)OCC 34a_100016278788_100000755133 [0,2,0,0,0,0|0,0,2]=4 12119 B16R0.61 CCC/C=C/COCCCCCC(=O)OCC 7a_100016278788_100000755133 [0,2,0,0,0,0|0,0,2]=4 12120 B16R0.61 CCCC#CCCOCCCCC(=O)OCC 34a_100000042726_100000750268 [0,2,0,0,0,0|0,0,2]=4 12121 B16R0.61 CCCC#CCCOCCCCC(=O)OCC 7a_100000042726_100000750268 [0,2,0,0,0,0|0,0,2]=4 12122 B16R0.61 CCCC#CCOCCCCCC(=O)OCC 34a_100000034806_100000755133 [0,2,0,0,0,0|0,0,2]=4 12123 B16R0.61 CCCC#CCOCCCCCC(=O)OCC 7a_100000034806_100000755133 [0,2,0,0,0,0|0,0,2]=4 12124 B16R0.61 CCCC(=O)CCCCCCCCCCCO 1458a_100000211992_100009812471 [0,2,0,0,0,0|1,0,0]=3 12125 B16R0.61 CCCC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747444 [0,2,0,0,0,0|2,0,0]=4 12126 B16R0.61 CCCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747444 [0,2,0,0,0,0|2,0,0]=4 12127 B16R0.61 CCCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747444 [0,2,0,0,0,0|2,0,0]=4 12128 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100000747444_100009813782 [0,2,0,0,0,0|2,0,0]=4 12129 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747444 [0,2,0,0,0,0|2,0,0]=4 12130 B16R0.61 CCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000211992 [0,2,0,0,0,0|2,0,0]=4 12131 B16R0.61 CCCC/C=C/CCCCOCC(=O)OCC 34a_200020645093_100000188475 [0,2,0,0,0,0|0,0,2]=4 12132 B16R0.61 CCCC/C=C/CCCCOCC(=O)OCC 7a_200020645093_100000188475 [0,2,0,0,0,0|0,0,2]=4 12133 B16R0.61 CCCC/C=C/COCCCCC(=O)OCC 34a_200016272032_100000750268 [0,2,0,0,0,0|0,0,2]=4 12134 B16R0.61 CCCC/C=C/COCCCCC(=O)OCC 7a_200016272032_100000750268 [0,2,0,0,0,0|0,0,2]=4 12135 B16R0.61 CCCC/C=C\CCOCCCC(=O)OCC 34a_200016286491_100009991533 [0,2,0,0,0,0|0,0,2]=4 12136 B16R0.61 CCCC/C=C\CCOCCCC(=O)OCC 7a_200016286491_100011215271 [0,2,0,0,0,0|0,0,2]=4 12137 B16R0.61 CCCCC#CCCCCCCC(=O)CCC 1458a_100000211992_200000043322 [0,2,0,0,0,0|1,0,1]=4 12138 B16R0.61 CCCCC#CCCCCCCC(=O)CCO 1458a_100011216618_200000043322 [0,2,0,0,0,0|1,0,1]=4 12139 B16R0.61 CCCCC#CCCCCCCC(=O)COC 1458a_100000210968_200000043322 [0,2,0,0,0,0|0,0,1]=3 12140 B16R0.61 CCCCC#CCCCCCCC(=O)CSC 1458a_100000184570_200000043322 [0,2,0,0,0,0|0,1,1]=4 12141 B16R0.61 CCCCC#CCCCCOCC(=O)OCC 34a_200000066234_100000188475 [0,2,0,0,0,0|0,0,2]=4 12142 B16R0.61 CCCCC#CCCCCOCC(=O)OCC 7a_200000066234_100000188475 [0,2,0,0,0,0|0,0,2]=4 12143 B16R0.61 CCCCC#CCCCSCCC(=O)OCC 62a_100000765890_200000047210 [0,2,0,0,0,0|0,0,2]=4 12144 B16R0.61 CCCCC#CCCCSCCC(=O)OCC 62a_200000047210_100000765890 [0,2,0,0,0,0|0,0,2]=4 12145 B16R0.61 CCCCC#CCCOCCCC(=O)OCC 34a_100000037610_100009991533 [0,2,0,0,0,0|0,0,2]=4 12146 B16R0.61 CCCCC#CCCOCCCC(=O)OCC 7a_100000037610_100011215271 [0,2,0,0,0,0|0,0,2]=4 12147 B16R0.61 CCCCC#CCOCCCCC(=O)OCC 34a_200000034558_100000750268 [0,2,0,0,0,0|0,0,2]=4 12148 B16R0.61 CCCCC#CCOCCCCC(=O)OCC 7a_200000034558_100000750268 [0,2,0,0,0,0|0,0,2]=4 12149 B16R0.61 CCCCC/C=C/COCCCC(=O)OCC 34a_100016258190_100009991533 [0,2,0,0,0,0|0,0,2]=4 12150 B16R0.61 CCCCC/C=C/COCCCC(=O)OCC 7a_100016258190_100011215271 [0,2,0,0,0,0|0,0,2]=4 12151 B16R0.61 CCCCC/C=C\CCCOCC(=O)OCC 34a_100020655193_100000188475 [0,2,0,0,0,0|0,0,2]=4 12152 B16R0.61 CCCCC/C=C\CCCOCC(=O)OCC 7a_100020655193_100000188475 [0,2,0,0,0,0|0,0,2]=4 12153 B16R0.61 CCCCC/C=C\CCOCCC(=O)OCC 34a_100016277358_100000765890 [0,2,0,0,0,0|0,0,2]=4 12154 B16R0.61 CCCCC/C=C\CCOCCC(=O)OCC 7a_100016277358_100011206558 [0,2,0,0,0,0|0,0,2]=4 12155 B16R0.61 CCCCCC#CCCOCCC(=O)OCC 34a_200000042877_100000765890 [0,2,0,0,0,0|0,0,2]=4 12156 B16R0.61 CCCCCC#CCCOCCC(=O)OCC 7a_200000042877_100011206558 [0,2,0,0,0,0|0,0,2]=4 12157 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 34a_200000033628_100009991533 [0,2,0,0,0,0|0,0,2]=4 12158 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 7a_100012001163_100009816472 [0,2,0,0,0,0|0,0,2]=4 12159 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 7a_200000033628_100011215271 [0,2,0,0,0,0|0,0,2]=4 12160 B16R0.61 CCCCCC#CCSCCCC(=O)OCC 62a_100009816472_100009991533 [0,2,0,0,0,0|0,0,2]=4 12161 B16R0.61 CCCCCC#CCSCCCC(=O)OCC 62a_100009991533_100009816472 [0,2,0,0,0,0|0,0,2]=4 12162 B16R0.61 CCCCCC/C=C/COCCC(=O)OCC 34a_200016276170_100000765890 [0,2,0,0,0,0|0,0,2]=4 12163 B16R0.61 CCCCCC/C=C/COCCC(=O)OCC 7a_200016276170_100011206558 [0,2,0,0,0,0|0,0,2]=4 12164 B16R0.61 CCCCCCC#CCCOCC(=O)OCC 34a_200000033163_100000188475 [0,2,0,0,0,0|0,0,2]=4 12165 B16R0.61 CCCCCCC#CCCOCC(=O)OCC 7a_200000033163_100000188475 [0,2,0,0,0,0|0,0,2]=4 12166 B16R0.61 CCCCCCC#CCOCCC(=O)OCC 34a_200000037284_100000765890 [0,2,0,0,0,0|0,0,2]=4 12167 B16R0.61 CCCCCCC#CCOCCC(=O)OCC 7a_200000037284_100011206558 [0,2,0,0,0,0|0,0,2]=4 12168 B16R0.61 CCCCCCCC#CCOCC(=O)OCC 34a_200000061759_100000188475 [0,2,0,0,0,0|0,0,2]=4 12169 B16R0.61 CCCCCCCC#CCOCC(=O)OCC 7a_200000061759_100000188475 [0,2,0,0,0,0|0,0,2]=4 12170 B16R0.61 CCCCCCCCCC=NNC(=O)COC 4a_100000216845_100000210895 [0,2,0,0,0,0|1,0,1]=4 12171 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 11a_100015525214_100015291182 [0,2,0,0,0,0|1,0,1]=4 12172 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 240690a_100015525214_100015291182 [0,2,0,0,0,0|1,0,1]=4 12173 B16R0.61 CCCCCCCCCCC=CC(=O)NNC 22a_100016993582_100015291182 [0,2,0,0,0,0|1,0,1]=4 12174 B16R0.61 CCCCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000759014 [0,2,0,0,0,0|1,0,1]=4 12175 B16R0.61 CCCCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000759014 [0,2,0,0,0,0|1,0,1]=4 12176 B16R0.61 CCCCCCCCCCCCC(=O)C=CI 1458a_100016256311_100000759014 [0,2,0,0,0,0|1,0,1]=4 12177 B16R0.61 CCCCCCCCCCCCC(=O)CC#N 1458a_100011215791_100011214920 [0,2,0,0,0,0|1,0,1]=4 12178 B16R0.61 CCCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000759014 [0,2,0,0,0,0|1,0,1]=4 12179 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100000211992_100000759014 [0,2,0,0,0,0|1,0,0]=3 12180 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100011215791_100000210303 [0,2,0,0,0,0|1,0,0]=3 12181 B16R0.61 CCCCCCCCCCCCC(=O)CCF 1458a_100011215791_100011217306 [0,2,0,0,0,0|1,0,0]=3 12182 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011215791_100000211926 [0,2,0,0,0,0|1,0,0]=3 12183 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000759014 [0,2,0,0,0,0|1,0,0]=3 12184 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [0,2,0,0,0,0|0,0,0]=2 12185 B16R0.61 CCCCCCCCCCCCC(=O)CSC 1458a_100000184570_100000759014 [0,2,0,0,0,0|0,1,0]=3 12186 B16R0.61 CCCCCCCCCCCCC(=O)NCC 11a_100015525214_100011215791 [0,2,0,0,0,0|1,0,0]=3 12187 B16R0.61 CCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100011215791 [0,2,0,0,0,0|1,0,0]=3 12188 B16R0.61 CCCCCCCCCCCCC(=O)NNC 22a_100016993582_100011215791 [0,2,0,0,0,0|1,0,0]=3 12189 B16R0.61 CCCCCCCCCCCCC(C)COC 34a_100000724949_200000210301 [0,2,0,0,0,0|1,0,1]=4 12190 B16R0.61 CCCCCCCCCCCCC(C)COC 7a_100000724949_200000210301 [0,2,0,0,0,0|1,0,1]=4 12191 B16R0.61 CCCCCCCCCCCCC(C)CO[13CH3] 34a_100000724949_200025704644 [0,2,0,0,0,0|1,0,1]=4 12192 B16R0.61 CCCCCCCCCCCCC(C)CO[13CH3] 7a_100000724949_200025704644 [0,2,0,0,0,0|1,0,1]=4 12193 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_100121572206_200011217028 [0,2,0,0,0,0|1,0,1]=4 12194 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_200011215752_100000210202 [0,2,0,0,0,0|1,0,1]=4 12195 B16R0.61 CCCCCCCCCCCCC(C)OCC 7a_200011215752_100000210202 [0,2,0,0,0,0|1,0,1]=4 12196 B16R0.61 CCCCCCCCCCCCC(C)OCF 34a_200011215752_100015361967 [0,2,0,0,0,0|1,0,1]=4 12197 B16R0.61 CCCCCCCCCCCCC(C)OCF 7a_200011215752_100015361967 [0,2,0,0,0,0|1,0,1]=4 12198 B16R0.61 CCCCCCCCCCCCN(C)COC 2230a_100000227908_100000766300 [0,2,0,0,0,0|2,0,0]=4 12199 B16R0.61 CCCCCCCCCCCCN(C)COC 269982a_100000227908_100000766300 [0,2,0,0,0,0|2,0,0]=4 12200 B16R0.61 CCCCCCCCCCCNC(=O)C=CBr 1626a_200011215754_100016273825 [0,2,0,0,0,0|1,0,1]=4 12201 B16R0.61 CCCCCCCCCCCNC(=O)C=CBr 240690a_200011215754_100016273825 [0,2,0,0,0,0|1,0,1]=4 12202 B16R0.61 CCCCCCCCCCCNC(=O)C=CCl 11a_200011215754_200016279998 [0,2,0,0,0,0|1,0,1]=4 12203 B16R0.61 CCCCCCCCCCCNC(=O)C=CCl 1626a_200011215754_200016279998 [0,2,0,0,0,0|1,0,1]=4 12204 B16R0.61 CCCCCCCCCCCNC(=O)C=CCl 240690a_200011215754_200016279998 [0,2,0,0,0,0|1,0,1]=4 12205 B16R0.61 CCCCCCCCCCCNC(=O)C=CI 1626a_200011215754_100016256311 [0,2,0,0,0,0|1,0,1]=4 12206 B16R0.61 CCCCCCCCCCCNC(=O)CC#N 1626a_200011215754_100051588842 [0,2,0,0,0,0|1,0,1]=4 12207 B16R0.61 CCCCCCCCCCCNC(=O)CC#N 240690a_200011215754_100051588842 [0,2,0,0,0,0|1,0,1]=4 12208 B16R0.61 CCCCCCCCCCCNC(=O)CCC 11a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 12209 B16R0.61 CCCCCCCCCCCNC(=O)CCC 1626a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 12210 B16R0.61 CCCCCCCCCCCNC(=O)CCC 240690a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 12211 B16R0.61 CCCCCCCCCCCNC(=O)CCC 527a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 12212 B16R0.61 CCCCCCCCCCCNC(=O)CCO 240690a_200011215754_100011216618 [0,2,0,0,0,0|1,0,0]=3 12213 B16R0.61 CCCCCCCCCCCNC(=O)COC 11a_200011215754_100000210968 [0,2,0,0,0,0|0,0,0]=2 12214 B16R0.61 CCCCCCCCCCCNC(=O)COC 1626a_200011215754_100000210968 [0,2,0,0,0,0|0,0,0]=2 12215 B16R0.61 CCCCCCCCCCCNC(=O)COC 240690a_200011215754_100000210968 [0,2,0,0,0,0|0,0,0]=2 12216 B16R0.61 CCCCCCCCCCCNC(=O)COC 527a_200011215754_100000210968 [0,2,0,0,0,0|0,0,0]=2 12217 B16R0.61 CCCCCCCCCCCNC(=O)CSC 11a_200011215754_100000184570 [0,2,0,0,0,0|0,1,0]=3 12218 B16R0.61 CCCCCCCCCCCNC(=O)CSC 1626a_200011215754_100000184570 [0,2,0,0,0,0|0,1,0]=3 12219 B16R0.61 CCCCCCCCCCCNC(=O)CSC 240690a_200011215754_100000184570 [0,2,0,0,0,0|0,1,0]=3 12220 B16R0.61 CCCCCCCCCCCNC(=O)CSC 527a_200011215754_100000184570 [0,2,0,0,0,0|0,1,0]=3 12221 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_100015525214_200011215754 [0,2,0,0,0,0|1,0,0]=3 12222 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_200011215754_100015525214 [0,2,0,0,0,0|1,0,0]=3 12223 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_100015525214_200011215754 [0,2,0,0,0,0|1,0,0]=3 12224 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_200011215754_100015525214 [0,2,0,0,0,0|1,0,0]=3 12225 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_100015525214_200011215754 [0,2,0,0,0,0|1,0,0]=3 12226 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_200011215754_100015525214 [0,2,0,0,0,0|1,0,0]=3 12227 B16R0.61 CCCCCCCCCCCNC(=O)NNC 273464a_200011215754_100016993582 [0,2,0,0,0,0|1,0,0]=3 12228 B16R0.61 CCCCCCCCCCCNC(=O)NNC 512a_100016993582_200011215754 [0,2,0,0,0,0|1,0,0]=3 12229 B16R0.61 CCCCCCCCCCCNC(=O)NNC 512a_200011215754_100016993582 [0,2,0,0,0,0|1,0,0]=3 12230 B16R0.61 CCCCCCCCCCCNC(C)COC 2230a_200011215754_100000765312 [0,2,0,0,0,0|1,0,1]=4 12231 B16R0.61 CCCCCCCCCCCNC(C)COC 270004a_200011215754_100000749346 [0,2,0,0,0,0|1,0,1]=4 12232 B16R0.61 CCCCCCCCCCCNC(C)COC 34a_200011215754_100000765312 [0,2,0,0,0,0|1,0,1]=4 12233 B16R0.61 CCCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100011215454 [0,2,0,0,0,0|1,0,1]=4 12234 B16R0.61 CCCCCCCCCCCOC(C)COC 34a_100000210809_100000765312 [0,2,0,0,0,0|1,0,1]=4 12235 B16R0.61 CCCCCCCCCCCOC(C)COC 7a_100000210809_100000765312 [0,2,0,0,0,0|1,0,1]=4 12236 B16R0.61 CCCCCCCCCCCO[C@H](C)COC 34a_100011934205_100011215454 [0,2,0,0,0,0|1,0,1]=4 12237 B16R0.61 CCCCCCCCCCCSC(C)COC 62a_100000765312_100011215454 [0,2,0,0,0,0|1,0,1]=4 12238 B16R0.61 CCCCCCCCCCNCC(=O)CCC 2230a_100000684558_100000747444 [0,2,0,0,0,0|1,0,0]=3 12239 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100000684558_100000183381 [0,2,0,0,0,0|1,0,0]=3 12240 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210320 [0,2,0,0,0,0|1,0,0]=3 12241 B16R0.61 CCCCCCCCCCNCC(=O)NCC 34a_100000684558_100000183381 [0,2,0,0,0,0|1,0,0]=3 12242 B16R0.61 CCCCCCCCCCNCC(=O)NCO 2230a_100000684558_100000185155 [0,2,0,0,0,0|1,0,0]=3 12243 B16R0.61 CCCCCCCCCCNCC(=O)NCO 34a_100000684558_100000185155 [0,2,0,0,0,0|1,0,0]=3 12244 B16R0.61 CCCCCCCCCCNCC(=O)OCC 2230a_100000684558_100000188475 [0,2,0,0,0,0|0,0,0]=2 12245 B16R0.61 CCCCCCCCCCNCC(=O)OCC 34a_100000684558_100000188475 [0,2,0,0,0,0|0,0,0]=2 12246 B16R0.61 CCCCCCCCCCNCC(O)COC 2230a_100000756049_100000210320 [0,2,0,0,0,0|0,0,2]=4 12247 B16R0.61 CCCCCCCCCCNCC(O)COC 34a_100000684558_100011215053 [0,2,0,0,0,0|0,0,2]=4 12248 B16R0.61 CCCCCCCCCCNCC(O)COC 34a_100000756049_100000210320 [0,2,0,0,0,0|0,0,2]=4 12249 B16R0.61 CCCCCCCCCCOCC(=O)CCC 7a_100000210711_100000747444 [0,2,0,0,0,0|1,0,0]=3 12250 B16R0.61 CCCCCCCCCCOCC(=O)NCC 34a_100000210711_100000183381 [0,2,0,0,0,0|1,0,0]=3 12251 B16R0.61 CCCCCCCCCCOCC(=O)NCC 7a_100000210711_100000183381 [0,2,0,0,0,0|1,0,0]=3 12252 B16R0.61 CCCCCCCCCCOCC(=O)NCO 34a_100000210711_100000185155 [0,2,0,0,0,0|1,0,0]=3 12253 B16R0.61 CCCCCCCCCCOCC(=O)NCO 7a_100000210711_100000185155 [0,2,0,0,0,0|1,0,0]=3 12254 B16R0.61 CCCCCCCCCCOCC(=O)OCC 34a_100000210711_100000188475 [0,2,0,0,0,0|0,0,0]=2 12255 B16R0.61 CCCCCCCCCCOCC(=O)OCC 7a_100000210711_100000188475 [0,2,0,0,0,0|0,0,0]=2 12256 B16R0.61 CCCCCCCCCCOCC(N)COC 34a_100000724102_100000210320 [0,2,0,0,0,0|1,0,1]=4 12257 B16R0.61 CCCCCCCCCCOCC(O)COC 34a_100000210711_100011215053 [0,2,0,0,0,0|0,0,2]=4 12258 B16R0.61 CCCCCCCCCCOCC(O)COC 7a_100000210711_100011215053 [0,2,0,0,0,0|0,0,2]=4 12259 B16R0.61 CCCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210320 [0,2,0,0,0,0|1,0,0]=3 12260 B16R0.61 CCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210320 [0,2,0,0,0,0|1,0,0]=3 12261 B16R0.61 CCCCCCCCCCSCC(=O)NCO 62a_100000185155_100000210320 [0,2,0,0,0,0|1,0,0]=3 12262 B16R0.61 CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210320 [0,2,0,0,0,0|0,0,0]=2 12263 B16R0.61 CCCCCCCCCCSCC(O)COC 62a_100011215053_100000210320 [0,2,0,0,0,0|0,0,2]=4 12264 B16R0.61 CCCCCCCCCNCCC(=O)NCC 2230a_100000212291_100000737597 [0,2,0,0,0,0|1,0,0]=3 12265 B16R0.61 CCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011214924 [0,2,0,0,0,0|1,0,0]=3 12266 B16R0.61 CCCCCCCCCNCCC(=O)OCC 2230a_100000212291_100011206558 [0,2,0,0,0,0|0,0,0]=2 12267 B16R0.61 CCCCCCCCCNCCC(=O)OCC 34a_100000212291_100000765890 [0,2,0,0,0,0|0,0,0]=2 12268 B16R0.61 CCCCCCCCCNCOC(=O)CCC 2230a_100000212291_100000034017 [0,2,0,0,0,0|2,0,0]=4 12269 B16R0.61 CCCCCCCCCNCOC(=O)CCC 34a_100000212291_100000034017 [0,2,0,0,0,0|2,0,0]=4 12270 B16R0.61 CCCCCCCCCOCCC(=O)NCC 7a_100000210712_100000737597 [0,2,0,0,0,0|1,0,0]=3 12271 B16R0.61 CCCCCCCCCOCCC(=O)OCC 34a_100000210712_100000765890 [0,2,0,0,0,0|0,0,0]=2 12272 B16R0.61 CCCCCCCCCOCCC(=O)OCC 7a_100000210712_100011206558 [0,2,0,0,0,0|0,0,0]=2 12273 B16R0.61 CCCCCCCCCOCOC(=O)CCC 34a_100000210712_100000034017 [0,2,0,0,0,0|2,0,0]=4 12274 B16R0.61 CCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210670 [0,2,0,0,0,0|1,0,0]=3 12275 B16R0.61 CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210670 [0,2,0,0,0,0|0,0,0]=2 12276 B16R0.61 CCCCCCCCNC/C=C/C(=O)OCC 2230a_100000229939_100016267167 [0,2,0,0,0,0|0,0,2]=4 12277 B16R0.61 CCCCCCCCNC/C=C/C(=O)OCC 34a_100000229939_100016267167 [0,2,0,0,0,0|0,0,2]=4 12278 B16R0.61 CCCCCCCCNCCCC(=O)OCC 2230a_100000229939_100009991533 [0,2,0,0,0,0|0,0,0]=2 12279 B16R0.61 CCCCCCCCNCCCC(=O)OCC 34a_100000229939_100009991533 [0,2,0,0,0,0|0,0,0]=2 12280 B16R0.61 CCCCCCCCOC/C=C/C(=O)OCC 34a_100000210232_100016267167 [0,2,0,0,0,0|0,0,2]=4 12281 B16R0.61 CCCCCCCCOC/C=C/C(=O)OCC 7a_100000210232_100016267167 [0,2,0,0,0,0|0,0,2]=4 12282 B16R0.61 CCCCCCCCOCCCC(=O)OCC 34a_100000210232_100009991533 [0,2,0,0,0,0|0,0,0]=2 12283 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100000210232_100011215271 [0,2,0,0,0,0|0,0,0]=2 12284 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210759 [0,2,0,0,0,0|0,0,0]=2 12285 B16R0.61 CCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210759 [0,2,0,0,0,0|1,0,0]=3 12286 B16R0.61 CCCCCCCCOCCNC(=O)OCC 7a_100000210232_200011445536 [0,2,0,0,0,0|1,0,0]=3 12287 B16R0.61 CCCCCCCCSC/C=C/C(=O)OCC 62a_100000210759_100016267167 [0,2,0,0,0,0|0,0,2]=4 12288 B16R0.61 CCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210317 [0,2,0,0,0,0|0,0,2]=4 12289 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100000210759_100009991533 [0,2,0,0,0,0|0,0,0]=2 12290 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210317 [0,2,0,0,0,0|0,0,0]=2 12291 B16R0.61 CCCCCCCCSCCNC(=O)OCC 62a_100000210759_200011445536 [0,2,0,0,0,0|1,0,0]=3 12292 B16R0.61 CCCCCCCNCCCCC(=O)OCC 2230a_100000229938_100000750268 [0,2,0,0,0,0|0,0,0]=2 12293 B16R0.61 CCCCCCCNCCOCC(=O)OCC 2230a_100000229938_100000088970 [0,2,0,0,0,0|1,0,0]=3 12294 B16R0.61 CCCCCCCOCCCCC(=O)OCC 34a_100000210272_100000750268 [0,2,0,0,0,0|0,0,0]=2 12295 B16R0.61 CCCCCCCOCCCCC(=O)OCC 7a_100000210272_100000750268 [0,2,0,0,0,0|0,0,0]=2 12296 B16R0.61 CCCCCCCOCCOCC(=O)OCC 34a_100000210272_100000088970 [0,2,0,0,0,0|1,0,0]=3 12297 B16R0.61 CCCCCCCOCCOCC(=O)OCC 7a_100000210272_100000088970 [0,2,0,0,0,0|1,0,0]=3 12298 B16R0.61 CCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210614 [0,2,0,0,0,0|1,0,0]=3 12299 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000210614_100000750268 [0,2,0,0,0,0|0,0,0]=2 12300 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210316 [0,2,0,0,0,0|0,0,0]=2 12301 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210316 [0,2,0,0,0,0|1,0,0]=3 12302 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000210614_100000088970 [0,2,0,0,0,0|1,0,0]=3 12303 B16R0.61 CCCCCCNCCCCCC(=O)OCC 2230a_100000210581_100000755133 [0,2,0,0,0,0|0,0,0]=2 12304 B16R0.61 CCCCCCNCCCOCC(=O)OCC 2230a_100000210581_100009893628 [0,2,0,0,0,0|1,0,0]=3 12305 B16R0.61 CCCCCCOCCCCCC(=O)OCC 34a_100000210259_100000755133 [0,2,0,0,0,0|0,0,0]=2 12306 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100000210259_100000755133 [0,2,0,0,0,0|0,0,0]=2 12307 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210314 [0,2,0,0,0,0|0,0,0]=2 12308 B16R0.61 CCCCCCOCCCOCC(=O)OCC 34a_100000210259_100009893628 [0,2,0,0,0,0|1,0,0]=3 12309 B16R0.61 CCCCCCOCCCOCC(=O)OCC 7a_100000210259_100009893628 [0,2,0,0,0,0|1,0,0]=3 12310 B16R0.61 CCCCCCOCCOCCC(=O)NCC 7a_100000691444_100000737597 [0,2,0,0,0,0|2,0,0]=4 12311 B16R0.61 CCCCCCOCCOCCC(=O)OCC 34a_100000691444_100000765890 [0,2,0,0,0,0|1,0,0]=3 12312 B16R0.61 CCCCCCOCCOCCC(=O)OCC 7a_100000691444_100011206558 [0,2,0,0,0,0|1,0,0]=3 12313 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000210314_100000755133 [0,2,0,0,0,0|0,0,0]=2 12314 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210757 [0,2,0,0,0,0|0,0,0]=2 12315 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100000210314_100009893628 [0,2,0,0,0,0|1,0,0]=3 12316 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210757 [0,2,0,0,0,0|1,0,0]=3 12317 B16R0.61 CCCCCNCCCCCCC(=O)OCC 2230a_100000209983_100009814379 [0,2,0,0,0,0|0,0,0]=2 12318 B16R0.61 CCCCCNCCOCCCC(=O)OCC 34a_100000224656_100009991533 [0,2,0,0,0,0|1,0,0]=3 12319 B16R0.61 CCCCCNN=CCCCCC(=O)OCC 4a_100000694160_100012182868 [0,2,0,0,0,0|1,0,1]=4 12320 B16R0.61 CCCCCOCCCCCCC(=O)OCC 34a_100000210253_100009814379 [0,2,0,0,0,0|0,0,0]=2 12321 B16R0.61 CCCCCOCCCCCCC(=O)OCC 7a_100000210253_100009814379 [0,2,0,0,0,0|0,0,0]=2 12322 B16R0.61 CCCCCOCCOCCCC(=O)OCC 34a_100011215259_100009991533 [0,2,0,0,0,0|1,0,0]=3 12323 B16R0.61 CCCCCOCCOCCCC(=O)OCC 7a_100011215259_100011215271 [0,2,0,0,0,0|1,0,0]=3 12324 B16R0.61 CCCCCOCCOCCNC(=O)OCC 7a_100011215259_200011445536 [0,2,0,0,0,0|2,0,0]=4 12325 B16R0.61 CCCCCSCCCCCCC(=O)OCC 62a_100000210326_100009814379 [0,2,0,0,0,0|0,0,0]=2 12326 B16R0.61 CCCCNCCCCCCCC(=O)OCC 2230a_100000102301_100009991516 [0,2,0,0,0,0|0,0,0]=2 12327 B16R0.61 CCCCNCCCCCCCC(=O)OCC 7a_106832991798_100009991516 [0,2,0,0,0,0|0,0,0]=2 12328 B16R0.61 CCCCNCCCCOCCC(=O)OCC 34a_200011216965_100000765890 [0,2,0,0,0,0|1,0,0]=3 12329 B16R0.61 CCCCNN=CCCCCCC(=O)OCC 4a_100025702795_100000085164 [0,2,0,0,0,0|1,0,1]=4 12330 B16R0.61 CCCCOCCCCCCCC(=O)OCC 34a_100000210227_100009991516 [0,2,0,0,0,0|0,0,0]=2 12331 B16R0.61 CCCCOCCCCCCCC(=O)OCC 7a_100000210227_100009991516 [0,2,0,0,0,0|0,0,0]=2 12332 B16R0.61 CCCCOCCCCOCCC(=O)NCC 7a_200000760531_100000737597 [0,2,0,0,0,0|2,0,0]=4 12333 B16R0.61 CCCCOCCCCOCCC(=O)OCC 34a_200000760531_100000765890 [0,2,0,0,0,0|1,0,0]=3 12334 B16R0.61 CCCCOCCCCOCCC(=O)OCC 7a_200000760531_100011206558 [0,2,0,0,0,0|1,0,0]=3 12335 B16R0.61 CCCCOCCCNCCCC(=O)OCC 2230a_200000211371_100009991533 [0,2,0,0,0,0|1,0,0]=3 12336 B16R0.61 CCCCOCCCNCCCC(=O)OCC 34a_200000211371_100009991533 [0,2,0,0,0,0|1,0,0]=3 12337 B16R0.61 CCCCOCCCOCCCC(=O)OCC 34a_200011215613_100009991533 [0,2,0,0,0,0|1,0,0]=3 12338 B16R0.61 CCCCOCCCOCCCC(=O)OCC 7a_200011215613_100011215271 [0,2,0,0,0,0|1,0,0]=3 12339 B16R0.61 CCCCOCCCOCCNC(=O)OCC 7a_200011215613_200011445536 [0,2,0,0,0,0|2,0,0]=4 12340 B16R0.61 CCCCOCCOCCCCC(=O)OCC 34a_100000210238_100000750268 [0,2,0,0,0,0|1,0,0]=3 12341 B16R0.61 CCCCOCCOCCCCC(=O)OCC 7a_100000210238_100000750268 [0,2,0,0,0,0|1,0,0]=3 12342 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100000210238_100000088970 [0,2,0,0,0,0|2,0,0]=4 12343 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100011215186_100000188475 [0,2,0,0,0,0|2,0,0]=4 12344 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100000210238_100000088970 [0,2,0,0,0,0|2,0,0]=4 12345 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100011215186_100000188475 [0,2,0,0,0,0|2,0,0]=4 12346 B16R0.61 CCCCOCCOCCSCC(=O)OCC 7a_200000230590_100000743108 [0,2,0,0,0,0|2,0,0]=4 12347 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000743108_100000750268 [0,2,0,0,0,0|1,0,0]=3 12348 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000750268_100000743108 [0,2,0,0,0,0|1,0,0]=3 12349 B16R0.61 CCCCOCCSCCOCC(=O)OCC 62a_100000088970_100000743108 [0,2,0,0,0,0|2,0,0]=4 12350 B16R0.61 CCCCOCCSCCOCC(=O)OCC 62a_100000743108_100000088970 [0,2,0,0,0,0|2,0,0]=4 12351 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100000755133_100011995733 [0,2,0,0,0,0|1,0,0]=3 12352 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100011995733_100000755133 [0,2,0,0,0,0|1,0,0]=3 12353 B16R0.61 CCCCOCSCCCOCC(=O)OCC 62a_100009893628_100011995733 [0,2,0,0,0,0|2,0,0]=4 12354 B16R0.61 CCCCOCSCCCOCC(=O)OCC 62a_100011995733_100009893628 [0,2,0,0,0,0|2,0,0]=4 12355 B16R0.61 CCCCSCCCCCCCC(=O)OCC 62a_100000210211_100009991516 [0,2,0,0,0,0|0,0,0]=2 12356 B16R0.61 CCCCSCCNCCCCC(=O)OCC 2230a_100025743550_100000750268 [0,2,0,0,0,0|1,0,0]=3 12357 B16R0.61 CCCCSCCNCCOCC(=O)OCC 2230a_100025743550_100000088970 [0,2,0,0,0,0|2,0,0]=4 12358 B16R0.61 CCCCSCCOCCCCC(=O)OCC 34a_200000230436_100000750268 [0,2,0,0,0,0|1,0,0]=3 12359 B16R0.61 CCCCSCCOCCCCC(=O)OCC 7a_200000230436_100000750268 [0,2,0,0,0,0|1,0,0]=3 12360 B16R0.61 CCCCSCCOCCOCC(=O)OCC 34a_200000230436_100000088970 [0,2,0,0,0,0|2,0,0]=4 12361 B16R0.61 CCCCSCCOCCOCC(=O)OCC 7a_200000230436_100000088970 [0,2,0,0,0,0|2,0,0]=4 12362 B16R0.61 CCCOCCCCCCCCC(=O)OCC 34a_100000210258_100010175975 [0,2,0,0,0,0|0,0,0]=2 12363 B16R0.61 CCCOCCCNCCCCC(=O)OCC 2230a_100011217757_100000750268 [0,2,0,0,0,0|1,0,0]=3 12364 B16R0.61 CCCOCCCNCCCCC(=O)OCC 34a_100011217757_100000750268 [0,2,0,0,0,0|1,0,0]=3 12365 B16R0.61 CCCOCCCNCCOCC(=O)OCC 2230a_100011217757_100000088970 [0,2,0,0,0,0|2,0,0]=4 12366 B16R0.61 CCCOCCCNCCOCC(=O)OCC 34a_100011217757_100000088970 [0,2,0,0,0,0|2,0,0]=4 12367 B16R0.61 CCCOCCNCCCCCC(=O)OCC 2230a_100161115042_100000755133 [0,2,0,0,0,0|1,0,0]=3 12368 B16R0.61 CCCOCCNCCCCCC(=O)OCC 34a_100161115042_100000755133 [0,2,0,0,0,0|1,0,0]=3 12369 B16R0.61 CCCOCCNCCCOCC(=O)OCC 2230a_100161115042_100009893628 [0,2,0,0,0,0|2,0,0]=4 12370 B16R0.61 CCCOCCNCCCOCC(=O)OCC 34a_100161115042_100009893628 [0,2,0,0,0,0|2,0,0]=4 12371 B16R0.61 CCCOCCOCCCCCC(=O)OCC 34a_100000752267_100000755133 [0,2,0,0,0,0|1,0,0]=3 12372 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100000752267_100000755133 [0,2,0,0,0,0|1,0,0]=3 12373 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215938 [0,2,0,0,0,0|1,0,0]=3 12374 B16R0.61 CCCOCCOCCCOCC(=O)OCC 34a_100000752267_100009893628 [0,2,0,0,0,0|2,0,0]=4 12375 B16R0.61 CCCOCCOCCCOCC(=O)OCC 7a_100000752267_100009893628 [0,2,0,0,0,0|2,0,0]=4 12376 B16R0.61 CCCOCCOCCNCCC(=O)OCC 2230a_200011904461_100011206558 [0,2,0,0,0,0|2,0,0]=4 12377 B16R0.61 CCCOCCOCCNCCC(=O)OCC 34a_200011904461_100000765890 [0,2,0,0,0,0|2,0,0]=4 12378 B16R0.61 CCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210303 [0,2,0,0,0,0|2,0,0]=4 12379 B16R0.61 CCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210303 [0,2,0,0,0,0|2,0,0]=4 12380 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215938 [0,2,0,0,0,0|1,0,0]=3 12381 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100011215938_100000755133 [0,2,0,0,0,0|1,0,0]=3 12382 B16R0.61 CCCOCCSCCCOCC(=O)OCC 62a_100009893628_100011215938 [0,2,0,0,0,0|2,0,0]=4 12383 B16R0.61 CCCOCCSCCCOCC(=O)OCC 62a_100011215938_100009893628 [0,2,0,0,0,0|2,0,0]=4 12384 B16R0.61 CCCSCCCCCCCCC(=O)OCC 62a_100000210303_100010175975 [0,2,0,0,0,0|0,0,0]=2 12385 B16R0.61 CCCSCCNCCCCCC(=O)OCC 2230a_100020603323_100000755133 [0,2,0,0,0,0|1,0,0]=3 12386 B16R0.61 CCCSCCNCCCOCC(=O)OCC 2230a_100020603323_100009893628 [0,2,0,0,0,0|2,0,0]=4 12387 B16R0.61 CCCSCCOCCCCCC(=O)OCC 34a_200000230433_100000755133 [0,2,0,0,0,0|1,0,0]=3 12388 B16R0.61 CCCSCCOCCCCCC(=O)OCC 7a_200000230433_100000755133 [0,2,0,0,0,0|1,0,0]=3 12389 B16R0.61 CCCSCCOCCCOCC(=O)OCC 34a_200000230433_100009893628 [0,2,0,0,0,0|2,0,0]=4 12390 B16R0.61 CCCSCCOCCCOCC(=O)OCC 7a_200000230433_100009893628 [0,2,0,0,0,0|2,0,0]=4 12391 B16R0.61 CCNC(=O)CCCCCCCCCCCO 240690a_100015525214_100000037981 [0,2,0,0,0,0|1,0,0]=3 12392 B16R0.61 CCNC(=O)CCNCCCCCCCCO 2230a_102515433106_100000737597 [0,2,0,0,0,0|2,0,0]=4 12393 B16R0.61 CCNC(=O)CCNCCCCCCCCO 34a_100025743525_100000033203 [0,2,0,0,0,0|2,0,0]=4 12394 B16R0.61 CCNC(=O)CCOCCCCCCCCBr 7a_100009813846_100000737597 [0,2,0,0,0,0|2,0,0]=4 12395 B16R0.61 CCNC(=O)CCOCCCCCCCCCl 7a_100000033203_100000737597 [0,2,0,0,0,0|2,0,0]=4 12396 B16R0.61 CCNC(=O)CCSCCCCCCCCO 62a_100000033203_100000737597 [0,2,0,0,0,0|2,0,0]=4 12397 B16R0.61 CCNC(=O)CCSCCCCCCCCO 62a_100000737597_100000033203 [0,2,0,0,0,0|2,0,0]=4 12398 B16R0.61 CCNC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183381 [0,2,0,0,0,0|2,0,0]=4 12399 B16R0.61 CCNC(=O)CNCCCCCCCCCO 2230a_100016988866_100009813782 [0,2,0,0,0,0|2,0,0]=4 12400 B16R0.61 CCNC(=O)CNCCCCCCCCCO 34a_100000078944_100000183381 [0,2,0,0,0,0|2,0,0]=4 12401 B16R0.61 CCNC(=O)COCCCCCCCCCBr 34a_100009813782_100000183381 [0,2,0,0,0,0|2,0,0]=4 12402 B16R0.61 CCNC(=O)COCCCCCCCCCBr 7a_100009813782_100000183381 [0,2,0,0,0,0|2,0,0]=4 12403 B16R0.61 CCNC(=O)COCCCCCCCCCCl 34a_100009868337_100000183381 [0,2,0,0,0,0|2,0,0]=4 12404 B16R0.61 CCNC(=O)COCCCCCCCCCCl 7a_100009868337_100000183381 [0,2,0,0,0,0|2,0,0]=4 12405 B16R0.61 CCNC(=O)COCCCCCCCCCN 34a_100000078944_100000183381 [0,2,0,0,0,0|2,0,0]=4 12406 B16R0.61 CCNC(=O)CSCCCCCCCCCO 62a_100000183381_100009813782 [0,2,0,0,0,0|2,0,0]=4 12407 B16R0.61 CCNC(=O)CSCCCCCCCCCO 62a_100009813782_100000183381 [0,2,0,0,0,0|2,0,0]=4 12408 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100000066964_100015525214 [0,2,0,0,0,0|2,0,0]=4 12409 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100015525214_100000066964 [0,2,0,0,0,0|2,0,0]=4 12410 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100000066964_100015525214 [0,2,0,0,0,0|2,0,0]=4 12411 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100015525214_100000066964 [0,2,0,0,0,0|2,0,0]=4 12412 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100000066964_100015525214 [0,2,0,0,0,0|2,0,0]=4 12413 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100015525214_100000066964 [0,2,0,0,0,0|2,0,0]=4 12414 B16R0.61 CCNCCCCCCCCCC(=O)OCC 2230a_100015525214_100009828014 [0,2,0,0,0,0|0,0,0]=2 12415 B16R0.61 CCNN=CCCCCCCCC(=O)OCC 4a_100000756455_100102623289 [0,2,0,0,0,0|1,0,1]=4 12416 B16R0.61 CCOC(=O)CCCCCCCCCCNC 2230a_106832991635_100009827693 [0,2,0,0,0,0|0,0,0]=2 12417 B16R0.61 CCOC(=O)CCCCCCCCCCNC 34a_100102657272_100009827693 [0,2,0,0,0,0|0,0,0]=2 12418 B16R0.61 CCOC(=O)CCCCCCCCCCNC 7a_106832991635_100009827693 [0,2,0,0,0,0|0,0,0]=2 12419 B16R0.61 CCOC(=O)CCCCCCCCCCOC 34a_100138415774_100009827693 [0,2,0,0,0,0|0,0,0]=2 12420 B16R0.61 CCOC(=O)CCCCCCCCCCSC 62a_200000210301_100009827693 [0,2,0,0,0,0|0,0,0]=2 12421 B16R0.61 CCOC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009827693 [0,2,0,0,0,0|0,0,0]=2 12422 B16R0.61 CCOC(=O)CCCCCCCCCSCC 62a_100000210202_100009828014 [0,2,0,0,0,0|0,0,0]=2 12423 B16R0.61 CCOC(=O)CCCCCCCCCSCF 62a_100015361967_100009828014 [0,2,0,0,0,0|1,0,0]=3 12424 B16R0.61 CCOC(=O)CCCCCCCCNCCF 34a_100000724931_100010175975 [0,2,0,0,0,0|1,0,0]=3 12425 B16R0.61 CCOC(=O)CCCCCCCCNCCO 2230a_100016997473_100010175975 [0,2,0,0,0,0|1,0,0]=3 12426 B16R0.61 CCOC(=O)CCCCCCCCNCCO 34a_100016990907_100010175975 [0,2,0,0,0,0|1,0,0]=3 12427 B16R0.61 CCOC(=O)CCCCCCCCOCCBr 34a_100000211926_100010175975 [0,2,0,0,0,0|1,0,0]=3 12428 B16R0.61 CCOC(=O)CCCCCCCCOCCN 34a_100000210304_100010175975 [0,2,0,0,0,0|1,0,0]=3 12429 B16R0.61 CCOC(=O)CCCCCCCCSCC#N 62a_100011215382_100010175975 [0,2,0,0,0,0|1,0,1]=4 12430 B16R0.61 CCOC(=O)CCCCCCCCSCC=O 62a_200015260668_100010175975 [0,2,0,0,0,0|1,0,1]=4 12431 B16R0.61 CCOC(=O)CCCCCCCCSCCF 62a_100011217306_100010175975 [0,2,0,0,0,0|1,0,0]=3 12432 B16R0.61 CCOC(=O)CCCCCCCCSCCO 62a_100000211926_100010175975 [0,2,0,0,0,0|1,0,0]=3 12433 B16R0.61 CCOC(=O)CCCCCCCCSCOC 62a_100000766300_100010175975 [0,2,0,0,0,0|1,0,0]=3 12434 B16R0.61 CCOC(=O)CCCCCCCCSCSC 62a_100011218213_100010175975 [0,2,0,0,0,0|1,0,0]=3 12435 B16R0.61 CCOC(=O)CCCCCCCNCCCF 2230a_100015189416_100009991516 [0,2,0,0,0,0|1,0,0]=3 12436 B16R0.61 CCOC(=O)CCCCCCCNCCCF 34a_100015189416_100009991516 [0,2,0,0,0,0|1,0,0]=3 12437 B16R0.61 CCOC(=O)CCCCCCCNCCOC 2230a_100000209980_100009991516 [0,2,0,0,0,0|1,0,0]=3 12438 B16R0.61 CCOC(=O)CCCCCCCNCCSC 2230a_100020590264_100009991516 [0,2,0,0,0,0|1,0,0]=3 12439 B16R0.61 CCOC(=O)CCCCCCCOCCCBr 34a_100011217188_100009991516 [0,2,0,0,0,0|1,0,0]=3 12440 B16R0.61 CCOC(=O)CCCCCCCOCCCCl 34a_100000230001_100009991516 [0,2,0,0,0,0|1,0,0]=3 12441 B16R0.61 CCOC(=O)CCCCCCCOCCCF 34a_100000759539_100009991516 [0,2,0,0,0,0|1,0,0]=3 12442 B16R0.61 CCOC(=O)CCCCCCCOCCCN 34a_100000182051_100009991516 [0,2,0,0,0,0|1,0,0]=3 12443 B16R0.61 CCOC(=O)CCCCCCCOCCOC 34a_100000210237_100009991516 [0,2,0,0,0,0|1,0,0]=3 12444 B16R0.61 CCOC(=O)CCCCCCCOCCON 34a_100000700252_100009991516 [0,2,0,0,0,0|2,0,0]=4 12445 B16R0.61 CCOC(=O)CCCCCCCOCCSC 34a_100000230434_100009991516 [0,2,0,0,0,0|1,0,0]=3 12446 B16R0.61 CCOC(=O)CCCCCCCOCCSC 7a_100000230434_100009991516 [0,2,0,0,0,0|1,0,0]=3 12447 B16R0.61 CCOC(=O)CCCCCCCSCCC#N 62a_100011215226_100009991516 [0,2,0,0,0,0|1,0,1]=4 12448 B16R0.61 CCOC(=O)CCCCCCCSCCCF 62a_100011934791_100009991516 [0,2,0,0,0,0|1,0,0]=3 12449 B16R0.61 CCOC(=O)CCCCCCCSCCCO 62a_100011215043_100009991516 [0,2,0,0,0,0|1,0,0]=3 12450 B16R0.61 CCOC(=O)CCCCCCCSCCOC 62a_100000233755_100009991516 [0,2,0,0,0,0|1,0,0]=3 12451 B16R0.61 CCOC(=O)CCCCCCCSCCSC 62a_100000212216_100009991516 [0,2,0,0,0,0|1,0,0]=3 12452 B16R0.61 CCOC(=O)CCCCCCNCCCCO 2230a_100000750430_100009814379 [0,2,0,0,0,0|1,0,0]=3 12453 B16R0.61 CCOC(=O)CCCCCCNCCCCO 34a_100000750430_100009814379 [0,2,0,0,0,0|1,0,0]=3 12454 B16R0.61 CCOC(=O)CCCCCCNCCCOC 34a_100150723488_100009814379 [0,2,0,0,0,0|1,0,0]=3 12455 B16R0.61 CCOC(=O)CCCCCCNCCCSC 2230a_100000749238_100009814379 [0,2,0,0,0,0|1,0,0]=3 12456 B16R0.61 CCOC(=O)CCCCCCNCCSCC 2230a_100000106463_100009814379 [0,2,0,0,0,0|1,0,0]=3 12457 B16R0.61 CCOC(=O)CCCCCCOCCCCBr 34a_100011216708_100009814379 [0,2,0,0,0,0|1,0,0]=3 12458 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 34a_100000210776_100009814379 [0,2,0,0,0,0|1,0,0]=3 12459 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 7a_100000210776_100009814379 [0,2,0,0,0,0|1,0,0]=3 12460 B16R0.61 CCOC(=O)CCCCCCOCCCCF 34a_100011995726_100009814379 [0,2,0,0,0,0|1,0,0]=3 12461 B16R0.61 CCOC(=O)CCCCCCOCCCCF 7a_100011995726_100009814379 [0,2,0,0,0,0|1,0,0]=3 12462 B16R0.61 CCOC(=O)CCCCCCOCCCCI 34a_200012148704_100009814379 [0,2,0,0,0,0|1,0,0]=3 12463 B16R0.61 CCOC(=O)CCCCCCOCCCCN 34a_100000750430_100009814379 [0,2,0,0,0,0|1,0,0]=3 12464 B16R0.61 CCOC(=O)CCCCCCOCCCNC 34a_100000213112_100009814379 [0,2,0,0,0,0|1,0,0]=3 12465 B16R0.61 CCOC(=O)CCCCCCOCCCOC 34a_100000740835_100009814379 [0,2,0,0,0,0|1,0,0]=3 12466 B16R0.61 CCOC(=O)CCCCCCOCCCSC 34a_100000690336_100009814379 [0,2,0,0,0,0|1,0,0]=3 12467 B16R0.61 CCOC(=O)CCCCCCOCCCSC 7a_100000690336_100009814379 [0,2,0,0,0,0|1,0,0]=3 12468 B16R0.61 CCOC(=O)CCCCCCOCCSCC 34a_100000212035_100009814379 [0,2,0,0,0,0|1,0,0]=3 12469 B16R0.61 CCOC(=O)CCCCCCOCCSCC 7a_100000212035_100009814379 [0,2,0,0,0,0|1,0,0]=3 12470 B16R0.61 CCOC(=O)CCCCCCSCCCC#N 62a_100000687738_100009814379 [0,2,0,0,0,0|1,0,1]=4 12471 B16R0.61 CCOC(=O)CCCCCCSCCCC=O 62a_200011292268_100009814379 [0,2,0,0,0,0|1,0,1]=4 12472 B16R0.61 CCOC(=O)CCCCCCSCCCCF 62a_100000729493_100009814379 [0,2,0,0,0,0|1,0,0]=3 12473 B16R0.61 CCOC(=O)CCCCCCSCCCCO 62a_100000210776_100009814379 [0,2,0,0,0,0|1,0,0]=3 12474 B16R0.61 CCOC(=O)CCCCCCSCCCOC 62a_100000709357_100009814379 [0,2,0,0,0,0|1,0,0]=3 12475 B16R0.61 CCOC(=O)CCCCCCSCCSCC 62a_100000757381_100009814379 [0,2,0,0,0,0|1,0,0]=3 12476 B16R0.61 CCOC(=O)CCCCCNCCCCCO 2230a_100000762737_100000755133 [0,2,0,0,0,0|1,0,0]=3 12477 B16R0.61 CCOC(=O)CCCCCNCCCCCO 34a_100000762737_100000755133 [0,2,0,0,0,0|1,0,0]=3 12478 B16R0.61 CCOC(=O)CCCCCNCCOCCO 2230a_100000211614_100000755133 [0,2,0,0,0,0|2,0,0]=4 12479 B16R0.61 CCOC(=O)CCCCCNCCOCCO 34a_100000211614_100000755133 [0,2,0,0,0,0|2,0,0]=4 12480 B16R0.61 CCOC(=O)CCCCCNCCSCCO 2230a_100011219999_100000755133 [0,2,0,0,0,0|2,0,0]=4 12481 B16R0.61 CCOC(=O)CCCCCOCCCCC#N 7a_100011214988_100000211819 [0,2,0,0,0,0|1,0,1]=4 12482 B16R0.61 CCOC(=O)CCCCCOCCCCC=O 7a_100011214988_100000139335 [0,2,0,0,0,0|1,0,1]=4 12483 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 34a_100000746331_100000755133 [0,2,0,0,0,0|1,0,0]=3 12484 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 7a_100000746331_100000755133 [0,2,0,0,0,0|1,0,0]=3 12485 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 34a_100000746330_100000755133 [0,2,0,0,0,0|1,0,0]=3 12486 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 7a_100000746330_100000755133 [0,2,0,0,0,0|1,0,0]=3 12487 B16R0.61 CCOC(=O)CCCCCOCCCCCF 7a_100011214988_100000729378 [0,2,0,0,0,0|1,0,0]=3 12488 B16R0.61 CCOC(=O)CCCCCOCCCCCI 34a_200012148887_100000755133 [0,2,0,0,0,0|1,0,0]=3 12489 B16R0.61 CCOC(=O)CCCCCOCCCCCI 7a_200012148887_100000755133 [0,2,0,0,0,0|1,0,0]=3 12490 B16R0.61 CCOC(=O)CCCCCOCCCCCN 34a_100000762737_100000755133 [0,2,0,0,0,0|1,0,0]=3 12491 B16R0.61 CCOC(=O)CCCCCOCCCCCO 7a_100011214988_100000746330 [0,2,0,0,0,0|1,0,0]=3 12492 B16R0.61 CCOC(=O)CCCCCOCCCCOC 34a_100000740925_100000755133 [0,2,0,0,0,0|1,0,0]=3 12493 B16R0.61 CCOC(=O)CCCCCOCCCCOC 7a_100011214988_100000730899 [0,2,0,0,0,0|1,0,0]=3 12494 B16R0.61 CCOC(=O)CCCCCOCCCCSC 34a_100011217163_100000755133 [0,2,0,0,0,0|1,0,0]=3 12495 B16R0.61 CCOC(=O)CCCCCOCCCCSC 7a_100011217163_100000755133 [0,2,0,0,0,0|1,0,0]=3 12496 B16R0.61 CCOC(=O)CCCCCOCCCSCC 34a_100011216438_100000755133 [0,2,0,0,0,0|1,0,0]=3 12497 B16R0.61 CCOC(=O)CCCCCOCCCSCC 7a_100011216438_100000755133 [0,2,0,0,0,0|1,0,0]=3 12498 B16R0.61 CCOC(=O)CCCCCOCCOCCBr 34a_100000692535_100000755133 [0,2,0,0,0,0|2,0,0]=4 12499 B16R0.61 CCOC(=O)CCCCCOCCOCCBr 7a_100000692535_100000755133 [0,2,0,0,0,0|2,0,0]=4 12500 B16R0.61 CCOC(=O)CCCCCOCCOCCCl 34a_100011215305_100000755133 [0,2,0,0,0,0|2,0,0]=4 12501 B16R0.61 CCOC(=O)CCCCCOCCOCCCl 7a_100011215305_100000755133 [0,2,0,0,0,0|2,0,0]=4 12502 B16R0.61 CCOC(=O)CCCCCOCCOCCF 34a_200015357709_100000755133 [0,2,0,0,0,0|2,0,0]=4 12503 B16R0.61 CCOC(=O)CCCCCOCCOCCF 7a_200015357709_100000755133 [0,2,0,0,0,0|2,0,0]=4 12504 B16R0.61 CCOC(=O)CCCCCOCCOCCI 34a_100012149058_100000755133 [0,2,0,0,0,0|2,0,0]=4 12505 B16R0.61 CCOC(=O)CCCCCOCCOCCI 7a_100012149058_100000755133 [0,2,0,0,0,0|2,0,0]=4 12506 B16R0.61 CCOC(=O)CCCCCOCCOCCN 34a_100000211614_100000755133 [0,2,0,0,0,0|2,0,0]=4 12507 B16R0.61 CCOC(=O)CCCCCOCCOCCO 7a_100011214988_100011215305 [0,2,0,0,0,0|2,0,0]=4 12508 B16R0.61 CCOC(=O)CCCCCSCCCCC#N 62a_100000755133_100000211819 [0,2,0,0,0,0|1,0,1]=4 12509 B16R0.61 CCOC(=O)CCCCCSCCCCC#N 62a_100011219923_100000755133 [0,2,0,0,0,0|1,0,1]=4 12510 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000139335_100000755133 [0,2,0,0,0,0|1,0,1]=4 12511 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000755133_100000139335 [0,2,0,0,0,0|1,0,1]=4 12512 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000729378_100000755133 [0,2,0,0,0,0|1,0,0]=3 12513 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000755133_100000729378 [0,2,0,0,0,0|1,0,0]=3 12514 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000746330_100000755133 [0,2,0,0,0,0|1,0,0]=3 12515 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000755133_100000746330 [0,2,0,0,0,0|1,0,0]=3 12516 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000730899_100000755133 [0,2,0,0,0,0|1,0,0]=3 12517 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000755133_100000730899 [0,2,0,0,0,0|1,0,0]=3 12518 B16R0.61 CCOC(=O)CCCCCSCCOCCO 62a_100000755133_100011215305 [0,2,0,0,0,0|2,0,0]=4 12519 B16R0.61 CCOC(=O)CCCCCSCCOCCO 62a_100011215305_100000755133 [0,2,0,0,0,0|2,0,0]=4 12520 B16R0.61 CCOC(=O)CCCCCSCOCCOC 62a_100000231047_100000755133 [0,2,0,0,0,0|2,0,0]=4 12521 B16R0.61 CCOC(=O)CCCCCSCOCCOC 62a_100000755133_100000231047 [0,2,0,0,0,0|2,0,0]=4 12522 B16R0.61 CCOC(=O)CCCCNCCCCCCO 2230a_100000686447_100000750268 [0,2,0,0,0,0|1,0,0]=3 12523 B16R0.61 CCOC(=O)CCCCNCCCCCCO 34a_100000686447_100000750268 [0,2,0,0,0,0|1,0,0]=3 12524 B16R0.61 CCOC(=O)CCCCNCCCCCOC 2230a_100000747528_100000750268 [0,2,0,0,0,0|1,0,0]=3 12525 B16R0.61 CCOC(=O)CCCCNCCCCCOC 34a_100000747528_100000750268 [0,2,0,0,0,0|1,0,0]=3 12526 B16R0.61 CCOC(=O)CCCCNCCOCCOC 2230a_100000745349_100000750268 [0,2,0,0,0,0|2,0,0]=4 12527 B16R0.61 CCOC(=O)CCCCNCCOCCOC 34a_100000745349_100000750268 [0,2,0,0,0,0|2,0,0]=4 12528 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 34a_100011215345_100000750268 [0,2,0,0,0,0|1,0,0]=3 12529 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 7a_100011215345_100000750268 [0,2,0,0,0,0|1,0,0]=3 12530 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 34a_100000766143_100000750268 [0,2,0,0,0,0|1,0,0]=3 12531 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 7a_100000766143_100000750268 [0,2,0,0,0,0|1,0,0]=3 12532 B16R0.61 CCOC(=O)CCCCOCCCCCCF 34a_100000732779_100000750268 [0,2,0,0,0,0|1,0,0]=3 12533 B16R0.61 CCOC(=O)CCCCOCCCCCCF 7a_100000732779_100000750268 [0,2,0,0,0,0|1,0,0]=3 12534 B16R0.61 CCOC(=O)CCCCOCCCCCCN 34a_100000686447_100000750268 [0,2,0,0,0,0|1,0,0]=3 12535 B16R0.61 CCOC(=O)CCCCOCCCCCNC 34a_100000722520_100000750268 [0,2,0,0,0,0|1,0,0]=3 12536 B16R0.61 CCOC(=O)CCCCOCCOCCNC 34a_100000228057_100000750268 [0,2,0,0,0,0|2,0,0]=4 12537 B16R0.61 CCOC(=O)CCCCOCCOCCOC 34a_100011215163_100000750268 [0,2,0,0,0,0|2,0,0]=4 12538 B16R0.61 CCOC(=O)CCCCOCCOCCOC 7a_100011215163_100000750268 [0,2,0,0,0,0|2,0,0]=4 12539 B16R0.61 CCOC(=O)CCCCSCCCCCC#N 62a_100000750268_100009813376 [0,2,0,0,0,0|1,0,1]=4 12540 B16R0.61 CCOC(=O)CCCCSCCCCCC#N 62a_100009813376_100000750268 [0,2,0,0,0,0|1,0,1]=4 12541 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000139337_100000750268 [0,2,0,0,0,0|1,0,1]=4 12542 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000750268_100000139337 [0,2,0,0,0,0|1,0,1]=4 12543 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100000750268_100015922095 [0,2,0,0,0,0|1,0,0]=3 12544 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100015922095_100000750268 [0,2,0,0,0,0|1,0,0]=3 12545 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000750268_100000766143 [0,2,0,0,0,0|1,0,0]=3 12546 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000766143_100000750268 [0,2,0,0,0,0|1,0,0]=3 12547 B16R0.61 CCOC(=O)CCCCSCCOCCOC 62a_100000695917_100000750268 [0,2,0,0,0,0|2,0,0]=4 12548 B16R0.61 CCOC(=O)CCCCSCCOCCOC 62a_100000750268_100000695917 [0,2,0,0,0,0|2,0,0]=4 12549 B16R0.61 CCOC(=O)CCCNCCCCCCCO 2230a_100011996573_100009991533 [0,2,0,0,0,0|1,0,0]=3 12550 B16R0.61 CCOC(=O)CCCNCCCCCCCO 34a_100011996573_100009991533 [0,2,0,0,0,0|1,0,0]=3 12551 B16R0.61 CCOC(=O)CCCNCCCOCCCO 2230a_100011310245_100009991533 [0,2,0,0,0,0|2,0,0]=4 12552 B16R0.61 CCOC(=O)CCCNCCCOCCCO 34a_100011310245_100009991533 [0,2,0,0,0,0|2,0,0]=4 12553 B16R0.61 CCOC(=O)CCCNCCCOCCOC 2230a_100000206027_100009991533 [0,2,0,0,0,0|2,0,0]=4 12554 B16R0.61 CCOC(=O)CCCNCCCOCCOC 34a_100000206027_100009991533 [0,2,0,0,0,0|2,0,0]=4 12555 B16R0.61 CCOC(=O)CCCOCCCCCCC#N 7a_100012001163_100009813337 [0,2,0,0,0,0|1,0,1]=4 12556 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 34a_100000760002_100009991533 [0,2,0,0,0,0|1,0,0]=3 12557 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215271 [0,2,0,0,0,0|1,0,0]=3 12558 B16R0.61 CCOC(=O)CCCOCCCCCCCN 34a_100011996573_100009991533 [0,2,0,0,0,0|1,0,0]=3 12559 B16R0.61 CCOC(=O)CCCOCCCCCCCO 7a_100012001163_100000760002 [0,2,0,0,0,0|1,0,0]=3 12560 B16R0.61 CCOC(=O)CCCOCCCCCCOC 34a_200012092642_100009991533 [0,2,0,0,0,0|1,0,0]=3 12561 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_100012001163_100011998445 [0,2,0,0,0,0|1,0,0]=3 12562 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_200012092642_100011215271 [0,2,0,0,0,0|1,0,0]=3 12563 B16R0.61 CCOC(=O)CCCOCCCOCCCN 34a_100011310245_100009991533 [0,2,0,0,0,0|2,0,0]=4 12564 B16R0.61 CCOC(=O)CCCOCCCOCCOC 7a_100012001163_100011216529 [0,2,0,0,0,0|2,0,0]=4 12565 B16R0.61 CCOC(=O)CCCSCCCCCCC#N 62a_100009813337_100009991533 [0,2,0,0,0,0|1,0,1]=4 12566 B16R0.61 CCOC(=O)CCCSCCCCCCC#N 62a_100009991533_100009813337 [0,2,0,0,0,0|1,0,1]=4 12567 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100000760002_100009991533 [0,2,0,0,0,0|1,0,0]=3 12568 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100009991533_100000760002 [0,2,0,0,0,0|1,0,0]=3 12569 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100009991533_100011998445 [0,2,0,0,0,0|1,0,0]=3 12570 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100011998445_100009991533 [0,2,0,0,0,0|1,0,0]=3 12571 B16R0.61 CCOC(=O)CCCSCCCOCCOC 62a_100009991533_100011216529 [0,2,0,0,0,0|2,0,0]=4 12572 B16R0.61 CCOC(=O)CCCSCCCOCCOC 62a_100011216529_100009991533 [0,2,0,0,0,0|2,0,0]=4 12573 B16R0.61 CCOC(=O)CCNCCCCCCCCO 2230a_102515433106_100011206558 [0,2,0,0,0,0|1,0,0]=3 12574 B16R0.61 CCOC(=O)CCNCCCCCCCCO 34a_102515433106_100000765890 [0,2,0,0,0,0|1,0,0]=3 12575 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 34a_100009813846_100000765890 [0,2,0,0,0,0|1,0,0]=3 12576 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 7a_100009813846_100011206558 [0,2,0,0,0,0|1,0,0]=3 12577 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 34a_100000033203_100000765890 [0,2,0,0,0,0|1,0,0]=3 12578 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 7a_100000033203_100011206558 [0,2,0,0,0,0|1,0,0]=3 12579 B16R0.61 CCOC(=O)CCOCCCCCCCCN 34a_102515433106_100000765890 [0,2,0,0,0,0|1,0,0]=3 12580 B16R0.61 CCOC(=O)CCOCCCCCNCCN 34a_103619048469_100000765890 [0,2,0,0,0,0|2,0,0]=4 12581 B16R0.61 CCOC(=O)CCOCCCOCCCOC 34a_200011215475_100000765890 [0,2,0,0,0,0|2,0,0]=4 12582 B16R0.61 CCOC(=O)CCOCCCOCCCOC 7a_200011215475_100011206558 [0,2,0,0,0,0|2,0,0]=4 12583 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000033203_100000765890 [0,2,0,0,0,0|1,0,0]=3 12584 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000765890_100000033203 [0,2,0,0,0,0|1,0,0]=3 12585 B16R0.61 CCOC(=O)CNCCCCCCCCCO 2230a_100000078944_100000188475 [0,2,0,0,0,0|1,0,0]=3 12586 B16R0.61 CCOC(=O)CNCCCCCCCCCO 34a_100000078944_100000188475 [0,2,0,0,0,0|1,0,0]=3 12587 B16R0.61 CCOC(=O)COCCCCCCCCCBr 34a_100009813782_100000188475 [0,2,0,0,0,0|1,0,0]=3 12588 B16R0.61 CCOC(=O)COCCCCCCCCCBr 7a_100009813782_100000188475 [0,2,0,0,0,0|1,0,0]=3 12589 B16R0.61 CCOC(=O)COCCCCCCCCCCl 34a_100009868337_100000188475 [0,2,0,0,0,0|1,0,0]=3 12590 B16R0.61 CCOC(=O)COCCCCCCCCCCl 7a_100009868337_100000188475 [0,2,0,0,0,0|1,0,0]=3 12591 B16R0.61 CCOC(=O)COCCCCCCCCCN 34a_100000078944_100000188475 [0,2,0,0,0,0|1,0,0]=3 12592 B16R0.61 CCOC(=O)COCCCNCCCCCO 2230a_100000762737_100009893628 [0,2,0,0,0,0|2,0,0]=4 12593 B16R0.61 CCOC(=O)COCCCNCCCCCO 34a_100000762737_100009893628 [0,2,0,0,0,0|2,0,0]=4 12594 B16R0.61 CCOC(=O)COCCCOCCCCCBr 34a_100000746331_100009893628 [0,2,0,0,0,0|2,0,0]=4 12595 B16R0.61 CCOC(=O)COCCCOCCCCCBr 7a_100000746331_100009893628 [0,2,0,0,0,0|2,0,0]=4 12596 B16R0.61 CCOC(=O)COCCCOCCCCCCl 34a_100000746330_100009893628 [0,2,0,0,0,0|2,0,0]=4 12597 B16R0.61 CCOC(=O)COCCCOCCCCCCl 7a_100000746330_100009893628 [0,2,0,0,0,0|2,0,0]=4 12598 B16R0.61 CCOC(=O)COCCCOCCCCCI 34a_200012148887_100009893628 [0,2,0,0,0,0|2,0,0]=4 12599 B16R0.61 CCOC(=O)COCCCOCCCCCI 7a_200012148887_100009893628 [0,2,0,0,0,0|2,0,0]=4 12600 B16R0.61 CCOC(=O)COCCCOCCCCCN 34a_100000762737_100009893628 [0,2,0,0,0,0|2,0,0]=4 12601 B16R0.61 CCOC(=O)COCCCOCCCCOC 34a_100000740925_100009893628 [0,2,0,0,0,0|2,0,0]=4 12602 B16R0.61 CCOC(=O)COCCCOCCCCSC 34a_100011217163_100009893628 [0,2,0,0,0,0|2,0,0]=4 12603 B16R0.61 CCOC(=O)COCCCOCCCCSC 7a_100011217163_100009893628 [0,2,0,0,0,0|2,0,0]=4 12604 B16R0.61 CCOC(=O)COCCCOCCCSCC 34a_100011216438_100009893628 [0,2,0,0,0,0|2,0,0]=4 12605 B16R0.61 CCOC(=O)COCCCOCCCSCC 7a_100011216438_100009893628 [0,2,0,0,0,0|2,0,0]=4 12606 B16R0.61 CCOC(=O)COCCCSCCCCCF 62a_100000729378_100009893628 [0,2,0,0,0,0|2,0,0]=4 12607 B16R0.61 CCOC(=O)COCCCSCCCCCF 62a_100009893628_100000729378 [0,2,0,0,0,0|2,0,0]=4 12608 B16R0.61 CCOC(=O)COCCCSCCCCCO 62a_100000746330_100009893628 [0,2,0,0,0,0|2,0,0]=4 12609 B16R0.61 CCOC(=O)COCCCSCCCCCO 62a_100009893628_100000746330 [0,2,0,0,0,0|2,0,0]=4 12610 B16R0.61 CCOC(=O)COCCCSCCCCOC 62a_100000730899_100009893628 [0,2,0,0,0,0|2,0,0]=4 12611 B16R0.61 CCOC(=O)COCCCSCCCCOC 62a_100009893628_100000730899 [0,2,0,0,0,0|2,0,0]=4 12612 B16R0.61 CCOC(=O)COCCNCCCCCCO 2230a_100000686447_100000088970 [0,2,0,0,0,0|2,0,0]=4 12613 B16R0.61 CCOC(=O)COCCNCCCCCCO 34a_100000686447_100000088970 [0,2,0,0,0,0|2,0,0]=4 12614 B16R0.61 CCOC(=O)COCCNCCCCCOC 2230a_100000747528_100000088970 [0,2,0,0,0,0|2,0,0]=4 12615 B16R0.61 CCOC(=O)COCCNCCCCCOC 34a_100000747528_100000088970 [0,2,0,0,0,0|2,0,0]=4 12616 B16R0.61 CCOC(=O)COCCOCCCCCCBr 34a_100011215345_100000088970 [0,2,0,0,0,0|2,0,0]=4 12617 B16R0.61 CCOC(=O)COCCOCCCCCCBr 7a_100011215345_100000088970 [0,2,0,0,0,0|2,0,0]=4 12618 B16R0.61 CCOC(=O)COCCOCCCCCCCl 34a_100000766143_100000088970 [0,2,0,0,0,0|2,0,0]=4 12619 B16R0.61 CCOC(=O)COCCOCCCCCCCl 7a_100000766143_100000088970 [0,2,0,0,0,0|2,0,0]=4 12620 B16R0.61 CCOC(=O)COCCOCCCCCCF 34a_100000732779_100000088970 [0,2,0,0,0,0|2,0,0]=4 12621 B16R0.61 CCOC(=O)COCCOCCCCCCF 7a_100000732779_100000088970 [0,2,0,0,0,0|2,0,0]=4 12622 B16R0.61 CCOC(=O)COCCOCCCCCCN 34a_100000686447_100000088970 [0,2,0,0,0,0|2,0,0]=4 12623 B16R0.61 CCOC(=O)COCCOCCCCCNC 34a_100000722520_100000088970 [0,2,0,0,0,0|2,0,0]=4 12624 B16R0.61 CCOC(=O)COCCSCCCCCCF 62a_100000088970_100015922095 [0,2,0,0,0,0|2,0,0]=4 12625 B16R0.61 CCOC(=O)COCCSCCCCCCF 62a_100015922095_100000088970 [0,2,0,0,0,0|2,0,0]=4 12626 B16R0.61 CCOC(=O)COCCSCCCCCCO 62a_100000088970_100000766143 [0,2,0,0,0,0|2,0,0]=4 12627 B16R0.61 CCOC(=O)COCCSCCCCCCO 62a_100000766143_100000088970 [0,2,0,0,0,0|2,0,0]=4 12628 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100000188475_100009813782 [0,2,0,0,0,0|1,0,0]=3 12629 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100009813782_100000188475 [0,2,0,0,0,0|1,0,0]=3 12630 B16R0.61 CCOC(=O)CSCCOCCCCCCF 7a_200000230590_100015922095 [0,2,0,0,0,0|2,0,0]=4 12631 B16R0.61 CCOC(=O)CSCCOCCCCCCO 7a_200000230590_100000766143 [0,2,0,0,0,0|2,0,0]=4 12632 B16R0.61 CCOC(=O)NCCOCCCCCCCBr 7a_100000760002_200011445536 [0,2,0,0,0,0|2,0,0]=4 12633 B16R0.61 CCOC(=O)NCCOCCCCCCCO 34a_100000158857_100000760002 [0,2,0,0,0,0|2,0,0]=4 12634 B16R0.61 CCOC(=O)NCCOCCCCCCOC 34a_100000158857_100011998445 [0,2,0,0,0,0|2,0,0]=4 12635 B16R0.61 CCOC(=O)NCCOCCCCCCOC 7a_200012092642_200011445536 [0,2,0,0,0,0|2,0,0]=4 12636 B16R0.61 CCOC(=O)NCCSCCCCCCCO 62a_100000760002_200011445536 [0,2,0,0,0,0|2,0,0]=4 12637 B16R0.61 CCOC(=O)NCCSCCCCCCOC 62a_100011998445_200011445536 [0,2,0,0,0,0|2,0,0]=4 12638 B16R0.61 CCOC(=O)OCSCCCCCCCCO 62a_100000033203_100000075025 [0,2,0,0,0,0|2,0,0]=4 12639 B16R0.61 CCOCCCCCCCCCC(=O)OCC 34a_100121572206_100009828014 [0,2,0,0,0,0|0,0,0]=2 12640 B16R0.61 CCOCCCNCCCCCC(=O)OCC 2230a_100000210961_100000755133 [0,2,0,0,0,0|1,0,0]=3 12641 B16R0.61 CCOCCCNCCCCCC(=O)OCC 34a_100000210961_100000755133 [0,2,0,0,0,0|1,0,0]=3 12642 B16R0.61 CCOCCCNCCCOCC(=O)OCC 2230a_100000210961_100009893628 [0,2,0,0,0,0|2,0,0]=4 12643 B16R0.61 CCOCCCNCCCOCC(=O)OCC 34a_100000210961_100009893628 [0,2,0,0,0,0|2,0,0]=4 12644 B16R0.61 CCOCCCOCCCCCC(=O)OCC 34a_100000757476_100000755133 [0,2,0,0,0,0|1,0,0]=3 12645 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100000757476_100000755133 [0,2,0,0,0,0|1,0,0]=3 12646 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100011214988_100012232248 [0,2,0,0,0,0|1,0,0]=3 12647 B16R0.61 CCOCCCOCCCOCC(=O)OCC 34a_100000757476_100009893628 [0,2,0,0,0,0|2,0,0]=4 12648 B16R0.61 CCOCCCOCCCOCC(=O)OCC 7a_100000757476_100009893628 [0,2,0,0,0,0|2,0,0]=4 12649 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100000755133_100012232248 [0,2,0,0,0,0|1,0,0]=3 12650 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100012232248_100000755133 [0,2,0,0,0,0|1,0,0]=3 12651 B16R0.61 CCOCCCSCCCOCC(=O)OCC 62a_100009893628_100012232248 [0,2,0,0,0,0|2,0,0]=4 12652 B16R0.61 CCOCCCSCCCOCC(=O)OCC 62a_100012232248_100009893628 [0,2,0,0,0,0|2,0,0]=4 12653 B16R0.61 CCOCCNCCCCCCC(=O)OCC 2230a_102516460346_100009814379 [0,2,0,0,0,0|1,0,0]=3 12654 B16R0.61 CCOCCNCCCCCCC(=O)OCC 34a_102516460346_100009814379 [0,2,0,0,0,0|1,0,0]=3 12655 B16R0.61 CCOCCOCCCCCCC(=O)OCC 34a_100000210136_100009814379 [0,2,0,0,0,0|1,0,0]=3 12656 B16R0.61 CCOCCOCCCCCCC(=O)OCC 7a_100000210136_100009814379 [0,2,0,0,0,0|1,0,0]=3 12657 B16R0.61 CCOCCOCCNCCCC(=O)OCC 2230a_100102712874_100009991533 [0,2,0,0,0,0|2,0,0]=4 12658 B16R0.61 CCOCCOCCNCCCC(=O)OCC 34a_100102712874_100009991533 [0,2,0,0,0,0|2,0,0]=4 12659 B16R0.61 CCOCCOCCOCCCC(=O)OCC 34a_100000210240_100009991533 [0,2,0,0,0,0|2,0,0]=4 12660 B16R0.61 CCOCCOCCOCCCC(=O)OCC 7a_100000210240_100011215271 [0,2,0,0,0,0|2,0,0]=4 12661 B16R0.61 CCOCCOCCOCCCC(=O)OCC 7a_100012001163_100011211534 [0,2,0,0,0,0|2,0,0]=4 12662 B16R0.61 CCOCCOCCSCCCC(=O)OCC 62a_100009991533_100011211534 [0,2,0,0,0,0|2,0,0]=4 12663 B16R0.61 CCOCCOCCSCCCC(=O)OCC 62a_100011211534_100009991533 [0,2,0,0,0,0|2,0,0]=4 12664 B16R0.61 CCOCCSCCCCCCC(=O)OCC 62a_100000210147_100009814379 [0,2,0,0,0,0|1,0,0]=3 12665 B16R0.61 CCOCSCCCCCCCC(=O)OCC 62a_100000739092_100009991516 [0,2,0,0,0,0|1,0,0]=3 12666 B16R0.61 CNNC(=O)CCCCCCCCCCCO 22a_100016993582_100000037981 [0,2,0,0,0,0|1,0,0]=3 12667 B16R0.61 CNNC(=O)NCCCCCCCCCCO 273464a_100000066964_100016993582 [0,2,0,0,0,0|2,0,0]=4 12668 B16R0.61 CNNC(=O)NCCCCCCCCCCO 512a_100000066964_100016993582 [0,2,0,0,0,0|2,0,0]=4 12669 B16R0.61 CNNC(=O)NCCCCCCCCCCO 512a_100016993582_100000066964 [0,2,0,0,0,0|2,0,0]=4 12670 B16R0.61 COCC(=O)CCCCCCCCCCCO 1458a_100000210968_100009812471 [0,2,0,0,0,0|0,0,0]=2 12671 B16R0.61 COCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210968 [0,2,0,0,0,0|1,0,0]=3 12672 B16R0.61 CSCC(=O)CCCCCCCCCCCO 1458a_100000184570_100009812471 [0,2,0,0,0,0|0,1,0]=3 12673 B16R0.61 CSCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000184570 [0,2,0,0,0,0|1,1,0]=4 12674 B16R0.61 N#CCC(=O)CCCCCCCCCCCO 1458a_100051588842_100009812471 [0,2,0,0,0,0|1,0,1]=4 12675 B16R0.61 NCCCCCCCCCOCC(=O)NCO 34a_100000078944_100000185155 [0,2,0,0,0,0|2,0,0]=4 12676 B16R0.61 O=C(C=CBr)CCCCCCCCCCCO 1458a_100016273825_100009812471 [0,2,0,0,0,0|1,0,1]=4 12677 B16R0.61 O=C(C=CCl)CCCCCCCCCCCO 1458a_200016279998_100009812471 [0,2,0,0,0,0|1,0,1]=4 12678 B16R0.61 O=C(C=CI)CCCCCCCCCCCO 1458a_100016256311_100009812471 [0,2,0,0,0,0|1,0,1]=4 12679 B16R0.61 O=C(CCO)CCCCCCCCCCCO 1458a_100011216618_100009812471 [0,2,0,0,0,0|1,0,0]=3 12680 B16R0.61 O=C(CCO)NCCCCCCCCCCO 240690a_100000066964_100011216618 [0,2,0,0,0,0|2,0,0]=4 12681 B16R0.61 O=C(CNCCCCCCCCCO)NCO 2230a_100000078944_100000185155 [0,2,0,0,0,0|2,0,0]=4 12682 B16R0.61 O=C(CNCCCCCCCCCO)NCO 34a_100000078944_100000185155 [0,2,0,0,0,0|2,0,0]=4 12683 B16R0.61 O=C(COCCCCCCCCCBr)NCO 34a_100009813782_100000185155 [0,2,0,0,0,0|2,0,0]=4 12684 B16R0.61 O=C(COCCCCCCCCCBr)NCO 7a_100009813782_100000185155 [0,2,0,0,0,0|2,0,0]=4 12685 B16R0.61 O=C(COCCCCCCCCCCl)NCO 34a_100009868337_100000185155 [0,2,0,0,0,0|2,0,0]=4 12686 B16R0.61 O=C(COCCCCCCCCCCl)NCO 7a_100009868337_100000185155 [0,2,0,0,0,0|2,0,0]=4 12687 B16R0.61 O=C(CSCCCCCCCCCO)NCO 62a_100000185155_100009813782 [0,2,0,0,0,0|2,0,0]=4 12688 B16R0.61 O=C(CSCCCCCCCCCO)NCO 62a_100009813782_100000185155 [0,2,0,0,0,0|2,0,0]=4 12689 B16R0.70 C#CC(C)C(=O)CCCCCCCCCCC 1458a_100000210736_200000035995 [0,2,0,0,0,0|1,0,0]=3 12690 B16R0.70 C#CCCCCCCCCOC(C)C(=O)OC 34a_100000065265_100000211248 [0,2,0,0,0,0|0,0,2]=4 12691 B16R0.70 C#CCCCCCCCCOC(C)C(=O)OC 7a_100000065265_100000211248 [0,2,0,0,0,0|0,0,2]=4 12692 B16R0.70 C#CCCCCCCCOCC(C)C(=O)OC 34a_100000054614_100000698445 [0,2,0,0,0,0|0,0,2]=4 12693 B16R0.70 C#CCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100153394163 [0,2,0,0,0,0|0,0,2]=4 12694 B16R0.70 C#CCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100153394163 [0,2,0,0,0,0|0,0,2]=4 12695 B16R0.70 C#CCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100153394163 [0,2,0,0,0,0|0,0,2]=4 12696 B16R0.70 C#CCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100153394163 [0,2,0,0,0,0|0,0,2]=4 12697 B16R0.70 C#CCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100153394163 [0,2,0,0,0,0|0,0,2]=4 12698 B16R0.70 C#CCCCCCCCSCC(C)C(=O)OC 62a_100153394163_100000698445 [0,2,0,0,0,0|0,0,2]=4 12699 B16R0.70 C#CCCCCCCOCCC(C)C(=O)OC 34a_100011217361_100000034942 [0,2,0,0,0,0|0,0,2]=4 12700 B16R0.70 C#CCCCCCCOCCC(C)C(=O)OC 7a_100011217361_100000034942 [0,2,0,0,0,0|0,0,2]=4 12701 B16R0.70 C#CCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100012276617 [0,2,0,0,0,0|0,0,2]=4 12702 B16R0.70 C#CCCCCCCSCCC(C)C(=O)OC 62a_100012276617_100000034942 [0,2,0,0,0,0|0,0,2]=4 12703 B16R0.70 C/C=C(\C)/C(=O)CCCCCCCCCCC 1458a_100020587367_100011215454 [0,2,0,0,0,0|1,0,0]=3 12704 B16R0.70 C/C=C(\C)/C(=O)CCCCCCCCCCO 1458a_100020587367_100009813290 [0,2,0,0,0,0|2,0,0]=4 12705 B16R0.70 C/C=C(\C)/C(=O)NCCCCCCCCCC 11a_100000684558_100020587367 [0,2,0,0,0,0|2,0,0]=4 12706 B16R0.70 C/C=C(\C)/C(=O)NCCCCCCCCCC 1626a_100000684558_100020587367 [0,2,0,0,0,0|2,0,0]=4 12707 B16R0.70 C/C=C(\C)/C(C)NCCCCCCCCCC 269862a_100000684558_100020675665 [0,2,0,0,0,0|2,0,0]=4 12708 B16R0.70 C=C(CNCCCCCCCCC)C(=O)OC 34a_100000212291_100009813391 [0,2,0,0,0,0|0,0,1]=3 12709 B16R0.70 C=C(CNCCCCCCCCO)C(=O)OC 34a_102515433106_100009813391 [0,2,0,0,0,0|1,0,1]=4 12710 B16R0.70 C=C(COCCCCCCCCBr)C(=O)OC 34a_100009813846_100009813391 [0,2,0,0,0,0|1,0,1]=4 12711 B16R0.70 C=C(COCCCCCCCCC)C(=O)OC 34a_100000210712_100009813391 [0,2,0,0,0,0|0,0,1]=3 12712 B16R0.70 C=C(COCCCCCCCCCl)C(=O)OC 34a_100000033203_100009813391 [0,2,0,0,0,0|1,0,1]=4 12713 B16R0.70 C=C(COCCCCCCCCN)C(=O)OC 34a_102515433106_100009813391 [0,2,0,0,0,0|1,0,1]=4 12714 B16R0.70 C=C(COCCCCNCCCC)C(=O)OC 34a_200011216965_100009813391 [0,2,0,0,0,0|1,0,1]=4 12715 B16R0.70 C=C(COCCCCOCCCC)C(=O)OC 34a_200000760531_100009813391 [0,2,0,0,0,0|1,0,1]=4 12716 B16R0.70 C=C(COCCOCCCCCC)C(=O)OC 34a_100000691444_100009813391 [0,2,0,0,0,0|1,0,1]=4 12717 B16R0.70 C=C(CSCCCCCCCCC)C(=O)OC 62a_100009813391_100000210670 [0,2,0,0,0,0|0,0,1]=3 12718 B16R0.70 C=C(CSCCCCCCCCO)C(=O)OC 62a_100000033203_100009813391 [0,2,0,0,0,0|1,0,1]=4 12719 B16R0.70 C=C(CSCCCCCCCCO)C(=O)OC 62a_100009813391_100000033203 [0,2,0,0,0,0|1,0,1]=4 12720 B16R0.70 C=CC(C)C(=O)CCCCCCCCCCC 1458a_100011216780_100011215454 [0,2,0,0,0,0|1,0,0]=3 12721 B16R0.70 C=CC(C)C(=O)CCCCCCCCCCO 1458a_100011216780_100009813290 [0,2,0,0,0,0|2,0,0]=4 12722 B16R0.70 C=CC(C)C(=O)NCCCCCCCCCC 11a_100000684558_100011216780 [0,2,0,0,0,0|2,0,0]=4 12723 B16R0.70 C=CC(C)C(=O)NCCCCCCCCCC 1626a_100000684558_100011216780 [0,2,0,0,0,0|2,0,0]=4 12724 B16R0.70 C=CC(C)C(=O)NCCCCCCCCCC 240690a_100000684558_100011216780 [0,2,0,0,0,0|2,0,0]=4 12725 B16R0.70 C=CC(C)C(=O)NCCCCCCCCCC 527a_100000684558_100011216780 [0,2,0,0,0,0|2,0,0]=4 12726 B16R0.70 C=CCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100009814027 [0,2,0,0,0,0|0,0,2]=4 12727 B16R0.70 C=CCCCCCCCCOC(C)C(=O)OC 34a_100011215194_100000211248 [0,2,0,0,0,0|0,0,2]=4 12728 B16R0.70 C=CCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100011933949 [0,2,0,0,0,0|0,0,2]=4 12729 B16R0.70 C=CCCCCCCCCOC(C)C(=O)OC 7a_100011215194_100000211248 [0,2,0,0,0,0|0,0,2]=4 12730 B16R0.70 C=CCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100011933949 [0,2,0,0,0,0|0,0,2]=4 12731 B16R0.70 C=CCCCCCCCCSC(C)C(=O)OC 62a_100011933949_100000211248 [0,2,0,0,0,0|0,0,2]=4 12732 B16R0.70 C=CCCCCCCCOCC(C)C(=O)OC 34a_100000730831_100000698445 [0,2,0,0,0,0|0,0,2]=4 12733 B16R0.70 C=CCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100012355270 [0,2,0,0,0,0|0,0,2]=4 12734 B16R0.70 C=CCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100012355270 [0,2,0,0,0,0|0,0,2]=4 12735 B16R0.70 C=CCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100012355270 [0,2,0,0,0,0|0,0,2]=4 12736 B16R0.70 C=CCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100012355270 [0,2,0,0,0,0|0,0,2]=4 12737 B16R0.70 C=CCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100012355270 [0,2,0,0,0,0|0,0,2]=4 12738 B16R0.70 C=CCCCCCCCSCC(C)C(=O)OC 62a_100012355270_100000698445 [0,2,0,0,0,0|0,0,2]=4 12739 B16R0.70 C=CCCCCCCOCCC(C)C(=O)OC 34a_200011216477_100000034942 [0,2,0,0,0,0|0,0,2]=4 12740 B16R0.70 C=CCCCCCCOCCC(C)C(=O)OC 7a_200011216477_100000034942 [0,2,0,0,0,0|0,0,2]=4 12741 B16R0.70 C=CCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100011215473 [0,2,0,0,0,0|0,0,2]=4 12742 B16R0.70 C=CCCCCCCSCCC(C)C(=O)OC 62a_100011215473_100000034942 [0,2,0,0,0,0|0,0,2]=4 12743 B16R0.70 CC(C#N)C(=O)CCCCCCCCCCO 1458a_100000753662_100009813290 [0,2,0,0,0,0|2,0,0]=4 12744 B16R0.70 CC/C=C\CCCCCOCC(C)C(=O)OC 34a_100016268722_100000698445 [0,2,0,0,0,0|0,0,2]=4 12745 B16R0.70 CC/C=C\CCCCOCCC(C)C(=O)OC 34a_100016287862_100000034942 [0,2,0,0,0,0|0,0,2]=4 12746 B16R0.70 CC/C=C\CCCCOCCC(C)C(=O)OC 7a_100016287862_100000034942 [0,2,0,0,0,0|0,0,2]=4 12747 B16R0.70 CCC#CCCCCCCOC(C)C(=O)OC 34a_100011215400_200000036426 [0,2,0,0,0,0|0,0,2]=4 12748 B16R0.70 CCC#CCCCCCCSC(C)C(=O)OC 62a_100000211248_200000036426 [0,2,0,0,0,0|0,0,2]=4 12749 B16R0.70 CCC#CCCCCCCSC(C)C(=O)OC 62a_200000036426_100000211248 [0,2,0,0,0,0|0,0,2]=4 12750 B16R0.70 CCC(=O)C(C)NCCCCCCCCCO 2230a_100000078944_100000742827 [0,2,0,0,0,0|2,0,0]=4 12751 B16R0.70 CCC(=O)C(C)OCCCCCCCCCBr 7a_100009813782_100000742827 [0,2,0,0,0,0|2,0,0]=4 12752 B16R0.70 CCC(=O)C(C)OCCCCCCCCCCl 7a_100009868337_100000742827 [0,2,0,0,0,0|2,0,0]=4 12753 B16R0.70 CCC(=O)C(C)SCCCCCCCCCO 62a_100000742827_100009813782 [0,2,0,0,0,0|2,0,0]=4 12754 B16R0.70 CCC(=O)C(C)SCCCCCCCCCO 62a_100009813782_100000742827 [0,2,0,0,0,0|2,0,0]=4 12755 B16R0.70 CCC(C)C(=O)CCCCCCCCCCO 1458a_100011192722_100009813290 [0,2,0,0,0,0|2,0,0]=4 12756 B16R0.70 CCC(O)C(=O)CCCCCCCCCCO 1458a_100011196387_100009813290 [0,2,0,0,0,0|2,0,0]=4 12757 B16R0.70 CCCC/C=C/CCCCOC(C)C(=O)OC 34a_200020645093_100000211248 [0,2,0,0,0,0|0,0,2]=4 12758 B16R0.70 CCCC/C=C/CCCCOC(C)C(=O)OC 7a_200020645093_100000211248 [0,2,0,0,0,0|0,0,2]=4 12759 B16R0.70 CCCC/C=C\CCOCCC(C)C(=O)OC 34a_200016286491_100000034942 [0,2,0,0,0,0|0,0,2]=4 12760 B16R0.70 CCCC/C=C\CCOCCC(C)C(=O)OC 7a_200016286491_100000034942 [0,2,0,0,0,0|0,0,2]=4 12761 B16R0.70 CCCCC#CCCCCOC(C)C(=O)OC 34a_200000066234_100000211248 [0,2,0,0,0,0|0,0,2]=4 12762 B16R0.70 CCCCC#CCCCCOC(C)C(=O)OC 7a_200000066234_100000211248 [0,2,0,0,0,0|0,0,2]=4 12763 B16R0.70 CCCCC#CCCCOCC(C)C(=O)OC 34a_100000749362_200000047210 [0,2,0,0,0,0|0,0,2]=4 12764 B16R0.70 CCCCC#CCCCOCC(C)C(=O)OC 7a_100000749362_200000047210 [0,2,0,0,0,0|0,0,2]=4 12765 B16R0.70 CCCCC#CCCCOCC(F)C(=O)OC 34a_200009849844_200000047210 [0,2,0,0,0,0|0,0,2]=4 12766 B16R0.70 CCCCC#CCCCOC[C@@H](N)C(=O)OC 34a_100000003586_200000047210 [0,2,0,0,0,0|0,0,2]=4 12767 B16R0.70 CCCCC#CCCCSCC(C)C(=O)OC 62a_100000698445_200000047210 [0,2,0,0,0,0|0,0,2]=4 12768 B16R0.70 CCCCC#CCCCSCC(C)C(=O)OC 62a_200000047210_100000698445 [0,2,0,0,0,0|0,0,2]=4 12769 B16R0.70 CCCCC#CCCOCCC(C)C(=O)OC 34a_100000037610_100000034942 [0,2,0,0,0,0|0,0,2]=4 12770 B16R0.70 CCCCC#CCCOCCC(C)C(=O)OC 7a_100000037610_100000034942 [0,2,0,0,0,0|0,0,2]=4 12771 B16R0.70 CCCCC/C=C/COCCC(C)C(=O)OC 34a_100016258190_100000034942 [0,2,0,0,0,0|0,0,2]=4 12772 B16R0.70 CCCCC/C=C/COCCC(C)C(=O)OC 7a_100016258190_100000034942 [0,2,0,0,0,0|0,0,2]=4 12773 B16R0.70 CCCCC/C=C\CCCOC(C)C(=O)OC 34a_100020655193_100000211248 [0,2,0,0,0,0|0,0,2]=4 12774 B16R0.70 CCCCC/C=C\CCCOC(C)C(=O)OC 7a_100020655193_100000211248 [0,2,0,0,0,0|0,0,2]=4 12775 B16R0.70 CCCCC/C=C\CCOCC(C)C(=O)OC 34a_100016277358_100000698445 [0,2,0,0,0,0|0,0,2]=4 12776 B16R0.70 CCCCCC#CCCOCC(C)C(=O)OC 34a_200000042877_100000698445 [0,2,0,0,0,0|0,0,2]=4 12777 B16R0.70 CCCCCC#CCOCCC(C)C(=O)OC 34a_200000033628_100000034942 [0,2,0,0,0,0|0,0,2]=4 12778 B16R0.70 CCCCCC#CCOCCC(C)C(=O)OC 7a_200000033628_100000034942 [0,2,0,0,0,0|0,0,2]=4 12779 B16R0.70 CCCCCC#CCSCCC(C)C(=O)OC 62a_100000034942_100009816472 [0,2,0,0,0,0|0,0,2]=4 12780 B16R0.70 CCCCCC#CCSCCC(C)C(=O)OC 62a_100009816472_100000034942 [0,2,0,0,0,0|0,0,2]=4 12781 B16R0.70 CCCCCC/C=C/COCC(C)C(=O)OC 34a_200016276170_100000698445 [0,2,0,0,0,0|0,0,2]=4 12782 B16R0.70 CCCCCCC#CCCOC(C)C(=O)OC 34a_200000033163_100000211248 [0,2,0,0,0,0|0,0,2]=4 12783 B16R0.70 CCCCCCC#CCCOC(C)C(=O)OC 7a_200000033163_100000211248 [0,2,0,0,0,0|0,0,2]=4 12784 B16R0.70 CCCCCCC#CCOCC(C)C(=O)OC 34a_200000037284_100000698445 [0,2,0,0,0,0|0,0,2]=4 12785 B16R0.70 CCCCCCCC#CCOC(C)C(=O)OC 34a_200000061759_100000211248 [0,2,0,0,0,0|0,0,2]=4 12786 B16R0.70 CCCCCCCC#CCOC(C)C(=O)OC 7a_200000061759_100000211248 [0,2,0,0,0,0|0,0,2]=4 12787 B16R0.70 CCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100011215454 [0,2,0,0,0,0|1,0,0]=3 12788 B16R0.70 CCCCCCCCCCCC(=O)C(C)C#N 1458a_100000210736_100000703298 [0,2,0,0,0,0|1,0,0]=3 12789 B16R0.70 CCCCCCCCCCCC(=O)C(C)C#N 1458a_100000753662_100011215454 [0,2,0,0,0,0|1,0,0]=3 12790 B16R0.70 CCCCCCCCCCCC(=O)C(C)CC 1458a_100000210736_100000758301 [0,2,0,0,0,0|1,0,0]=3 12791 B16R0.70 CCCCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100011215454 [0,2,0,0,0,0|1,0,0]=3 12792 B16R0.70 CCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100011215454 [0,2,0,0,0,0|0,0,0]=2 12793 B16R0.70 CCCCCCCCCCCC(=O)C(C)SC 1458a_100000149566_100011215454 [0,2,0,0,0,0|0,1,0]=3 12794 B16R0.70 CCCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100011215454 [0,2,0,0,0,0|1,0,0]=3 12795 B16R0.70 CCCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100011215454 [0,2,0,0,0,0|1,0,0]=3 12796 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000210736 [0,2,0,0,0,0|1,0,0]=3 12797 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000210736 [0,2,0,0,0,0|1,0,0]=3 12798 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000210736 [0,2,0,0,0,0|1,0,0]=3 12799 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC 1626a_100000684558_100011218921 [0,2,0,0,0,0|1,0,1]=4 12800 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC 240690a_100000684558_100011218921 [0,2,0,0,0,0|1,0,1]=4 12801 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC 527a_100000684558_100011218921 [0,2,0,0,0,0|1,0,1]=4 12802 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 11a_100000684558_100000024059 [0,2,0,0,0,0|0,0,1]=3 12803 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 1626a_100000684558_100000024059 [0,2,0,0,0,0|0,0,1]=3 12804 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 240690a_100000684558_100000024059 [0,2,0,0,0,0|0,0,1]=3 12805 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 527a_100000684558_100000024059 [0,2,0,0,0,0|0,0,1]=3 12806 B16R0.70 CCCCCCCCCCNC(=O)C(C)C#N 11a_100000684558_100000753662 [0,2,0,0,0,0|2,0,0]=4 12807 B16R0.70 CCCCCCCCCCNC(=O)C(C)C#N 1626a_100000684558_100000753662 [0,2,0,0,0,0|2,0,0]=4 12808 B16R0.70 CCCCCCCCCCNC(=O)C(C)C#N 240690a_100000684558_100000753662 [0,2,0,0,0,0|2,0,0]=4 12809 B16R0.70 CCCCCCCCCCNC(=O)C(C)C#N 527a_100000684558_100000753662 [0,2,0,0,0,0|2,0,0]=4 12810 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 11a_100000684558_100011192722 [0,2,0,0,0,0|2,0,0]=4 12811 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 1626a_100000684558_100011192722 [0,2,0,0,0,0|2,0,0]=4 12812 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 240690a_100000684558_100011192722 [0,2,0,0,0,0|2,0,0]=4 12813 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 527a_100000684558_100011192722 [0,2,0,0,0,0|2,0,0]=4 12814 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 11a_100000684558_100000743197 [0,2,0,0,0,0|1,0,0]=3 12815 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 1626a_100000684558_100000743197 [0,2,0,0,0,0|1,0,0]=3 12816 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 240690a_100000684558_100000743197 [0,2,0,0,0,0|1,0,0]=3 12817 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 527a_100000684558_100000743197 [0,2,0,0,0,0|1,0,0]=3 12818 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 11a_100000684558_100000149566 [0,2,0,0,0,0|1,1,0]=4 12819 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 1626a_100000684558_100000149566 [0,2,0,0,0,0|1,1,0]=4 12820 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 240690a_100000684558_100000149566 [0,2,0,0,0,0|1,1,0]=4 12821 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 527a_100000684558_100000149566 [0,2,0,0,0,0|1,1,0]=4 12822 B16R0.70 CCCCCCCCCCNC(=O)C(O)CC 240690a_100000684558_100011196387 [0,2,0,0,0,0|2,0,0]=4 12823 B16R0.70 CCCCCCCCCCNC(=O)C(O)CO 240690a_100000684558_100011215603 [0,2,0,0,0,0|2,0,0]=4 12824 B16R0.70 CCCCCCCCCCNC(=O)N(C)CC 2708a_100000684558_100000225621 [0,2,0,0,0,0|2,0,0]=4 12825 B16R0.70 CCCCCCCCCCNC(=O)N(C)CC 273464a_100000684558_100000225621 [0,2,0,0,0,0|2,0,0]=4 12826 B16R0.70 CCCCCCCCCCNC(C)C(=O)CC 2230a_100000684558_100000742827 [0,2,0,0,0,0|1,0,0]=3 12827 B16R0.70 CCCCCCCCCCNC(C)C(=O)NC 2230a_100000684558_100000731044 [0,2,0,0,0,0|1,0,0]=3 12828 B16R0.70 CCCCCCCCCCNC(C)C(=O)NC 34a_100000684558_100000731044 [0,2,0,0,0,0|1,0,0]=3 12829 B16R0.70 CCCCCCCCCCNC(C)C(=O)OC 2230a_100000684558_100000211248 [0,2,0,0,0,0|0,0,0]=2 12830 B16R0.70 CCCCCCCCCCNC(C)C(=O)OC 34a_100000684558_100000211248 [0,2,0,0,0,0|0,0,0]=2 12831 B16R0.70 CCCCCCCCCCNC(F)C(=O)NC 2230a_100000684558_100009813575 [0,2,0,0,0,0|1,0,0]=3 12832 B16R0.70 CCCCCCCCCCNC(F)C(=O)NC 34a_100000684558_100009813575 [0,2,0,0,0,0|1,0,0]=3 12833 B16R0.70 CCCCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210320 [0,2,0,0,0,0|1,0,0]=3 12834 B16R0.70 CCCCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100000210320 [0,2,0,0,0,0|1,0,0]=3 12835 B16R0.70 CCCCCCCCCCOC(C)C(=O)CC 7a_100000210711_100000742827 [0,2,0,0,0,0|1,0,0]=3 12836 B16R0.70 CCCCCCCCCCOC(C)C(=O)NC 34a_100000210711_100000731044 [0,2,0,0,0,0|1,0,0]=3 12837 B16R0.70 CCCCCCCCCCOC(C)C(=O)NC 7a_100000210711_100000209862 [0,2,0,0,0,0|1,0,0]=3 12838 B16R0.70 CCCCCCCCCCOC(C)C(=O)NN 34a_100000725659_100000210320 [0,2,0,0,0,0|2,0,0]=4 12839 B16R0.70 CCCCCCCCCCOC(C)C(=O)OC 34a_100000210711_100000211248 [0,2,0,0,0,0|0,0,0]=2 12840 B16R0.70 CCCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100000210320 [0,2,0,0,0,0|0,0,0]=2 12841 B16R0.70 CCCCCCCCCCOC(C)C(=O)OC 7a_100000210711_100000211248 [0,2,0,0,0,0|0,0,0]=2 12842 B16R0.70 CCCCCCCCCCOC(F)C(=O)NC 34a_100000210711_100009813575 [0,2,0,0,0,0|1,0,0]=3 12843 B16R0.70 CCCCCCCCCCOC(F)C(=O)NC 7a_100000210711_100009813575 [0,2,0,0,0,0|1,0,0]=3 12844 B16R0.70 CCCCCCCCCCSC(C)C(=O)CC 62a_100000742827_100000210320 [0,2,0,0,0,0|1,0,0]=3 12845 B16R0.70 CCCCCCCCCCSC(C)C(=O)NC 62a_100000209862_100000210320 [0,2,0,0,0,0|1,0,0]=3 12846 B16R0.70 CCCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100000210320 [0,2,0,0,0,0|0,0,0]=2 12847 B16R0.70 CCCCCCCCCCSC(F)C(=O)NC 62a_100009813575_100000210320 [0,2,0,0,0,0|1,0,0]=3 12848 B16R0.70 CCCCCCCCCNCC(=O)C(=O)OC 34a_100000212291_100011610305 [0,2,0,0,0,0|0,0,1]=3 12849 B16R0.70 CCCCCCCCCNCC(=O)N(C)CC 2230a_100000212291_100000738999 [0,2,0,0,0,0|2,0,0]=4 12850 B16R0.70 CCCCCCCCCNCC(=O)N(C)CC 34a_100000212291_100000738999 [0,2,0,0,0,0|2,0,0]=4 12851 B16R0.70 CCCCCCCCCNCC(=O)N(C)OC 2230a_100000212291_100000764215 [0,2,0,0,0,0|1,0,0]=3 12852 B16R0.70 CCCCCCCCCNCC(=O)N(C)OC 2230a_100015207273_100011214924 [0,2,0,0,0,0|1,0,0]=3 12853 B16R0.70 CCCCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100011214924 [0,2,0,0,0,0|1,0,0]=3 12854 B16R0.70 CCCCCCCCCNCC(C)C(=O)NC 34a_100015187722_100011214924 [0,2,0,0,0,0|1,0,0]=3 12855 B16R0.70 CCCCCCCCCNCC(C)C(=O)OC 34a_100000212291_100000698445 [0,2,0,0,0,0|0,0,0]=2 12856 B16R0.70 CCCCCCCCCOCC(=O)C(=O)OC 34a_100000210712_100011610305 [0,2,0,0,0,0|0,0,1]=3 12857 B16R0.70 CCCCCCCCCOCC(=O)N(C)CC 34a_100000210712_100000738999 [0,2,0,0,0,0|2,0,0]=4 12858 B16R0.70 CCCCCCCCCOCC(=O)N(C)CC 7a_100000210712_100000738999 [0,2,0,0,0,0|2,0,0]=4 12859 B16R0.70 CCCCCCCCCOCC(=O)N(C)OC 7a_100000210712_100000764215 [0,2,0,0,0,0|1,0,0]=3 12860 B16R0.70 CCCCCCCCCOCC(C)C(=O)OC 34a_100000210712_100000698445 [0,2,0,0,0,0|0,0,0]=2 12861 B16R0.70 CCCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100011214924 [0,2,0,0,0,0|0,0,0]=2 12862 B16R0.70 CCCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210328 [0,2,0,0,0,0|0,0,0]=2 12863 B16R0.70 CCCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100011214924 [0,2,0,0,0,0|0,0,0]=2 12864 B16R0.70 CCCCCCCCCOCC(N)C(=O)NN 34a_100016989258_100011214924 [0,2,0,0,0,0|2,0,0]=4 12865 B16R0.70 CCCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011214924 [0,2,0,0,0,0|0,0,0]=2 12866 B16R0.70 CCCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210670 [0,2,0,0,0,0|0,0,1]=3 12867 B16R0.70 CCCCCCCCCSCC(=O)N(C)CC 62a_100000738999_100000210670 [0,2,0,0,0,0|2,0,0]=4 12868 B16R0.70 CCCCCCCCCSCC(=O)N(C)OC 62a_100000764215_100000210670 [0,2,0,0,0,0|1,0,0]=3 12869 B16R0.70 CCCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210670 [0,2,0,0,0,0|0,0,0]=2 12870 B16R0.70 CCCCCCCCNCCC(C)C(=O)OC 2230a_100000229939_100000034942 [0,2,0,0,0,0|0,0,0]=2 12871 B16R0.70 CCCCCCCCNCCC(C)C(=O)OC 34a_100000229939_100000034942 [0,2,0,0,0,0|0,0,0]=2 12872 B16R0.70 CCCCCCCCOCCC(C)C(=O)OC 34a_100000210232_100000034942 [0,2,0,0,0,0|0,0,0]=2 12873 B16R0.70 CCCCCCCCOCCC(C)C(=O)OC 7a_100000210232_100000034942 [0,2,0,0,0,0|0,0,0]=2 12874 B16R0.70 CCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210317 [0,2,0,0,0,0|0,0,0]=2 12875 B16R0.70 CCCCCCCCSCCC(C)C(=O)OC 62a_100000210759_100000034942 [0,2,0,0,0,0|0,0,0]=2 12876 B16R0.70 CCCCCCCOCCCC(=O)N(C)OC 7a_100000210272_100011842776 [0,2,0,0,0,0|1,0,0]=3 12877 B16R0.70 CCCCCCCSCCCC(=O)N(C)OC 62a_100000210614_100011842776 [0,2,0,0,0,0|1,0,0]=3 12878 B16R0.70 CCCCCCCSCCCC(=O)N(C)OC 62a_100011842776_100000210316 [0,2,0,0,0,0|1,0,0]=3 12879 B16R0.70 CCCCCCOCCOCC(=O)C(=O)OC 34a_100000691444_100011610305 [0,2,0,0,0,0|1,0,1]=4 12880 B16R0.70 CCCCCCOCCOCC(=O)N(C)OC 7a_100000691444_100000764215 [0,2,0,0,0,0|2,0,0]=4 12881 B16R0.70 CCCCCCOCCOCC(C)C(=O)OC 34a_100000691444_100000698445 [0,2,0,0,0,0|1,0,0]=3 12882 B16R0.70 CCCCCNCCOCCC(C)C(=O)OC 34a_100000224656_100000034942 [0,2,0,0,0,0|1,0,0]=3 12883 B16R0.70 CCCCCOCCOCCC(C)C(=O)OC 34a_100011215259_100000034942 [0,2,0,0,0,0|1,0,0]=3 12884 B16R0.70 CCCCCOCCOCCC(C)C(=O)OC 7a_100011215259_100000034942 [0,2,0,0,0,0|1,0,0]=3 12885 B16R0.70 CCCCNCCCCOCC(=O)C(=O)OC 34a_200011216965_100011610305 [0,2,0,0,0,0|1,0,1]=4 12886 B16R0.70 CCCCNCCCCOCC(C)C(=O)OC 34a_200011216965_100000698445 [0,2,0,0,0,0|1,0,0]=3 12887 B16R0.70 CCCCOCCCCOCC(=O)C(=O)OC 34a_200000760531_100011610305 [0,2,0,0,0,0|1,0,1]=4 12888 B16R0.70 CCCCOCCCCOCC(=O)N(C)OC 7a_200000760531_100000764215 [0,2,0,0,0,0|2,0,0]=4 12889 B16R0.70 CCCCOCCCCOCC(C)C(=O)OC 34a_200000760531_100000698445 [0,2,0,0,0,0|1,0,0]=3 12890 B16R0.70 CCCCOCCCNCCC(C)C(=O)OC 2230a_200000211371_100000034942 [0,2,0,0,0,0|1,0,0]=3 12891 B16R0.70 CCCCOCCCNCCC(C)C(=O)OC 34a_200000211371_100000034942 [0,2,0,0,0,0|1,0,0]=3 12892 B16R0.70 CCCCOCCCOCCC(C)C(=O)OC 34a_200011215613_100000034942 [0,2,0,0,0,0|1,0,0]=3 12893 B16R0.70 CCCCOCCCOCCC(C)C(=O)OC 7a_200011215613_100000034942 [0,2,0,0,0,0|1,0,0]=3 12894 B16R0.70 CCCCOCCOCCCC(=O)N(C)OC 7a_100000210238_100011842776 [0,2,0,0,0,0|2,0,0]=4 12895 B16R0.70 CCCCOCCOCCOC(C)C(=O)OC 34a_100011215186_100000211248 [0,2,0,0,0,0|2,0,0]=4 12896 B16R0.70 CCCCOCCOCCOC(C)C(=O)OC 7a_100011215186_100000211248 [0,2,0,0,0,0|2,0,0]=4 12897 B16R0.70 CCCCOCCSCCCC(=O)N(C)OC 62a_100000743108_100011842776 [0,2,0,0,0,0|2,0,0]=4 12898 B16R0.70 CCCCOCCSCCCC(=O)N(C)OC 62a_100011842776_100000743108 [0,2,0,0,0,0|2,0,0]=4 12899 B16R0.70 CCCCSCCOCCCC(=O)N(C)OC 7a_200000230436_100011842776 [0,2,0,0,0,0|2,0,0]=4 12900 B16R0.70 CCCOCCOCCNCC(C)C(=O)OC 34a_200011904461_100000698445 [0,2,0,0,0,0|2,0,0]=4 12901 B16R0.70 CCN(C)C(=O)CCCCCCCCCCO 240690a_100000225621_200000016029 [0,2,0,0,0,0|2,0,0]=4 12902 B16R0.70 CCOCCOCCNCCC(C)C(=O)OC 2230a_100102712874_100000034942 [0,2,0,0,0,0|2,0,0]=4 12903 B16R0.70 CCOCCOCCNCCC(C)C(=O)OC 34a_100102712874_100000034942 [0,2,0,0,0,0|2,0,0]=4 12904 B16R0.70 CCOCCOCCOCCC(C)C(=O)OC 34a_100000210240_100000034942 [0,2,0,0,0,0|2,0,0]=4 12905 B16R0.70 CCOCCOCCOCCC(C)C(=O)OC 7a_100000210240_100000034942 [0,2,0,0,0,0|2,0,0]=4 12906 B16R0.70 CCOCCOCCSCCC(C)C(=O)OC 62a_100000034942_100011211534 [0,2,0,0,0,0|2,0,0]=4 12907 B16R0.70 CCOCCOCCSCCC(C)C(=O)OC 62a_100011211534_100000034942 [0,2,0,0,0,0|2,0,0]=4 12908 B16R0.70 CNC(=O)C(=O)CCCCCCCCCCO 1458a_100011218921_100009813290 [0,2,0,0,0,0|1,0,1]=4 12909 B16R0.70 CNC(=O)C(C)CNCCCCCCCCO 2230a_100015187722_100000033203 [0,2,0,0,0,0|2,0,0]=4 12910 B16R0.70 CNC(=O)C(C)CNCCCCCCCCO 34a_100015187722_100000033203 [0,2,0,0,0,0|2,0,0]=4 12911 B16R0.70 CNC(=O)C(C)NCCCCCCCCCO 2230a_100000078944_100000731044 [0,2,0,0,0,0|2,0,0]=4 12912 B16R0.70 CNC(=O)C(C)NCCCCCCCCCO 34a_100000078944_100000731044 [0,2,0,0,0,0|2,0,0]=4 12913 B16R0.70 CNC(=O)C(C)OCCCCCCCCCBr 34a_100009813782_100000731044 [0,2,0,0,0,0|2,0,0]=4 12914 B16R0.70 CNC(=O)C(C)OCCCCCCCCCBr 7a_100009813782_100000209862 [0,2,0,0,0,0|2,0,0]=4 12915 B16R0.70 CNC(=O)C(C)OCCCCCCCCCCl 34a_100009868337_100000731044 [0,2,0,0,0,0|2,0,0]=4 12916 B16R0.70 CNC(=O)C(C)OCCCCCCCCCCl 7a_100009868337_100000209862 [0,2,0,0,0,0|2,0,0]=4 12917 B16R0.70 CNC(=O)C(C)OCCCCCCCCCN 34a_100000078944_100000731044 [0,2,0,0,0,0|2,0,0]=4 12918 B16R0.70 CNC(=O)C(C)SCCCCCCCCCO 62a_100000209862_100009813782 [0,2,0,0,0,0|2,0,0]=4 12919 B16R0.70 CNC(=O)C(C)SCCCCCCCCCO 62a_100009813782_100000731044 [0,2,0,0,0,0|2,0,0]=4 12920 B16R0.70 CNC(=O)C(F)NCCCCCCCCCO 2230a_100000078944_100009813575 [0,2,0,0,0,0|2,0,0]=4 12921 B16R0.70 CNC(=O)C(F)NCCCCCCCCCO 34a_100000078944_100009813575 [0,2,0,0,0,0|2,0,0]=4 12922 B16R0.70 CNC(=O)C(F)OCCCCCCCCCBr 34a_100009813782_100009813575 [0,2,0,0,0,0|2,0,0]=4 12923 B16R0.70 CNC(=O)C(F)OCCCCCCCCCBr 7a_100009813782_100009813575 [0,2,0,0,0,0|2,0,0]=4 12924 B16R0.70 CNC(=O)C(F)OCCCCCCCCCCl 34a_100009868337_100009813575 [0,2,0,0,0,0|2,0,0]=4 12925 B16R0.70 CNC(=O)C(F)OCCCCCCCCCCl 7a_100009868337_100009813575 [0,2,0,0,0,0|2,0,0]=4 12926 B16R0.70 CNC(=O)C(F)OCCCCCCCCCN 34a_100000078944_100009813575 [0,2,0,0,0,0|2,0,0]=4 12927 B16R0.70 CNC(=O)C(F)SCCCCCCCCCO 62a_100009813575_100009813782 [0,2,0,0,0,0|2,0,0]=4 12928 B16R0.70 CNC(=O)C(F)SCCCCCCCCCO 62a_100009813782_100009813575 [0,2,0,0,0,0|2,0,0]=4 12929 B16R0.70 CNC(=O)[C@@H](C)NCCCCCCCCCO 2230a_100000684985_100009813782 [0,2,0,0,0,0|2,0,0]=4 12930 B16R0.70 CNC(=O)[C@@H](C)NCCCCCCCCCO 34a_100000684985_100009813782 [0,2,0,0,0,0|2,0,0]=4 12931 B16R0.70 COC(=O)C(=O)CNCCCCCCCCO 34a_102515433106_100011610305 [0,2,0,0,0,0|1,0,1]=4 12932 B16R0.70 COC(=O)C(=O)COCCCCCCCCBr 34a_100009813846_100011610305 [0,2,0,0,0,0|1,0,1]=4 12933 B16R0.70 COC(=O)C(=O)COCCCCCCCCCl 34a_100000033203_100011610305 [0,2,0,0,0,0|1,0,1]=4 12934 B16R0.70 COC(=O)C(=O)COCCCCCCCCN 34a_102515433106_100011610305 [0,2,0,0,0,0|1,0,1]=4 12935 B16R0.70 COC(=O)C(=O)CSCCCCCCCCO 62a_100000033203_100011610305 [0,2,0,0,0,0|1,0,1]=4 12936 B16R0.70 COC(=O)C(=O)CSCCCCCCCCO 62a_100011610305_100000033203 [0,2,0,0,0,0|1,0,1]=4 12937 B16R0.70 COC(=O)C(=O)NCCCCCCCCCO 240690a_100000078944_100000024059 [0,2,0,0,0,0|1,0,1]=4 12938 B16R0.70 COC(=O)C(C)CCNCCCCCCCO 2230a_100011996573_100000034942 [0,2,0,0,0,0|1,0,0]=3 12939 B16R0.70 COC(=O)C(C)CCNCCCCCCCO 34a_100011996573_100000034942 [0,2,0,0,0,0|1,0,0]=3 12940 B16R0.70 COC(=O)C(C)CCNCCCOCCCO 2230a_100011310245_100000034942 [0,2,0,0,0,0|2,0,0]=4 12941 B16R0.70 COC(=O)C(C)CCNCCCOCCCO 34a_100011310245_100000034942 [0,2,0,0,0,0|2,0,0]=4 12942 B16R0.70 COC(=O)C(C)CCOCCCCCCCBr 34a_100000760002_100000034942 [0,2,0,0,0,0|1,0,0]=3 12943 B16R0.70 COC(=O)C(C)CCOCCCCCCCBr 7a_100000760002_100000034942 [0,2,0,0,0,0|1,0,0]=3 12944 B16R0.70 COC(=O)C(C)CCOCCCCCCCN 34a_100011996573_100000034942 [0,2,0,0,0,0|1,0,0]=3 12945 B16R0.70 COC(=O)C(C)CCOCCCOCCCN 34a_100011310245_100000034942 [0,2,0,0,0,0|2,0,0]=4 12946 B16R0.70 COC(=O)C(C)CCSCCCCCCC#N 62a_100000034942_100009813337 [0,2,0,0,0,0|1,0,1]=4 12947 B16R0.70 COC(=O)C(C)CCSCCCCCCC#N 62a_100009813337_100000034942 [0,2,0,0,0,0|1,0,1]=4 12948 B16R0.70 COC(=O)C(C)CCSCCCCCCCO 62a_100000034942_100000760002 [0,2,0,0,0,0|1,0,0]=3 12949 B16R0.70 COC(=O)C(C)CCSCCCCCCCO 62a_100000760002_100000034942 [0,2,0,0,0,0|1,0,0]=3 12950 B16R0.70 COC(=O)C(C)CNCCCCCCCCO 34a_102515433106_100000698445 [0,2,0,0,0,0|1,0,0]=3 12951 B16R0.70 COC(=O)C(C)COCCCCCCCCBr 34a_100009813846_100000698445 [0,2,0,0,0,0|1,0,0]=3 12952 B16R0.70 COC(=O)C(C)COCCCCCCCCCl 34a_100000033203_100000698445 [0,2,0,0,0,0|1,0,0]=3 12953 B16R0.70 COC(=O)C(C)COCCCCCCCCN 34a_102515433106_100000698445 [0,2,0,0,0,0|1,0,0]=3 12954 B16R0.70 COC(=O)C(C)COCCCCCCCCO 34a_100000749362_100000033203 [0,2,0,0,0,0|1,0,0]=3 12955 B16R0.70 COC(=O)C(C)COCCCCCCCCO 7a_100000749362_100000033203 [0,2,0,0,0,0|1,0,0]=3 12956 B16R0.70 COC(=O)C(C)COCCCCCNCCN 34a_103619048469_100000698445 [0,2,0,0,0,0|2,0,0]=4 12957 B16R0.70 COC(=O)C(C)CSCCCCCCCCO 62a_100000033203_100000698445 [0,2,0,0,0,0|1,0,0]=3 12958 B16R0.70 COC(=O)C(C)CSCCCCCCCCO 62a_100000698445_100000033203 [0,2,0,0,0,0|1,0,0]=3 12959 B16R0.70 COC(=O)C(C)NCCCCCCCCCO 2230a_100000078944_100000211248 [0,2,0,0,0,0|1,0,0]=3 12960 B16R0.70 COC(=O)C(C)NCCCCCCCCCO 34a_100000078944_100000211248 [0,2,0,0,0,0|1,0,0]=3 12961 B16R0.70 COC(=O)C(C)OCCCCCCCCCBr 34a_100009813782_100000211248 [0,2,0,0,0,0|1,0,0]=3 12962 B16R0.70 COC(=O)C(C)OCCCCCCCCCBr 7a_100009813782_100000211248 [0,2,0,0,0,0|1,0,0]=3 12963 B16R0.70 COC(=O)C(C)OCCCCCCCCCCl 34a_100009868337_100000211248 [0,2,0,0,0,0|1,0,0]=3 12964 B16R0.70 COC(=O)C(C)OCCCCCCCCCCl 7a_100009868337_100000211248 [0,2,0,0,0,0|1,0,0]=3 12965 B16R0.70 COC(=O)C(C)OCCCCCCCCCN 34a_100000078944_100000211248 [0,2,0,0,0,0|1,0,0]=3 12966 B16R0.70 COC(=O)C(C)OCCCCCCCCCO 34a_100011215400_100009813782 [0,2,0,0,0,0|1,0,0]=3 12967 B16R0.70 COC(=O)C(C)SCCCCCCCCCO 62a_100000211248_100009813782 [0,2,0,0,0,0|1,0,0]=3 12968 B16R0.70 COC(=O)C(C)SCCCCCCCCCO 62a_100009813782_100000211248 [0,2,0,0,0,0|1,0,0]=3 12969 B16R0.70 COC(=O)C(F)COCCCCCCCCO 34a_200009849844_100000033203 [0,2,0,0,0,0|1,0,0]=3 12970 B16R0.70 COC(=O)[C@H](N)COCCCCCCCCO 34a_100000003586_100000033203 [0,2,0,0,0,0|1,0,0]=3 12971 B16R0.70 COC(C)C(=O)CCCCCCCCCCO 1458a_100000743197_100009813290 [0,2,0,0,0,0|1,0,0]=3 12972 B16R0.70 COC(C)C(=O)NCCCCCCCCCO 240690a_100000078944_100000743197 [0,2,0,0,0,0|2,0,0]=4 12973 B16R0.70 COCCCCCCOCCC(C)C(=O)OC 34a_200012092642_100000034942 [0,2,0,0,0,0|1,0,0]=3 12974 B16R0.70 COCCCCCCOCCC(C)C(=O)OC 7a_200012092642_100000034942 [0,2,0,0,0,0|1,0,0]=3 12975 B16R0.70 COCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100011998445 [0,2,0,0,0,0|1,0,0]=3 12976 B16R0.70 COCCCCCCSCCC(C)C(=O)OC 62a_100011998445_100000034942 [0,2,0,0,0,0|1,0,0]=3 12977 B16R0.70 COCCCOCCCOCC(C)C(=O)OC 34a_200011215475_100000698445 [0,2,0,0,0,0|2,0,0]=4 12978 B16R0.70 COCCOCCCNCCC(C)C(=O)OC 2230a_100000206027_100000034942 [0,2,0,0,0,0|2,0,0]=4 12979 B16R0.70 COCCOCCCNCCC(C)C(=O)OC 34a_100000206027_100000034942 [0,2,0,0,0,0|2,0,0]=4 12980 B16R0.70 COCCOCCCSCCC(C)C(=O)OC 62a_100000034942_100011216529 [0,2,0,0,0,0|2,0,0]=4 12981 B16R0.70 COCCOCCCSCCC(C)C(=O)OC 62a_100011216529_100000034942 [0,2,0,0,0,0|2,0,0]=4 12982 B16R0.70 CON(C)C(=O)CCCOCCCCCCBr 7a_100011215345_100011842776 [0,2,0,0,0,0|2,0,0]=4 12983 B16R0.70 CON(C)C(=O)CCCOCCCCCCCl 7a_100000766143_100011842776 [0,2,0,0,0,0|2,0,0]=4 12984 B16R0.70 CON(C)C(=O)CCCOCCCCCCF 7a_100000732779_100011842776 [0,2,0,0,0,0|2,0,0]=4 12985 B16R0.70 CON(C)C(=O)CCCSCCCCCCF 62a_100011842776_100015922095 [0,2,0,0,0,0|2,0,0]=4 12986 B16R0.70 CON(C)C(=O)CCCSCCCCCCF 62a_100015922095_100011842776 [0,2,0,0,0,0|2,0,0]=4 12987 B16R0.70 CON(C)C(=O)CCCSCCCCCCO 62a_100000766143_100011842776 [0,2,0,0,0,0|2,0,0]=4 12988 B16R0.70 CON(C)C(=O)CCCSCCCCCCO 62a_100011842776_100000766143 [0,2,0,0,0,0|2,0,0]=4 12989 B16R0.70 CON(C)C(=O)CNCCCCCCCCO 2230a_100015207273_100000033203 [0,2,0,0,0,0|2,0,0]=4 12990 B16R0.70 CON(C)C(=O)CNCCCCCCCCO 2230a_102515433106_100000764215 [0,2,0,0,0,0|2,0,0]=4 12991 B16R0.70 CON(C)C(=O)COCCCCCCCCBr 7a_100009813846_100000764215 [0,2,0,0,0,0|2,0,0]=4 12992 B16R0.70 CON(C)C(=O)COCCCCCCCCCl 7a_100000033203_100000764215 [0,2,0,0,0,0|2,0,0]=4 12993 B16R0.70 CON(C)C(=O)CSCCCCCCCCO 62a_100000033203_100000764215 [0,2,0,0,0,0|2,0,0]=4 12994 B16R0.70 CON(C)C(=O)CSCCCCCCCCO 62a_100000764215_100000033203 [0,2,0,0,0,0|2,0,0]=4 12995 B16R0.70 CSC(C)C(=O)CCCCCCCCCCO 1458a_100000149566_100009813290 [0,2,0,0,0,0|1,1,0]=4 12996 B16R0.70 O=C(CCCCCCCCCCO)C(O)CO 1458a_100011215603_100009813290 [0,2,0,0,0,0|2,0,0]=4 12997 B16R0.108 C#CCCCCCC(=O)CCCCC(=O)OC 1458a_100000694772_100000204269 [0,2,0,0,0,0|0,0,2]=4 12998 B16R0.108 C#CCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100012094781 [0,2,0,0,0,0|0,0,2]=4 12999 B16R0.108 C=CCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000700193 [0,2,0,0,0,0|0,0,2]=4 13000 B16R0.108 C=CCCCCCC(=O)CCCCC(=O)OC 1458a_100011934241_100000204269 [0,2,0,0,0,0|0,0,2]=4 13001 B16R0.108 CCCC/C=C/CC(=O)CCCCC(=O)OC 1458a_200016282684_100000204269 [0,2,0,0,0,0|0,0,2]=4 13002 B16R0.108 CCCCCC#CC(=O)CCCCC(=O)OC 1458a_100011215388_100000204269 [0,2,0,0,0,0|0,0,2]=4 13003 B16R0.108 CCCCCC=CC(=O)CCCCC(=O)OC 1458a_100016263427_100000204269 [0,2,0,0,0,0|0,0,2]=4 13004 B16R0.108 CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000211969_100000204269 [0,2,0,0,0,0|0,0,0]=2 13005 B16R0.108 CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210614 [0,2,0,0,0,0|0,0,0]=2 13006 B16R0.108 CCCCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210614 [0,2,0,0,0,0|0,0,1]=3 13007 B16R0.108 CCCCCCCC(=O)CCOCC(=O)OC 1458a_100000211969_100000090808 [0,2,0,0,0,0|0,0,1]=3 13008 B16R0.108 CCCCCCCC(=O)NCCCC(=O)NC 11a_100000740002_100000211969 [0,2,0,0,0,0|1,0,1]=4 13009 B16R0.108 CCCCCCCC(=O)NCCCC(=O)NC 240690a_100000740002_100000211969 [0,2,0,0,0,0|1,0,1]=4 13010 B16R0.108 CCCCCCCC(=O)NCCCC(=O)NC 527a_100000740002_100000211969 [0,2,0,0,0,0|1,0,1]=4 13011 B16R0.108 CCCCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100000211969 [0,2,0,0,0,0|0,0,1]=3 13012 B16R0.108 CCCCCCCC(=O)OCSCC(=O)OC 62a_100000747449_100009852258 [0,2,0,0,0,0|1,0,1]=4 13013 B16R0.108 CCCCCCCC(C)NCCCC(=O)NC 2230a_100000740002_200011218727 [0,2,0,0,0,0|1,0,0]=3 13014 B16R0.108 CCCCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100000210596 [0,2,0,0,0,0|1,0,0]=3 13015 B16R0.108 CCCCCCCC(C)NCCCC(=O)NC 34a_100000740002_200011218727 [0,2,0,0,0,0|1,0,0]=3 13016 B16R0.108 CCCCCCCC(C)NCCNC(=O)CC 270004a_100132302217_100000210596 [0,2,0,0,0,0|2,0,0]=4 13017 B16R0.108 CCCCCCCC(C)NCCNC(=O)CC 34a_100132302217_200011218727 [0,2,0,0,0,0|2,0,0]=4 13018 B16R0.108 CCCCCCCC(C)NCCNC(=O)NC 34a_100015205895_200011218727 [0,2,0,0,0,0|2,0,0]=4 13019 B16R0.108 CCCCCCCC(C)OC/C=C/C(=O)OC 34a_200011215852_100000742655 [0,2,0,0,0,0|0,0,2]=4 13020 B16R0.108 CCCCCCCC(C)OC/C=C/C(=O)OC 7a_200011215852_100000742655 [0,2,0,0,0,0|0,0,2]=4 13021 B16R0.108 CCCCCCCC(C)OCCCC(=O)NC 34a_200011215852_100000741757 [0,2,0,0,0,0|1,0,0]=3 13022 B16R0.108 CCCCCCCC(C)OCCCC(=O)NC 7a_200011215852_100000741757 [0,2,0,0,0,0|1,0,0]=3 13023 B16R0.108 CCCCCCCC(C)OCCCC(=O)NN 34a_100000211488_200011218727 [0,2,0,0,0,0|2,0,0]=4 13024 B16R0.108 CCCCCCCC(C)OCCCC(=O)OC 34a_200011215852_100000742333 [0,2,0,0,0,0|0,0,0]=2 13025 B16R0.108 CCCCCCCC(C)OCCCC(=O)OC 7a_200011215852_100011218270 [0,2,0,0,0,0|0,0,0]=2 13026 B16R0.108 CCCCCCCC(C)OCCNC(=O)CC 34a_200000158885_200011218727 [0,2,0,0,0,0|2,0,0]=4 13027 B16R0.108 CCCCCCCC(C)OCCNC(=O)CC 7a_200000158885_200011218727 [0,2,0,0,0,0|2,0,0]=4 13028 B16R0.108 CCCCCCCC(C)OCCNC(=O)OC 34a_100000757965_200011218727 [0,2,0,0,0,0|1,0,0]=3 13029 B16R0.108 CCCCCCCC(C)OCCOC(=O)CC 7a_200000031056_200011218727 [0,2,0,0,0,0|2,0,0]=4 13030 B16R0.108 CCCCCCCC(C)OCCOC(=O)NC 34a_200011215852_200011997002 [0,2,0,0,0,0|2,0,0]=4 13031 B16R0.108 CCCCCCCC(C)OCCOC(=O)NC 7a_200011215852_200011997002 [0,2,0,0,0,0|2,0,0]=4 13032 B16R0.108 CCCCCCCC(C)OCCOC(=O)OC 34a_100010262106_200011218727 [0,2,0,0,0,0|1,0,0]=3 13033 B16R0.108 CCCCCCCC(C)SC/C=C/C(=O)OC 62a_100000742655_200011218727 [0,2,0,0,0,0|0,0,2]=4 13034 B16R0.108 CCCCCCCC(C)SC/C=C/C(=O)OC 62a_200011218727_100000742655 [0,2,0,0,0,0|0,0,2]=4 13035 B16R0.108 CCCCCCCC(C)SCCCC(=O)NC 62a_100000741757_200011218727 [0,2,0,0,0,0|1,0,0]=3 13036 B16R0.108 CCCCCCCC(C)SCCCC(=O)NC 62a_200011218727_100000741757 [0,2,0,0,0,0|1,0,0]=3 13037 B16R0.108 CCCCCCCC(C)SCCCC(=O)OC 62a_100011218270_200011218727 [0,2,0,0,0,0|0,0,0]=2 13038 B16R0.108 CCCCCCCC(C)SCCCC(=O)OC 62a_200011218727_100011218270 [0,2,0,0,0,0|0,0,0]=2 13039 B16R0.108 CCCCCCCC(C)SCCOC(=O)NC 62a_200011218727_200011997002 [0,2,0,0,0,0|2,0,0]=4 13040 B16R0.108 CCCCCCCC(C)SCCOC(=O)NC 62a_200011997002_200011218727 [0,2,0,0,0,0|2,0,0]=4 13041 B16R0.108 CCCCCCCN(C)CCCCC(=O)OC 2230a_100000228206_100000204269 [0,2,0,0,0,0|0,0,0]=2 13042 B16R0.108 CCCCCCCN(C)CCCCC(=O)OC 269982a_100000228206_100000204269 [0,2,0,0,0,0|0,0,0]=2 13043 B16R0.108 CCCCCCCN(C)CCOCC(=O)OC 2230a_100000228206_100000090808 [0,2,0,0,0,0|1,0,0]=3 13044 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 11a_100000210581_100000695723 [0,2,0,0,0,0|0,0,1]=3 13045 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 1626a_100000210581_100000695723 [0,2,0,0,0,0|0,0,1]=3 13046 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 240690a_100000210581_100000695723 [0,2,0,0,0,0|0,0,1]=3 13047 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 527a_100000210581_100000695723 [0,2,0,0,0,0|0,0,1]=3 13048 B16R0.108 CCCCCCNC(=O)CCCNC(=O)OC 11a_100000210581_100000753017 [0,2,0,0,0,0|1,0,1]=4 13049 B16R0.108 CCCCCCNC(=O)CCCNC(=O)OC 1626a_100000210581_100000753017 [0,2,0,0,0,0|1,0,1]=4 13050 B16R0.108 CCCCCCNC(=O)CCCNC(=O)OC 240690a_100000210581_100000753017 [0,2,0,0,0,0|1,0,1]=4 13051 B16R0.108 CCCCCCNC(=O)CCCNC(=O)OC 527a_100000210581_100000753017 [0,2,0,0,0,0|1,0,1]=4 13052 B16R0.108 CCCCCCNC(=O)CSCCC(=O)OC 62a_100000230325_100000204255 [0,2,0,0,0,0|1,0,1]=4 13053 B16R0.108 CCCCCNCC(=O)NCCCC(=O)OC 2230a_100000209983_100000230218 [0,2,0,0,0,0|1,0,1]=4 13054 B16R0.108 CCCCCNN=C(C)CCCCC(=O)OC 4a_100000694160_100010369326 [0,2,0,0,0,0|1,0,1]=4 13055 B16R0.108 CCCCCNNC(=O)CCCCC(=O)OC 22a_100000694160_100000695723 [0,2,0,0,0,0|1,0,1]=4 13056 B16R0.108 CCCCCOCC(=O)NCCCC(=O)OC 34a_100000210253_100000230218 [0,2,0,0,0,0|1,0,1]=4 13057 B16R0.108 CCCCCOCC(=O)NCCCC(=O)OC 7a_100000210253_100000230218 [0,2,0,0,0,0|1,0,1]=4 13058 B16R0.108 CCCCCSCC(=O)NCCCC(=O)OC 62a_100000210326_100000230218 [0,2,0,0,0,0|1,0,1]=4 13059 B16R0.108 CCCCCSCC(=O)NCCCC(=O)OC 62a_100000230218_100000210326 [0,2,0,0,0,0|1,0,1]=4 13060 B16R0.108 CCCCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000743108 [0,2,0,0,0,0|0,0,1]=3 13061 B16R0.108 CCCCOCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000743108 [0,2,0,0,0,0|1,0,1]=4 13062 B16R0.108 CCCOCCNC(=O)CCCCC(=O)OC 1626a_100161115042_100000695723 [0,2,0,0,0,0|1,0,1]=4 13063 B16R0.108 CCCOCCNC(=O)CCCCC(=O)OC 240690a_100161115042_100000695723 [0,2,0,0,0,0|1,0,1]=4 13064 B16R0.108 CCCOCCNC(=O)CCCCC(=O)OC 527a_100161115042_100000695723 [0,2,0,0,0,0|1,0,1]=4 13065 B16R0.108 CCCSCCNC(=O)CCCCC(=O)OC 11a_100020603323_100000695723 [0,2,0,0,0,0|1,0,1]=4 13066 B16R0.108 CCCSCCNC(=O)CCCCC(=O)OC 240690a_100020603323_100000695723 [0,2,0,0,0,0|1,0,1]=4 13067 B16R0.108 CCCSCCNC(=O)CCCCC(=O)OC 527a_100020603323_100000695723 [0,2,0,0,0,0|1,0,1]=4 13068 B16R0.108 CCOCCCNC(=O)CCCCC(=O)OC 11a_100000210961_100000695723 [0,2,0,0,0,0|1,0,1]=4 13069 B16R0.108 CCOCCCNC(=O)CCCCC(=O)OC 1626a_100000210961_100000695723 [0,2,0,0,0,0|1,0,1]=4 13070 B16R0.108 CCOCCCNC(=O)CCCCC(=O)OC 240690a_100000210961_100000695723 [0,2,0,0,0,0|1,0,1]=4 13071 B16R0.108 CCOCCCNC(=O)CCCCC(=O)OC 527a_100000210961_100000695723 [0,2,0,0,0,0|1,0,1]=4 13072 B16R0.108 COC(=O)CCCCC(=O)CCCCCC#N 1458a_100000695723_100009813376 [0,2,0,0,0,0|0,0,2]=4 13073 B16R0.108 COC(=O)CCCCC(=O)CCCCCCF 1458a_100000695723_100015922095 [0,2,0,0,0,0|0,0,1]=3 13074 B16R0.108 COC(=O)CCCCC(=O)CCCCCCO 1458a_100000695723_100000766143 [0,2,0,0,0,0|0,0,1]=3 13075 B16R0.108 COC(=O)CCCCC(=O)CCCCCCO 1458a_100011996774_100000204269 [0,2,0,0,0,0|0,0,1]=3 13076 B16R0.108 COC(=O)CCCCC(=O)NCCCCCO 240690a_100000762737_100000695723 [0,2,0,0,0,0|1,0,1]=4 13077 B16R0.108 COC(=O)CCCNC(=O)CCCCCCO 188690a_100000184769_100011996774 [0,2,0,0,0,0|1,0,1]=4 13078 B16R0.108 COC(=O)COCCC(=O)CCCCCCO 1458a_100011996774_100000090808 [0,2,0,0,0,0|1,0,1]=4 13079 B16R0.108 COC(=O)NCCCC(=O)CCCCCCF 1458a_100000753017_100015922095 [0,2,0,0,0,0|1,0,1]=4 13080 B16R0.108 COC(=O)NCCCC(=O)CCCCCCO 1458a_100000753017_100000766143 [0,2,0,0,0,0|1,0,1]=4 13081 B16R0.108 COCCCCCC(=O)CCCCC(=O)OC 1458a_100011935119_100000204269 [0,2,0,0,0,0|0,0,1]=3 13082 B16R0.108 COCCCCCC(=O)CCOCC(=O)OC 1458a_100011935119_100000090808 [0,2,0,0,0,0|1,0,1]=4 13083 B16R0.108 COCCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100011935119 [0,2,0,0,0,0|1,0,1]=4 13084 B16R0.108 COCCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000695917 [0,2,0,0,0,0|1,0,1]=4 13085 B16R0.108 COCCOCCC(=O)CCCCC(=O)OC 1458a_100000745395_100000204269 [0,2,0,0,0,0|1,0,1]=4 13086 B16R0.164 C#CC(=O)CCCCCCCCCC(=O)OC 1458a_100000211873_100009813843 [0,2,0,0,0,0|0,0,2]=4 13087 B16R0.164 C#CC(C)NCCCCCCCCC(=O)OC 2230a_100000707721_100010282707 [0,2,0,0,0,0|1,0,0]=3 13088 B16R0.164 C#CC(C)NCCCCCCCCC(=O)OC 34a_100000707721_100010282707 [0,2,0,0,0,0|1,0,0]=3 13089 B16R0.164 C#CC(C)OCCCCCCCCC(=O)OC 34a_100000035544_200000035995 [0,2,0,0,0,0|1,0,0]=3 13090 B16R0.164 C#CC(C)SCCCCCCCCC(=O)OC 62a_200000035995_100010282707 [0,2,0,0,0,0|1,0,0]=3 13091 B16R0.164 C#CC(O)CCCCCSCCCC(=O)OC 62a_100011218270_200010408556 [0,2,0,0,0,0|0,0,2]=4 13092 B16R0.164 C#CC(O)CCCCCSCCCC(=O)OC 62a_200010408556_100011218270 [0,2,0,0,0,0|0,0,2]=4 13093 B16R0.164 C#C[C@@H](C)OCCCCCCCCC(=O)OC 34a_100009815206_100010282707 [0,2,0,0,0,0|1,0,0]=3 13094 B16R0.164 C#C[C@@H](C)OCCCCCCCCC(=O)OC 7a_100009815206_100010282707 [0,2,0,0,0,0|1,0,0]=3 13095 B16R0.164 C=CC(=O)CCCCCCCCCC(=O)OC 1458a_100000185746_100009813843 [0,2,0,0,0,0|0,0,2]=4 13096 B16R0.164 C=CC(C)COCCCCCCCC(=O)OC 34a_100011215527_100010004213 [0,2,0,0,0,0|1,0,0]=3 13097 B16R0.164 C=CC(C)COCCCCCCCC(=O)OC 7a_100011215527_100010004213 [0,2,0,0,0,0|1,0,0]=3 13098 B16R0.164 C=CC(C)OCCCCCCCCC(=O)OC 34a_100000695699_100010282707 [0,2,0,0,0,0|1,0,0]=3 13099 B16R0.164 C=CC(C)SCCCCCCCCC(=O)OC 62a_100011215867_100010282707 [0,2,0,0,0,0|1,0,0]=3 13100 B16R0.164 C=CC(O)COCCCCCCCC(=O)OC 34a_100011022521_100000730141 [0,2,0,0,0,0|0,0,2]=4 13101 B16R0.164 C=CC(O)COCCCCCCCC(=O)OC 7a_100011022521_100000730141 [0,2,0,0,0,0|0,0,2]=4 13102 B16R0.164 C=CC(O)CSCCCCCCCC(=O)OC 62a_100000730141_100010004213 [0,2,0,0,0,0|0,0,2]=4 13103 B16R0.164 C=CC(O)CSCCCCCCCC(=O)OC 62a_100010004213_100000730141 [0,2,0,0,0,0|0,0,2]=4 13104 B16R0.164 C=C[C@H](N)COCCCCCCCC(=O)OC 34a_100016989147_100010004213 [0,2,0,0,0,0|0,0,2]=4 13105 B16R0.164 CCC(=O)CCCCCCCCCC(=O)OC 1458a_100000210414_100009813843 [0,2,0,0,0,0|0,0,0]=2 13106 B16R0.164 CCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000210202 [0,2,0,0,0,0|0,0,0]=2 13107 B16R0.164 CCC(=O)COCCCCCCCC(=O)OC 34a_100000725409_100010004213 [0,2,0,0,0,0|0,0,1]=3 13108 B16R0.164 CCC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000747405 [0,2,0,0,0,0|0,0,1]=3 13109 B16R0.164 CCC(=O)CSCCCCCCCC(=O)OC 62a_100000747405_100010004213 [0,2,0,0,0,0|0,0,1]=3 13110 B16R0.164 CCC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000747405 [0,2,0,0,0,0|0,0,1]=3 13111 B16R0.164 CCC(=O)NCCNCCCCCC(=O)OC 34a_100132302217_100009816466 [0,2,0,0,0,0|1,0,1]=4 13112 B16R0.164 CCC(=O)NCCOCCCCCC(=O)OC 34a_200000158885_100009816466 [0,2,0,0,0,0|1,0,1]=4 13113 B16R0.164 CCC(=O)NCCOCCCCCC(=O)OC 7a_200000158885_100009816466 [0,2,0,0,0,0|1,0,1]=4 13114 B16R0.164 CCC(=O)OCCOCCCCCC(=O)OC 7a_200000031056_100009816466 [0,2,0,0,0,0|1,0,1]=4 13115 B16R0.164 CCC(C)CCCCCOC/C=C/C(=O)OC 7a_200000035636_100000742655 [0,2,0,0,0,0|0,0,2]=4 13116 B16R0.164 CCC(C)CCCCCOCCCC(=O)NC 7a_200000035636_100000741757 [0,2,0,0,0,0|1,0,0]=3 13117 B16R0.164 CCC(C)CCCCCOCCCC(=O)OC 7a_200000035636_100011218270 [0,2,0,0,0,0|0,0,0]=2 13118 B16R0.164 CCC(C)CCCCCOCCOC(=O)NC 7a_200000035636_200011997002 [0,2,0,0,0,0|2,0,0]=4 13119 B16R0.164 CCC(C)CCCOCCCCCC(=O)OC 7a_100011216074_100009816466 [0,2,0,0,0,0|0,0,0]=2 13120 B16R0.164 CCC(C)CCNCCCCCCC(=O)OC 2230a_100020591266_100009815986 [0,2,0,0,0,0|0,0,0]=2 13121 B16R0.164 CCC(C)CCOCCCCCCC(=O)OC 7a_100011215188_100009815986 [0,2,0,0,0,0|0,0,0]=2 13122 B16R0.164 CCC(C)CNCCCCCCCC(=O)OC 2230a_100020588543_100010004213 [0,2,0,0,0,0|0,0,0]=2 13123 B16R0.164 CCC(C)COCCCCCCCC(=O)OC 34a_100011022521_100000748023 [0,2,0,0,0,0|0,0,0]=2 13124 B16R0.164 CCC(C)COCCCCCCCC(=O)OC 7a_100011022521_100000748023 [0,2,0,0,0,0|0,0,0]=2 13125 B16R0.164 CCC(C)COCCOCCOCC(=O)OC 34a_100011023656_100000748023 [0,2,0,0,0,0|2,0,0]=4 13126 B16R0.164 CCC(C)COCCOCCOCC(=O)OC 7a_100011023656_100000748023 [0,2,0,0,0,0|2,0,0]=4 13127 B16R0.164 CCC(C)CSCCCCCCCC(=O)OC 62a_100000748023_100010004213 [0,2,0,0,0,0|0,0,0]=2 13128 B16R0.164 CCC(C)CSCCCCCCCC(=O)OC 62a_100010004213_100000748023 [0,2,0,0,0,0|0,0,0]=2 13129 B16R0.164 CCC(C)NCCCCCCCCC(=O)OC 2230a_100000209981_100010282707 [0,2,0,0,0,0|0,0,0]=2 13130 B16R0.164 CCC(C)OCCCCCCCCC(=O)OC 34a_100000035544_100011215416 [0,2,0,0,0,0|0,0,0]=2 13131 B16R0.164 CCC(C)OCCCCCCCCC(=O)OC 7a_100000035544_100000758301 [0,2,0,0,0,0|0,0,0]=2 13132 B16R0.164 CCC(C)OCCCCCCCCC(=O)OC 7a_100000210228_100010282707 [0,2,0,0,0,0|0,0,0]=2 13133 B16R0.164 CCC(C)OCCOCCOCCC(=O)OC 34a_100010982084_100011215416 [0,2,0,0,0,0|2,0,0]=4 13134 B16R0.164 CCC(C)OCCOCCOCCC(=O)OC 7a_100010982084_100000758301 [0,2,0,0,0,0|2,0,0]=4 13135 B16R0.164 CCC(C)SCCCCCCCCC(=O)OC 62a_100000758301_100010282707 [0,2,0,0,0,0|0,0,0]=2 13136 B16R0.164 CCC(C)SCCCCCCCCC(=O)OC 62a_100010282707_100000758301 [0,2,0,0,0,0|0,0,0]=2 13137 B16R0.164 CCC(O)CNCCCCCCCC(=O)OC 2230a_100011218483_100010004213 [0,2,0,0,0,0|0,0,0]=2 13138 B16R0.164 CCC(O)COCCCCCCCC(=O)OC 34a_100011022521_100011218378 [0,2,0,0,0,0|0,0,0]=2 13139 B16R0.164 CCC(O)COCCCCCCCC(=O)OC 7a_100011022521_100011218378 [0,2,0,0,0,0|0,0,0]=2 13140 B16R0.164 CCC(O)COCCOCCOCC(=O)OC 34a_100011023656_100011218378 [0,2,0,0,0,0|2,0,0]=4 13141 B16R0.164 CCC(O)COCCOCCOCC(=O)OC 7a_100011023656_100011218378 [0,2,0,0,0,0|2,0,0]=4 13142 B16R0.164 CCC(O)CSCCCCCCCC(=O)OC 62a_100010004213_100011218378 [0,2,0,0,0,0|0,0,0]=2 13143 B16R0.164 CCC(O)CSCCCCCCCC(=O)OC 62a_100011218378_100010004213 [0,2,0,0,0,0|0,0,0]=2 13144 B16R0.164 CCN(C)CCCCCCCCCC(=O)OC 2230a_100000225621_100009813843 [0,2,0,0,0,0|0,0,0]=2 13145 B16R0.164 CCN(C)CCCCCCCCCC(=O)OC 269982a_100000225621_100009813843 [0,2,0,0,0,0|0,0,0]=2 13146 B16R0.164 CCN(C)CCCOCCCCCC(=O)OC 7a_100000074720_100015186262 [0,2,0,0,0,0|1,0,0]=3 13147 B16R0.164 CCN(C)CCCSCCCCCC(=O)OC 62a_100009816466_100015186262 [0,2,0,0,0,0|1,0,0]=3 13148 B16R0.164 CC[C@H](C)COCCCCCCCC(=O)OC 34a_100011022521_100009816398 [0,2,0,0,0,0|0,0,0]=2 13149 B16R0.164 CC[C@H](C)COCCCCCCCC(=O)OC 7a_100009816381_100010004213 [0,2,0,0,0,0|0,0,0]=2 13150 B16R0.164 CC[C@H](C)COCCCCCCCC(=O)OC 7a_100011022521_100009816398 [0,2,0,0,0,0|0,0,0]=2 13151 B16R0.164 CC[C@H](C)COCCOCCOCC(=O)OC 34a_100011023656_100009816398 [0,2,0,0,0,0|2,0,0]=4 13152 B16R0.164 CC[C@H](C)COCCOCCOCC(=O)OC 7a_100011023656_100009816398 [0,2,0,0,0,0|2,0,0]=4 13153 B16R0.164 CC[C@H](C)CSCCCCCCCC(=O)OC 62a_100009816398_100010004213 [0,2,0,0,0,0|0,0,0]=2 13154 B16R0.164 CC[C@H](C)CSCCCCCCCC(=O)OC 62a_100010004213_100009816398 [0,2,0,0,0,0|0,0,0]=2 13155 B16R0.164 CNC(=O)CCCCCCCCCC(=O)OC 11a_106832991635_100009997464 [0,2,0,0,0,0|0,0,1]=3 13156 B16R0.164 CNC(=O)CCCCCCCCCC(=O)OC 1626a_100102657272_100009997464 [0,2,0,0,0,0|0,0,1]=3 13157 B16R0.164 CNC(=O)CCCCCCCCCC(=O)OC 240690a_100102657272_100009997464 [0,2,0,0,0,0|0,0,1]=3 13158 B16R0.164 CNC(=O)CCCNCCCCCC(=O)OC 2230a_100000740002_100009816466 [0,2,0,0,0,0|1,0,1]=4 13159 B16R0.164 CNC(=O)CCCNCCCCCC(=O)OC 34a_100000740002_100009816466 [0,2,0,0,0,0|1,0,1]=4 13160 B16R0.164 CNC(=O)CCCOCCCCCC(=O)OC 34a_100000074720_100000741757 [0,2,0,0,0,0|1,0,1]=4 13161 B16R0.164 CNC(=O)CCCOCCCCCC(=O)OC 7a_100000074720_100000741757 [0,2,0,0,0,0|1,0,1]=4 13162 B16R0.164 CNC(=O)CCCSCCCCCC(=O)OC 62a_100000741757_100009816466 [0,2,0,0,0,0|1,0,1]=4 13163 B16R0.164 CNC(=O)CCCSCCCCCC(=O)OC 62a_100009816466_100000741757 [0,2,0,0,0,0|1,0,1]=4 13164 B16R0.164 CNC(=O)CCNCCCCCCC(=O)OC 2230a_100000738227_100009815986 [0,2,0,0,0,0|1,0,1]=4 13165 B16R0.164 CNC(=O)CCNCCCCCCC(=O)OC 34a_100000738227_100009815986 [0,2,0,0,0,0|1,0,1]=4 13166 B16R0.164 CNC(=O)CCOCCCCCCC(=O)OC 34a_100000754576_100009815986 [0,2,0,0,0,0|1,0,1]=4 13167 B16R0.164 CNC(=O)CCOCCCCCCC(=O)OC 34a_100009863599_100012179268 [0,2,0,0,0,0|1,0,1]=4 13168 B16R0.164 CNC(=O)CCOCCCCCCC(=O)OC 7a_100009863599_100000737683 [0,2,0,0,0,0|1,0,1]=4 13169 B16R0.164 CNC(=O)CCSCCCCCCC(=O)OC 62a_100000737683_100009815986 [0,2,0,0,0,0|1,0,1]=4 13170 B16R0.164 CNC(=O)CCSCCCCCCC(=O)OC 62a_100009815986_100000737683 [0,2,0,0,0,0|1,0,1]=4 13171 B16R0.164 CNC(=O)CNCCCCCCCC(=O)OC 2230a_100000693194_100010004213 [0,2,0,0,0,0|1,0,1]=4 13172 B16R0.164 CNC(=O)COCCCCCCCC(=O)OC 34a_100000750040_100010004213 [0,2,0,0,0,0|1,0,1]=4 13173 B16R0.164 CNC(=O)COCCCCCCCC(=O)OC 34a_100011022521_100000183359 [0,2,0,0,0,0|1,0,1]=4 13174 B16R0.164 CNC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000183359 [0,2,0,0,0,0|1,0,1]=4 13175 B16R0.164 CNC(=O)CSCCCCCCCC(=O)OC 62a_100000183359_100010004213 [0,2,0,0,0,0|1,0,1]=4 13176 B16R0.164 CNC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000183359 [0,2,0,0,0,0|1,0,1]=4 13177 B16R0.164 COC(=O)CCCCCCCCCC(=O)CF 1458a_100009997464_100015361967 [0,2,0,0,0,0|0,0,1]=3 13178 B16R0.164 COC(=O)CCCCCCCCCC(=O)CO 1458a_100000210174_100009813843 [0,2,0,0,0,0|0,0,1]=3 13179 B16R0.164 COC(=O)CCCCCCCCNC(C)C#N 2230a_100000737613_100010282707 [0,2,0,0,0,0|1,0,0]=3 13180 B16R0.164 COC(=O)CCCCCCCCN[C@H](C)CO 2230a_100000737577_100010282707 [0,2,0,0,0,0|1,0,0]=3 13181 B16R0.164 COC(=O)CCCCCCCCOC(C)C#N 34a_100011218135_100010282707 [0,2,0,0,0,0|1,0,0]=3 13182 B16R0.164 COC(=O)CCCCCCCCOC(C)C#N 7a_100000035544_100000703298 [0,2,0,0,0,0|1,0,0]=3 13183 B16R0.164 COC(=O)CCCCCCCCOC(C)CF 34a_100016041109_100010282707 [0,2,0,0,0,0|1,0,0]=3 13184 B16R0.164 COC(=O)CCCCCCCCOC(C)CF 7a_100016041109_100010282707 [0,2,0,0,0,0|1,0,0]=3 13185 B16R0.164 COC(=O)CCCCCCCCOC(C)CN 34a_100000210904_100010282707 [0,2,0,0,0,0|1,0,0]=3 13186 B16R0.164 COC(=O)CCCCCCCCOC(C)CO 34a_100000035544_100012180447 [0,2,0,0,0,0|1,0,0]=3 13187 B16R0.164 COC(=O)CCCCCCCCOC(C)CO 7a_100000035544_100012180447 [0,2,0,0,0,0|1,0,0]=3 13188 B16R0.164 COC(=O)CCCCCCCCSC(C)C#N 62a_100000703298_100010282707 [0,2,0,0,0,0|1,0,0]=3 13189 B16R0.164 COC(=O)CCCCCCCCSC(C)C#N 62a_100010282707_100000703298 [0,2,0,0,0,0|1,0,0]=3 13190 B16R0.164 COC(=O)CCCCCCCCSC(C)CO 62a_100012180447_100010282707 [0,2,0,0,0,0|1,0,0]=3 13191 B16R0.164 COC(=O)CCCCCCCCSC(C)OC 62a_100009879195_100010282707 [0,2,0,0,0,0|1,0,0]=3 13192 B16R0.164 COC(=O)CCCCCCCCSC(C)OC 62a_100010282707_100009879195 [0,2,0,0,0,0|1,0,0]=3 13193 B16R0.164 COC(=O)CCCCCCCCSC(F)C#N 62a_100010282707_200000117898 [0,2,0,0,0,0|1,0,1]=4 13194 B16R0.164 COC(=O)CCCCCCCCSC(F)C#N 62a_200000117898_100010282707 [0,2,0,0,0,0|1,0,1]=4 13195 B16R0.164 COC(=O)CCCCCCCCS[C@H](C)CO 62a_100010282707_100016084084 [0,2,0,0,0,0|1,0,0]=3 13196 B16R0.164 COC(=O)CCCCCCCCS[C@H](C)CO 62a_100016084084_100010282707 [0,2,0,0,0,0|1,0,0]=3 13197 B16R0.164 COC(=O)CCCCCCCNCC(C)CO 34a_100000744482_100010004213 [0,2,0,0,0,0|1,0,0]=3 13198 B16R0.164 COC(=O)CCCCCCCNC[C@@H](C)OC 2230a_100020591295_100010004213 [0,2,0,0,0,0|1,0,0]=3 13199 B16R0.164 COC(=O)CCCCCCCNC[C@@H](F)CO 34a_100015665980_100010004213 [0,2,0,0,0,0|1,0,0]=3 13200 B16R0.164 COC(=O)CCCCCCCNC[C@H](O)CO 2230a_100020644852_100010004213 [0,2,0,0,0,0|1,0,0]=3 13201 B16R0.164 COC(=O)CCCCCCCOCC(=O)OC 34a_100011022521_100000747449 [0,2,0,0,0,0|1,0,1]=4 13202 B16R0.164 COC(=O)CCCCCCCOCC(=O)OC 7a_100011022521_100000747449 [0,2,0,0,0,0|1,0,1]=4 13203 B16R0.164 COC(=O)CCCCCCCOCC(C)CN 34a_100000744482_100010004213 [0,2,0,0,0,0|1,0,0]=3 13204 B16R0.164 COC(=O)CCCCCCCOCC(C)OC 34a_100000690652_100010004213 [0,2,0,0,0,0|1,0,0]=3 13205 B16R0.164 COC(=O)CCCCCCCOCC(Cl)CCl 34a_100000033668_100010004213 [0,2,0,0,0,0|1,0,0]=3 13206 B16R0.164 COC(=O)CCCCCCCOCC(O)CO 34a_100011022521_100011219619 [0,2,0,0,0,0|1,0,0]=3 13207 B16R0.164 COC(=O)CCCCCCCOCC(O)CO 7a_100011022521_100011219619 [0,2,0,0,0,0|1,0,0]=3 13208 B16R0.164 COC(=O)CCCCCCCOC[C@@H](C)CO 34a_100011022521_100000059175 [0,2,0,0,0,0|1,0,0]=3 13209 B16R0.164 COC(=O)CCCCCCCOC[C@@H](C)CO 7a_100011022521_100000059175 [0,2,0,0,0,0|1,0,0]=3 13210 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CF 34a_100011022521_100015614560 [0,2,0,0,0,0|1,0,0]=3 13211 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CF 7a_100011022521_100015614560 [0,2,0,0,0,0|1,0,0]=3 13212 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CO 34a_100011022521_100009815848 [0,2,0,0,0,0|1,0,0]=3 13213 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CO 7a_100011022521_100009815848 [0,2,0,0,0,0|1,0,0]=3 13214 B16R0.164 COC(=O)CCCCCCCOC[C@H](F)CN 34a_100015665980_100010004213 [0,2,0,0,0,0|1,0,0]=3 13215 B16R0.164 COC(=O)CCCCCCCSCC(=O)OC 62a_100000747449_100010004213 [0,2,0,0,0,0|1,0,1]=4 13216 B16R0.164 COC(=O)CCCCCCCSCC(=O)OC 62a_100010004213_100000747449 [0,2,0,0,0,0|1,0,1]=4 13217 B16R0.164 COC(=O)CCCCCCCSCC(O)CO 62a_100010004213_100011219619 [0,2,0,0,0,0|1,0,0]=3 13218 B16R0.164 COC(=O)CCCCCCCSCC(O)CO 62a_100011219619_100010004213 [0,2,0,0,0,0|1,0,0]=3 13219 B16R0.164 COC(=O)CCCCCCCSC[C@@H](C)CO 62a_100000059175_100010004213 [0,2,0,0,0,0|1,0,0]=3 13220 B16R0.164 COC(=O)CCCCCCCSC[C@@H](C)CO 62a_100010004213_100000059175 [0,2,0,0,0,0|1,0,0]=3 13221 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CF 62a_100010004213_100015614560 [0,2,0,0,0,0|1,0,0]=3 13222 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CF 62a_100015614560_100010004213 [0,2,0,0,0,0|1,0,0]=3 13223 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CO 62a_100009815848_100010004213 [0,2,0,0,0,0|1,0,0]=3 13224 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CO 62a_100010004213_100009815848 [0,2,0,0,0,0|1,0,0]=3 13225 B16R0.164 COC(=O)CCCCCCNCCC(C)CO 2230a_106354213184_100009815986 [0,2,0,0,0,0|1,0,0]=3 13226 B16R0.164 COC(=O)CCCCCCNCCC(C)CO 34a_106354213184_100009815986 [0,2,0,0,0,0|1,0,0]=3 13227 B16R0.164 COC(=O)CCCCCCOCCC(=O)OC 34a_100009863599_100000742370 [0,2,0,0,0,0|1,0,1]=4 13228 B16R0.164 COC(=O)CCCCCCOCCC(=O)OC 7a_100009863599_100000204255 [0,2,0,0,0,0|1,0,1]=4 13229 B16R0.164 COC(=O)CCCCCCOCCC(C)OC 7a_100000764861_100009815986 [0,2,0,0,0,0|1,0,0]=3 13230 B16R0.164 COC(=O)CCCCCCSCCC(=O)OC 62a_100000204255_100009815986 [0,2,0,0,0,0|1,0,1]=4 13231 B16R0.164 COC(=O)CCCCCCSCCC(=O)OC 62a_100009815986_100000204255 [0,2,0,0,0,0|1,0,1]=4 13232 B16R0.164 COC(=O)CCCCCOCCCC(=O)OC 34a_100000074720_100000742333 [0,2,0,0,0,0|1,0,1]=4 13233 B16R0.164 COC(=O)CCCCCOCCCC(=O)OC 7a_100000074720_100011218270 [0,2,0,0,0,0|1,0,1]=4 13234 B16R0.164 COC(=O)CCCCCOCCC[C@@H](C)CN 34a_100160569302_100009816466 [0,2,0,0,0,0|1,0,0]=3 13235 B16R0.164 COC(=O)CCCCCSCCCC(=O)OC 62a_100009816466_100011218270 [0,2,0,0,0,0|1,0,1]=4 13236 B16R0.164 COC(=O)CCCCCSCCCC(=O)OC 62a_100011218270_100009816466 [0,2,0,0,0,0|1,0,1]=4 13237 B16R0.164 COC(=O)CCCCOCCCCC(=O)OC 34a_100000059025_100000204269 [0,2,0,0,0,0|1,0,1]=4 13238 B16R0.164 COC(=O)CCCCOCCCCC(=O)OC 7a_100000059025_100000204269 [0,2,0,0,0,0|1,0,1]=4 13239 B16R0.164 COC(=O)CCCCSCCCCC(=O)OC 62a_100000204269_100000204269 [0,2,0,0,0,0|1,0,1]=4 13240 B16R0.165 C=C(Br)CCOCCCCCCCC(=O)OC 34a_100009813270_100010004213 [0,2,0,0,0,0|0,0,2]=4 13241 B16R0.165 C=C(C)CCOCCCCCCCC(=O)OC 34a_100000764851_100010004213 [0,2,0,0,0,0|0,0,1]=3 13242 B16R0.165 C=C(C)CCOCCCCCCCC(=O)OC 34a_100011022521_100000730704 [0,2,0,0,0,0|0,0,1]=3 13243 B16R0.165 C=C(C)CCOCCCCCCCC(=O)OC 7a_100011022521_100000730704 [0,2,0,0,0,0|0,0,1]=3 13244 B16R0.165 C=C(C)CCSCCCCCCCC(=O)OC 62a_100000730704_100010004213 [0,2,0,0,0,0|0,0,1]=3 13245 B16R0.165 C=C(C)CCSCCCCCCCC(=O)OC 62a_100010004213_100000730704 [0,2,0,0,0,0|0,0,1]=3 13246 B16R0.165 C=C(C)COCCCCCCCCC(=O)OC 34a_100000035544_100000748629 [0,2,0,0,0,0|0,0,1]=3 13247 B16R0.165 C=C(C)COCCCCCCCCC(=O)OC 34a_100000210245_100010282707 [0,2,0,0,0,0|0,0,1]=3 13248 B16R0.165 C=C(C)COCCCCCCCCC(=O)OC 7a_100000035544_100000748629 [0,2,0,0,0,0|0,0,1]=3 13249 B16R0.165 C=C(C)CSCCCCCCCCC(=O)OC 62a_100000748629_100010282707 [0,2,0,0,0,0|0,0,1]=3 13250 B16R0.165 C=C(C)CSCCCCCCCCC(=O)OC 62a_100010282707_100000211660 [0,2,0,0,0,0|0,0,1]=3 13251 B16R0.165 C=C(F)COCCCCCCCCC(=O)OC 34a_100000035544_100009893438 [0,2,0,0,0,0|0,0,2]=4 13252 B16R0.165 C=C(F)COCCCCCCCCC(=O)OC 34a_200010262243_100010282707 [0,2,0,0,0,0|0,0,2]=4 13253 B16R0.165 C=C(F)COCCCCCCCCC(=O)OC 7a_100000035544_100000042424 [0,2,0,0,0,0|0,0,2]=4 13254 B16R0.165 C=C(F)CSCCCCCCCCC(=O)OC 62a_100000042424_100010282707 [0,2,0,0,0,0|0,0,2]=4 13255 B16R0.165 C=C(F)CSCCCCCCCCC(=O)OC 62a_100010282707_100000042424 [0,2,0,0,0,0|0,0,2]=4 13256 B16R0.165 CCC(=O)CCCCCCCCCCC(=O)N 1458a_100000210414_200010167045 [0,2,0,0,0,0|1,0,1]=4 13257 B16R0.165 CNC(=O)CCCNCCCCCCC(C)C 2230a_100000211014_100000741757 [0,2,0,0,0,0|1,0,0]=3 13258 B16R0.165 CNC(=O)CCCNCCCCCCC(C)C 34a_100000211014_100000741757 [0,2,0,0,0,0|1,0,0]=3 13259 B16R0.165 CNC(=O)CCCOCCCCCNC(C)C 34a_100011629493_100000741757 [0,2,0,0,0,0|2,0,0]=4 13260 B16R0.165 CNC(=O)CCOCCCCCCCC(C)C 34a_200000210741_100012179268 [0,2,0,0,0,0|1,0,0]=3 13261 B16R0.165 CNC(=O)CCOCCCCCCCC(C)C 7a_200000210741_100000737683 [0,2,0,0,0,0|1,0,0]=3 13262 B16R0.165 CNC(=O)OCCNCCCCCCC(C)C 34a_100000211014_200011997002 [0,2,0,0,0,0|2,0,0]=4 13263 B16R0.165 COC(=O)/C=C/CNCCCCCCC(C)C 2230a_100000211014_100000742655 [0,2,0,0,0,0|0,0,2]=4 13264 B16R0.165 COC(=O)/C=C/CNCCCCCCC(C)C 34a_100000211014_100000742655 [0,2,0,0,0,0|0,0,2]=4 13265 B16R0.165 COC(=O)CCCCCCCCCCC(=O)C 1458a_100000070787_100009812566 [0,2,0,0,0,0|0,0,0]=2 13266 B16R0.165 COC(=O)CCCCCCCCCCC(=O)C 1458a_100016987261_200000210301 [0,2,0,0,0,0|0,0,0]=2 13267 B16R0.165 COC(=O)CCCCCCCCCCC(=O)[13CH3] 1458a_100016987261_200025704644 [0,2,0,0,0,0|0,0,0]=2 13268 B16R0.165 COC(=O)CCCCCCCCCCN(C)C 2230a_100102631434_100009812566 [0,2,0,0,0,0|0,0,0]=2 13269 B16R0.165 COC(=O)CCCCCCCCCCN(C)C 269982a_100102631434_100009812566 [0,2,0,0,0,0|0,0,0]=2 13270 B16R0.165 COC(=O)CCCCCCCCCNC(C)C 2230a_100138425928_100009813843 [0,2,0,0,0,0|0,0,0]=2 13271 B16R0.165 COC(=O)CCCCCCCCCNC(C)C 34a_100138425928_100009813843 [0,2,0,0,0,0|0,0,0]=2 13272 B16R0.165 COC(=O)CCCCCCCCCOC(C)C 34a_100000212225_100009813843 [0,2,0,0,0,0|0,0,0]=2 13273 B16R0.165 COC(=O)CCCCCCCCCSC(C)C 62a_100000210206_100009813843 [0,2,0,0,0,0|0,0,0]=2 13274 B16R0.165 COC(=O)CCCCCCCCNCC(=O)N 2230a_100000711301_100010282707 [0,2,0,0,0,0|1,0,1]=4 13275 B16R0.165 COC(=O)CCCCCCCCNCC(=O)O 269956a_100016091260_100010282707 [0,2,0,0,0,0|1,0,1]=4 13276 B16R0.165 COC(=O)CCCCCCCCNCC(C)C 2230a_100000210953_100010282707 [0,2,0,0,0,0|0,0,0]=2 13277 B16R0.165 COC(=O)CCCCCCCCNCC(C)C 34a_100000210953_100010282707 [0,2,0,0,0,0|0,0,0]=2 13278 B16R0.165 COC(=O)CCCCCCCCNCC(C)O 2230a_100000210904_100010282707 [0,2,0,0,0,0|0,0,0]=2 13279 B16R0.165 COC(=O)CCCCCCCCNCC(C)O 34a_100000210904_100010282707 [0,2,0,0,0,0|0,0,0]=2 13280 B16R0.165 COC(=O)CCCCCCCCNCC(F)F 34a_100000765723_100010282707 [0,2,0,0,0,0|1,0,0]=3 13281 B16R0.165 COC(=O)CCCCCCCCOCC(=O)C 34a_100000211253_100010282707 [0,2,0,0,0,0|0,0,1]=3 13282 B16R0.165 COC(=O)CCCCCCCCOCC(=O)N 34a_100000035544_100000187820 [0,2,0,0,0,0|1,0,1]=4 13283 B16R0.165 COC(=O)CCCCCCCCOCC(=O)N 7a_100000035544_100000187820 [0,2,0,0,0,0|1,0,1]=4 13284 B16R0.165 COC(=O)CCCCCCCCOCC(=O)[O-] 34a_100000035544_100020667443 [0,2,0,0,0,0|1,0,1]=4 13285 B16R0.165 COC(=O)CCCCCCCCOCC(C)Br 34a_100012180447_100010282707 [0,2,0,0,0,0|0,0,0]=2 13286 B16R0.165 COC(=O)CCCCCCCCOCC(C)C 34a_100000035544_100000210624 [0,2,0,0,0,0|0,0,0]=2 13287 B16R0.165 COC(=O)CCCCCCCCOCC(C)C 34a_100000210257_100010282707 [0,2,0,0,0,0|0,0,0]=2 13288 B16R0.165 COC(=O)CCCCCCCCOCC(C)C 7a_100000035544_100000210760 [0,2,0,0,0,0|0,0,0]=2 13289 B16R0.165 COC(=O)CCCCCCCCOCC(C)F 34a_100015925927_100010282707 [0,2,0,0,0,0|0,0,0]=2 13290 B16R0.165 COC(=O)CCCCCCCCOCC(C)O 34a_100000035544_100011218427 [0,2,0,0,0,0|0,0,0]=2 13291 B16R0.165 COC(=O)CCCCCCCCOCC(C)O 7a_100000035544_100011218427 [0,2,0,0,0,0|0,0,0]=2 13292 B16R0.165 COC(=O)CCCCCCCCOCC(F)F 34a_100000035544_100011934356 [0,2,0,0,0,0|1,0,0]=3 13293 B16R0.165 COC(=O)CCCCCCCCOCC(F)F 34a_100000743014_100010282707 [0,2,0,0,0,0|1,0,0]=3 13294 B16R0.165 COC(=O)CCCCCCCCOCC(F)F 7a_100000035544_100011934356 [0,2,0,0,0,0|1,0,0]=3 13295 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100010282707 [0,2,0,0,0,0|0,0,0]=2 13296 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)N 34a_100000737577_100010282707 [0,2,0,0,0,0|0,0,0]=2 13297 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)O 34a_100000035544_100009817552 [0,2,0,0,0,0|0,0,0]=2 13298 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)O 7a_100000035544_100009817552 [0,2,0,0,0,0|0,0,0]=2 13299 B16R0.165 COC(=O)CCCCCCCCOC[N+](=O)[O-] 34a_100000035544_100000761209 [0,2,0,0,0,0|2,0,0]=4 13300 B16R0.165 COC(=O)CCCCCCCCSCC(=O)N 62a_100000747473_100010282707 [0,2,0,0,0,0|1,0,1]=4 13301 B16R0.165 COC(=O)CCCCCCCCSCC(=O)N 62a_100010282707_100000747473 [0,2,0,0,0,0|1,0,1]=4 13302 B16R0.165 COC(=O)CCCCCCCCSCC(=O)[O-] 62a_100010282707_100020667443 [0,2,0,0,0,0|1,0,1]=4 13303 B16R0.165 COC(=O)CCCCCCCCSCC(=O)[O-] 62a_100020667443_100010282707 [0,2,0,0,0,0|1,0,1]=4 13304 B16R0.165 COC(=O)CCCCCCCCSCC(C)C 62a_100000210624_100010282707 [0,2,0,0,0,0|0,0,0]=2 13305 B16R0.165 COC(=O)CCCCCCCCSCC(C)C 62a_100010282707_100000210760 [0,2,0,0,0,0|0,0,0]=2 13306 B16R0.165 COC(=O)CCCCCCCCSCC(C)O 62a_100010282707_100011218427 [0,2,0,0,0,0|0,0,0]=2 13307 B16R0.165 COC(=O)CCCCCCCCSCC(C)O 62a_100011218427_100010282707 [0,2,0,0,0,0|0,0,0]=2 13308 B16R0.165 COC(=O)CCCCCCCCSCC(F)F 62a_100010282707_100011934356 [0,2,0,0,0,0|1,0,0]=3 13309 B16R0.165 COC(=O)CCCCCCCCSCC(F)F 62a_100011934356_100010282707 [0,2,0,0,0,0|1,0,0]=3 13310 B16R0.165 COC(=O)CCCCCCCCSC[C@@H](C)O 62a_100009817552_100010282707 [0,2,0,0,0,0|0,0,0]=2 13311 B16R0.165 COC(=O)CCCCCCCCSC[C@@H](C)O 62a_100010282707_100009817552 [0,2,0,0,0,0|0,0,0]=2 13312 B16R0.165 COC(=O)CCCCCCCCSC[N+](=O)[O-] 62a_100010282707_100000761209 [0,2,0,0,0,0|2,0,0]=4 13313 B16R0.165 COC(=O)CCCCCCCNCC=C(C)C 34a_100000718196_100010004213 [0,2,0,0,0,0|0,0,2]=4 13314 B16R0.165 COC(=O)CCCCCCCNCCC(C)O 2230a_200000755665_100010004213 [0,2,0,0,0,0|0,0,0]=2 13315 B16R0.165 COC(=O)CCCCCCCOCC=C(C)C 34a_100000753907_100010004213 [0,2,0,0,0,0|0,0,2]=4 13316 B16R0.165 COC(=O)CCCCCCCOCC=C(C)C 34a_100011022521_100000761012 [0,2,0,0,0,0|0,0,2]=4 13317 B16R0.165 COC(=O)CCCCCCCOCC=C(C)C 7a_100011022521_100000761012 [0,2,0,0,0,0|0,0,2]=4 13318 B16R0.165 COC(=O)CCCCCCCOCCC(=O)C 34a_100000759926_100010004213 [0,2,0,0,0,0|0,0,1]=3 13319 B16R0.165 COC(=O)CCCCCCCOCCC(=O)C 7a_100000759926_100010004213 [0,2,0,0,0,0|0,0,1]=3 13320 B16R0.165 COC(=O)CCCCCCCOCCC(=O)C 7a_100011022521_100000053229 [0,2,0,0,0,0|0,0,1]=3 13321 B16R0.165 COC(=O)CCCCCCCOCCC(=O)N 34a_100000757172_100010004213 [0,2,0,0,0,0|1,0,1]=4 13322 B16R0.165 COC(=O)CCCCCCCOCCC(=O)N 34a_100011022521_100000731001 [0,2,0,0,0,0|1,0,1]=4 13323 B16R0.165 COC(=O)CCCCCCCOCCC(=O)N 7a_100000757172_100010004213 [0,2,0,0,0,0|1,0,1]=4 13324 B16R0.165 COC(=O)CCCCCCCOCCC(=O)N 7a_100011022521_100000744528 [0,2,0,0,0,0|1,0,1]=4 13325 B16R0.165 COC(=O)CCCCCCCOCCC(C)Br 34a_100009893172_100010004213 [0,2,0,0,0,0|0,0,0]=2 13326 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 34a_100000210254_100010004213 [0,2,0,0,0,0|0,0,0]=2 13327 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 34a_100011022521_100000210312 [0,2,0,0,0,0|0,0,0]=2 13328 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 7a_100000210254_100010004213 [0,2,0,0,0,0|0,0,0]=2 13329 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 7a_100011022521_100000210626 [0,2,0,0,0,0|0,0,0]=2 13330 B16R0.165 COC(=O)CCCCCCCOCCC(C)O 34a_100011022521_100012276601 [0,2,0,0,0,0|0,0,0]=2 13331 B16R0.165 COC(=O)CCCCCCCOCCC(C)O 7a_100011022521_100012276601 [0,2,0,0,0,0|0,0,0]=2 13332 B16R0.165 COC(=O)CCCCCCCOCCC(F)F 34a_100103093639_100010004213 [0,2,0,0,0,0|1,0,0]=3 13333 B16R0.165 COC(=O)CCCCCCCOCCN(C)C 7a_100011022521_100000755713 [0,2,0,0,0,0|1,0,0]=3 13334 B16R0.165 COC(=O)CCCCCCCOCC[C@@H](C)N 34a_100000706166_100010004213 [0,2,0,0,0,0|0,0,0]=2 13335 B16R0.165 COC(=O)CCCCCCCOCOC(=O)C 34a_100011022521_100009813279 [0,2,0,0,0,0|1,0,1]=4 13336 B16R0.165 COC(=O)CCCCCCCOCOC(C)C 34a_100011022521_100000709892 [0,2,0,0,0,0|1,0,0]=3 13337 B16R0.165 COC(=O)CCCCCCCSCC=C(C)C 62a_100000761012_100010004213 [0,2,0,0,0,0|0,0,2]=4 13338 B16R0.165 COC(=O)CCCCCCCSCC=C(C)C 62a_100010004213_100000761012 [0,2,0,0,0,0|0,0,2]=4 13339 B16R0.165 COC(=O)CCCCCCCSCCC(=O)C 62a_100000053229_100010004213 [0,2,0,0,0,0|0,0,1]=3 13340 B16R0.165 COC(=O)CCCCCCCSCCC(=O)C 62a_100010004213_100000053229 [0,2,0,0,0,0|0,0,1]=3 13341 B16R0.165 COC(=O)CCCCCCCSCCC(=O)N 62a_100000744528_100010004213 [0,2,0,0,0,0|1,0,1]=4 13342 B16R0.165 COC(=O)CCCCCCCSCCC(=O)N 62a_100010004213_100000744528 [0,2,0,0,0,0|1,0,1]=4 13343 B16R0.165 COC(=O)CCCCCCCSCCC(C)C 62a_100000210312_100010004213 [0,2,0,0,0,0|0,0,0]=2 13344 B16R0.165 COC(=O)CCCCCCCSCCC(C)C 62a_100010004213_100000210312 [0,2,0,0,0,0|0,0,0]=2 13345 B16R0.165 COC(=O)CCCCCCCSCCC(C)O 62a_100010004213_100012276601 [0,2,0,0,0,0|0,0,0]=2 13346 B16R0.165 COC(=O)CCCCCCCSCCC(C)O 62a_100012276601_100010004213 [0,2,0,0,0,0|0,0,0]=2 13347 B16R0.165 COC(=O)CCCCCCCSCCN(C)C 62a_100010004213_100000755713 [0,2,0,0,0,0|1,0,0]=3 13348 B16R0.165 COC(=O)CCCCCCCSCOC(=O)C 62a_100000076356_100010004213 [0,2,0,0,0,0|1,0,1]=4 13349 B16R0.165 COC(=O)CCCCCCCSCOC(=O)C 62a_100010004213_100000076356 [0,2,0,0,0,0|1,0,1]=4 13350 B16R0.165 COC(=O)CCCCCCCSCOC(C)C 62a_100000709892_100010004213 [0,2,0,0,0,0|1,0,0]=3 13351 B16R0.165 COC(=O)CCCCCCCSCOC(C)C 62a_100010004213_100000709892 [0,2,0,0,0,0|1,0,0]=3 13352 B16R0.165 COC(=O)CCCCCCNCCCC(=O)N 34a_100000739312_100009815986 [0,2,0,0,0,0|1,0,1]=4 13353 B16R0.165 COC(=O)CCCCCCNCCCC(C)C 2230a_200000737386_100009815986 [0,2,0,0,0,0|0,0,0]=2 13354 B16R0.165 COC(=O)CCCCCCNCCCC(C)C 34a_200000737386_100009815986 [0,2,0,0,0,0|0,0,0]=2 13355 B16R0.165 COC(=O)CCCCCCNCCCS(=O)C 2230a_200000753449_100009815986 [0,2,0,0,0,0|1,0,0]=3 13356 B16R0.165 COC(=O)CCCCCCNCCNC(=O)C 2230a_100000209853_100009815986 [0,2,0,0,0,0|1,0,1]=4 13357 B16R0.165 COC(=O)CCCCCCNCCOC(C)C 2230a_100000701111_100009815986 [0,2,0,0,0,0|1,0,0]=3 13358 B16R0.165 COC(=O)CCCCCCNCCOC(C)C 34a_100000701111_100009815986 [0,2,0,0,0,0|1,0,0]=3 13359 B16R0.165 COC(=O)CCCCCCNCCSC(C)C 2230a_100000731138_100009815986 [0,2,0,0,0,0|1,0,0]=3 13360 B16R0.165 COC(=O)CCCCCCNCCSC(C)C 34a_100000731138_100009815986 [0,2,0,0,0,0|1,0,0]=3 13361 B16R0.165 COC(=O)CCCCCCOCCC=C(C)C 34a_100009863599_100011217483 [0,2,0,0,0,0|0,0,2]=4 13362 B16R0.165 COC(=O)CCCCCCOCCC=C(C)C 7a_100009863599_100011217483 [0,2,0,0,0,0|0,0,2]=4 13363 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 34a_100000759063_100009815986 [0,2,0,0,0,0|0,0,1]=3 13364 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 34a_100009863599_100000685027 [0,2,0,0,0,0|0,0,1]=3 13365 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 7a_100000759063_100009815986 [0,2,0,0,0,0|0,0,1]=3 13366 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 7a_100009863599_100011215641 [0,2,0,0,0,0|0,0,1]=3 13367 B16R0.165 COC(=O)CCCCCCOCCCC(=O)N 34a_100009863599_100102525003 [0,2,0,0,0,0|1,0,1]=4 13368 B16R0.165 COC(=O)CCCCCCOCCCC(=O)N 7a_100009863599_100102525003 [0,2,0,0,0,0|1,0,1]=4 13369 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 34a_100000210774_100009815986 [0,2,0,0,0,0|0,0,0]=2 13370 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 34a_100009863599_100011214892 [0,2,0,0,0,0|0,0,0]=2 13371 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 7a_100000210774_100009815986 [0,2,0,0,0,0|0,0,0]=2 13372 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 7a_100009863599_100011214892 [0,2,0,0,0,0|0,0,0]=2 13373 B16R0.165 COC(=O)CCCCCCOCCCC(C)O 34a_100009863599_200000718107 [0,2,0,0,0,0|0,0,0]=2 13374 B16R0.165 COC(=O)CCCCCCOCCCC(C)O 7a_100009863599_200000718107 [0,2,0,0,0,0|0,0,0]=2 13375 B16R0.165 COC(=O)CCCCCCOCCCN(C)C 7a_100009863599_100000757444 [0,2,0,0,0,0|1,0,0]=3 13376 B16R0.165 COC(=O)CCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100009815986 [0,2,0,0,0,0|2,0,0]=4 13377 B16R0.165 COC(=O)CCCCCCOCCNC(=O)C 34a_100000158858_100009815986 [0,2,0,0,0,0|1,0,1]=4 13378 B16R0.165 COC(=O)CCCCCCOCCNC(=O)C 7a_100009863599_100000189650 [0,2,0,0,0,0|1,0,1]=4 13379 B16R0.165 COC(=O)CCCCCCOCCNC(C)C 34a_100000224655_100009815986 [0,2,0,0,0,0|1,0,0]=3 13380 B16R0.165 COC(=O)CCCCCCOCCOC(=O)C 34a_100009863599_100009814007 [0,2,0,0,0,0|1,0,1]=4 13381 B16R0.165 COC(=O)CCCCCCOCCOC(=O)C 7a_100009863599_100009814007 [0,2,0,0,0,0|1,0,1]=4 13382 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 34a_100000211219_100009815986 [0,2,0,0,0,0|1,0,0]=3 13383 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 34a_100009863599_100000211751 [0,2,0,0,0,0|1,0,0]=3 13384 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 7a_100000211219_100009815986 [0,2,0,0,0,0|1,0,0]=3 13385 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 7a_100009863599_100000211751 [0,2,0,0,0,0|1,0,0]=3 13386 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 34a_100009863599_100000730970 [0,2,0,0,0,0|1,0,0]=3 13387 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 34a_200011212901_100009815986 [0,2,0,0,0,0|1,0,0]=3 13388 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 7a_100009863599_100000730970 [0,2,0,0,0,0|1,0,0]=3 13389 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 7a_200011212901_100009815986 [0,2,0,0,0,0|1,0,0]=3 13390 B16R0.165 COC(=O)CCCCCCSCCC=C(C)C 62a_100009815986_100011217483 [0,2,0,0,0,0|0,0,2]=4 13391 B16R0.165 COC(=O)CCCCCCSCCC=C(C)C 62a_100011217483_100009815986 [0,2,0,0,0,0|0,0,2]=4 13392 B16R0.165 COC(=O)CCCCCCSCCCC(=O)C 62a_100009815986_100011215641 [0,2,0,0,0,0|0,0,1]=3 13393 B16R0.165 COC(=O)CCCCCCSCCCC(=O)C 62a_100011215641_100009815986 [0,2,0,0,0,0|0,0,1]=3 13394 B16R0.165 COC(=O)CCCCCCSCCCC(=O)N 62a_100009815986_100102525003 [0,2,0,0,0,0|1,0,1]=4 13395 B16R0.165 COC(=O)CCCCCCSCCCC(=O)N 62a_100102525003_100009815986 [0,2,0,0,0,0|1,0,1]=4 13396 B16R0.165 COC(=O)CCCCCCSCCCC(C)C 62a_100009815986_100011214892 [0,2,0,0,0,0|0,0,0]=2 13397 B16R0.165 COC(=O)CCCCCCSCCCC(C)C 62a_100011214892_100009815986 [0,2,0,0,0,0|0,0,0]=2 13398 B16R0.165 COC(=O)CCCCCCSCCCC(C)O 62a_100009815986_200000718107 [0,2,0,0,0,0|0,0,0]=2 13399 B16R0.165 COC(=O)CCCCCCSCCCC(C)O 62a_200000718107_100009815986 [0,2,0,0,0,0|0,0,0]=2 13400 B16R0.165 COC(=O)CCCCCCSCCCN(C)C 62a_100009815986_100000757444 [0,2,0,0,0,0|1,0,0]=3 13401 B16R0.165 COC(=O)CCCCCCSCCNC(=O)C 62a_100000189650_100009815986 [0,2,0,0,0,0|1,0,1]=4 13402 B16R0.165 COC(=O)CCCCCCSCCNC(=O)C 62a_100009815986_100000189650 [0,2,0,0,0,0|1,0,1]=4 13403 B16R0.165 COC(=O)CCCCCCSCCOC(=O)C 62a_100009814007_100009815986 [0,2,0,0,0,0|1,0,1]=4 13404 B16R0.165 COC(=O)CCCCCCSCCOC(=O)C 62a_100009815986_100009814007 [0,2,0,0,0,0|1,0,1]=4 13405 B16R0.165 COC(=O)CCCCCCSCCOC(C)C 62a_100000211751_100009815986 [0,2,0,0,0,0|1,0,0]=3 13406 B16R0.165 COC(=O)CCCCCCSCCOC(C)C 62a_100009815986_100000211751 [0,2,0,0,0,0|1,0,0]=3 13407 B16R0.165 COC(=O)CCCCCCSCCSC(C)C 62a_100000730970_100009815986 [0,2,0,0,0,0|1,0,0]=3 13408 B16R0.165 COC(=O)CCCCCCSCCSC(C)C 62a_100009815986_100000730970 [0,2,0,0,0,0|1,0,0]=3 13409 B16R0.165 COC(=O)CCCCCNCCCCC(=O)N 34a_100000696515_100009816466 [0,2,0,0,0,0|1,0,1]=4 13410 B16R0.165 COC(=O)CCCCCNCCCNC(=O)C 34a_100000736810_100009816466 [0,2,0,0,0,0|1,0,1]=4 13411 B16R0.165 COC(=O)CCCCCNCCCOC(C)C 2230a_100000737246_100009816466 [0,2,0,0,0,0|1,0,0]=3 13412 B16R0.165 COC(=O)CCCCCNCCCOC(C)C 34a_100000737246_100009816466 [0,2,0,0,0,0|1,0,0]=3 13413 B16R0.165 COC(=O)CCCCCOCCCCB(O)O 34a_100000074720_200009817182 [0,2,0,0,0,0|2,0,0]=4 13414 B16R0.165 COC(=O)CCCCCOCCCCB(O)O 7a_100000074720_200009817182 [0,2,0,0,0,0|2,0,0]=4 13415 B16R0.165 COC(=O)CCCCCOCCCCC(=O)C 34a_100000074720_100009817362 [0,2,0,0,0,0|0,0,1]=3 13416 B16R0.165 COC(=O)CCCCCOCCCCC(=O)C 7a_100000074720_100000735457 [0,2,0,0,0,0|0,0,1]=3 13417 B16R0.165 COC(=O)CCCCCOCCCCC(=O)N 34a_100012022536_100009816466 [0,2,0,0,0,0|1,0,1]=4 13418 B16R0.165 COC(=O)CCCCCOCCCCC(=O)N 7a_100012022536_100009816466 [0,2,0,0,0,0|1,0,1]=4 13419 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 34a_100000074720_100011216152 [0,2,0,0,0,0|0,0,0]=2 13420 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 34a_100011214890_100009816466 [0,2,0,0,0,0|0,0,0]=2 13421 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 7a_100000074720_100011216152 [0,2,0,0,0,0|0,0,0]=2 13422 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 7a_100011214890_100009816466 [0,2,0,0,0,0|0,0,0]=2 13423 B16R0.165 COC(=O)CCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100009816466 [0,2,0,0,0,0|2,0,0]=4 13424 B16R0.165 COC(=O)CCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100009816466 [0,2,0,0,0,0|2,0,0]=4 13425 B16R0.165 COC(=O)CCCCCOCCCNC(=O)C 34a_100000752032_100009816466 [0,2,0,0,0,0|1,0,1]=4 13426 B16R0.165 COC(=O)CCCCCOCCCNC(C)C 34a_100000182298_100009816466 [0,2,0,0,0,0|1,0,0]=3 13427 B16R0.165 COC(=O)CCCCCOCCCOC(=O)C 34a_100000074720_100000042594 [0,2,0,0,0,0|1,0,1]=4 13428 B16R0.165 COC(=O)CCCCCOCCCOC(=O)C 7a_100000074720_100000042594 [0,2,0,0,0,0|1,0,1]=4 13429 B16R0.165 COC(=O)CCCCCOCCCOC(=S)C 34a_100000074720_200135323944 [0,2,0,0,0,0|1,0,1]=4 13430 B16R0.165 COC(=O)CCCCCOCCCOC(=S)C 7a_100000074720_200135323944 [0,2,0,0,0,0|1,0,1]=4 13431 B16R0.165 COC(=O)CCCCCOCCCSC(=O)C 34a_100000074720_100000038929 [0,2,0,0,0,0|1,0,1]=4 13432 B16R0.165 COC(=O)CCCCCOCCCSC(=O)C 7a_100000074720_100000038929 [0,2,0,0,0,0|1,0,1]=4 13433 B16R0.165 COC(=O)CCCCCOCCNCC(C)C 34a_100015185251_100009816466 [0,2,0,0,0,0|1,0,0]=3 13434 B16R0.165 COC(=O)CCCCCOCCOCC(C)C 34a_100000703358_100009816466 [0,2,0,0,0,0|1,0,0]=3 13435 B16R0.165 COC(=O)CCCCCOCCOCC(C)C 7a_100000703358_100009816466 [0,2,0,0,0,0|1,0,0]=3 13436 B16R0.165 COC(=O)CCCCCOCCOCC(F)F 34a_100000074720_200012177212 [0,2,0,0,0,0|2,0,0]=4 13437 B16R0.165 COC(=O)CCCCCOCCOCC(F)F 34a_100000704375_100009816466 [0,2,0,0,0,0|2,0,0]=4 13438 B16R0.165 COC(=O)CCCCCOCCOCC(F)F 7a_100000074720_200012177212 [0,2,0,0,0,0|2,0,0]=4 13439 B16R0.165 COC(=O)CCCCCOCCOCC(F)F 7a_100000704375_100009816466 [0,2,0,0,0,0|2,0,0]=4 13440 B16R0.165 COC(=O)CCCCCOCCSCC(C)C 34a_200000230437_100009816466 [0,2,0,0,0,0|1,0,0]=3 13441 B16R0.165 COC(=O)CCCCCOCCSCC(C)C 7a_200000230437_100009816466 [0,2,0,0,0,0|1,0,0]=3 13442 B16R0.165 COC(=O)CCCCCSCCCCB(O)O 62a_100009816466_200009817182 [0,2,0,0,0,0|2,0,0]=4 13443 B16R0.165 COC(=O)CCCCCSCCCCB(O)O 62a_200009817182_100009816466 [0,2,0,0,0,0|2,0,0]=4 13444 B16R0.165 COC(=O)CCCCCSCCCCC(=O)C 62a_100000735457_100009816466 [0,2,0,0,0,0|0,0,1]=3 13445 B16R0.165 COC(=O)CCCCCSCCCCC(=O)C 62a_100009816466_100000735457 [0,2,0,0,0,0|0,0,1]=3 13446 B16R0.165 COC(=O)CCCCCSCCCCC(C)C 62a_100009816466_100011216152 [0,2,0,0,0,0|0,0,0]=2 13447 B16R0.165 COC(=O)CCCCCSCCCCC(C)C 62a_100011216152_100009816466 [0,2,0,0,0,0|0,0,0]=2 13448 B16R0.165 COC(=O)CCCCCSCCCCN(C)C 62a_100009816466_100000690147 [0,2,0,0,0,0|1,0,0]=3 13449 B16R0.165 COC(=O)CCCCCSCCCOC(=O)C 62a_100000042594_100009816466 [0,2,0,0,0,0|1,0,1]=4 13450 B16R0.165 COC(=O)CCCCCSCCCOC(=O)C 62a_100009816466_100000042594 [0,2,0,0,0,0|1,0,1]=4 13451 B16R0.165 COC(=O)CCCCCSCCCOC(=S)C 62a_100009816466_200135323944 [0,2,0,0,0,0|1,0,1]=4 13452 B16R0.165 COC(=O)CCCCCSCCCOC(=S)C 62a_200135323944_100009816466 [0,2,0,0,0,0|1,0,1]=4 13453 B16R0.165 COC(=O)CCCCCSCCCSC(=O)C 62a_100000038929_100009816466 [0,2,0,0,0,0|1,0,1]=4 13454 B16R0.165 COC(=O)CCCCCSCCCSC(=O)C 62a_100009816466_100000038929 [0,2,0,0,0,0|1,0,1]=4 13455 B16R0.165 COC(=O)CCCCCSCCOCC(F)F 62a_100009816466_200012177212 [0,2,0,0,0,0|2,0,0]=4 13456 B16R0.165 COC(=O)CCCCCSCCOCC(F)F 62a_200012177212_100009816466 [0,2,0,0,0,0|2,0,0]=4 13457 B16R0.165 COC(=O)CCCCNCCCCCC(C)C 2230a_100011290863_100000204269 [0,2,0,0,0,0|0,0,0]=2 13458 B16R0.165 COC(=O)CCCCNCCCCCC(C)C 34a_100011290863_100000204269 [0,2,0,0,0,0|0,0,0]=2 13459 B16R0.165 COC(=O)CCCCNCCCCNC(=O)C 2230a_200011368371_100000204269 [0,2,0,0,0,0|1,0,1]=4 13460 B16R0.165 COC(=O)CCCCNCCCCNC(=O)C 34a_200011368371_100000204269 [0,2,0,0,0,0|1,0,1]=4 13461 B16R0.165 COC(=O)CCCCNCCCOCC(C)C 2230a_100000205972_100000204269 [0,2,0,0,0,0|1,0,0]=3 13462 B16R0.165 COC(=O)CCCCNCCCOCC(C)C 34a_100000205972_100000204269 [0,2,0,0,0,0|1,0,0]=3 13463 B16R0.165 COC(=O)CCCCOCCCCCB(O)O 34a_100000059025_200009817188 [0,2,0,0,0,0|2,0,0]=4 13464 B16R0.165 COC(=O)CCCCOCCCCCB(O)O 7a_100000059025_200009817188 [0,2,0,0,0,0|2,0,0]=4 13465 B16R0.165 COC(=O)CCCCOCCCCCC(=O)N 34a_100000059025_100009817443 [0,2,0,0,0,0|1,0,1]=4 13466 B16R0.165 COC(=O)CCCCOCCCCCC(=O)N 34a_100000123541_100000204269 [0,2,0,0,0,0|1,0,1]=4 13467 B16R0.165 COC(=O)CCCCOCCCCCC(=O)N 7a_100000059025_100009817443 [0,2,0,0,0,0|1,0,1]=4 13468 B16R0.165 COC(=O)CCCCOCCCCCC(=O)N 7a_100000123541_100000204269 [0,2,0,0,0,0|1,0,1]=4 13469 B16R0.165 COC(=O)CCCCOCCCCCC(=O)[O-] 7a_100102619762_100000204269 [0,2,0,0,0,0|1,0,1]=4 13470 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 34a_100000059025_100000210682 [0,2,0,0,0,0|0,0,0]=2 13471 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 34a_100011995859_100000204269 [0,2,0,0,0,0|0,0,0]=2 13472 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 7a_100000059025_100000210682 [0,2,0,0,0,0|0,0,0]=2 13473 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 7a_100011995859_100000204269 [0,2,0,0,0,0|0,0,0]=2 13474 B16R0.165 COC(=O)CCCCOCCCCNC(C)C 34a_100011521146_100000204269 [0,2,0,0,0,0|1,0,0]=3 13475 B16R0.165 COC(=O)CCCCOCCCCOC(=O)C 34a_100000059025_100000033659 [0,2,0,0,0,0|1,0,1]=4 13476 B16R0.165 COC(=O)CCCCOCCCCOC(=O)C 34a_100000073216_100000204269 [0,2,0,0,0,0|1,0,1]=4 13477 B16R0.165 COC(=O)CCCCOCCCCOC(=O)C 7a_100000059025_100000033659 [0,2,0,0,0,0|1,0,1]=4 13478 B16R0.165 COC(=O)CCCCOCCCCOC(=O)C 7a_100000073216_100000204269 [0,2,0,0,0,0|1,0,1]=4 13479 B16R0.165 COC(=O)CCCCOCCCCSC(=O)C 34a_100000059025_200010402107 [0,2,0,0,0,0|1,0,1]=4 13480 B16R0.165 COC(=O)CCCCOCCCCSC(=O)C 7a_100000059025_200010402107 [0,2,0,0,0,0|1,0,1]=4 13481 B16R0.165 COC(=O)CCCCSCCCCCB(O)O 62a_100000204269_200009817188 [0,2,0,0,0,0|2,0,0]=4 13482 B16R0.165 COC(=O)CCCCSCCCCCB(O)O 62a_200009817188_100000204269 [0,2,0,0,0,0|2,0,0]=4 13483 B16R0.165 COC(=O)CCCCSCCCCCC(=O)N 62a_100000204269_100009817443 [0,2,0,0,0,0|1,0,1]=4 13484 B16R0.165 COC(=O)CCCCSCCCCCC(=O)N 62a_100009817443_100000204269 [0,2,0,0,0,0|1,0,1]=4 13485 B16R0.165 COC(=O)CCCCSCCCCCC(C)C 62a_100000204269_100000210682 [0,2,0,0,0,0|0,0,0]=2 13486 B16R0.165 COC(=O)CCCCSCCCCCC(C)C 62a_100000210682_100000204269 [0,2,0,0,0,0|0,0,0]=2 13487 B16R0.165 COC(=O)CCCCSCCCCOC(=O)C 62a_100000033659_100000204269 [0,2,0,0,0,0|1,0,1]=4 13488 B16R0.165 COC(=O)CCCCSCCCCOC(=O)C 62a_100000204269_100000033659 [0,2,0,0,0,0|1,0,1]=4 13489 B16R0.165 COC(=O)CCCCSCCCCSC(=O)C 62a_100000204269_200010402107 [0,2,0,0,0,0|1,0,1]=4 13490 B16R0.165 COC(=O)CCCCSCCCCSC(=O)C 62a_200010402107_100000204269 [0,2,0,0,0,0|1,0,1]=4 13491 B16R0.165 COC(=O)CCCNCCCCCCC(C)C 2230a_100000211014_100011218270 [0,2,0,0,0,0|0,0,0]=2 13492 B16R0.165 COC(=O)CCCNCCCCCCC(C)C 34a_100000211014_100000742333 [0,2,0,0,0,0|0,0,0]=2 13493 B16R0.165 COC(=O)CCCNCCCCCNC(=O)C 2230a_200012022750_100011218270 [0,2,0,0,0,0|1,0,1]=4 13494 B16R0.165 COC(=O)CCCNCCCCCNC(=O)C 34a_200012022750_100000742333 [0,2,0,0,0,0|1,0,1]=4 13495 B16R0.165 COC(=O)CCCOCCCCCNC(C)C 34a_100011629493_100000742333 [0,2,0,0,0,0|1,0,0]=3 13496 B16R0.165 COC(=O)CCCSCCCCCCB(O)O 62a_100009817187_100011218270 [0,2,0,0,0,0|2,0,0]=4 13497 B16R0.165 COC(=O)CCCSCCCCCCB(O)O 62a_100011218270_100009817187 [0,2,0,0,0,0|2,0,0]=4 13498 B16R0.165 COC(=O)CCCSCCCCCOC(=O)C 62a_100000033007_100011218270 [0,2,0,0,0,0|1,0,1]=4 13499 B16R0.165 COC(=O)CCCSCCCCCOC(=O)C 62a_100011218270_100000033007 [0,2,0,0,0,0|1,0,1]=4 13500 B16R0.165 COC(=O)CCNCCCCCCNC(=O)C 2230a_200011996284_100000204255 [0,2,0,0,0,0|1,0,1]=4 13501 B16R0.165 COC(=O)CCNCCCCCCNC(=O)C 34a_200011996284_100000742370 [0,2,0,0,0,0|1,0,1]=4 13502 B16R0.165 COC(=O)CCOCCCCCCCC(C)C 34a_200000210741_100000742370 [0,2,0,0,0,0|0,0,0]=2 13503 B16R0.165 COC(=O)CCOCCCCCCCC(C)C 7a_200000210741_100000204255 [0,2,0,0,0,0|0,0,0]=2 13504 B16R0.165 COC(=O)CCOCCOCCOCC(C)C 34a_100010982084_100000210624 [0,2,0,0,0,0|2,0,0]=4 13505 B16R0.165 COC(=O)CCOCCOCCOCC(C)C 7a_100010982084_100000210760 [0,2,0,0,0,0|2,0,0]=4 13506 B16R0.165 COC(=O)CCOCCOCCOCC(C)O 34a_100010982084_100011218427 [0,2,0,0,0,0|2,0,0]=4 13507 B16R0.165 COC(=O)CCOCCOCCOCC(C)O 7a_100010982084_100011218427 [0,2,0,0,0,0|2,0,0]=4 13508 B16R0.165 COC(=O)CCOCCOCCOC[C@@H](C)O 34a_100010982084_100009817552 [0,2,0,0,0,0|2,0,0]=4 13509 B16R0.165 COC(=O)CCOCCOCCOC[C@@H](C)O 7a_100010982084_100009817552 [0,2,0,0,0,0|2,0,0]=4 13510 B16R0.165 COC(=O)COCCNCCCCCC(C)C 2230a_100011290863_100000090808 [0,2,0,0,0,0|1,0,0]=3 13511 B16R0.165 COC(=O)COCCNCCCCCC(C)C 34a_100011290863_100000090808 [0,2,0,0,0,0|1,0,0]=3 13512 B16R0.165 COC(=O)COCCNCCCOCC(C)C 2230a_100000205972_100000090808 [0,2,0,0,0,0|2,0,0]=4 13513 B16R0.165 COC(=O)COCCNCCCOCC(C)C 34a_100000205972_100000090808 [0,2,0,0,0,0|2,0,0]=4 13514 B16R0.165 COC(=O)COCCOCCCCCC(C)C 34a_100011995859_100000090808 [0,2,0,0,0,0|1,0,0]=3 13515 B16R0.165 COC(=O)COCCOCCCCCC(C)C 7a_100011995859_100000090808 [0,2,0,0,0,0|1,0,0]=3 13516 B16R0.165 COC(=O)COCCOCCCCNC(C)C 34a_100011521146_100000090808 [0,2,0,0,0,0|2,0,0]=4 13517 B16R0.165 COC(=O)COCCOCCOCCC(C)C 34a_100011023656_100000210312 [0,2,0,0,0,0|2,0,0]=4 13518 B16R0.165 COC(=O)COCCOCCOCCC(C)C 7a_100011023656_100000210626 [0,2,0,0,0,0|2,0,0]=4 13519 B16R0.165 COC(=O)COCCOCCOCCC(C)O 34a_100011023656_100012276601 [0,2,0,0,0,0|2,0,0]=4 13520 B16R0.165 COC(=O)COCCOCCOCCC(C)O 7a_100011023656_100012276601 [0,2,0,0,0,0|2,0,0]=4 13521 B16R0.165 COC(=O)COCCSCCCCCC(C)C 62a_100000090808_100000210682 [0,2,0,0,0,0|1,0,0]=3 13522 B16R0.165 COC(=O)COCCSCCCCCC(C)C 62a_100000210682_100000090808 [0,2,0,0,0,0|1,0,0]=3 13523 B16R0.184 C#CCCCCC(=O)CCCCCC(=O)OC 1458a_100000696528_100009816466 [0,2,0,0,0,0|0,0,2]=4 13524 B16R0.184 C#CCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100010269958 [0,2,0,0,0,0|0,0,2]=4 13525 B16R0.184 C=CCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011215482 [0,2,0,0,0,0|0,0,2]=4 13526 B16R0.184 C=CCCCCC(=O)CCCCCC(=O)OC 1458a_100011215552_100009816466 [0,2,0,0,0,0|0,0,2]=4 13527 B16R0.184 C=CCCCCN(C)CCCCCC(=O)OC 2230a_100012000471_100009816466 [0,2,0,0,0,0|0,0,2]=4 13528 B16R0.184 C=CCCCCN(C)CCCCCC(=O)OC 269982a_100012000471_100009816466 [0,2,0,0,0,0|0,0,2]=4 13529 B16R0.184 CC/C=C\CCC(=O)CCCCCC(=O)OC 1458a_100009848860_100015370543 [0,2,0,0,0,0|0,0,2]=4 13530 B16R0.184 CCC/C=C/CC(=O)CCCCCC(=O)OC 1458a_200016266809_100009816466 [0,2,0,0,0,0|0,0,2]=4 13531 B16R0.184 CCCCC=CC(=O)CCCCCC(=O)OC 1458a_100016266645_100009816466 [0,2,0,0,0,0|0,0,2]=4 13532 B16R0.184 CCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210757 [0,2,0,0,0,0|0,0,0]=2 13533 B16R0.184 CCCCCCC(=O)CCCCCC(=O)OC 1458a_100102632555_100009816466 [0,2,0,0,0,0|0,0,0]=2 13534 B16R0.184 CCCCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100102632555 [0,2,0,0,0,0|0,0,1]=3 13535 B16R0.184 CCCCCCC(C)CCOCCC(=O)NC 34a_200011024964_100012179268 [0,2,0,0,0,0|1,0,0]=3 13536 B16R0.184 CCCCCCC(C)CCOCCC(=O)NC 7a_200011024964_100000737683 [0,2,0,0,0,0|1,0,0]=3 13537 B16R0.184 CCCCCCC(C)CCOCCC(=O)OC 34a_200011024964_100000742370 [0,2,0,0,0,0|0,0,0]=2 13538 B16R0.184 CCCCCCC(C)CCOCCC(=O)OC 7a_200011024964_100000204255 [0,2,0,0,0,0|0,0,0]=2 13539 B16R0.184 CCCCCCC(C)NCCCCC(=O)OC 2230a_100000210919_100000204269 [0,2,0,0,0,0|0,0,0]=2 13540 B16R0.184 CCCCCCC(C)NCCCCC(=O)OC 34a_100000210919_100000204269 [0,2,0,0,0,0|0,0,0]=2 13541 B16R0.184 CCCCCCC(C)NCCOCC(=O)OC 2230a_100000210919_100000090808 [0,2,0,0,0,0|1,0,0]=3 13542 B16R0.184 CCCCCCC(C)NCCOCC(=O)OC 34a_100000210919_100000090808 [0,2,0,0,0,0|1,0,0]=3 13543 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 34a_100000059025_100011215978 [0,2,0,0,0,0|0,0,0]=2 13544 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 34a_100000210265_100000204269 [0,2,0,0,0,0|0,0,0]=2 13545 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 7a_100000059025_100011215978 [0,2,0,0,0,0|0,0,0]=2 13546 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 7a_100000210265_100000204269 [0,2,0,0,0,0|0,0,0]=2 13547 B16R0.184 CCCCCCC(C)OCCOCC(=O)OC 34a_100000210265_100000090808 [0,2,0,0,0,0|1,0,0]=3 13548 B16R0.184 CCCCCCC(C)OCCOCC(=O)OC 7a_100000210265_100000090808 [0,2,0,0,0,0|1,0,0]=3 13549 B16R0.184 CCCCCCC(C)SCCCCC(=O)OC 62a_100000204269_100011215978 [0,2,0,0,0,0|0,0,0]=2 13550 B16R0.184 CCCCCCC(C)SCCCCC(=O)OC 62a_100011215978_100000204269 [0,2,0,0,0,0|0,0,0]=2 13551 B16R0.184 CCCCCCC(C)SCCOCC(=O)OC 62a_100000090808_100011215978 [0,2,0,0,0,0|1,0,0]=3 13552 B16R0.184 CCCCCCC(C)SCCOCC(=O)OC 62a_100011215978_100000090808 [0,2,0,0,0,0|1,0,0]=3 13553 B16R0.184 CCCCCCN(C)CCCCCC(=O)OC 2230a_106256046315_100009816466 [0,2,0,0,0,0|0,0,0]=2 13554 B16R0.184 CCCCCCN(C)CCCCCC(=O)OC 269982a_106256046315_100009816466 [0,2,0,0,0,0|0,0,0]=2 13555 B16R0.184 CCCCCNC(=O)CCCCCC(=O)OC 11a_100000209983_100009848860 [0,2,0,0,0,0|0,0,1]=3 13556 B16R0.184 CCCCCNC(=O)CCCCCC(=O)OC 1626a_100000209983_100009848860 [0,2,0,0,0,0|0,0,1]=3 13557 B16R0.184 CCCCCNC(=O)CCCCCC(=O)OC 240690a_100000209983_100009848860 [0,2,0,0,0,0|0,0,1]=3 13558 B16R0.184 CCCCCNC(=O)CSCCCC(=O)OC 62a_100000230301_100011218270 [0,2,0,0,0,0|1,0,1]=4 13559 B16R0.184 CCCCCNC(=O)CSCCCC(=O)OC 62a_100011218270_100000230301 [0,2,0,0,0,0|1,0,1]=4 13560 B16R0.184 CCCCNNC(=O)CCCCCC(=O)OC 22a_100025702795_100009848860 [0,2,0,0,0,0|1,0,1]=4 13561 B16R0.184 CCCCOCC(=O)CCCCCC(=O)OC 1458a_100000757543_100009816466 [0,2,0,0,0,0|0,0,1]=3 13562 B16R0.184 CCCCOCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011995733 [0,2,0,0,0,0|0,0,1]=3 13563 B16R0.184 CCCCOCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000757543 [0,2,0,0,0,0|1,0,1]=4 13564 B16R0.184 CCCCOCC(C)OCCCCC(=O)OC 34a_100011217071_100000204269 [0,2,0,0,0,0|1,0,0]=3 13565 B16R0.184 CCCCOCC(C)OCCCCC(=O)OC 7a_100011217071_100000204269 [0,2,0,0,0,0|1,0,0]=3 13566 B16R0.184 CCCCOCC(C)OCCOCC(=O)OC 34a_100011217071_100000090808 [0,2,0,0,0,0|2,0,0]=4 13567 B16R0.184 CCCCOCC(C)OCCOCC(=O)OC 7a_100011217071_100000090808 [0,2,0,0,0,0|2,0,0]=4 13568 B16R0.184 CCCCSCC(=O)CCCCCC(=O)OC 1458a_100000191162_100009816466 [0,2,0,0,0,0|0,0,1]=3 13569 B16R0.184 CCCCSCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000191162 [0,2,0,0,0,0|1,0,1]=4 13570 B16R0.184 CCCOCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011215938 [0,2,0,0,0,0|0,0,1]=3 13571 B16R0.184 CCOCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100012232248 [0,2,0,0,0,0|0,0,1]=3 13572 B16R0.184 CCOCCNC(=O)CCCCCC(=O)OC 11a_100011200944_100009848860 [0,2,0,0,0,0|1,0,1]=4 13573 B16R0.184 CCOCCNC(=O)CCCCCC(=O)OC 1626a_102516460346_100009848860 [0,2,0,0,0,0|1,0,1]=4 13574 B16R0.184 CCOCCNC(=O)CCCCCC(=O)OC 240690a_100011200944_100009848860 [0,2,0,0,0,0|1,0,1]=4 13575 B16R0.184 CCSCCNC(=O)CCCCCC(=O)OC 11a_100000106463_100009848860 [0,2,0,0,0,0|1,0,1]=4 13576 B16R0.184 CCSCCNC(=O)CCCCCC(=O)OC 1626a_100000106463_100009848860 [0,2,0,0,0,0|1,0,1]=4 13577 B16R0.184 CCSCCNC(=O)CCCCCC(=O)OC 240690a_100000106463_100009848860 [0,2,0,0,0,0|1,0,1]=4 13578 B16R0.184 COC(=O)CCCCCC(=O)CCCCC#N 1458a_100009848860_100000211819 [0,2,0,0,0,0|0,0,2]=4 13579 B16R0.184 COC(=O)CCCCCC(=O)CCCCCF 1458a_100009848860_100000729378 [0,2,0,0,0,0|0,0,1]=3 13580 B16R0.184 COC(=O)CCCCCC(=O)CCCCCO 1458a_100009848860_100000746330 [0,2,0,0,0,0|0,0,1]=3 13581 B16R0.184 COC(=O)CCCCCC(=O)CCCCCO 1458a_100102619762_100009816466 [0,2,0,0,0,0|0,0,1]=3 13582 B16R0.184 COC(=O)CCCCCC(=O)CCOCCO 1458a_100009848860_100011215305 [0,2,0,0,0,0|1,0,1]=4 13583 B16R0.184 COC(=O)CCCCCC(=O)CCOCCO 1458a_100011229844_100009816466 [0,2,0,0,0,0|1,0,1]=4 13584 B16R0.184 COC(=O)CCCCCC(=O)NCCCCO 240690a_100000750430_100009848860 [0,2,0,0,0,0|1,0,1]=4 13585 B16R0.184 COC(=O)CCCCCC(=O)NCCCSC 11a_100000749238_100009848860 [0,2,0,0,0,0|1,0,1]=4 13586 B16R0.184 COC(=O)CCCCCC(=O)NCCCSC 1626a_100000749238_100009848860 [0,2,0,0,0,0|1,0,1]=4 13587 B16R0.184 COC(=O)CCCCCC(=O)NCCCSC 240690a_100000749238_100009848860 [0,2,0,0,0,0|1,0,1]=4 13588 B16R0.184 COC(=O)CCCCCN(C)CCCCCO 2230a_100000722520_100009816466 [0,2,0,0,0,0|1,0,0]=3 13589 B16R0.184 COC(=O)CCCCCN(C)CCCCCO 269982a_100000722520_100009816466 [0,2,0,0,0,0|1,0,0]=3 13590 B16R0.184 COC(=O)CCCCCN(C)CCOCCO 2230a_100000228057_100009816466 [0,2,0,0,0,0|2,0,0]=4 13591 B16R0.184 COC(=O)CCCCCN(C)CCOCCO 269982a_100000228057_100009816466 [0,2,0,0,0,0|2,0,0]=4 13592 B16R0.184 COC(=O)CCCCNC(=O)CCCCCO 188690a_100000746077_100102619762 [0,2,0,0,0,0|1,0,1]=4 13593 B16R0.184 COCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000755781 [0,2,0,0,0,0|0,0,1]=3 13594 B16R0.184 COCCCNC(=O)CCCCCC(=O)OC 1626a_100150723488_100009848860 [0,2,0,0,0,0|1,0,1]=4 13595 B16R0.184 COCCCNC(=O)CCCCCC(=O)OC 240690a_100150723488_100009848860 [0,2,0,0,0,0|1,0,1]=4 13596 B16R0.184 COCCOCC(=O)CCCCCC(=O)OC 1458a_100000211095_100009816466 [0,2,0,0,0,0|1,0,1]=4 13597 B16R0.221 C#CC(=O)CCCCCCCCCCCC=C 1458a_100000211873_102130925996 [0,2,0,0,0,0|1,0,1]=4 13598 B16R0.221 C#CC(=O)CCCCCCCCCCCCC 1458a_100000211873_100000210684 [0,2,0,0,0,0|1,0,1]=4 13599 B16R0.221 C#CC(=O)CCCCCCCCCCCCO 1458a_100000211873_100009813331 [0,2,0,0,0,0|1,0,1]=4 13600 B16R0.221 C#CC(=O)CCCCCCOCCCCCO 1458a_100000211873_200132310570 [0,2,0,0,0,0|1,0,1]=4 13601 B16R0.221 C#CCCCCCCCCCOCC(=O)CC 7a_100000034437_100000747405 [0,2,0,0,0,0|1,0,1]=4 13602 B16R0.221 C#CCCCCCCCCCOCC(=O)NC 34a_100000034437_100000183359 [0,2,0,0,0,0|1,0,1]=4 13603 B16R0.221 C#CCCCCCCCCCOCC(=O)NC 7a_100000034437_100000183359 [0,2,0,0,0,0|1,0,1]=4 13604 B16R0.221 C#CCCCCCCCCCOCC(=O)OC 34a_100000034437_100000747449 [0,2,0,0,0,0|0,0,1]=3 13605 B16R0.221 C#CCCCCCCCCCOCC(=O)OC 7a_100000034437_100000747449 [0,2,0,0,0,0|0,0,1]=3 13606 B16R0.221 C#CCCCCCCCCOCCC(=O)NC 34a_100000065265_100012179268 [0,2,0,0,0,0|1,0,1]=4 13607 B16R0.221 C#CCCCCCCCCOCCC(=O)NC 7a_100000065265_100000737683 [0,2,0,0,0,0|1,0,1]=4 13608 B16R0.221 C#CCCCCCCCCOCCC(=O)OC 34a_100000065265_100000742370 [0,2,0,0,0,0|0,0,1]=3 13609 B16R0.221 C#CCCCCCCCCOCCC(=O)OC 7a_100000065265_100000204255 [0,2,0,0,0,0|0,0,1]=3 13610 B16R0.221 C#CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100153394163 [0,2,0,0,0,0|1,0,1]=4 13611 B16R0.221 C#CCCCCCCCNCCCC(=O)NC 34a_100000740002_100153394163 [0,2,0,0,0,0|1,0,1]=4 13612 B16R0.221 C#CCCCCCCCOCCCC(=O)NC 34a_100000054614_100000741757 [0,2,0,0,0,0|1,0,1]=4 13613 B16R0.221 C#CCCCCCCCOCCCC(=O)NC 7a_100000054614_100000741757 [0,2,0,0,0,0|1,0,1]=4 13614 B16R0.221 C#CCCCCCCCOCCCC(=O)OC 34a_100000054614_100000742333 [0,2,0,0,0,0|0,0,1]=3 13615 B16R0.221 C#CCCCCCCCOCCCC(=O)OC 7a_100000054614_100011218270 [0,2,0,0,0,0|0,0,1]=3 13616 B16R0.221 C#CCCCCCCCOCCNC(=O)OC 34a_100000757965_100153394163 [0,2,0,0,0,0|0,0,2]=4 13617 B16R0.221 C#CCCCCCCCOCCOC(=O)OC 34a_100010262106_100153394163 [0,2,0,0,0,0|0,0,2]=4 13618 B16R0.221 C#CCCCCCCCSCCCC(=O)NC 62a_100000741757_100153394163 [0,2,0,0,0,0|1,0,1]=4 13619 B16R0.221 C#CCCCCCCCSCCCC(=O)NC 62a_100153394163_100000741757 [0,2,0,0,0,0|1,0,1]=4 13620 B16R0.221 C#CCCCCCCCSCCCC(=O)OC 62a_100011218270_100153394163 [0,2,0,0,0,0|0,0,1]=3 13621 B16R0.221 C#CCCCCCCCSCCCC(=O)OC 62a_100153394163_100011218270 [0,2,0,0,0,0|0,0,1]=3 13622 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 34a_100000059025_100012276617 [0,2,0,0,0,0|0,0,1]=3 13623 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 34a_100011217361_100000204269 [0,2,0,0,0,0|0,0,1]=3 13624 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 7a_100000059025_100012276617 [0,2,0,0,0,0|0,0,1]=3 13625 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 7a_100011217361_100000204269 [0,2,0,0,0,0|0,0,1]=3 13626 B16R0.221 C#CCCCCCCOCCOCC(=O)OC 34a_100011217361_100000090808 [0,2,0,0,0,0|0,0,2]=4 13627 B16R0.221 C#CCCCCCCOCCOCC(=O)OC 7a_100011217361_100000090808 [0,2,0,0,0,0|0,0,2]=4 13628 B16R0.221 C#CCCCCCCSCCCCC(=O)OC 62a_100000204269_100012276617 [0,2,0,0,0,0|0,0,1]=3 13629 B16R0.221 C#CCCCCCCSCCCCC(=O)OC 62a_100012276617_100000204269 [0,2,0,0,0,0|0,0,1]=3 13630 B16R0.221 C#CCCCCCCSCCOCC(=O)OC 62a_100000090808_100012276617 [0,2,0,0,0,0|0,0,2]=4 13631 B16R0.221 C#CCCCCCCSCCOCC(=O)OC 62a_100012276617_100000090808 [0,2,0,0,0,0|0,0,2]=4 13632 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 34a_100000074720_100012094781 [0,2,0,0,0,0|0,0,1]=3 13633 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 34a_100000766912_100009816466 [0,2,0,0,0,0|0,0,1]=3 13634 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 7a_100000074720_100012094781 [0,2,0,0,0,0|0,0,1]=3 13635 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 7a_100000766912_100009816466 [0,2,0,0,0,0|0,0,1]=3 13636 B16R0.221 C#CCCCCCSCCCCCC(=O)OC 62a_100009816466_100012094781 [0,2,0,0,0,0|0,0,1]=3 13637 B16R0.221 C#CCCCCCSCCCCCC(=O)OC 62a_100012094781_100009816466 [0,2,0,0,0,0|0,0,1]=3 13638 B16R0.221 C#CCCCCNCCCCCCC(=O)OC 2230a_100000706060_100009815986 [0,2,0,0,0,0|0,0,1]=3 13639 B16R0.221 C#CCCCCNCCCCCCC(=O)OC 34a_100000706060_100009815986 [0,2,0,0,0,0|0,0,1]=3 13640 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 34a_100000766709_100009815986 [0,2,0,0,0,0|0,0,1]=3 13641 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 34a_100009863599_100010269958 [0,2,0,0,0,0|0,0,1]=3 13642 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 7a_100000766709_100009815986 [0,2,0,0,0,0|0,0,1]=3 13643 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 7a_100009863599_100010269958 [0,2,0,0,0,0|0,0,1]=3 13644 B16R0.221 C#CCCCCSCCCCCCC(=O)OC 62a_100009815986_100010269958 [0,2,0,0,0,0|0,0,1]=3 13645 B16R0.221 C#CCCCCSCCCCCCC(=O)OC 62a_100010269958_100009815986 [0,2,0,0,0,0|0,0,1]=3 13646 B16R0.221 C#CCCCNCCCCCCCC(=O)OC 34a_100000718082_100010004213 [0,2,0,0,0,0|0,0,1]=3 13647 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 34a_100000215630_100010004213 [0,2,0,0,0,0|0,0,1]=3 13648 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000695029 [0,2,0,0,0,0|0,0,1]=3 13649 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 7a_100000215630_100010004213 [0,2,0,0,0,0|0,0,1]=3 13650 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 7a_100011022521_100011215417 [0,2,0,0,0,0|0,0,1]=3 13651 B16R0.221 C#CCCCSCCCCCCCC(=O)OC 62a_100010004213_100011215417 [0,2,0,0,0,0|0,0,1]=3 13652 B16R0.221 C#CCCCSCCCCCCCC(=O)OC 62a_100011215417_100010004213 [0,2,0,0,0,0|0,0,1]=3 13653 B16R0.221 C#CCCNCCCCCCCCC(=O)OC 34a_100000755551_100010282707 [0,2,0,0,0,0|0,0,1]=3 13654 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000688953 [0,2,0,0,0,0|0,0,1]=3 13655 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 34a_100011215631_100010282707 [0,2,0,0,0,0|0,0,1]=3 13656 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000688953 [0,2,0,0,0,0|0,0,1]=3 13657 B16R0.221 C#CCCSCCCCCCCCC(=O)OC 62a_100000688953_100010282707 [0,2,0,0,0,0|0,0,1]=3 13658 B16R0.221 C#CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000688953 [0,2,0,0,0,0|0,0,1]=3 13659 B16R0.221 C#CCNCCCCCCCCCC(=O)OC 34a_100000212058_100009813843 [0,2,0,0,0,0|0,0,1]=3 13660 B16R0.221 C#CCOCCCCCCCCCC(=O)OC 34a_100000210247_100009813843 [0,2,0,0,0,0|0,0,1]=3 13661 B16R0.221 C#CCOCCCCCCOCCC(=O)OC 34a_200011021349_100000742370 [0,2,0,0,0,0|0,0,2]=4 13662 B16R0.221 C#CCOCCCCCCOCCC(=O)OC 7a_200011021349_100000204255 [0,2,0,0,0,0|0,0,2]=4 13663 B16R0.221 C#CCOCCNCCCCCCC(=O)OC 2230a_100000700922_100009815986 [0,2,0,0,0,0|0,0,2]=4 13664 B16R0.221 C#CCOCCNCCCCCCC(=O)OC 34a_100000700922_100009815986 [0,2,0,0,0,0|0,0,2]=4 13665 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 34a_100000054580_100009815986 [0,2,0,0,0,0|0,0,2]=4 13666 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 34a_100009863599_100010402529 [0,2,0,0,0,0|0,0,2]=4 13667 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 7a_100000054580_100009815986 [0,2,0,0,0,0|0,0,2]=4 13668 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 7a_100009863599_100010402529 [0,2,0,0,0,0|0,0,2]=4 13669 B16R0.221 C#CCOCCSCCCCCCC(=O)OC 62a_100009815986_100010402529 [0,2,0,0,0,0|0,0,2]=4 13670 B16R0.221 C#CCOCCSCCCCCCC(=O)OC 62a_100010402529_100009815986 [0,2,0,0,0,0|0,0,2]=4 13671 B16R0.221 C#CCSCCCCCCCCCC(=O)OC 62a_100000038162_100009813843 [0,2,0,0,0,0|0,0,1]=3 13672 B16R0.221 C/C=C/CCOCCCCCCCC(=O)OC 34a_100016278192_100010004213 [0,2,0,0,0,0|0,0,1]=3 13673 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 34a_100000035544_100102629194 [0,2,0,0,0,0|0,0,1]=3 13674 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 34a_100016270725_100010282707 [0,2,0,0,0,0|0,0,1]=3 13675 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 7a_100000035544_100102629194 [0,2,0,0,0,0|0,0,1]=3 13676 B16R0.221 C/C=C/CSCCCCCCCCC(=O)OC 62a_100010282707_100102629194 [0,2,0,0,0,0|0,0,1]=3 13677 B16R0.221 C/C=C/CSCCCCCCCCC(=O)OC 62a_100102629194_100010282707 [0,2,0,0,0,0|0,0,1]=3 13678 B16R0.221 C=CC(=O)CCCCCCCCCCCCC 1458a_100000185746_100000210684 [0,2,0,0,0,0|1,0,1]=4 13679 B16R0.221 C=CC(=O)CCCCCCCCCCCCO 1458a_100000185746_100009813331 [0,2,0,0,0,0|1,0,1]=4 13680 B16R0.221 C=CC(=O)CCCCCCOCCCCCO 1458a_100000185746_200132310570 [0,2,0,0,0,0|1,0,1]=4 13681 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185746 [0,2,0,0,0,0|1,0,1]=4 13682 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_200121576911 [0,2,0,0,0,0|1,0,1]=4 13683 B16R0.221 C=CC(=O)NCCCCOCCCCCCC 34a_100014118770_100000210614 [0,2,0,0,0,0|1,0,1]=4 13684 B16R0.221 C=CC(=O)NCCNCCCCCCCCC 2230a_114873766552_100011214924 [0,2,0,0,0,0|1,0,1]=4 13685 B16R0.221 C=CC(=O)NCCOCCCCCCCCC 34a_100011304386_100011214924 [0,2,0,0,0,0|1,0,1]=4 13686 B16R0.221 C=CC(=O)OCCCCCCNCCCCC 2230a_100000209983_100009894100 [0,2,0,0,0,0|1,0,1]=4 13687 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 34a_100000210253_100009894100 [0,2,0,0,0,0|1,0,1]=4 13688 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 7a_100000210253_100009894100 [0,2,0,0,0,0|1,0,1]=4 13689 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100000210326_100009894100 [0,2,0,0,0,0|1,0,1]=4 13690 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100009894100_100000210326 [0,2,0,0,0,0|1,0,1]=4 13691 B16R0.221 C=CC(=O)OCCCCCOCCCCCC 7a_200011023508_100000210314 [0,2,0,0,0,0|1,0,1]=4 13692 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 2230a_100000212291_100009813456 [0,2,0,0,0,0|1,0,1]=4 13693 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 34a_100000212291_100009813456 [0,2,0,0,0,0|1,0,1]=4 13694 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 34a_100000210712_100009813456 [0,2,0,0,0,0|1,0,1]=4 13695 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 7a_100000210712_100009813456 [0,2,0,0,0,0|1,0,1]=4 13696 B16R0.221 C=CC(=O)OCCSCCCCCCCCC 62a_100009813456_100000210670 [0,2,0,0,0,0|1,0,1]=4 13697 B16R0.221 C=CCCCCCCCCCCCC(=O)C=C 1458a_100000185746_102130925996 [0,2,0,0,0,0|1,0,1]=4 13698 B16R0.221 C=CCCCCCCCCCCCC(=O)CC 1458a_100000210414_102130925996 [0,2,0,0,0,0|1,0,0]=3 13699 B16R0.221 C=CCCCCCCCCCCCC(=O)CO 1458a_100000210174_102130925996 [0,2,0,0,0,0|2,0,0]=4 13700 B16R0.221 C=CCCCCCCCCCNCC(=O)NC 2230a_100000081888_100000183359 [0,2,0,0,0,0|1,0,1]=4 13701 B16R0.221 C=CCCCCCCCCCNCC(=O)NC 2230a_100000693194_100009814027 [0,2,0,0,0,0|1,0,1]=4 13702 B16R0.221 C=CCCCCCCCCCNCC(=O)NC 34a_100000081888_100000183359 [0,2,0,0,0,0|1,0,1]=4 13703 B16R0.221 C=CCCCCCCCCCNCC(=O)OC 2230a_100000081888_100000747449 [0,2,0,0,0,0|0,0,1]=3 13704 B16R0.221 C=CCCCCCCCCCNCC(=O)OC 34a_100000081888_100000747449 [0,2,0,0,0,0|0,0,1]=3 13705 B16R0.221 C=CCCCCCCCCCOCC(=O)CC 34a_100000725409_100009814027 [0,2,0,0,0,0|1,0,1]=4 13706 B16R0.221 C=CCCCCCCCCCOCC(=O)CC 7a_100000038209_100000747405 [0,2,0,0,0,0|1,0,1]=4 13707 B16R0.221 C=CCCCCCCCCCOCC(=O)NC 34a_100000038209_100000183359 [0,2,0,0,0,0|1,0,1]=4 13708 B16R0.221 C=CCCCCCCCCCOCC(=O)NC 34a_100000750040_100009814027 [0,2,0,0,0,0|1,0,1]=4 13709 B16R0.221 C=CCCCCCCCCCOCC(=O)NC 7a_100000038209_100000183359 [0,2,0,0,0,0|1,0,1]=4 13710 B16R0.221 C=CCCCCCCCCCOCC(=O)OC 34a_100000038209_100000747449 [0,2,0,0,0,0|0,0,1]=3 13711 B16R0.221 C=CCCCCCCCCCOCC(=O)OC 7a_100000038209_100000747449 [0,2,0,0,0,0|0,0,1]=3 13712 B16R0.221 C=CCCCCCCCCCSCC(=O)CC 62a_100000747405_100009814027 [0,2,0,0,0,0|1,0,1]=4 13713 B16R0.221 C=CCCCCCCCCCSCC(=O)CC 62a_100009814027_100000747405 [0,2,0,0,0,0|1,0,1]=4 13714 B16R0.221 C=CCCCCCCCCCSCC(=O)NC 62a_100000183359_100009814027 [0,2,0,0,0,0|1,0,1]=4 13715 B16R0.221 C=CCCCCCCCCCSCC(=O)NC 62a_100009814027_100000183359 [0,2,0,0,0,0|1,0,1]=4 13716 B16R0.221 C=CCCCCCCCCCSCC(=O)OC 62a_100000747449_100009814027 [0,2,0,0,0,0|0,0,1]=3 13717 B16R0.221 C=CCCCCCCCCCSCC(=O)OC 62a_100009814027_100000747449 [0,2,0,0,0,0|0,0,1]=3 13718 B16R0.221 C=CCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011933949 [0,2,0,0,0,0|1,0,1]=4 13719 B16R0.221 C=CCCCCCCCCNCCC(=O)NC 34a_100000738227_100011933949 [0,2,0,0,0,0|1,0,1]=4 13720 B16R0.221 C=CCCCCCCCCOCCC(=O)NC 34a_100000754576_100011933949 [0,2,0,0,0,0|1,0,1]=4 13721 B16R0.221 C=CCCCCCCCCOCCC(=O)NC 34a_100011215194_100012179268 [0,2,0,0,0,0|1,0,1]=4 13722 B16R0.221 C=CCCCCCCCCOCCC(=O)NC 7a_100011215194_100000737683 [0,2,0,0,0,0|1,0,1]=4 13723 B16R0.221 C=CCCCCCCCCOCCC(=O)OC 34a_100011215194_100000742370 [0,2,0,0,0,0|0,0,1]=3 13724 B16R0.221 C=CCCCCCCCCOCCC(=O)OC 7a_100011215194_100000204255 [0,2,0,0,0,0|0,0,1]=3 13725 B16R0.221 C=CCCCCCCCCSCCC(=O)NC 62a_100000737683_100011933949 [0,2,0,0,0,0|1,0,1]=4 13726 B16R0.221 C=CCCCCCCCCSCCC(=O)NC 62a_100011933949_100000737683 [0,2,0,0,0,0|1,0,1]=4 13727 B16R0.221 C=CCCCCCCCCSCCC(=O)OC 62a_100000204255_100011933949 [0,2,0,0,0,0|0,0,1]=3 13728 B16R0.221 C=CCCCCCCCCSCCC(=O)OC 62a_100011933949_100000204255 [0,2,0,0,0,0|0,0,1]=3 13729 B16R0.221 C=CCCCCCCCCSCOC(=O)OC 62a_100011933949_100000139417 [0,2,0,0,0,0|0,0,2]=4 13730 B16R0.221 C=CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100012355270 [0,2,0,0,0,0|1,0,1]=4 13731 B16R0.221 C=CCCCCCCCNCCCC(=O)NC 34a_100000740002_100012355270 [0,2,0,0,0,0|1,0,1]=4 13732 B16R0.221 C=CCCCCCCCOCCCC(=O)NC 34a_100000730831_100000741757 [0,2,0,0,0,0|1,0,1]=4 13733 B16R0.221 C=CCCCCCCCOCCCC(=O)NC 7a_100000730831_100000741757 [0,2,0,0,0,0|1,0,1]=4 13734 B16R0.221 C=CCCCCCCCOCCCC(=O)OC 34a_100000730831_100000742333 [0,2,0,0,0,0|0,0,1]=3 13735 B16R0.221 C=CCCCCCCCOCCCC(=O)OC 7a_100000730831_100011218270 [0,2,0,0,0,0|0,0,1]=3 13736 B16R0.221 C=CCCCCCCCOCCNC(=O)OC 34a_100000757965_100012355270 [0,2,0,0,0,0|0,0,2]=4 13737 B16R0.221 C=CCCCCCCCOCCOC(=O)OC 34a_100010262106_100012355270 [0,2,0,0,0,0|0,0,2]=4 13738 B16R0.221 C=CCCCCCCCSCCCC(=O)NC 62a_100000741757_100012355270 [0,2,0,0,0,0|1,0,1]=4 13739 B16R0.221 C=CCCCCCCCSCCCC(=O)NC 62a_100012355270_100000741757 [0,2,0,0,0,0|1,0,1]=4 13740 B16R0.221 C=CCCCCCCCSCCCC(=O)OC 62a_100011218270_100012355270 [0,2,0,0,0,0|0,0,1]=3 13741 B16R0.221 C=CCCCCCCCSCCCC(=O)OC 62a_100012355270_100011218270 [0,2,0,0,0,0|0,0,1]=3 13742 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 34a_100000059025_100011215473 [0,2,0,0,0,0|0,0,1]=3 13743 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 34a_200011216477_100000204269 [0,2,0,0,0,0|0,0,1]=3 13744 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 7a_100000059025_100011215473 [0,2,0,0,0,0|0,0,1]=3 13745 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 7a_200011216477_100000204269 [0,2,0,0,0,0|0,0,1]=3 13746 B16R0.221 C=CCCCCCCOCCOCC(=O)OC 34a_200011216477_100000090808 [0,2,0,0,0,0|0,0,2]=4 13747 B16R0.221 C=CCCCCCCOCCOCC(=O)OC 7a_200011216477_100000090808 [0,2,0,0,0,0|0,0,2]=4 13748 B16R0.221 C=CCCCCCCSCCCCC(=O)OC 62a_100000204269_100011215473 [0,2,0,0,0,0|0,0,1]=3 13749 B16R0.221 C=CCCCCCCSCCCCC(=O)OC 62a_100011215473_100000204269 [0,2,0,0,0,0|0,0,1]=3 13750 B16R0.221 C=CCCCCCCSCCOCC(=O)OC 62a_100000090808_100011215473 [0,2,0,0,0,0|0,0,2]=4 13751 B16R0.221 C=CCCCCCCSCCOCC(=O)OC 62a_100011215473_100000090808 [0,2,0,0,0,0|0,0,2]=4 13752 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 34a_100000074720_100000700193 [0,2,0,0,0,0|0,0,1]=3 13753 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 34a_100011216702_100009816466 [0,2,0,0,0,0|0,0,1]=3 13754 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 7a_100000074720_100000700193 [0,2,0,0,0,0|0,0,1]=3 13755 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 7a_100011216702_100009816466 [0,2,0,0,0,0|0,0,1]=3 13756 B16R0.221 C=CCCCCCSCCCCCC(=O)OC 62a_100000700193_100009816466 [0,2,0,0,0,0|0,0,1]=3 13757 B16R0.221 C=CCCCCCSCCCCCC(=O)OC 62a_100009816466_100000700193 [0,2,0,0,0,0|0,0,1]=3 13758 B16R0.221 C=CCCCCNCCCCCCC(=O)OC 2230a_100000703577_100009815986 [0,2,0,0,0,0|0,0,1]=3 13759 B16R0.221 C=CCCCCNCCCCCCC(=O)OC 34a_100000703577_100009815986 [0,2,0,0,0,0|0,0,1]=3 13760 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 34a_100000766645_100009815986 [0,2,0,0,0,0|0,0,1]=3 13761 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 34a_100009863599_100011215482 [0,2,0,0,0,0|0,0,1]=3 13762 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 7a_100000766645_100009815986 [0,2,0,0,0,0|0,0,1]=3 13763 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 7a_100009863599_100011215482 [0,2,0,0,0,0|0,0,1]=3 13764 B16R0.221 C=CCCCCSCCCCCCC(=O)OC 62a_100009815986_100011215482 [0,2,0,0,0,0|0,0,1]=3 13765 B16R0.221 C=CCCCCSCCCCCCC(=O)OC 62a_100011215482_100009815986 [0,2,0,0,0,0|0,0,1]=3 13766 B16R0.221 C=CCCCNCCCCCCCC(=O)OC 2230a_100000700776_100010004213 [0,2,0,0,0,0|0,0,1]=3 13767 B16R0.221 C=CCCCNCCCCCCCC(=O)OC 34a_100000700776_100010004213 [0,2,0,0,0,0|0,0,1]=3 13768 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 34a_100000758997_100010004213 [0,2,0,0,0,0|0,0,1]=3 13769 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000757094 [0,2,0,0,0,0|0,0,1]=3 13770 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 7a_100000758997_100010004213 [0,2,0,0,0,0|0,0,1]=3 13771 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 7a_100011022521_100000757094 [0,2,0,0,0,0|0,0,1]=3 13772 B16R0.221 C=CCCCSCCCCCCCC(=O)OC 62a_100010004213_100000757094 [0,2,0,0,0,0|0,0,1]=3 13773 B16R0.221 C=CCCCSCCCCCCCC(=O)OC 62a_100011713584_100010004213 [0,2,0,0,0,0|0,0,1]=3 13774 B16R0.221 C=CCCNCCCCCCCCC(=O)OC 2230a_100015191253_100010282707 [0,2,0,0,0,0|0,0,1]=3 13775 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000754431 [0,2,0,0,0,0|0,0,1]=3 13776 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 34a_100011205117_100010282707 [0,2,0,0,0,0|0,0,1]=3 13777 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000754431 [0,2,0,0,0,0|0,0,1]=3 13778 B16R0.221 C=CCCSCCCCCCCCC(=O)OC 62a_100000754431_100010282707 [0,2,0,0,0,0|0,0,1]=3 13779 B16R0.221 C=CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000754431 [0,2,0,0,0,0|0,0,1]=3 13780 B16R0.221 C=CCNCCCCCCCCCC(=O)OC 2230a_100020586998_100009813843 [0,2,0,0,0,0|0,0,1]=3 13781 B16R0.221 C=CCOCCCCCCCCCC(=O)OC 34a_200000210373_100009813843 [0,2,0,0,0,0|0,0,1]=3 13782 B16R0.221 C=CCOCCOCCCCCCC(=O)OC 34a_100000037705_100009815986 [0,2,0,0,0,0|0,0,2]=4 13783 B16R0.221 C=CCOCCOCCCCCCC(=O)OC 7a_100000037705_100009815986 [0,2,0,0,0,0|0,0,2]=4 13784 B16R0.221 C=CCSCCCCCCCCCC(=O)OC 62a_100000210623_100009813843 [0,2,0,0,0,0|0,0,1]=3 13785 B16R0.221 C=COCCCCOCCCCCC(=O)OC 34a_100000031558_100009816466 [0,2,0,0,0,0|0,0,2]=4 13786 B16R0.221 C=COCCCCOCCCCCC(=O)OC 7a_100000031558_100009816466 [0,2,0,0,0,0|0,0,2]=4 13787 B16R0.221 C=COCCCNCCCCCCC(=O)OC 2230a_100000210767_100009815986 [0,2,0,0,0,0|0,0,2]=4 13788 B16R0.221 C=COCCCNCCCCCCC(=O)OC 34a_100000210767_100009815986 [0,2,0,0,0,0|0,0,2]=4 13789 B16R0.221 C=COCCOCCCCCCCC(=O)OC 34a_100000033082_100010004213 [0,2,0,0,0,0|0,0,2]=4 13790 B16R0.221 C=COCCOCCCCCCCC(=O)OC 34a_100011022521_100000039644 [0,2,0,0,0,0|0,0,2]=4 13791 B16R0.221 C=COCCOCCCCCCCC(=O)OC 7a_100011022521_100000039644 [0,2,0,0,0,0|0,0,2]=4 13792 B16R0.221 C=COCCSCCCCCCCC(=O)OC 62a_100000039644_100010004213 [0,2,0,0,0,0|0,0,2]=4 13793 B16R0.221 C=COCCSCCCCCCCC(=O)OC 62a_100010004213_100000039644 [0,2,0,0,0,0|0,0,2]=4 13794 B16R0.221 CC#CCCOCCCCCCCC(=O)OC 34a_100000750427_100010004213 [0,2,0,0,0,0|0,0,1]=3 13795 B16R0.221 CC#CCNCCCCCCCCC(=O)OC 2230a_100000685387_100010282707 [0,2,0,0,0,0|0,0,1]=3 13796 B16R0.221 CC#CCNCCCCCCCCC(=O)OC 34a_100000685387_100010282707 [0,2,0,0,0,0|0,0,1]=3 13797 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 34a_100000035544_100000748600 [0,2,0,0,0,0|0,0,1]=3 13798 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 34a_100000761923_100010282707 [0,2,0,0,0,0|0,0,1]=3 13799 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 7a_100000035544_100000748600 [0,2,0,0,0,0|0,0,1]=3 13800 B16R0.221 CC#CCSCCCCCCCCC(=O)OC 62a_100000748600_100010282707 [0,2,0,0,0,0|0,0,1]=3 13801 B16R0.221 CC#CCSCCCCCCCCC(=O)OC 62a_100010282707_100000748600 [0,2,0,0,0,0|0,0,1]=3 13802 B16R0.221 CC/C=C/CCCOCCCCCC(=O)OC 34a_100016287902_100009816466 [0,2,0,0,0,0|0,0,1]=3 13803 B16R0.221 CC/C=C/CCCOCCCCCC(=O)OC 7a_100016287902_100009816466 [0,2,0,0,0,0|0,0,1]=3 13804 B16R0.221 CC/C=C\CCCCCCCNCC(=O)NC 269862a_100000693194_200025770492 [0,2,0,0,0,0|1,0,1]=4 13805 B16R0.221 CC/C=C\CCCCCNCCCC(=O)NC 269862a_100000740002_100016288537 [0,2,0,0,0,0|1,0,1]=4 13806 B16R0.221 CC/C=C\CCCCCOCCCC(=O)NC 34a_100016268722_100000741757 [0,2,0,0,0,0|1,0,1]=4 13807 B16R0.221 CC/C=C\CCCCCOCCCC(=O)NC 7a_100016268722_100000741757 [0,2,0,0,0,0|1,0,1]=4 13808 B16R0.221 CC/C=C\CCCCCOCCCC(=O)OC 34a_100016268722_100000742333 [0,2,0,0,0,0|0,0,1]=3 13809 B16R0.221 CC/C=C\CCCCCOCCCC(=O)OC 7a_100016268722_100011218270 [0,2,0,0,0,0|0,0,1]=3 13810 B16R0.221 CC/C=C\CCCCOCCCCC(=O)OC 34a_100016287862_100000204269 [0,2,0,0,0,0|0,0,1]=3 13811 B16R0.221 CC/C=C\CCCCOCCCCC(=O)OC 7a_100016287862_100000204269 [0,2,0,0,0,0|0,0,1]=3 13812 B16R0.221 CC/C=C\CCCCOCCOCC(=O)OC 34a_100016287862_100000090808 [0,2,0,0,0,0|0,0,2]=4 13813 B16R0.221 CC/C=C\CCCCOCCOCC(=O)OC 7a_100016287862_100000090808 [0,2,0,0,0,0|0,0,2]=4 13814 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 34a_100009863599_100015370543 [0,2,0,0,0,0|0,0,1]=3 13815 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 34a_100016288707_100009815986 [0,2,0,0,0,0|0,0,1]=3 13816 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 7a_100009863599_100015370543 [0,2,0,0,0,0|0,0,1]=3 13817 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 7a_100016288707_100009815986 [0,2,0,0,0,0|0,0,1]=3 13818 B16R0.221 CC/C=C\CCSCCCCCCC(=O)OC 62a_100009815986_100015370543 [0,2,0,0,0,0|0,0,1]=3 13819 B16R0.221 CC/C=C\CCSCCCCCCC(=O)OC 62a_100015370543_100009815986 [0,2,0,0,0,0|0,0,1]=3 13820 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 34a_100011022521_100103147603 [0,2,0,0,0,0|0,0,1]=3 13821 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 34a_100016268518_100010004213 [0,2,0,0,0,0|0,0,1]=3 13822 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 7a_100011022521_100103147603 [0,2,0,0,0,0|0,0,1]=3 13823 B16R0.221 CC/C=C\CSCCCCCCCC(=O)OC 62a_100010004213_100103147603 [0,2,0,0,0,0|0,0,1]=3 13824 B16R0.221 CC/C=C\CSCCCCCCCC(=O)OC 62a_100103147603_100010004213 [0,2,0,0,0,0|0,0,1]=3 13825 B16R0.221 CC=C=CCCOCCCCCCC(=O)OC 34a_100011020354_100009815986 [0,2,0,0,0,0|0,0,2]=4 13826 B16R0.221 CC=CCCCOCCCCCCC(=O)OC 34a_100020645299_100009815986 [0,2,0,0,0,0|0,0,1]=3 13827 B16R0.221 CC=CCOCCCCCCCCC(=O)OC 34a_100000035544_100000070051 [0,2,0,0,0,0|0,0,1]=3 13828 B16R0.221 CC=CCOCCCCCCCCC(=O)OC 7a_100000035544_100000070051 [0,2,0,0,0,0|0,0,1]=3 13829 B16R0.221 CC=CCSCCCCCCCCC(=O)OC 62a_100000070051_100010282707 [0,2,0,0,0,0|0,0,1]=3 13830 B16R0.221 CC=CCSCCCCCCCCC(=O)OC 62a_100010282707_100000070051 [0,2,0,0,0,0|0,0,1]=3 13831 B16R0.221 CCC#CCCCCCCNCCC(=O)NC 2230a_100000738227_200000036426 [0,2,0,0,0,0|1,0,1]=4 13832 B16R0.221 CCC#CCCCCCCNCCC(=O)NC 34a_100000738227_200000036426 [0,2,0,0,0,0|1,0,1]=4 13833 B16R0.221 CCC#CCCCCCCOCCC(=O)NC 34a_100000754576_200000036426 [0,2,0,0,0,0|1,0,1]=4 13834 B16R0.221 CCC#CCCCCCCSCCC(=O)NC 62a_100000737683_200000036426 [0,2,0,0,0,0|1,0,1]=4 13835 B16R0.221 CCC#CCCCCCCSCCC(=O)NC 62a_200000036426_100000737683 [0,2,0,0,0,0|1,0,1]=4 13836 B16R0.221 CCC#CCCCCCCSCCC(=O)OC 62a_100000204255_200000036426 [0,2,0,0,0,0|0,0,1]=3 13837 B16R0.221 CCC#CCCCCCCSCCC(=O)OC 62a_200000036426_100000204255 [0,2,0,0,0,0|0,0,1]=3 13838 B16R0.221 CCC#CCCCCCCSCOC(=O)OC 62a_200000036426_100000139417 [0,2,0,0,0,0|0,0,2]=4 13839 B16R0.221 CCC#CCCOCCCCCCC(=O)OC 34a_100000036655_100009815986 [0,2,0,0,0,0|0,0,1]=3 13840 B16R0.221 CCC#CCCOCCCCCCC(=O)OC 7a_100000036655_100009815986 [0,2,0,0,0,0|0,0,1]=3 13841 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 34a_100000032950_100010004213 [0,2,0,0,0,0|0,0,1]=3 13842 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 34a_100011022521_100009813939 [0,2,0,0,0,0|0,0,1]=3 13843 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 7a_100011022521_100009813939 [0,2,0,0,0,0|0,0,1]=3 13844 B16R0.221 CCC#CCSCCCCCCCC(=O)OC 62a_100009813939_100010004213 [0,2,0,0,0,0|0,0,1]=3 13845 B16R0.221 CCC#CCSCCCCCCCC(=O)OC 62a_100010004213_100009813939 [0,2,0,0,0,0|0,0,1]=3 13846 B16R0.221 CCC(=O)CCCCCCCCCCCCO 1458a_100000210414_100009813331 [0,2,0,0,0,0|1,0,0]=3 13847 B16R0.221 CCC(=O)CCCCCCOCCCCCO 1458a_100000210414_200132310570 [0,2,0,0,0,0|1,0,0]=3 13848 B16R0.221 CCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747405 [0,2,0,0,0,0|1,0,0]=3 13849 B16R0.221 CCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747405 [0,2,0,0,0,0|1,0,0]=3 13850 B16R0.221 CCC(=O)COCCCCCCCCCCO 34a_100000725409_100009813290 [0,2,0,0,0,0|1,0,0]=3 13851 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100000747405_200000033068 [0,2,0,0,0,0|1,0,0]=3 13852 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747405 [0,2,0,0,0,0|1,0,0]=3 13853 B16R0.221 CCC(=O)NCCNCCCCCCCCO 34a_100132302217_100000033203 [0,2,0,0,0,0|2,0,0]=4 13854 B16R0.221 CCC(=O)NCCOCCCCCCCCO 34a_200000158885_100000033203 [0,2,0,0,0,0|2,0,0]=4 13855 B16R0.221 CCC(=O)NCCOCCCCCCCCO 7a_200000158885_100000033203 [0,2,0,0,0,0|2,0,0]=4 13856 B16R0.221 CCC(=O)OCCOCCCCCCCCO 7a_200000031056_100000033203 [0,2,0,0,0,0|2,0,0]=4 13857 B16R0.221 CCC/C=C/COCCCCCCC(=O)OC 34a_100016278788_100009815986 [0,2,0,0,0,0|0,0,1]=3 13858 B16R0.221 CCC/C=C/COCCCCCCC(=O)OC 7a_100016278788_100009815986 [0,2,0,0,0,0|0,0,1]=3 13859 B16R0.221 CCCC#CCCOCCCCCC(=O)OC 34a_100000042726_100009816466 [0,2,0,0,0,0|0,0,1]=3 13860 B16R0.221 CCCC#CCCOCCCCCC(=O)OC 7a_100000042726_100009816466 [0,2,0,0,0,0|0,0,1]=3 13861 B16R0.221 CCCC#CCOCCCCCCC(=O)OC 34a_100000034806_100009815986 [0,2,0,0,0,0|0,0,1]=3 13862 B16R0.221 CCCC#CCOCCCCCCC(=O)OC 7a_100000034806_100009815986 [0,2,0,0,0,0|0,0,1]=3 13863 B16R0.221 CCCC/C=C/CCCCOCCC(=O)NC 34a_200020645093_100012179268 [0,2,0,0,0,0|1,0,1]=4 13864 B16R0.221 CCCC/C=C/CCCCOCCC(=O)NC 7a_200020645093_100000737683 [0,2,0,0,0,0|1,0,1]=4 13865 B16R0.221 CCCC/C=C/CCCCOCCC(=O)OC 34a_200020645093_100000742370 [0,2,0,0,0,0|0,0,1]=3 13866 B16R0.221 CCCC/C=C/CCCCOCCC(=O)OC 7a_200020645093_100000204255 [0,2,0,0,0,0|0,0,1]=3 13867 B16R0.221 CCCC/C=C/COCCCCCC(=O)OC 34a_200016272032_100009816466 [0,2,0,0,0,0|0,0,1]=3 13868 B16R0.221 CCCC/C=C/COCCCCCC(=O)OC 7a_200016272032_100009816466 [0,2,0,0,0,0|0,0,1]=3 13869 B16R0.221 CCCC/C=C\CCOCCCCC(=O)OC 34a_200016286491_100000204269 [0,2,0,0,0,0|0,0,1]=3 13870 B16R0.221 CCCC/C=C\CCOCCCCC(=O)OC 7a_200016286491_100000204269 [0,2,0,0,0,0|0,0,1]=3 13871 B16R0.221 CCCC/C=C\CCOCCOCC(=O)OC 34a_200016286491_100000090808 [0,2,0,0,0,0|0,0,2]=4 13872 B16R0.221 CCCC/C=C\CCOCCOCC(=O)OC 7a_200016286491_100000090808 [0,2,0,0,0,0|0,0,2]=4 13873 B16R0.221 CCCCC#CCCCCOCCC(=O)NC 34a_200000066234_100012179268 [0,2,0,0,0,0|1,0,1]=4 13874 B16R0.221 CCCCC#CCCCCOCCC(=O)NC 7a_200000066234_100000737683 [0,2,0,0,0,0|1,0,1]=4 13875 B16R0.221 CCCCC#CCCCCOCCC(=O)OC 34a_200000066234_100000742370 [0,2,0,0,0,0|0,0,1]=3 13876 B16R0.221 CCCCC#CCCCCOCCC(=O)OC 7a_200000066234_100000204255 [0,2,0,0,0,0|0,0,1]=3 13877 B16R0.221 CCCCC#CCCCNCCCC(=O)NC 2230a_100000740002_200000047210 [0,2,0,0,0,0|1,0,1]=4 13878 B16R0.221 CCCCC#CCCCNCCCC(=O)NC 34a_100000740002_200000047210 [0,2,0,0,0,0|1,0,1]=4 13879 B16R0.221 CCCCC#CCCCOCCNC(=O)OC 34a_100000757965_200000047210 [0,2,0,0,0,0|0,0,2]=4 13880 B16R0.221 CCCCC#CCCCOCCOC(=O)OC 34a_100010262106_200000047210 [0,2,0,0,0,0|0,0,2]=4 13881 B16R0.221 CCCCC#CCCCSCCCC(=O)NC 62a_100000741757_200000047210 [0,2,0,0,0,0|1,0,1]=4 13882 B16R0.221 CCCCC#CCCCSCCCC(=O)NC 62a_200000047210_100000741757 [0,2,0,0,0,0|1,0,1]=4 13883 B16R0.221 CCCCC#CCCCSCCCC(=O)OC 62a_100011218270_200000047210 [0,2,0,0,0,0|0,0,1]=3 13884 B16R0.221 CCCCC#CCCCSCCCC(=O)OC 62a_200000047210_100011218270 [0,2,0,0,0,0|0,0,1]=3 13885 B16R0.221 CCCCC#CCCOCCCCC(=O)OC 34a_100000037610_100000204269 [0,2,0,0,0,0|0,0,1]=3 13886 B16R0.221 CCCCC#CCCOCCCCC(=O)OC 7a_100000037610_100000204269 [0,2,0,0,0,0|0,0,1]=3 13887 B16R0.221 CCCCC#CCCOCCOCC(=O)OC 34a_100000037610_100000090808 [0,2,0,0,0,0|0,0,2]=4 13888 B16R0.221 CCCCC#CCCOCCOCC(=O)OC 7a_100000037610_100000090808 [0,2,0,0,0,0|0,0,2]=4 13889 B16R0.221 CCCCC#CCOCCCCCC(=O)OC 34a_200000034558_100009816466 [0,2,0,0,0,0|0,0,1]=3 13890 B16R0.221 CCCCC#CCOCCCCCC(=O)OC 7a_200000034558_100009816466 [0,2,0,0,0,0|0,0,1]=3 13891 B16R0.221 CCCCC/C=C/COCCCCC(=O)OC 34a_100016258190_100000204269 [0,2,0,0,0,0|0,0,1]=3 13892 B16R0.221 CCCCC/C=C/COCCCCC(=O)OC 7a_100016258190_100000204269 [0,2,0,0,0,0|0,0,1]=3 13893 B16R0.221 CCCCC/C=C/COCCOCC(=O)OC 34a_100016258190_100000090808 [0,2,0,0,0,0|0,0,2]=4 13894 B16R0.221 CCCCC/C=C/COCCOCC(=O)OC 7a_100016258190_100000090808 [0,2,0,0,0,0|0,0,2]=4 13895 B16R0.221 CCCCC/C=C\CCCOCCC(=O)NC 34a_100020655193_100012179268 [0,2,0,0,0,0|1,0,1]=4 13896 B16R0.221 CCCCC/C=C\CCCOCCC(=O)NC 7a_100020655193_100000737683 [0,2,0,0,0,0|1,0,1]=4 13897 B16R0.221 CCCCC/C=C\CCCOCCC(=O)OC 34a_100020655193_100000742370 [0,2,0,0,0,0|0,0,1]=3 13898 B16R0.221 CCCCC/C=C\CCCOCCC(=O)OC 7a_100020655193_100000204255 [0,2,0,0,0,0|0,0,1]=3 13899 B16R0.221 CCCCC/C=C\CCOCCCC(=O)NC 34a_100016277358_100000741757 [0,2,0,0,0,0|1,0,1]=4 13900 B16R0.221 CCCCC/C=C\CCOCCCC(=O)NC 7a_100016277358_100000741757 [0,2,0,0,0,0|1,0,1]=4 13901 B16R0.221 CCCCC/C=C\CCOCCCC(=O)OC 34a_100016277358_100000742333 [0,2,0,0,0,0|0,0,1]=3 13902 B16R0.221 CCCCC/C=C\CCOCCCC(=O)OC 7a_100016277358_100011218270 [0,2,0,0,0,0|0,0,1]=3 13903 B16R0.221 CCCCCC#CCCOCCCC(=O)NC 34a_200000042877_100000741757 [0,2,0,0,0,0|1,0,1]=4 13904 B16R0.221 CCCCCC#CCCOCCCC(=O)NC 7a_200000042877_100000741757 [0,2,0,0,0,0|1,0,1]=4 13905 B16R0.221 CCCCCC#CCCOCCCC(=O)OC 34a_200000042877_100000742333 [0,2,0,0,0,0|0,0,1]=3 13906 B16R0.221 CCCCCC#CCCOCCCC(=O)OC 7a_200000042877_100011218270 [0,2,0,0,0,0|0,0,1]=3 13907 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 34a_100000059025_100009816472 [0,2,0,0,0,0|0,0,1]=3 13908 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 34a_200000033628_100000204269 [0,2,0,0,0,0|0,0,1]=3 13909 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 7a_100000059025_100009816472 [0,2,0,0,0,0|0,0,1]=3 13910 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 7a_200000033628_100000204269 [0,2,0,0,0,0|0,0,1]=3 13911 B16R0.221 CCCCCC#CCOCCOCC(=O)OC 34a_200000033628_100000090808 [0,2,0,0,0,0|0,0,2]=4 13912 B16R0.221 CCCCCC#CCOCCOCC(=O)OC 7a_200000033628_100000090808 [0,2,0,0,0,0|0,0,2]=4 13913 B16R0.221 CCCCCC#CCSCCCCC(=O)OC 62a_100000204269_100009816472 [0,2,0,0,0,0|0,0,1]=3 13914 B16R0.221 CCCCCC#CCSCCCCC(=O)OC 62a_100009816472_100000204269 [0,2,0,0,0,0|0,0,1]=3 13915 B16R0.221 CCCCCC#CCSCCOCC(=O)OC 62a_100000090808_100009816472 [0,2,0,0,0,0|0,0,2]=4 13916 B16R0.221 CCCCCC#CCSCCOCC(=O)OC 62a_100009816472_100000090808 [0,2,0,0,0,0|0,0,2]=4 13917 B16R0.221 CCCCCC/C=C/COCCCC(=O)NC 34a_200016276170_100000741757 [0,2,0,0,0,0|1,0,1]=4 13918 B16R0.221 CCCCCC/C=C/COCCCC(=O)NC 7a_200016276170_100000741757 [0,2,0,0,0,0|1,0,1]=4 13919 B16R0.221 CCCCCC/C=C/COCCCC(=O)OC 34a_200016276170_100000742333 [0,2,0,0,0,0|0,0,1]=3 13920 B16R0.221 CCCCCC/C=C/COCCCC(=O)OC 7a_200016276170_100011218270 [0,2,0,0,0,0|0,0,1]=3 13921 B16R0.221 CCCCCCC#CCCOCCC(=O)NC 34a_200000033163_100012179268 [0,2,0,0,0,0|1,0,1]=4 13922 B16R0.221 CCCCCCC#CCCOCCC(=O)NC 7a_200000033163_100000737683 [0,2,0,0,0,0|1,0,1]=4 13923 B16R0.221 CCCCCCC#CCCOCCC(=O)OC 34a_200000033163_100000742370 [0,2,0,0,0,0|0,0,1]=3 13924 B16R0.221 CCCCCCC#CCCOCCC(=O)OC 7a_200000033163_100000204255 [0,2,0,0,0,0|0,0,1]=3 13925 B16R0.221 CCCCCCC#CCOCCCC(=O)NC 34a_200000037284_100000741757 [0,2,0,0,0,0|1,0,1]=4 13926 B16R0.221 CCCCCCC#CCOCCCC(=O)NC 7a_200000037284_100000741757 [0,2,0,0,0,0|1,0,1]=4 13927 B16R0.221 CCCCCCC#CCOCCCC(=O)OC 34a_200000037284_100000742333 [0,2,0,0,0,0|0,0,1]=3 13928 B16R0.221 CCCCCCC#CCOCCCC(=O)OC 7a_200000037284_100011218270 [0,2,0,0,0,0|0,0,1]=3 13929 B16R0.221 CCCCCCCC#CCOCCC(=O)NC 34a_200000061759_100012179268 [0,2,0,0,0,0|1,0,1]=4 13930 B16R0.221 CCCCCCCC#CCOCCC(=O)NC 7a_200000061759_100000737683 [0,2,0,0,0,0|1,0,1]=4 13931 B16R0.221 CCCCCCCC#CCOCCC(=O)OC 34a_200000061759_100000742370 [0,2,0,0,0,0|0,0,1]=3 13932 B16R0.221 CCCCCCCC#CCOCCC(=O)OC 7a_200000061759_100000204255 [0,2,0,0,0,0|0,0,1]=3 13933 B16R0.221 CCCCCCCC/C=C/COCC(=O)CC 7a_200020667288_100000747405 [0,2,0,0,0,0|1,0,1]=4 13934 B16R0.221 CCCCCCCC/C=C/COCC(=O)NC 34a_200020667288_100000183359 [0,2,0,0,0,0|1,0,1]=4 13935 B16R0.221 CCCCCCCC/C=C/COCC(=O)NC 7a_200020667288_100000183359 [0,2,0,0,0,0|1,0,1]=4 13936 B16R0.221 CCCCCCCC/C=C/COCC(=O)OC 34a_200020667288_100000747449 [0,2,0,0,0,0|0,0,1]=3 13937 B16R0.221 CCCCCCCC/C=C/COCC(=O)OC 7a_200020667288_100000747449 [0,2,0,0,0,0|0,0,1]=3 13938 B16R0.221 CCCCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218819 [0,2,0,0,0,0|1,0,1]=4 13939 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000210684 [0,2,0,0,0,0|1,0,0]=3 13940 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000756256_100000210202 [0,2,0,0,0,0|1,0,0]=3 13941 B16R0.221 CCCCCCCCCCCCCC(=O)CF 1458a_100000756256_100015361967 [0,2,0,0,0,0|2,0,0]=4 13942 B16R0.221 CCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000210684 [0,2,0,0,0,0|2,0,0]=4 13943 B16R0.221 CCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000756256 [0,2,0,0,0,0|1,0,0]=3 13944 B16R0.221 CCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000756256 [0,2,0,0,0,0|1,0,0]=3 13945 B16R0.221 CCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000756256 [0,2,0,0,0,0|1,0,0]=3 13946 B16R0.221 CCCCCCCCCCCCNC(=O)CC 11a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 13947 B16R0.221 CCCCCCCCCCCCNC(=O)CC 1626a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 13948 B16R0.221 CCCCCCCCCCCCNC(=O)CC 240690a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 13949 B16R0.221 CCCCCCCCCCCCNC(=O)CC 527a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 13950 B16R0.221 CCCCCCCCCCCCNC(=O)CO 240690a_100000210451_100000210174 [0,2,0,0,0,0|2,0,0]=4 13951 B16R0.221 CCCCCCCCCCCCNC(=O)CO 527a_100000210451_100000210174 [0,2,0,0,0,0|2,0,0]=4 13952 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100000210451_106832991635 [0,2,0,0,0,0|1,0,0]=3 13953 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100000210451 [0,2,0,0,0,0|1,0,0]=3 13954 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100000210451_100102657272 [0,2,0,0,0,0|1,0,0]=3 13955 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100000210451 [0,2,0,0,0,0|1,0,0]=3 13956 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_100000210451_100102657272 [0,2,0,0,0,0|1,0,0]=3 13957 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_106832991638_100000210451 [0,2,0,0,0,0|1,0,0]=3 13958 B16R0.221 CCCCCCCCCCCCSC(C)OC 62a_100009879195_100000759014 [0,2,0,0,0,0|1,0,1]=4 13959 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215454 [0,2,0,0,0,0|1,0,0]=3 13960 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_200011215754_100000183359 [0,2,0,0,0,0|1,0,0]=3 13961 B16R0.221 CCCCCCCCCCCNCC(=O)NC 34a_200011215754_100000183359 [0,2,0,0,0,0|1,0,0]=3 13962 B16R0.221 CCCCCCCCCCCNCC(=O)OC 2230a_200011215754_100000747449 [0,2,0,0,0,0|0,0,0]=2 13963 B16R0.221 CCCCCCCCCCCNCC(=O)OC 34a_200011215754_100000747449 [0,2,0,0,0,0|0,0,0]=2 13964 B16R0.221 CCCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011215454 [0,2,0,0,0,0|1,0,1]=4 13965 B16R0.221 CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011215454 [0,2,0,0,0,0|1,0,0]=3 13966 B16R0.221 CCCCCCCCCCCOCC(=O)CC 7a_100000210809_100000747405 [0,2,0,0,0,0|1,0,0]=3 13967 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000210809_100000183359 [0,2,0,0,0,0|1,0,0]=3 13968 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011215454 [0,2,0,0,0,0|1,0,0]=3 13969 B16R0.221 CCCCCCCCCCCOCC(=O)NC 7a_100000210809_100000183359 [0,2,0,0,0,0|1,0,0]=3 13970 B16R0.221 CCCCCCCCCCCOCC(=O)OC 34a_100000210809_100000747449 [0,2,0,0,0,0|0,0,0]=2 13971 B16R0.221 CCCCCCCCCCCOCC(=O)OC 7a_100000210809_100000747449 [0,2,0,0,0,0|0,0,0]=2 13972 B16R0.221 CCCCCCCCCCCOCC(C)OC 34a_100000690652_100011215454 [0,2,0,0,0,0|1,0,1]=4 13973 B16R0.221 CCCCCCCCCCCSCC(=O)CC 62a_100000747405_100011215454 [0,2,0,0,0,0|1,0,0]=3 13974 B16R0.221 CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011215454 [0,2,0,0,0,0|1,0,0]=3 13975 B16R0.221 CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011215454 [0,2,0,0,0,0|0,0,0]=2 13976 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000684558_100000737683 [0,2,0,0,0,0|1,0,0]=3 13977 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210320 [0,2,0,0,0,0|1,0,0]=3 13978 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000684558_100012179268 [0,2,0,0,0,0|1,0,0]=3 13979 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000210320 [0,2,0,0,0,0|1,0,0]=3 13980 B16R0.221 CCCCCCCCCCNCCC(=O)OC 2230a_100000684558_100000204255 [0,2,0,0,0,0|0,0,0]=2 13981 B16R0.221 CCCCCCCCCCNCCC(=O)OC 34a_100000684558_100000742370 [0,2,0,0,0,0|0,0,0]=2 13982 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000210711_100012179268 [0,2,0,0,0,0|1,0,0]=3 13983 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000210320 [0,2,0,0,0,0|1,0,0]=3 13984 B16R0.221 CCCCCCCCCCOCCC(=O)NC 7a_100000210711_100000737683 [0,2,0,0,0,0|1,0,0]=3 13985 B16R0.221 CCCCCCCCCCOCCC(=O)OC 34a_100000210711_100000742370 [0,2,0,0,0,0|0,0,0]=2 13986 B16R0.221 CCCCCCCCCCOCCC(=O)OC 7a_100000210711_100000204255 [0,2,0,0,0,0|0,0,0]=2 13987 B16R0.221 CCCCCCCCCCOCCC(C)OC 7a_100000764861_100000210320 [0,2,0,0,0,0|1,0,1]=4 13988 B16R0.221 CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210320 [0,2,0,0,0,0|1,0,0]=3 13989 B16R0.221 CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210320 [0,2,0,0,0,0|0,0,0]=2 13990 B16R0.221 CCCCCCCCCNC/C=C/C(=O)OC 2230a_100000212291_100000742655 [0,2,0,0,0,0|0,0,1]=3 13991 B16R0.221 CCCCCCCCCNC/C=C/C(=O)OC 34a_100000212291_100000742655 [0,2,0,0,0,0|0,0,1]=3 13992 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000212291_100000741757 [0,2,0,0,0,0|1,0,0]=3 13993 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011214924 [0,2,0,0,0,0|1,0,0]=3 13994 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000212291_100000741757 [0,2,0,0,0,0|1,0,0]=3 13995 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011214924 [0,2,0,0,0,0|1,0,0]=3 13996 B16R0.221 CCCCCCCCCNCCCC(=O)OC 2230a_100000212291_100011218270 [0,2,0,0,0,0|0,0,0]=2 13997 B16R0.221 CCCCCCCCCNCCCC(=O)OC 34a_100000212291_100000742333 [0,2,0,0,0,0|0,0,0]=2 13998 B16R0.221 CCCCCCCCCNCCNC(=O)CC 34a_100132302217_100011214924 [0,2,0,0,0,0|1,0,0]=3 13999 B16R0.221 CCCCCCCCCNCCNC(=O)NC 34a_100015205895_100011214924 [0,2,0,0,0,0|1,0,0]=3 14000 B16R0.221 CCCCCCCCCNCCOC(=O)NC 34a_100000212291_200011997002 [0,2,0,0,0,0|1,0,0]=3 14001 B16R0.221 CCCCCCCCCOC/C=C/C(=O)OC 34a_100000210712_100000742655 [0,2,0,0,0,0|0,0,1]=3 14002 B16R0.221 CCCCCCCCCOC/C=C/C(=O)OC 7a_100000210712_100000742655 [0,2,0,0,0,0|0,0,1]=3 14003 B16R0.221 CCCCCCCCCOCCCC(=O)NC 34a_100000210712_100000741757 [0,2,0,0,0,0|1,0,0]=3 14004 B16R0.221 CCCCCCCCCOCCCC(=O)NC 7a_100000210712_100000741757 [0,2,0,0,0,0|1,0,0]=3 14005 B16R0.221 CCCCCCCCCOCCCC(=O)NN 34a_100000211488_100011214924 [0,2,0,0,0,0|2,0,0]=4 14006 B16R0.221 CCCCCCCCCOCCCC(=O)OC 34a_100000210712_100000742333 [0,2,0,0,0,0|0,0,0]=2 14007 B16R0.221 CCCCCCCCCOCCCC(=O)OC 7a_100000210712_100011218270 [0,2,0,0,0,0|0,0,0]=2 14008 B16R0.221 CCCCCCCCCOCCNC(=O)CC 34a_200000158885_100011214924 [0,2,0,0,0,0|1,0,0]=3 14009 B16R0.221 CCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210328 [0,2,0,0,0,0|1,0,0]=3 14010 B16R0.221 CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011214924 [0,2,0,0,0,0|0,0,0]=2 14011 B16R0.221 CCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210328 [0,2,0,0,0,0|1,0,0]=3 14012 B16R0.221 CCCCCCCCCOCCOC(=O)NC 34a_100000210712_200011997002 [0,2,0,0,0,0|1,0,0]=3 14013 B16R0.221 CCCCCCCCCOCCOC(=O)NC 7a_100000210712_200011997002 [0,2,0,0,0,0|1,0,0]=3 14014 B16R0.221 CCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011214924 [0,2,0,0,0,0|0,0,0]=2 14015 B16R0.221 CCCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210670 [0,2,0,0,0,0|0,0,1]=3 14016 B16R0.221 CCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210670 [0,2,0,0,0,0|1,0,0]=3 14017 B16R0.221 CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210670 [0,2,0,0,0,0|0,0,0]=2 14018 B16R0.221 CCCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210670 [0,2,0,0,0,0|1,0,0]=3 14019 B16R0.221 CCCCCCCCNCCCCC(=O)OC 2230a_100000229939_100000204269 [0,2,0,0,0,0|0,0,0]=2 14020 B16R0.221 CCCCCCCCNCCCCC(=O)OC 34a_100000229939_100000204269 [0,2,0,0,0,0|0,0,0]=2 14021 B16R0.221 CCCCCCCCNCCOCC(=O)OC 2230a_100000229939_100000090808 [0,2,0,0,0,0|0,0,0]=2 14022 B16R0.221 CCCCCCCCNCCOCC(=O)OC 34a_100000229939_100000090808 [0,2,0,0,0,0|0,0,0]=2 14023 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210759 [0,2,0,0,0,0|0,0,0]=2 14024 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000210232_100000204269 [0,2,0,0,0,0|0,0,0]=2 14025 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210759 [0,2,0,0,0,0|0,0,0]=2 14026 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000210232_100000204269 [0,2,0,0,0,0|0,0,0]=2 14027 B16R0.221 CCCCCCCCOCCOCC(=O)OC 34a_100000210232_100000090808 [0,2,0,0,0,0|0,0,0]=2 14028 B16R0.221 CCCCCCCCOCCOCC(=O)OC 7a_100000210232_100000090808 [0,2,0,0,0,0|0,0,0]=2 14029 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210317 [0,2,0,0,0,0|0,0,0]=2 14030 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000210759_100000204269 [0,2,0,0,0,0|0,0,0]=2 14031 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210317 [0,2,0,0,0,0|0,0,0]=2 14032 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000210759_100000090808 [0,2,0,0,0,0|0,0,0]=2 14033 B16R0.221 CCCCCCCNCCCCCC(=O)OC 2230a_100000229938_100009816466 [0,2,0,0,0,0|0,0,0]=2 14034 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210614 [0,2,0,0,0,0|0,0,0]=2 14035 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000210272_100009816466 [0,2,0,0,0,0|0,0,0]=2 14036 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210614 [0,2,0,0,0,0|0,0,0]=2 14037 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000210272_100009816466 [0,2,0,0,0,0|0,0,0]=2 14038 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100000210614_100009816466 [0,2,0,0,0,0|0,0,0]=2 14039 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210316 [0,2,0,0,0,0|0,0,0]=2 14040 B16R0.221 CCCCCCNCCCCCCC(=O)OC 2230a_100000210581_100009815986 [0,2,0,0,0,0|0,0,0]=2 14041 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100000210259_100009815986 [0,2,0,0,0,0|0,0,0]=2 14042 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210314 [0,2,0,0,0,0|0,0,0]=2 14043 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100000210259_100009815986 [0,2,0,0,0,0|0,0,0]=2 14044 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210314 [0,2,0,0,0,0|0,0,0]=2 14045 B16R0.221 CCCCCCOCCOC/C=C/C(=O)OC 34a_100000691444_100000742655 [0,2,0,0,0,0|0,0,2]=4 14046 B16R0.221 CCCCCCOCCOC/C=C/C(=O)OC 7a_100000691444_100000742655 [0,2,0,0,0,0|0,0,2]=4 14047 B16R0.221 CCCCCCOCCOCCCC(=O)NC 34a_100000691444_100000741757 [0,2,0,0,0,0|1,0,0]=3 14048 B16R0.221 CCCCCCOCCOCCCC(=O)NC 7a_100000691444_100000741757 [0,2,0,0,0,0|1,0,0]=3 14049 B16R0.221 CCCCCCOCCOCCCC(=O)OC 34a_100000691444_100000742333 [0,2,0,0,0,0|0,0,0]=2 14050 B16R0.221 CCCCCCOCCOCCCC(=O)OC 7a_100000691444_100011218270 [0,2,0,0,0,0|0,0,0]=2 14051 B16R0.221 CCCCCCOCCOCCOC(=O)NC 34a_100000691444_200011997002 [0,2,0,0,0,0|2,0,0]=4 14052 B16R0.221 CCCCCCOCCOCCOC(=O)NC 7a_100000691444_200011997002 [0,2,0,0,0,0|2,0,0]=4 14053 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100000210314_100009815986 [0,2,0,0,0,0|0,0,0]=2 14054 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210757 [0,2,0,0,0,0|0,0,0]=2 14055 B16R0.221 CCCCCNCCCCCCCC(=O)OC 2230a_100000209983_100010004213 [0,2,0,0,0,0|0,0,0]=2 14056 B16R0.221 CCCCCNCCOCCCCC(=O)OC 34a_100000224656_100000204269 [0,2,0,0,0,0|0,0,0]=2 14057 B16R0.221 CCCCCNCCOCCOCC(=O)OC 34a_100000224656_100000090808 [0,2,0,0,0,0|1,0,0]=3 14058 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100000210253_100010004213 [0,2,0,0,0,0|0,0,0]=2 14059 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000718602 [0,2,0,0,0,0|0,0,0]=2 14060 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100000210253_100010004213 [0,2,0,0,0,0|0,0,0]=2 14061 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210326 [0,2,0,0,0,0|0,0,0]=2 14062 B16R0.221 CCCCCOCCOCCCCC(=O)OC 34a_100011215259_100000204269 [0,2,0,0,0,0|0,0,0]=2 14063 B16R0.221 CCCCCOCCOCCCCC(=O)OC 7a_100011215259_100000204269 [0,2,0,0,0,0|0,0,0]=2 14064 B16R0.221 CCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000718602 [0,2,0,0,0,0|1,0,0]=3 14065 B16R0.221 CCCCCOCCOCCOCC(=O)OC 34a_100011215259_100000090808 [0,2,0,0,0,0|1,0,0]=3 14066 B16R0.221 CCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210326 [0,2,0,0,0,0|1,0,0]=3 14067 B16R0.221 CCCCCOCCOCCOCC(=O)OC 7a_100011215259_100000090808 [0,2,0,0,0,0|1,0,0]=3 14068 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100000210326_100010004213 [0,2,0,0,0,0|0,0,0]=2 14069 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210326 [0,2,0,0,0,0|0,0,0]=2 14070 B16R0.221 CCCCNCCCCCCCCC(=O)OC 2230a_100000102301_100010282707 [0,2,0,0,0,0|0,0,0]=2 14071 B16R0.221 CCCCNCCCCCCCCC(=O)OC 7a_106832991798_100010282707 [0,2,0,0,0,0|0,0,0]=2 14072 B16R0.221 CCCCNCCCCOC/C=C/C(=O)OC 34a_200011216965_100000742655 [0,2,0,0,0,0|0,0,2]=4 14073 B16R0.221 CCCCNCCCCOCCCC(=O)NC 34a_200011216965_100000741757 [0,2,0,0,0,0|1,0,0]=3 14074 B16R0.221 CCCCNCCCCOCCCC(=O)OC 34a_200011216965_100000742333 [0,2,0,0,0,0|0,0,0]=2 14075 B16R0.221 CCCCNCCCCOCCOC(=O)NC 34a_200011216965_200011997002 [0,2,0,0,0,0|2,0,0]=4 14076 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210210 [0,2,0,0,0,0|0,0,0]=2 14077 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000210227_100010282707 [0,2,0,0,0,0|0,0,0]=2 14078 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210211 [0,2,0,0,0,0|0,0,0]=2 14079 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000210227_100010282707 [0,2,0,0,0,0|0,0,0]=2 14080 B16R0.221 CCCCOCCCCOC/C=C/C(=O)OC 34a_200000760531_100000742655 [0,2,0,0,0,0|0,0,2]=4 14081 B16R0.221 CCCCOCCCCOC/C=C/C(=O)OC 7a_200000760531_100000742655 [0,2,0,0,0,0|0,0,2]=4 14082 B16R0.221 CCCCOCCCCOCCCC(=O)NC 34a_200000760531_100000741757 [0,2,0,0,0,0|1,0,0]=3 14083 B16R0.221 CCCCOCCCCOCCCC(=O)NC 7a_200000760531_100000741757 [0,2,0,0,0,0|1,0,0]=3 14084 B16R0.221 CCCCOCCCCOCCCC(=O)OC 34a_200000760531_100000742333 [0,2,0,0,0,0|0,0,0]=2 14085 B16R0.221 CCCCOCCCCOCCCC(=O)OC 7a_200000760531_100011218270 [0,2,0,0,0,0|0,0,0]=2 14086 B16R0.221 CCCCOCCCCOCCOC(=O)NC 34a_200000760531_200011997002 [0,2,0,0,0,0|2,0,0]=4 14087 B16R0.221 CCCCOCCCCOCCOC(=O)NC 7a_200000760531_200011997002 [0,2,0,0,0,0|2,0,0]=4 14088 B16R0.221 CCCCOCCCNCCCCC(=O)OC 2230a_200000211371_100000204269 [0,2,0,0,0,0|0,0,0]=2 14089 B16R0.221 CCCCOCCCNCCCCC(=O)OC 34a_200000211371_100000204269 [0,2,0,0,0,0|0,0,0]=2 14090 B16R0.221 CCCCOCCCNCCOCC(=O)OC 2230a_200000211371_100000090808 [0,2,0,0,0,0|1,0,0]=3 14091 B16R0.221 CCCCOCCCNCCOCC(=O)OC 34a_200000211371_100000090808 [0,2,0,0,0,0|1,0,0]=3 14092 B16R0.221 CCCCOCCCOCCCCC(=O)OC 34a_200011215613_100000204269 [0,2,0,0,0,0|0,0,0]=2 14093 B16R0.221 CCCCOCCCOCCCCC(=O)OC 7a_200011215613_100000204269 [0,2,0,0,0,0|0,0,0]=2 14094 B16R0.221 CCCCOCCCOCCOCC(=O)OC 34a_200011215613_100000090808 [0,2,0,0,0,0|1,0,0]=3 14095 B16R0.221 CCCCOCCCOCCOCC(=O)OC 7a_200011215613_100000090808 [0,2,0,0,0,0|1,0,0]=3 14096 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [0,2,0,0,0,0|0,0,0]=2 14097 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [0,2,0,0,0,0|0,0,0]=2 14098 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [0,2,0,0,0,0|0,0,0]=2 14099 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [0,2,0,0,0,0|0,0,0]=2 14100 B16R0.221 CCCCOCCOCCOCCC(=O)NC 34a_100011215186_100012179268 [0,2,0,0,0,0|2,0,0]=4 14101 B16R0.221 CCCCOCCOCCOCCC(=O)NC 7a_100011215186_100000737683 [0,2,0,0,0,0|2,0,0]=4 14102 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210210 [0,2,0,0,0,0|1,0,0]=3 14103 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100011215186_100000742370 [0,2,0,0,0,0|1,0,0]=3 14104 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210211 [0,2,0,0,0,0|1,0,0]=3 14105 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100011215186_100000204255 [0,2,0,0,0,0|1,0,0]=3 14106 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100000743108_100009816466 [0,2,0,0,0,0|0,0,0]=2 14107 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100009816466_100000743108 [0,2,0,0,0,0|0,0,0]=2 14108 B16R0.221 CCCCOCOCCCCCCC(=O)OC 34a_100009863599_100011995733 [0,2,0,0,0,0|0,0,0]=2 14109 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100009815986_100011995733 [0,2,0,0,0,0|0,0,0]=2 14110 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100011995733_100009815986 [0,2,0,0,0,0|0,0,0]=2 14111 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100000210211_100010282707 [0,2,0,0,0,0|0,0,0]=2 14112 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210210 [0,2,0,0,0,0|0,0,0]=2 14113 B16R0.221 CCCCSCCNCCCCCC(=O)OC 2230a_100025743550_100009816466 [0,2,0,0,0,0|0,0,0]=2 14114 B16R0.221 CCCCSCCOCCCCCC(=O)OC 34a_200000230436_100009816466 [0,2,0,0,0,0|0,0,0]=2 14115 B16R0.221 CCCCSCCOCCCCCC(=O)OC 7a_200000230436_100009816466 [0,2,0,0,0,0|0,0,0]=2 14116 B16R0.221 CCCOCCCCCCCCCC(=O)OC 34a_100000210258_100009813843 [0,2,0,0,0,0|0,0,0]=2 14117 B16R0.221 CCCOCCCNCCCCCC(=O)OC 2230a_100011217757_100009816466 [0,2,0,0,0,0|0,0,0]=2 14118 B16R0.221 CCCOCCCNCCCCCC(=O)OC 34a_100011217757_100009816466 [0,2,0,0,0,0|0,0,0]=2 14119 B16R0.221 CCCOCCNCCCCCCC(=O)OC 2230a_100161115042_100009815986 [0,2,0,0,0,0|0,0,0]=2 14120 B16R0.221 CCCOCCNCCCCCCC(=O)OC 34a_100161115042_100009815986 [0,2,0,0,0,0|0,0,0]=2 14121 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100000752267_100009815986 [0,2,0,0,0,0|0,0,0]=2 14122 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011215938 [0,2,0,0,0,0|0,0,0]=2 14123 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100000752267_100009815986 [0,2,0,0,0,0|0,0,0]=2 14124 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215938 [0,2,0,0,0,0|0,0,0]=2 14125 B16R0.221 CCCOCCOCCNCCCC(=O)NC 2230a_200011904461_100000741757 [0,2,0,0,0,0|2,0,0]=4 14126 B16R0.221 CCCOCCOCCNCCCC(=O)NC 34a_200011904461_100000741757 [0,2,0,0,0,0|2,0,0]=4 14127 B16R0.221 CCCOCCOCCNCCCC(=O)OC 2230a_200011904461_100011218270 [0,2,0,0,0,0|1,0,0]=3 14128 B16R0.221 CCCOCCOCCNCCCC(=O)OC 34a_200011904461_100000742333 [0,2,0,0,0,0|1,0,0]=3 14129 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215938 [0,2,0,0,0,0|0,0,0]=2 14130 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100011215938_100009815986 [0,2,0,0,0,0|0,0,0]=2 14131 B16R0.221 CCCSCCCCCCCCCC(=O)OC 62a_100000210303_100009813843 [0,2,0,0,0,0|0,0,0]=2 14132 B16R0.221 CCCSCCNCCCCCCC(=O)OC 2230a_100020603323_100009815986 [0,2,0,0,0,0|0,0,0]=2 14133 B16R0.221 CCCSCCOCCCCCCC(=O)OC 34a_200000230433_100009815986 [0,2,0,0,0,0|0,0,0]=2 14134 B16R0.221 CCCSCCOCCCCCCC(=O)OC 7a_200000230433_100009815986 [0,2,0,0,0,0|0,0,0]=2 14135 B16R0.221 CCNCCCCCCCCCCC(=O)OC 2230a_100015525214_100009812566 [0,2,0,0,0,0|0,0,0]=2 14136 B16R0.221 CCNN=CCCCCCCCCC(=O)OC 4a_100000756455_200010166605 [0,2,0,0,0,0|0,0,1]=3 14137 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210202 [0,2,0,0,0,0|0,0,0]=2 14138 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100121572206_100009812566 [0,2,0,0,0,0|0,0,0]=2 14139 B16R0.221 CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210202 [0,2,0,0,0,0|0,0,0]=2 14140 B16R0.221 CCOCCCNCCCCCCC(=O)OC 2230a_100000210961_100009815986 [0,2,0,0,0,0|0,0,0]=2 14141 B16R0.221 CCOCCCNCCCCCCC(=O)OC 34a_100000210961_100009815986 [0,2,0,0,0,0|0,0,0]=2 14142 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100000757476_100009815986 [0,2,0,0,0,0|0,0,0]=2 14143 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100009863599_100012232248 [0,2,0,0,0,0|0,0,0]=2 14144 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100000757476_100009815986 [0,2,0,0,0,0|0,0,0]=2 14145 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100009863599_100012232248 [0,2,0,0,0,0|0,0,0]=2 14146 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100009815986_100012232248 [0,2,0,0,0,0|0,0,0]=2 14147 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100012232248_100009815986 [0,2,0,0,0,0|0,0,0]=2 14148 B16R0.221 CCOCCNCCCCCCCC(=O)OC 2230a_102516460346_100010004213 [0,2,0,0,0,0|0,0,0]=2 14149 B16R0.221 CCOCCNCCCCCCCC(=O)OC 34a_102516460346_100010004213 [0,2,0,0,0,0|0,0,0]=2 14150 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100000210136_100010004213 [0,2,0,0,0,0|0,0,0]=2 14151 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000210147 [0,2,0,0,0,0|0,0,0]=2 14152 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100000210136_100010004213 [0,2,0,0,0,0|0,0,0]=2 14153 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215890 [0,2,0,0,0,0|0,0,0]=2 14154 B16R0.221 CCOCCOCCNCCCCC(=O)OC 2230a_100102712874_100000204269 [0,2,0,0,0,0|1,0,0]=3 14155 B16R0.221 CCOCCOCCNCCCCC(=O)OC 34a_100102712874_100000204269 [0,2,0,0,0,0|1,0,0]=3 14156 B16R0.221 CCOCCOCCNCCOCC(=O)OC 2230a_100102712874_100000090808 [0,2,0,0,0,0|2,0,0]=4 14157 B16R0.221 CCOCCOCCNCCOCC(=O)OC 34a_100102712874_100000090808 [0,2,0,0,0,0|2,0,0]=4 14158 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000059025_100011211534 [0,2,0,0,0,0|1,0,0]=3 14159 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000210240_100000204269 [0,2,0,0,0,0|1,0,0]=3 14160 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000059025_100011211534 [0,2,0,0,0,0|1,0,0]=3 14161 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000210240_100000204269 [0,2,0,0,0,0|1,0,0]=3 14162 B16R0.221 CCOCCOCCOCCNCC(=O)OC 2230a_100012282185_100000747449 [0,2,0,0,0,0|2,0,0]=4 14163 B16R0.221 CCOCCOCCOCCNCC(=O)OC 34a_100012282185_100000747449 [0,2,0,0,0,0|2,0,0]=4 14164 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100000033264_100000747449 [0,2,0,0,0,0|2,0,0]=4 14165 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100000210240_100000090808 [0,2,0,0,0,0|2,0,0]=4 14166 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100011023656_100000210147 [0,2,0,0,0,0|2,0,0]=4 14167 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100000033264_100000747449 [0,2,0,0,0,0|2,0,0]=4 14168 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100000210240_100000090808 [0,2,0,0,0,0|2,0,0]=4 14169 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100011023656_100011215890 [0,2,0,0,0,0|2,0,0]=4 14170 B16R0.221 CCOCCOCCSCCCCC(=O)OC 62a_100000204269_100011211534 [0,2,0,0,0,0|1,0,0]=3 14171 B16R0.221 CCOCCOCCSCCCCC(=O)OC 62a_100011211534_100000204269 [0,2,0,0,0,0|1,0,0]=3 14172 B16R0.221 CCOCCOCCSCCOCC(=O)OC 62a_100000090808_100011211534 [0,2,0,0,0,0|2,0,0]=4 14173 B16R0.221 CCOCCOCCSCCOCC(=O)OC 62a_100011211534_100000090808 [0,2,0,0,0,0|2,0,0]=4 14174 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100000210147_100010004213 [0,2,0,0,0,0|0,0,0]=2 14175 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215890 [0,2,0,0,0,0|0,0,0]=2 14176 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100000739092_100010282707 [0,2,0,0,0,0|0,0,0]=2 14177 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000739092 [0,2,0,0,0,0|0,0,0]=2 14178 B16R0.221 CCSCCCCCCCCCCC(=O)OC 62a_100000210202_100009812566 [0,2,0,0,0,0|0,0,0]=2 14179 B16R0.221 CCSCCCOCCCCCCC(=O)OC 34a_100011216438_100009815986 [0,2,0,0,0,0|0,0,0]=2 14180 B16R0.221 CCSCCCOCCCCCCC(=O)OC 7a_100011216438_100009815986 [0,2,0,0,0,0|0,0,0]=2 14181 B16R0.221 CCSCCNCCCCCCCC(=O)OC 2230a_100000106463_100010004213 [0,2,0,0,0,0|0,0,0]=2 14182 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100000212035_100010004213 [0,2,0,0,0,0|0,0,0]=2 14183 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100011022521_100000757381 [0,2,0,0,0,0|0,0,0]=2 14184 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100000212035_100010004213 [0,2,0,0,0,0|0,0,0]=2 14185 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100011022521_100000757381 [0,2,0,0,0,0|0,0,0]=2 14186 B16R0.221 CCSCCOCCOCCOCC(=O)OC 34a_100011023656_100000757381 [0,2,0,0,0,0|2,0,0]=4 14187 B16R0.221 CCSCCOCCOCCOCC(=O)OC 7a_100011023656_100000757381 [0,2,0,0,0,0|2,0,0]=4 14188 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100000757381_100010004213 [0,2,0,0,0,0|0,0,0]=2 14189 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100010004213_100000757381 [0,2,0,0,0,0|0,0,0]=2 14190 B16R0.221 CNC(=O)CCCCCCCCCCCCO 240690a_100102657272_100102582631 [0,2,0,0,0,0|1,0,0]=3 14191 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_100000740002_100000033203 [0,2,0,0,0,0|1,0,0]=3 14192 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_102515433106_100000741757 [0,2,0,0,0,0|1,0,0]=3 14193 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_100000740002_100000033203 [0,2,0,0,0,0|1,0,0]=3 14194 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_102515433106_100000741757 [0,2,0,0,0,0|1,0,0]=3 14195 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000741757 [0,2,0,0,0,0|1,0,0]=3 14196 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 7a_100009813846_100000741757 [0,2,0,0,0,0|1,0,0]=3 14197 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000741757 [0,2,0,0,0,0|1,0,0]=3 14198 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 7a_100000033203_100000741757 [0,2,0,0,0,0|1,0,0]=3 14199 B16R0.221 CNC(=O)CCCOCCCCCCCCN 34a_102515433106_100000741757 [0,2,0,0,0,0|1,0,0]=3 14200 B16R0.221 CNC(=O)CCCOCCCCCNCCN 34a_103619048469_100000741757 [0,2,0,0,0,0|2,0,0]=4 14201 B16R0.221 CNC(=O)CCCOCCCOCCCOC 34a_200011215475_100000741757 [0,2,0,0,0,0|2,0,0]=4 14202 B16R0.221 CNC(=O)CCCOCCCOCCCOC 7a_200011215475_100000741757 [0,2,0,0,0,0|2,0,0]=4 14203 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000033203_100000741757 [0,2,0,0,0,0|1,0,0]=3 14204 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000741757_100000033203 [0,2,0,0,0,0|1,0,0]=3 14205 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737683 [0,2,0,0,0,0|1,0,0]=3 14206 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000738227_100009813782 [0,2,0,0,0,0|1,0,0]=3 14207 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000078944_100012179268 [0,2,0,0,0,0|1,0,0]=3 14208 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000738227_100009813782 [0,2,0,0,0,0|1,0,0]=3 14209 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 34a_100009813782_100012179268 [0,2,0,0,0,0|1,0,0]=3 14210 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737683 [0,2,0,0,0,0|1,0,0]=3 14211 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 34a_100009868337_100012179268 [0,2,0,0,0,0|1,0,0]=3 14212 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737683 [0,2,0,0,0,0|1,0,0]=3 14213 B16R0.221 CNC(=O)CCOCCCCCCCCCN 34a_100000078944_100012179268 [0,2,0,0,0,0|1,0,0]=3 14214 B16R0.221 CNC(=O)CCOCCCCCCCCCO 34a_100000754576_100009813782 [0,2,0,0,0,0|1,0,0]=3 14215 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100000737683_100009813782 [0,2,0,0,0,0|1,0,0]=3 14216 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737683 [0,2,0,0,0,0|1,0,0]=3 14217 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183359 [0,2,0,0,0,0|1,0,0]=3 14218 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000693194_100009813290 [0,2,0,0,0,0|1,0,0]=3 14219 B16R0.221 CNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183359 [0,2,0,0,0,0|1,0,0]=3 14220 B16R0.221 CNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183359 [0,2,0,0,0,0|1,0,0]=3 14221 B16R0.221 CNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183359 [0,2,0,0,0,0|1,0,0]=3 14222 B16R0.221 CNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183359 [0,2,0,0,0,0|1,0,0]=3 14223 B16R0.221 CNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183359 [0,2,0,0,0,0|1,0,0]=3 14224 B16R0.221 CNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183359 [0,2,0,0,0,0|1,0,0]=3 14225 B16R0.221 CNC(=O)COCCCCCCCCCCO 34a_100000750040_100009813290 [0,2,0,0,0,0|1,0,0]=3 14226 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100000183359_200000033068 [0,2,0,0,0,0|1,0,0]=3 14227 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183359 [0,2,0,0,0,0|1,0,0]=3 14228 B16R0.221 CNC(=O)NCCNCCCCCCCCO 34a_100015205895_100000033203 [0,2,0,0,0,0|2,0,0]=4 14229 B16R0.221 CNC(=O)OCCNCCCCCCCCO 34a_102515433106_200011997002 [0,2,0,0,0,0|2,0,0]=4 14230 B16R0.221 CNC(=O)OCCOCCCCCCCCBr 34a_100009813846_200011997002 [0,2,0,0,0,0|2,0,0]=4 14231 B16R0.221 CNC(=O)OCCOCCCCCCCCBr 7a_100009813846_200011997002 [0,2,0,0,0,0|2,0,0]=4 14232 B16R0.221 CNC(=O)OCCOCCCCCCCCCl 34a_100000033203_200011997002 [0,2,0,0,0,0|2,0,0]=4 14233 B16R0.221 CNC(=O)OCCOCCCCCCCCCl 7a_100000033203_200011997002 [0,2,0,0,0,0|2,0,0]=4 14234 B16R0.221 CNC(=O)OCCOCCCCCCCCN 34a_102515433106_200011997002 [0,2,0,0,0,0|2,0,0]=4 14235 B16R0.221 CNC(=O)OCCSCCCCCCCCO 62a_100000033203_200011997002 [0,2,0,0,0,0|2,0,0]=4 14236 B16R0.221 CNC(=O)OCCSCCCCCCCCO 62a_200011997002_100000033203 [0,2,0,0,0,0|2,0,0]=4 14237 B16R0.221 CNCCCCCCCCCCCC(=O)OC 2230a_106832991635_100010983606 [0,2,0,0,0,0|0,0,0]=2 14238 B16R0.221 CNCCCCCCCCCCCC(=O)OC 34a_100102657272_100010983606 [0,2,0,0,0,0|0,0,0]=2 14239 B16R0.221 CNCCCCCCCCCCCC(=O)OC 7a_106832991635_100010983606 [0,2,0,0,0,0|0,0,0]=2 14240 B16R0.221 CNCCCCCOCCCCCC(=O)OC 34a_100000722520_100009816466 [0,2,0,0,0,0|0,0,0]=2 14241 B16R0.221 CNCCCOCCCCCCCC(=O)OC 34a_100000213112_100010004213 [0,2,0,0,0,0|0,0,0]=2 14242 B16R0.221 CNCCOCCOCCCCCC(=O)OC 34a_100000228057_100009816466 [0,2,0,0,0,0|1,0,0]=3 14243 B16R0.221 CNCCOCCOCCOCCC(=O)OC 34a_200014138305_100000742370 [0,2,0,0,0,0|2,0,0]=4 14244 B16R0.221 COC(=O)/C=C/CNCCCCCCCCO 2230a_102515433106_100000742655 [0,2,0,0,0,0|0,0,2]=4 14245 B16R0.221 COC(=O)/C=C/CNCCCCCCCCO 34a_102515433106_100000742655 [0,2,0,0,0,0|0,0,2]=4 14246 B16R0.221 COC(=O)/C=C/COCCCCCCCCBr 34a_100009813846_100000742655 [0,2,0,0,0,0|0,0,2]=4 14247 B16R0.221 COC(=O)/C=C/COCCCCCCCCBr 7a_100009813846_100000742655 [0,2,0,0,0,0|0,0,2]=4 14248 B16R0.221 COC(=O)/C=C/COCCCCCCCCCl 34a_100000033203_100000742655 [0,2,0,0,0,0|0,0,2]=4 14249 B16R0.221 COC(=O)/C=C/COCCCCCCCCCl 7a_100000033203_100000742655 [0,2,0,0,0,0|0,0,2]=4 14250 B16R0.221 COC(=O)/C=C/COCCCCCCCCN 34a_102515433106_100000742655 [0,2,0,0,0,0|0,0,2]=4 14251 B16R0.221 COC(=O)/C=C/CSCCCCCCCCO 62a_100000033203_100000742655 [0,2,0,0,0,0|0,0,2]=4 14252 B16R0.221 COC(=O)/C=C/CSCCCCCCCCO 62a_100000742655_100000033203 [0,2,0,0,0,0|0,0,2]=4 14253 B16R0.221 COC(=O)CCCCCCCCCCCSC 62a_200000210301_100010983606 [0,2,0,0,0,0|0,0,0]=2 14254 B16R0.221 COC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100010983606 [0,2,0,0,0,0|0,0,0]=2 14255 B16R0.221 COC(=O)CCCCCCCCCCOCF 34a_100011003013_100015361967 [0,2,0,0,0,0|0,0,0]=2 14256 B16R0.221 COC(=O)CCCCCCCCCCOCF 7a_100011003013_100015361967 [0,2,0,0,0,0|0,0,0]=2 14257 B16R0.221 COC(=O)CCCCCCCCCCSCF 62a_100015361967_100009812566 [0,2,0,0,0,0|0,0,0]=2 14258 B16R0.221 COC(=O)CCCCCCCCCNCCF 34a_100000724931_100009813843 [0,2,0,0,0,0|0,0,0]=2 14259 B16R0.221 COC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009813843 [0,2,0,0,0,0|0,0,0]=2 14260 B16R0.221 COC(=O)CCCCCCCCCNCCO 34a_100016990907_100009813843 [0,2,0,0,0,0|0,0,0]=2 14261 B16R0.221 COC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009813843 [0,2,0,0,0,0|0,0,0]=2 14262 B16R0.221 COC(=O)CCCCCCCCCOCCN 34a_100000210304_100009813843 [0,2,0,0,0,0|0,0,0]=2 14263 B16R0.221 COC(=O)CCCCCCCCCSCC#N 62a_100011215382_100009813843 [0,2,0,0,0,0|0,0,1]=3 14264 B16R0.221 COC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009813843 [0,2,0,0,0,0|0,0,1]=3 14265 B16R0.221 COC(=O)CCCCCCCCCSCCF 62a_100011217306_100009813843 [0,2,0,0,0,0|0,0,0]=2 14266 B16R0.221 COC(=O)CCCCCCCCCSCCO 62a_100000211926_100009813843 [0,2,0,0,0,0|0,0,0]=2 14267 B16R0.221 COC(=O)CCCCCCCCCSCSC 62a_100011218213_100009813843 [0,2,0,0,0,0|0,0,0]=2 14268 B16R0.221 COC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010282707 [0,2,0,0,0,0|0,0,0]=2 14269 B16R0.221 COC(=O)CCCCCCCCNCCCF 34a_100015189416_100010282707 [0,2,0,0,0,0|0,0,0]=2 14270 B16R0.221 COC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010282707 [0,2,0,0,0,0|0,0,0]=2 14271 B16R0.221 COC(=O)CCCCCCCCOCCC#N 7a_100000035544_100000184422 [0,2,0,0,0,0|0,0,1]=3 14272 B16R0.221 COC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010282707 [0,2,0,0,0,0|0,0,0]=2 14273 B16R0.221 COC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010282707 [0,2,0,0,0,0|0,0,0]=2 14274 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000035544_100011934791 [0,2,0,0,0,0|0,0,0]=2 14275 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000759539_100010282707 [0,2,0,0,0,0|0,0,0]=2 14276 B16R0.221 COC(=O)CCCCCCCCOCCCF 7a_100000035544_100011934791 [0,2,0,0,0,0|0,0,0]=2 14277 B16R0.221 COC(=O)CCCCCCCCOCCCN 34a_100000182051_100010282707 [0,2,0,0,0,0|0,0,0]=2 14278 B16R0.221 COC(=O)CCCCCCCCOCCCO 34a_100000035544_100000230001 [0,2,0,0,0,0|0,0,0]=2 14279 B16R0.221 COC(=O)CCCCCCCCOCCCO 7a_100000035544_100011215043 [0,2,0,0,0,0|0,0,0]=2 14280 B16R0.221 COC(=O)CCCCCCCCOCCON 34a_100000700252_100010282707 [0,2,0,0,0,0|1,0,0]=3 14281 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000035544_100000212216 [0,2,0,0,0,0|0,0,0]=2 14282 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000230434_100010282707 [0,2,0,0,0,0|0,0,0]=2 14283 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000035544_100000212216 [0,2,0,0,0,0|0,0,0]=2 14284 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000230434_100010282707 [0,2,0,0,0,0|0,0,0]=2 14285 B16R0.221 COC(=O)CCCCCCCCSCCC#N 62a_100010282707_100011215226 [0,2,0,0,0,0|0,0,1]=3 14286 B16R0.221 COC(=O)CCCCCCCCSCCC#N 62a_100011215226_100010282707 [0,2,0,0,0,0|0,0,1]=3 14287 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100010282707_100011934791 [0,2,0,0,0,0|0,0,0]=2 14288 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100011934791_100010282707 [0,2,0,0,0,0|0,0,0]=2 14289 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100010282707_100011215043 [0,2,0,0,0,0|0,0,0]=2 14290 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100011215043_100010282707 [0,2,0,0,0,0|0,0,0]=2 14291 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100000212216_100010282707 [0,2,0,0,0,0|0,0,0]=2 14292 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100010282707_100000751147 [0,2,0,0,0,0|0,0,0]=2 14293 B16R0.221 COC(=O)CCCCCCCCSCSC#N 62a_100000211825_100010282707 [0,2,0,0,0,0|1,0,1]=4 14294 B16R0.221 COC(=O)CCCCCCCCSCSC#N 62a_100010282707_100000211825 [0,2,0,0,0,0|1,0,1]=4 14295 B16R0.221 COC(=O)CCCCCCCNCCCCO 2230a_100000750430_100010004213 [0,2,0,0,0,0|0,0,0]=2 14296 B16R0.221 COC(=O)CCCCCCCNCCCCO 34a_100000750430_100010004213 [0,2,0,0,0,0|0,0,0]=2 14297 B16R0.221 COC(=O)CCCCCCCNCCCSC 2230a_100000749238_100010004213 [0,2,0,0,0,0|0,0,0]=2 14298 B16R0.221 COC(=O)CCCCCCCOCC#CCCl 34a_200000047223_100010004213 [0,2,0,0,0,0|0,0,2]=4 14299 B16R0.221 COC(=O)CCCCCCCOCC#CCO 34a_100011022521_200000047223 [0,2,0,0,0,0|0,0,2]=4 14300 B16R0.221 COC(=O)CCCCCCCOCC#CCO 7a_100011022521_200000047223 [0,2,0,0,0,0|0,0,2]=4 14301 B16R0.221 COC(=O)CCCCCCCOCCCC#N 7a_100011022521_100000687738 [0,2,0,0,0,0|0,0,1]=3 14302 B16R0.221 COC(=O)CCCCCCCOCCCC=O 7a_100011022521_200011292268 [0,2,0,0,0,0|0,0,1]=3 14303 B16R0.221 COC(=O)CCCCCCCOCCCCBr 34a_100011216708_100010004213 [0,2,0,0,0,0|0,0,0]=2 14304 B16R0.221 COC(=O)CCCCCCCOCCCCCl 34a_100000210776_100010004213 [0,2,0,0,0,0|0,0,0]=2 14305 B16R0.221 COC(=O)CCCCCCCOCCCCCl 7a_100000210776_100010004213 [0,2,0,0,0,0|0,0,0]=2 14306 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011022521_100000729493 [0,2,0,0,0,0|0,0,0]=2 14307 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011995726_100010004213 [0,2,0,0,0,0|0,0,0]=2 14308 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011022521_100000729493 [0,2,0,0,0,0|0,0,0]=2 14309 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011995726_100010004213 [0,2,0,0,0,0|0,0,0]=2 14310 B16R0.221 COC(=O)CCCCCCCOCCCCI 34a_200012148704_100010004213 [0,2,0,0,0,0|0,0,0]=2 14311 B16R0.221 COC(=O)CCCCCCCOCCCCN 34a_100000750430_100010004213 [0,2,0,0,0,0|0,0,0]=2 14312 B16R0.221 COC(=O)CCCCCCCOCCCCO 34a_100011022521_100011216708 [0,2,0,0,0,0|0,0,0]=2 14313 B16R0.221 COC(=O)CCCCCCCOCCCCO 7a_100011022521_100000210776 [0,2,0,0,0,0|0,0,0]=2 14314 B16R0.221 COC(=O)CCCCCCCOCCCSC 34a_100000690336_100010004213 [0,2,0,0,0,0|0,0,0]=2 14315 B16R0.221 COC(=O)CCCCCCCOCCCSC 7a_100000690336_100010004213 [0,2,0,0,0,0|0,0,0]=2 14316 B16R0.221 COC(=O)CCCCCCCSCC#CCO 62a_100010004213_200000047223 [0,2,0,0,0,0|0,0,2]=4 14317 B16R0.221 COC(=O)CCCCCCCSCC#CCO 62a_200000047223_100010004213 [0,2,0,0,0,0|0,0,2]=4 14318 B16R0.221 COC(=O)CCCCCCCSCCCC#N 62a_100000687738_100010004213 [0,2,0,0,0,0|0,0,1]=3 14319 B16R0.221 COC(=O)CCCCCCCSCCCC#N 62a_100010004213_100000687738 [0,2,0,0,0,0|0,0,1]=3 14320 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_100010004213_200011292268 [0,2,0,0,0,0|0,0,1]=3 14321 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_200011292268_100010004213 [0,2,0,0,0,0|0,0,1]=3 14322 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100000729493_100010004213 [0,2,0,0,0,0|0,0,0]=2 14323 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100010004213_100000729493 [0,2,0,0,0,0|0,0,0]=2 14324 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100000210776_100010004213 [0,2,0,0,0,0|0,0,0]=2 14325 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100010004213_100000210776 [0,2,0,0,0,0|0,0,0]=2 14326 B16R0.221 COC(=O)CCCCCCCSCCSC#N 62a_100000034367_100010004213 [0,2,0,0,0,0|1,0,1]=4 14327 B16R0.221 COC(=O)CCCCCCCSCCSC#N 62a_100010004213_100000034367 [0,2,0,0,0,0|1,0,1]=4 14328 B16R0.221 COC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009815986 [0,2,0,0,0,0|0,0,0]=2 14329 B16R0.221 COC(=O)CCCCCCNCCCCCO 34a_100000762737_100009815986 [0,2,0,0,0,0|0,0,0]=2 14330 B16R0.221 COC(=O)CCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100009815986 [0,2,0,0,0,0|2,0,0]=4 14331 B16R0.221 COC(=O)CCCCCCNCCOCCO 2230a_100000211614_100009815986 [0,2,0,0,0,0|1,0,0]=3 14332 B16R0.221 COC(=O)CCCCCCNCCOCCO 34a_100000211614_100009815986 [0,2,0,0,0,0|1,0,0]=3 14333 B16R0.221 COC(=O)CCCCCCNCCSCCO 2230a_100011219999_100009815986 [0,2,0,0,0,0|1,0,0]=3 14334 B16R0.221 COC(=O)CCCCCCOCCCCC#N 7a_100009863599_100000211819 [0,2,0,0,0,0|0,0,1]=3 14335 B16R0.221 COC(=O)CCCCCCOCCCCC=O 7a_100009863599_100000139335 [0,2,0,0,0,0|0,0,1]=3 14336 B16R0.221 COC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009815986 [0,2,0,0,0,0|0,0,0]=2 14337 B16R0.221 COC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009815986 [0,2,0,0,0,0|0,0,0]=2 14338 B16R0.221 COC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009815986 [0,2,0,0,0,0|0,0,0]=2 14339 B16R0.221 COC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009815986 [0,2,0,0,0,0|0,0,0]=2 14340 B16R0.221 COC(=O)CCCCCCOCCCCCF 34a_100009863599_100000729378 [0,2,0,0,0,0|0,0,0]=2 14341 B16R0.221 COC(=O)CCCCCCOCCCCCF 7a_100009863599_100000729378 [0,2,0,0,0,0|0,0,0]=2 14342 B16R0.221 COC(=O)CCCCCCOCCCCCI 34a_200012148887_100009815986 [0,2,0,0,0,0|0,0,0]=2 14343 B16R0.221 COC(=O)CCCCCCOCCCCCI 7a_200012148887_100009815986 [0,2,0,0,0,0|0,0,0]=2 14344 B16R0.221 COC(=O)CCCCCCOCCCCCN 34a_100000762737_100009815986 [0,2,0,0,0,0|0,0,0]=2 14345 B16R0.221 COC(=O)CCCCCCOCCCCCO 34a_100009863599_100000746330 [0,2,0,0,0,0|0,0,0]=2 14346 B16R0.221 COC(=O)CCCCCCOCCCCCO 7a_100009863599_100000746330 [0,2,0,0,0,0|0,0,0]=2 14347 B16R0.221 COC(=O)CCCCCCOCCCCSC 34a_100011217163_100009815986 [0,2,0,0,0,0|0,0,0]=2 14348 B16R0.221 COC(=O)CCCCCCOCCCCSC 7a_100011217163_100009815986 [0,2,0,0,0,0|0,0,0]=2 14349 B16R0.221 COC(=O)CCCCCCOCCOCC#N 7a_100009863599_200000047693 [0,2,0,0,0,0|1,0,1]=4 14350 B16R0.221 COC(=O)CCCCCCOCCOCCBr 34a_100000692535_100009815986 [0,2,0,0,0,0|1,0,0]=3 14351 B16R0.221 COC(=O)CCCCCCOCCOCCBr 7a_100000692535_100009815986 [0,2,0,0,0,0|1,0,0]=3 14352 B16R0.221 COC(=O)CCCCCCOCCOCCCl 34a_100011215305_100009815986 [0,2,0,0,0,0|1,0,0]=3 14353 B16R0.221 COC(=O)CCCCCCOCCOCCCl 7a_100011215305_100009815986 [0,2,0,0,0,0|1,0,0]=3 14354 B16R0.221 COC(=O)CCCCCCOCCOCCF 34a_200015357709_100009815986 [0,2,0,0,0,0|1,0,0]=3 14355 B16R0.221 COC(=O)CCCCCCOCCOCCF 7a_200015357709_100009815986 [0,2,0,0,0,0|1,0,0]=3 14356 B16R0.221 COC(=O)CCCCCCOCCOCCI 34a_100012149058_100009815986 [0,2,0,0,0,0|1,0,0]=3 14357 B16R0.221 COC(=O)CCCCCCOCCOCCI 7a_100012149058_100009815986 [0,2,0,0,0,0|1,0,0]=3 14358 B16R0.221 COC(=O)CCCCCCOCCOCCN 34a_100000211614_100009815986 [0,2,0,0,0,0|1,0,0]=3 14359 B16R0.221 COC(=O)CCCCCCOCCOCCO 34a_100009863599_100000692535 [0,2,0,0,0,0|1,0,0]=3 14360 B16R0.221 COC(=O)CCCCCCOCCOCCO 7a_100009863599_100011215305 [0,2,0,0,0,0|1,0,0]=3 14361 B16R0.221 COC(=O)CCCCCCSCCCCC#N 62a_100009815986_100000211819 [0,2,0,0,0,0|0,0,1]=3 14362 B16R0.221 COC(=O)CCCCCCSCCCCC#N 62a_100011219923_100009815986 [0,2,0,0,0,0|0,0,1]=3 14363 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009815986 [0,2,0,0,0,0|0,0,1]=3 14364 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100009815986_100000139335 [0,2,0,0,0,0|0,0,1]=3 14365 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100000729378_100009815986 [0,2,0,0,0,0|0,0,0]=2 14366 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100009815986_100000729378 [0,2,0,0,0,0|0,0,0]=2 14367 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100000746330_100009815986 [0,2,0,0,0,0|0,0,0]=2 14368 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100009815986_100000746330 [0,2,0,0,0,0|0,0,0]=2 14369 B16R0.221 COC(=O)CCCCCCSCCOCC#N 62a_100009815986_200000047693 [0,2,0,0,0,0|1,0,1]=4 14370 B16R0.221 COC(=O)CCCCCCSCCOCC#N 62a_200000047693_100009815986 [0,2,0,0,0,0|1,0,1]=4 14371 B16R0.221 COC(=O)CCCCCCSCCOCCO 62a_100009815986_100011215305 [0,2,0,0,0,0|1,0,0]=3 14372 B16R0.221 COC(=O)CCCCCCSCCOCCO 62a_100011215305_100009815986 [0,2,0,0,0,0|1,0,0]=3 14373 B16R0.221 COC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009816466 [0,2,0,0,0,0|0,0,0]=2 14374 B16R0.221 COC(=O)CCCCCNCCCCCCO 34a_100000686447_100009816466 [0,2,0,0,0,0|0,0,0]=2 14375 B16R0.221 COC(=O)CCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100009816466 [0,2,0,0,0,0|2,0,0]=4 14376 B16R0.221 COC(=O)CCCCCOCCCCCC#N 7a_100000074720_100009813376 [0,2,0,0,0,0|0,0,1]=3 14377 B16R0.221 COC(=O)CCCCCOCCCCCC=O 7a_100000074720_100000139337 [0,2,0,0,0,0|0,0,1]=3 14378 B16R0.221 COC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009816466 [0,2,0,0,0,0|0,0,0]=2 14379 B16R0.221 COC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009816466 [0,2,0,0,0,0|0,0,0]=2 14380 B16R0.221 COC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009816466 [0,2,0,0,0,0|0,0,0]=2 14381 B16R0.221 COC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009816466 [0,2,0,0,0,0|0,0,0]=2 14382 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000074720_100015922095 [0,2,0,0,0,0|0,0,0]=2 14383 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000732779_100009816466 [0,2,0,0,0,0|0,0,0]=2 14384 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000074720_100015922095 [0,2,0,0,0,0|0,0,0]=2 14385 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000732779_100009816466 [0,2,0,0,0,0|0,0,0]=2 14386 B16R0.221 COC(=O)CCCCCOCCCCCCN 34a_100000686447_100009816466 [0,2,0,0,0,0|0,0,0]=2 14387 B16R0.221 COC(=O)CCCCCOCCCCCCO 34a_100000074720_100000766143 [0,2,0,0,0,0|0,0,0]=2 14388 B16R0.221 COC(=O)CCCCCOCCCCCCO 7a_100000074720_100000766143 [0,2,0,0,0,0|0,0,0]=2 14389 B16R0.221 COC(=O)CCCCCSCCCCCC#N 62a_100009813376_100009816466 [0,2,0,0,0,0|0,0,1]=3 14390 B16R0.221 COC(=O)CCCCCSCCCCCC#N 62a_100009816466_100009813376 [0,2,0,0,0,0|0,0,1]=3 14391 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100000139337_100009816466 [0,2,0,0,0,0|0,0,1]=3 14392 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100009816466_100000139337 [0,2,0,0,0,0|0,0,1]=3 14393 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100009816466_100015922095 [0,2,0,0,0,0|0,0,0]=2 14394 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100015922095_100009816466 [0,2,0,0,0,0|0,0,0]=2 14395 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100000766143_100009816466 [0,2,0,0,0,0|0,0,0]=2 14396 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100009816466_100000766143 [0,2,0,0,0,0|0,0,0]=2 14397 B16R0.221 COC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000204269 [0,2,0,0,0,0|0,0,0]=2 14398 B16R0.221 COC(=O)CCCCNCCCCCCCO 34a_100011996573_100000204269 [0,2,0,0,0,0|0,0,0]=2 14399 B16R0.221 COC(=O)CCCCNCCCOCCCO 2230a_100011310245_100000204269 [0,2,0,0,0,0|1,0,0]=3 14400 B16R0.221 COC(=O)CCCCNCCCOCCCO 34a_100011310245_100000204269 [0,2,0,0,0,0|1,0,0]=3 14401 B16R0.221 COC(=O)CCCCOCCCCCCC#N 7a_100000059025_100009813337 [0,2,0,0,0,0|0,0,1]=3 14402 B16R0.221 COC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000204269 [0,2,0,0,0,0|0,0,0]=2 14403 B16R0.221 COC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000204269 [0,2,0,0,0,0|0,0,0]=2 14404 B16R0.221 COC(=O)CCCCOCCCCCCCN 34a_100011996573_100000204269 [0,2,0,0,0,0|0,0,0]=2 14405 B16R0.221 COC(=O)CCCCOCCCCCCCO 34a_100000059025_100000760002 [0,2,0,0,0,0|0,0,0]=2 14406 B16R0.221 COC(=O)CCCCOCCCCCCCO 7a_100000059025_100000760002 [0,2,0,0,0,0|0,0,0]=2 14407 B16R0.221 COC(=O)CCCCOCCCOCCCN 34a_100011310245_100000204269 [0,2,0,0,0,0|1,0,0]=3 14408 B16R0.221 COC(=O)CCCCSCCCCCCC#N 62a_100000204269_100009813337 [0,2,0,0,0,0|0,0,1]=3 14409 B16R0.221 COC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000204269 [0,2,0,0,0,0|0,0,1]=3 14410 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000204269_100000760002 [0,2,0,0,0,0|0,0,0]=2 14411 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000760002_100000204269 [0,2,0,0,0,0|0,0,0]=2 14412 B16R0.221 COC(=O)CCCNCCCCCCCCO 2230a_102515433106_100011218270 [0,2,0,0,0,0|0,0,0]=2 14413 B16R0.221 COC(=O)CCCNCCCCCCCCO 34a_102515433106_100000742333 [0,2,0,0,0,0|0,0,0]=2 14414 B16R0.221 COC(=O)CCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100011218270 [0,2,0,0,0,0|2,0,0]=4 14415 B16R0.221 COC(=O)CCCNCCOCCOCCO 2230a_100011998139_100011218270 [0,2,0,0,0,0|2,0,0]=4 14416 B16R0.221 COC(=O)CCCNCCOCCOCCO 34a_100011998139_100000742333 [0,2,0,0,0,0|2,0,0]=4 14417 B16R0.221 COC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000742333 [0,2,0,0,0,0|0,0,0]=2 14418 B16R0.221 COC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011218270 [0,2,0,0,0,0|0,0,0]=2 14419 B16R0.221 COC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000742333 [0,2,0,0,0,0|0,0,0]=2 14420 B16R0.221 COC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011218270 [0,2,0,0,0,0|0,0,0]=2 14421 B16R0.221 COC(=O)CCCOCCCCCCCCN 34a_102515433106_100000742333 [0,2,0,0,0,0|0,0,0]=2 14422 B16R0.221 COC(=O)CCCOCCCCCNCCN 34a_103619048469_100000742333 [0,2,0,0,0,0|1,0,0]=3 14423 B16R0.221 COC(=O)CCCOCCOCCOCCBr 34a_100010132937_100000742333 [0,2,0,0,0,0|2,0,0]=4 14424 B16R0.221 COC(=O)CCCOCCOCCOCCBr 7a_100010132937_100011218270 [0,2,0,0,0,0|2,0,0]=4 14425 B16R0.221 COC(=O)CCCOCCOCCOCCCl 34a_100000032323_100000742333 [0,2,0,0,0,0|2,0,0]=4 14426 B16R0.221 COC(=O)CCCOCCOCCOCCCl 7a_100000032323_100011218270 [0,2,0,0,0,0|2,0,0]=4 14427 B16R0.221 COC(=O)CCCOCCOCCOCCN 34a_100011998139_100000742333 [0,2,0,0,0,0|2,0,0]=4 14428 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100000033203_100011218270 [0,2,0,0,0,0|0,0,0]=2 14429 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100011218270_100000033203 [0,2,0,0,0,0|0,0,0]=2 14430 B16R0.221 COC(=O)CCCSCCOCCOCCO 62a_100000032323_100011218270 [0,2,0,0,0,0|2,0,0]=4 14431 B16R0.221 COC(=O)CCCSCCOCCOCCO 62a_100011218270_100000032323 [0,2,0,0,0,0|2,0,0]=4 14432 B16R0.221 COC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000204255 [0,2,0,0,0,0|0,0,0]=2 14433 B16R0.221 COC(=O)CCNCCCCCCCCCO 34a_100000078944_100000742370 [0,2,0,0,0,0|0,0,0]=2 14434 B16R0.221 COC(=O)CCNCCCOCCOCCO 2230a_100011996194_100000204255 [0,2,0,0,0,0|2,0,0]=4 14435 B16R0.221 COC(=O)CCNCCCOCCOCCO 34a_100011996194_100000742370 [0,2,0,0,0,0|2,0,0]=4 14436 B16R0.221 COC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000742370 [0,2,0,0,0,0|0,0,0]=2 14437 B16R0.221 COC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000204255 [0,2,0,0,0,0|0,0,0]=2 14438 B16R0.221 COC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000742370 [0,2,0,0,0,0|0,0,0]=2 14439 B16R0.221 COC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000204255 [0,2,0,0,0,0|0,0,0]=2 14440 B16R0.221 COC(=O)CCOCCCCCCCCCN 34a_100000078944_100000742370 [0,2,0,0,0,0|0,0,0]=2 14441 B16R0.221 COC(=O)CCOCCOCCOCCCF 34a_100010982084_100011934791 [0,2,0,0,0,0|2,0,0]=4 14442 B16R0.221 COC(=O)CCOCCOCCOCCCF 7a_100010982084_100011934791 [0,2,0,0,0,0|2,0,0]=4 14443 B16R0.221 COC(=O)CCOCCOCCOCCCN 34a_100011996194_100000742370 [0,2,0,0,0,0|2,0,0]=4 14444 B16R0.221 COC(=O)CCOCCOCCOCCCO 34a_100010982084_100000230001 [0,2,0,0,0,0|2,0,0]=4 14445 B16R0.221 COC(=O)CCOCCOCCOCCCO 7a_100010982084_100011215043 [0,2,0,0,0,0|2,0,0]=4 14446 B16R0.221 COC(=O)CCOCCOCCOCCSC 34a_100010982084_100000212216 [0,2,0,0,0,0|2,0,0]=4 14447 B16R0.221 COC(=O)CCOCCOCCOCCSC 7a_100010982084_100000212216 [0,2,0,0,0,0|2,0,0]=4 14448 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100000204255_100009813782 [0,2,0,0,0,0|0,0,0]=2 14449 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100009813782_100000204255 [0,2,0,0,0,0|0,0,0]=2 14450 B16R0.221 COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747449 [0,2,0,0,0,0|0,0,0]=2 14451 B16R0.221 COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000747449 [0,2,0,0,0,0|0,0,0]=2 14452 B16R0.221 COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000747449 [0,2,0,0,0,0|0,0,0]=2 14453 B16R0.221 COC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747449 [0,2,0,0,0,0|0,0,0]=2 14454 B16R0.221 COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000747449 [0,2,0,0,0,0|0,0,0]=2 14455 B16R0.221 COC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747449 [0,2,0,0,0,0|0,0,0]=2 14456 B16R0.221 COC(=O)COCCCCCCCCCCN 34a_100000066964_100000747449 [0,2,0,0,0,0|0,0,0]=2 14457 B16R0.221 COC(=O)COCCNCCCCCCCO 2230a_100011996573_100000090808 [0,2,0,0,0,0|1,0,0]=3 14458 B16R0.221 COC(=O)COCCNCCCCCCCO 34a_100011996573_100000090808 [0,2,0,0,0,0|1,0,0]=3 14459 B16R0.221 COC(=O)COCCNCCCOCCCO 2230a_100011310245_100000090808 [0,2,0,0,0,0|2,0,0]=4 14460 B16R0.221 COC(=O)COCCNCCCOCCCO 34a_100011310245_100000090808 [0,2,0,0,0,0|2,0,0]=4 14461 B16R0.221 COC(=O)COCCOCCCCCCCBr 34a_100000760002_100000090808 [0,2,0,0,0,0|1,0,0]=3 14462 B16R0.221 COC(=O)COCCOCCCCCCCBr 7a_100000760002_100000090808 [0,2,0,0,0,0|1,0,0]=3 14463 B16R0.221 COC(=O)COCCOCCCCCCCN 34a_100011996573_100000090808 [0,2,0,0,0,0|1,0,0]=3 14464 B16R0.221 COC(=O)COCCOCCCOCCCN 34a_100011310245_100000090808 [0,2,0,0,0,0|2,0,0]=4 14465 B16R0.221 COC(=O)COCCOCCOCCCCF 34a_100011023656_100000729493 [0,2,0,0,0,0|2,0,0]=4 14466 B16R0.221 COC(=O)COCCOCCOCCCCF 7a_100011023656_100000729493 [0,2,0,0,0,0|2,0,0]=4 14467 B16R0.221 COC(=O)COCCOCCOCCCCO 34a_100011023656_100011216708 [0,2,0,0,0,0|2,0,0]=4 14468 B16R0.221 COC(=O)COCCOCCOCCCCO 7a_100011023656_100000210776 [0,2,0,0,0,0|2,0,0]=4 14469 B16R0.221 COC(=O)COCCSCCCCCCC#N 62a_100000090808_100009813337 [0,2,0,0,0,0|1,0,1]=4 14470 B16R0.221 COC(=O)COCCSCCCCCCC#N 62a_100009813337_100000090808 [0,2,0,0,0,0|1,0,1]=4 14471 B16R0.221 COC(=O)COCCSCCCCCCCO 62a_100000090808_100000760002 [0,2,0,0,0,0|1,0,0]=3 14472 B16R0.221 COC(=O)COCCSCCCCCCCO 62a_100000760002_100000090808 [0,2,0,0,0,0|1,0,0]=3 14473 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100000747449_200000033068 [0,2,0,0,0,0|0,0,0]=2 14474 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747449 [0,2,0,0,0,0|0,0,0]=2 14475 B16R0.221 COC(=O)NCCOCCCCCCCCO 34a_100000757965_100000033203 [0,2,0,0,0,0|1,0,0]=3 14476 B16R0.221 COC(=O)OCCOCCCCCCCCO 34a_100010262106_100000033203 [0,2,0,0,0,0|1,0,0]=3 14477 B16R0.221 COC(=O)OCSCCCCCCCCCO 62a_100009813782_100000139417 [0,2,0,0,0,0|1,0,0]=3 14478 B16R0.221 COC(C)CCOCCCCCCCCCO 7a_100000764861_100009813782 [0,2,0,0,0,0|1,0,1]=4 14479 B16R0.221 COC(C)COCCCCCCCCCCO 34a_100000690652_100009813290 [0,2,0,0,0,0|1,0,1]=4 14480 B16R0.221 COC(C)SCCCCCCCCCCCO 62a_100009812471_100009879195 [0,2,0,0,0,0|1,0,1]=4 14481 B16R0.221 COCCCCCCCCCCCC(=O)OC 34a_100138415774_100010983606 [0,2,0,0,0,0|0,0,0]=2 14482 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_100000059025_100011998445 [0,2,0,0,0,0|0,0,0]=2 14483 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_200012092642_100000204269 [0,2,0,0,0,0|0,0,0]=2 14484 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_100000059025_100011998445 [0,2,0,0,0,0|0,0,0]=2 14485 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_200012092642_100000204269 [0,2,0,0,0,0|0,0,0]=2 14486 B16R0.221 COCCCCCCOCCOCC(=O)OC 34a_200012092642_100000090808 [0,2,0,0,0,0|1,0,0]=3 14487 B16R0.221 COCCCCCCOCCOCC(=O)OC 7a_200012092642_100000090808 [0,2,0,0,0,0|1,0,0]=3 14488 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100000204269_100011998445 [0,2,0,0,0,0|0,0,0]=2 14489 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100011998445_100000204269 [0,2,0,0,0,0|0,0,0]=2 14490 B16R0.221 COCCCCCCSCCOCC(=O)OC 62a_100000090808_100011998445 [0,2,0,0,0,0|1,0,0]=3 14491 B16R0.221 COCCCCCCSCCOCC(=O)OC 62a_100011998445_100000090808 [0,2,0,0,0,0|1,0,0]=3 14492 B16R0.221 COCCCCCNCCCCCC(=O)OC 2230a_100000747528_100009816466 [0,2,0,0,0,0|0,0,0]=2 14493 B16R0.221 COCCCCCNCCCCCC(=O)OC 34a_100000747528_100009816466 [0,2,0,0,0,0|0,0,0]=2 14494 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100000740925_100009815986 [0,2,0,0,0,0|0,0,0]=2 14495 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100009863599_100000755781 [0,2,0,0,0,0|0,0,0]=2 14496 B16R0.221 COCCCCOCCCCCCC(=O)OC 7a_100009863599_100000730899 [0,2,0,0,0,0|0,0,0]=2 14497 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100000730899_100009815986 [0,2,0,0,0,0|0,0,0]=2 14498 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100009815986_100000730899 [0,2,0,0,0,0|0,0,0]=2 14499 B16R0.221 COCCCNCCCCCCCC(=O)OC 34a_100150723488_100010004213 [0,2,0,0,0,0|0,0,0]=2 14500 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100000740835_100010004213 [0,2,0,0,0,0|0,0,0]=2 14501 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100011022521_100000740836 [0,2,0,0,0,0|0,0,0]=2 14502 B16R0.221 COCCCOCCCCCCCC(=O)OC 7a_100011022521_100000740836 [0,2,0,0,0,0|0,0,0]=2 14503 B16R0.221 COCCCOCCCOCCCC(=O)OC 34a_200011215475_100000742333 [0,2,0,0,0,0|1,0,0]=3 14504 B16R0.221 COCCCOCCCOCCCC(=O)OC 7a_200011215475_100011218270 [0,2,0,0,0,0|1,0,0]=3 14505 B16R0.221 COCCCOCCOCCOCC(=O)OC 34a_100011023656_100000740836 [0,2,0,0,0,0|2,0,0]=4 14506 B16R0.221 COCCCOCCOCCOCC(=O)OC 7a_100011023656_100000740836 [0,2,0,0,0,0|2,0,0]=4 14507 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100000709357_100010004213 [0,2,0,0,0,0|0,0,0]=2 14508 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100010004213_100000709357 [0,2,0,0,0,0|0,0,0]=2 14509 B16R0.221 COCCNCCCCCCCCC(=O)OC 2230a_100000209980_100010282707 [0,2,0,0,0,0|0,0,0]=2 14510 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [0,2,0,0,0,0|0,0,0]=2 14511 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [0,2,0,0,0,0|0,0,0]=2 14512 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [0,2,0,0,0,0|0,0,0]=2 14513 B16R0.221 COCCOCCCNCCCCC(=O)OC 2230a_100000206027_100000204269 [0,2,0,0,0,0|1,0,0]=3 14514 B16R0.221 COCCOCCCNCCCCC(=O)OC 34a_100000206027_100000204269 [0,2,0,0,0,0|1,0,0]=3 14515 B16R0.221 COCCOCCCNCCOCC(=O)OC 2230a_100000206027_100000090808 [0,2,0,0,0,0|2,0,0]=4 14516 B16R0.221 COCCOCCCNCCOCC(=O)OC 34a_100000206027_100000090808 [0,2,0,0,0,0|2,0,0]=4 14517 B16R0.221 COCCOCCCOCCCCC(=O)OC 34a_100000059025_100011216529 [0,2,0,0,0,0|1,0,0]=3 14518 B16R0.221 COCCOCCCOCCCCC(=O)OC 7a_100000059025_100011216529 [0,2,0,0,0,0|1,0,0]=3 14519 B16R0.221 COCCOCCCSCCCCC(=O)OC 62a_100000204269_100011216529 [0,2,0,0,0,0|1,0,0]=3 14520 B16R0.221 COCCOCCCSCCCCC(=O)OC 62a_100011216529_100000204269 [0,2,0,0,0,0|1,0,0]=3 14521 B16R0.221 COCCOCCCSCCOCC(=O)OC 62a_100000090808_100011216529 [0,2,0,0,0,0|2,0,0]=4 14522 B16R0.221 COCCOCCCSCCOCC(=O)OC 62a_100011216529_100000090808 [0,2,0,0,0,0|2,0,0]=4 14523 B16R0.221 COCCOCCNCCCCCC(=O)OC 2230a_100000745349_100009816466 [0,2,0,0,0,0|1,0,0]=3 14524 B16R0.221 COCCOCCNCCCCCC(=O)OC 34a_100000745349_100009816466 [0,2,0,0,0,0|1,0,0]=3 14525 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100000074720_100000695917 [0,2,0,0,0,0|1,0,0]=3 14526 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100011215163_100009816466 [0,2,0,0,0,0|1,0,0]=3 14527 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100000074720_100000695917 [0,2,0,0,0,0|1,0,0]=3 14528 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100011215163_100009816466 [0,2,0,0,0,0|1,0,0]=3 14529 B16R0.221 COCCOCCOCCNCCC(=O)OC 2230a_100012028300_100000204255 [0,2,0,0,0,0|2,0,0]=4 14530 B16R0.221 COCCOCCOCCNCCC(=O)OC 34a_100012028300_100000742370 [0,2,0,0,0,0|2,0,0]=4 14531 B16R0.221 COCCOCCOCCOCCC(=O)OC 34a_100000688194_100000742370 [0,2,0,0,0,0|2,0,0]=4 14532 B16R0.221 COCCOCCOCCOCCC(=O)OC 34a_100010982084_100011201679 [0,2,0,0,0,0|2,0,0]=4 14533 B16R0.221 COCCOCCOCCOCCC(=O)OC 7a_100000688194_100000204255 [0,2,0,0,0,0|2,0,0]=4 14534 B16R0.221 COCCOCCOCCOCCC(=O)OC 7a_100010982084_100000233755 [0,2,0,0,0,0|2,0,0]=4 14535 B16R0.221 COCCOCCOCCSCCC(=O)OC 62a_100000204255_100013367474 [0,2,0,0,0,0|2,0,0]=4 14536 B16R0.221 COCCOCCOCCSCCC(=O)OC 62a_100013367474_100000204255 [0,2,0,0,0,0|2,0,0]=4 14537 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100000695917_100009816466 [0,2,0,0,0,0|1,0,0]=3 14538 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100009816466_100000695917 [0,2,0,0,0,0|1,0,0]=3 14539 B16R0.221 COCCOCSCCCCCCC(=O)OC 62a_100000231047_100009815986 [0,2,0,0,0,0|1,0,0]=3 14540 B16R0.221 COCCOCSCCCCCCC(=O)OC 62a_100009815986_100000231047 [0,2,0,0,0,0|1,0,0]=3 14541 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100000233755_100010282707 [0,2,0,0,0,0|0,0,0]=2 14542 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000233755 [0,2,0,0,0,0|0,0,0]=2 14543 B16R0.221 COCSCCCCCCCCCC(=O)OC 62a_100000766300_100009813843 [0,2,0,0,0,0|0,0,0]=2 14544 B16R0.221 CO[C@H](C)CNCCCCCCCCCCO 2230a_100020591295_100009813290 [0,2,0,0,0,0|1,0,1]=4 14545 B16R0.221 NNC(=O)CCCOCCCCCCCCO 34a_100000211488_100000033203 [0,2,0,0,0,0|2,0,0]=4 14546 B16R0.221 O=C(CO)CCCCCCCCCCCCO 1458a_100000210174_100009813331 [0,2,0,0,0,0|2,0,0]=4 14547 B16R0.221 O=C(CO)CCCCCCOCCCCCO 1458a_100000210174_200132310570 [0,2,0,0,0,0|2,0,0]=4 14548 B16R0.222 CCCCCCCCCCNCC(OC)OC 2230a_100000684558_100000751394 [0,2,0,0,0,0|0,0,2]=4 14549 B16R0.222 CCCCCCCCCCNCC(OC)OC 270004a_100000684558_100000752162 [0,2,0,0,0,0|0,0,2]=4 14550 B16R0.222 CCCCCCCCCCNCC(OC)OC 34a_100000684558_100000211822 [0,2,0,0,0,0|0,0,2]=4 14551 B16R0.222 CCCCCCCCCCOCC(CC)OC 34a_100011934954_100000210320 [0,2,0,0,0,0|1,0,1]=4 14552 B16R0.222 CCCCCCCCCCOCC(CC)OC 7a_100011934954_100000210320 [0,2,0,0,0,0|1,0,1]=4 14553 B16R0.222 CCCCCCCCCCOCC(OC)OC 34a_100000210711_100000211822 [0,2,0,0,0,0|0,0,2]=4 14554 B16R0.222 CCCCCCCCCCOCC(OC)OC 34a_100011216393_100000210320 [0,2,0,0,0,0|0,0,2]=4 14555 B16R0.222 CCCCCCCCCCOCC(OC)OC 7a_100000210711_100000751394 [0,2,0,0,0,0|0,0,2]=4 14556 B16R0.222 CCCCCCCCCCSCC(OC)OC 62a_100000751394_100000210320 [0,2,0,0,0,0|0,0,2]=4 14557 B16R0.222 CCCCCCCCCNCCC(OC)OC 2230a_100000212291_100009813347 [0,2,0,0,0,0|0,0,2]=4 14558 B16R0.222 CCCCCCCCCNCCC(OC)OC 34a_100000212291_100000139399 [0,2,0,0,0,0|0,0,2]=4 14559 B16R0.222 CCCCCCCCCOCCC(OC)OC 34a_100000210712_100000139399 [0,2,0,0,0,0|0,0,2]=4 14560 B16R0.222 CCCCCCCCCOCCC(OC)OC 7a_100000210712_100009813347 [0,2,0,0,0,0|0,0,2]=4 14561 B16R0.222 CCCCCCCCCSCCC(OC)OC 62a_100000139399_100000210670 [0,2,0,0,0,0|0,0,2]=4 14562 B16R0.222 CCCCCCCCNCCCC(OC)OC 2230a_100000229939_100000069011 [0,2,0,0,0,0|0,0,2]=4 14563 B16R0.222 CCCCCCCCNCCCC(OC)OC 34a_100000229939_100000069011 [0,2,0,0,0,0|0,0,2]=4 14564 B16R0.222 CCCCCCCCOCCCC(OC)OC 34a_100000210232_100000069011 [0,2,0,0,0,0|0,0,2]=4 14565 B16R0.222 CCCCCCCCOCCCC(OC)OC 7a_100000210232_100000069011 [0,2,0,0,0,0|0,0,2]=4 14566 B16R0.222 CCCCCCCCSCCCC(OC)OC 62a_100000069011_100000210317 [0,2,0,0,0,0|0,0,2]=4 14567 B16R0.222 CCCCCCCCSCCCC(OC)OC 62a_100000210759_100000069011 [0,2,0,0,0,0|0,0,2]=4 14568 B16R0.222 CCCCCCCOCCCCN(CC)N=O 34a_200000035056_100000210614 [0,2,0,0,0,0|2,0,0]=4 14569 B16R0.224 C=C(Br)C(=O)NCCCCCCCCCCC 11a_200011215754_100009813364 [0,2,0,0,0,0|1,0,1]=4 14570 B16R0.224 C=C(Br)C(=O)NCCCCCCCCCCC 1626a_200011215754_100009813364 [0,2,0,0,0,0|1,0,1]=4 14571 B16R0.224 C=C(C)C(=O)CCCCCCC#CCCCC 1458a_100000185857_200000043322 [0,2,0,0,0,0|1,0,1]=4 14572 B16R0.224 C=C(C)C(=O)CCCCCCCCCCCC 1458a_100000185857_100000759014 [0,2,0,0,0,0|1,0,0]=3 14573 B16R0.224 C=C(C)C(=O)CCCCCCCCCCCO 1458a_100000185857_100009812471 [0,2,0,0,0,0|1,0,0]=3 14574 B16R0.224 C=C(C)C(=O)NCCCCCCCCCCC 11a_200011215754_100000185857 [0,2,0,0,0,0|1,0,0]=3 14575 B16R0.224 C=C(C)C(=O)NCCCCCCCCCCC 1626a_200011215754_100000185857 [0,2,0,0,0,0|1,0,0]=3 14576 B16R0.224 C=C(C)C(=O)NCCCNCCCCCCC 2230a_100016987756_100000210681 [0,2,0,0,0,0|2,0,0]=4 14577 B16R0.224 C=C(C)C(=O)NCCNCCCCCCCC 2230a_100102636416_100000210759 [0,2,0,0,0,0|2,0,0]=4 14578 B16R0.224 C=C(C)C(=O)OCCCCCCNCCCC 2230a_100000102301_200010402237 [0,2,0,0,0,0|2,0,0]=4 14579 B16R0.224 C=C(C)C(=O)OCCCCCCNCCCC 7a_106832991798_200010402237 [0,2,0,0,0,0|2,0,0]=4 14580 B16R0.224 C=C(C)C(=O)OCCCCCCOCCCC 34a_100000210227_200010402237 [0,2,0,0,0,0|2,0,0]=4 14581 B16R0.224 C=C(C)C(=O)OCCCCCCOCCCC 7a_100000210227_200010402237 [0,2,0,0,0,0|2,0,0]=4 14582 B16R0.224 C=C(C)C(=O)OCCCCCCSCCCC 62a_100000210211_200010402237 [0,2,0,0,0,0|2,0,0]=4 14583 B16R0.224 C=C(C)C(=O)OCCCCCCSCCCC 62a_200010402237_100000210210 [0,2,0,0,0,0|2,0,0]=4 14584 B16R0.224 C=C(C)C(=O)OCCCCOCCCCCC 7a_100000065474_100000210314 [0,2,0,0,0,0|2,0,0]=4 14585 B16R0.224 C=C(C)C(=O)OCCCOCCCCCCC 7a_100000032641_100000210614 [0,2,0,0,0,0|2,0,0]=4 14586 B16R0.224 C=C(C)C(=O)OCCNCCCCCCCC 2230a_100000229939_100009816335 [0,2,0,0,0,0|2,0,0]=4 14587 B16R0.224 C=C(C)C(=O)OCCNCCCCCCCC 34a_100000229939_100009816335 [0,2,0,0,0,0|2,0,0]=4 14588 B16R0.224 C=C(C)C(=O)OCCOCCCCCCCC 34a_100000210232_100009816335 [0,2,0,0,0,0|2,0,0]=4 14589 B16R0.224 C=C(C)C(=O)OCCOCCCCCCCC 7a_100000210232_100009816335 [0,2,0,0,0,0|2,0,0]=4 14590 B16R0.224 C=C(C)C(=O)OCCSCCCCCCCC 62a_100000210759_100009816335 [0,2,0,0,0,0|2,0,0]=4 14591 B16R0.224 C=C(C)C(=O)OCCSCCCCCCCC 62a_100009816335_100000210317 [0,2,0,0,0,0|2,0,0]=4 14592 B16R0.224 C=C(Cl)C(=O)NCCCCCCCCCCC 11a_200011215754_100000039160 [0,2,0,0,0,0|1,0,1]=4 14593 B16R0.224 C=C(Cl)C(=O)NCCCCCCCCCCC 1626a_200011215754_100000039160 [0,2,0,0,0,0|1,0,1]=4 14594 B16R0.224 C=C(F)C(=O)NCCCCCCCCCCC 11a_200011215754_100000036797 [0,2,0,0,0,0|1,0,1]=4 14595 B16R0.224 C=C(F)C(=O)NCCCCCCCCCCC 1626a_200011215754_100000036797 [0,2,0,0,0,0|1,0,1]=4 14596 B16R0.224 C=CCCCCCCCCCCC(=O)C(=C)C 1458a_100000185857_100011093070 [0,2,0,0,0,0|1,0,1]=4 14597 B16R0.224 C=CCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100011093070 [0,2,0,0,0,0|1,0,1]=4 14598 B16R0.224 C=CCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100011093070 [0,2,0,0,0,0|1,0,1]=4 14599 B16R0.224 C=CCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100011093070 [0,2,0,0,0,0|1,0,1]=4 14600 B16R0.224 C=CCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100011093070 [0,2,0,0,0,0|1,0,1]=4 14601 B16R0.224 CC(=O)C(=O)CNCCCCCCCCCO 34a_100000078944_100011261029 [0,2,0,0,0,0|2,0,0]=4 14602 B16R0.224 CC(=O)C(=O)COCCCCCCCCCBr 34a_100009813782_100011261029 [0,2,0,0,0,0|2,0,0]=4 14603 B16R0.224 CC(=O)C(=O)COCCCCCCCCCCl 34a_100009868337_100011261029 [0,2,0,0,0,0|2,0,0]=4 14604 B16R0.224 CC(=O)C(=O)COCCCCCCCCCN 34a_100000078944_100011261029 [0,2,0,0,0,0|2,0,0]=4 14605 B16R0.224 CC(=O)C(=O)CSCCCCCCCCCO 62a_100009813782_100011261029 [0,2,0,0,0,0|2,0,0]=4 14606 B16R0.224 CC(=O)C(=O)CSCCCCCCCCCO 62a_100011261029_100009813782 [0,2,0,0,0,0|2,0,0]=4 14607 B16R0.224 CC(C)C(=O)CCCCCCCCCCCO 1458a_100000210198_100009812471 [0,2,0,0,0,0|1,0,0]=3 14608 B16R0.224 CC(C)C(=O)CNCCCCCCCCCO 2230a_100000078944_100000753385 [0,2,0,0,0,0|2,0,0]=4 14609 B16R0.224 CC(C)C(=O)CNCCCCCCCCCO 34a_100000078944_100000753385 [0,2,0,0,0,0|2,0,0]=4 14610 B16R0.224 CC(C)C(=O)COCCCCCCCCCBr 34a_100009813782_100000753385 [0,2,0,0,0,0|2,0,0]=4 14611 B16R0.224 CC(C)C(=O)COCCCCCCCCCBr 7a_100009813782_100000753385 [0,2,0,0,0,0|2,0,0]=4 14612 B16R0.224 CC(C)C(=O)COCCCCCCCCCCl 34a_100009868337_100000753385 [0,2,0,0,0,0|2,0,0]=4 14613 B16R0.224 CC(C)C(=O)COCCCCCCCCCCl 7a_100009868337_100000753385 [0,2,0,0,0,0|2,0,0]=4 14614 B16R0.224 CC(C)C(=O)COCCCCCCCCCN 34a_100000078944_100000753385 [0,2,0,0,0,0|2,0,0]=4 14615 B16R0.224 CC(C)C(=O)CSCCCCCCCCCO 62a_100000753385_100009813782 [0,2,0,0,0,0|2,0,0]=4 14616 B16R0.224 CC(C)C(=O)CSCCCCCCCCCO 62a_100009813782_100000753385 [0,2,0,0,0,0|2,0,0]=4 14617 B16R0.224 CC(C)C(=O)NCCCCCCCCCCO 240690a_100000066964_100000210198 [0,2,0,0,0,0|2,0,0]=4 14618 B16R0.224 CC(F)C(=O)CCCCCCCCCCCO 1458a_100000062450_100009812471 [0,2,0,0,0,0|1,0,0]=3 14619 B16R0.224 CC(F)C(=O)NCCCCCCCCCCO 240690a_100000066964_100000062450 [0,2,0,0,0,0|2,0,0]=4 14620 B16R0.224 CCCCC#CCCCCCCC(=O)C(C)C 1458a_100000210198_200000043322 [0,2,0,0,0,0|1,0,1]=4 14621 B16R0.224 CCCCC#CCCCCCCC(=O)C(C)F 1458a_100000062450_200000043322 [0,2,0,0,0,0|1,0,1]=4 14622 B16R0.224 CCCCC#CCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_200000043322 [0,2,0,0,0,0|1,0,1]=4 14623 B16R0.224 CCCCC#CCCCCCCC(=O)[C@H](C)O 1458a_217856618621_200000043322 [0,2,0,0,0,0|1,0,1]=4 14624 B16R0.224 CCCCCCCCCCC=CC(=O)N(C)C 11a_100102631434_100015291182 [0,2,0,0,0,0|1,0,1]=4 14625 B16R0.224 CCCCCCCCCCC=CC(=O)N(C)C 1626a_100102631434_100015291182 [0,2,0,0,0,0|1,0,1]=4 14626 B16R0.224 CCCCCCCCCCC=CC(=O)N(C)C 240690a_100102631434_100015291182 [0,2,0,0,0,0|1,0,1]=4 14627 B16R0.224 CCCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100000759014 [0,2,0,0,0,0|1,0,0]=3 14628 B16R0.224 CCCCCCCCCCCCC(=O)C(C)C 1458a_100011215791_100000210206 [0,2,0,0,0,0|1,0,0]=3 14629 B16R0.224 CCCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100000759014 [0,2,0,0,0,0|1,0,0]=3 14630 B16R0.224 CCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000759014 [0,2,0,0,0,0|2,0,0]=4 14631 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100011215791 [0,2,0,0,0,0|1,0,0]=3 14632 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100011215791 [0,2,0,0,0,0|1,0,0]=3 14633 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100011215791 [0,2,0,0,0,0|1,0,0]=3 14634 B16R0.224 CCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000759014 [0,2,0,0,0,0|1,0,0]=3 14635 B16R0.224 CCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000759014 [0,2,0,0,0,0|1,0,0]=3 14636 B16R0.224 CCCCCCCCCCCNC(=O)C(=O)N 240690a_200011215754_100011215815 [0,2,0,0,0,0|2,0,0]=4 14637 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 11a_200011215754_100000210198 [0,2,0,0,0,0|1,0,0]=3 14638 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 1626a_200011215754_100000210198 [0,2,0,0,0,0|1,0,0]=3 14639 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 240690a_200011215754_100000210198 [0,2,0,0,0,0|1,0,0]=3 14640 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 527a_200011215754_100000210198 [0,2,0,0,0,0|1,0,0]=3 14641 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 11a_200011215754_100000062450 [0,2,0,0,0,0|1,0,0]=3 14642 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 1626a_200011215754_100000062450 [0,2,0,0,0,0|1,0,0]=3 14643 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 240690a_200011215754_100000062450 [0,2,0,0,0,0|1,0,0]=3 14644 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 527a_200011215754_100000062450 [0,2,0,0,0,0|1,0,0]=3 14645 B16R0.224 CCCCCCCCCCCNC(=O)C(F)F 11a_200011215754_100000210393 [0,2,0,0,0,0|2,0,0]=4 14646 B16R0.224 CCCCCCCCCCCNC(=O)C(F)F 1626a_200011215754_100000210393 [0,2,0,0,0,0|2,0,0]=4 14647 B16R0.224 CCCCCCCCCCCNC(=O)C(F)F 240690a_200011215754_100000210393 [0,2,0,0,0,0|2,0,0]=4 14648 B16R0.224 CCCCCCCCCCCNC(=O)C(F)F 527a_200011215754_100000210393 [0,2,0,0,0,0|2,0,0]=4 14649 B16R0.224 CCCCCCCCCCCNC(=O)C(O)O 240690a_200011215754_100000233687 [0,2,0,0,0,0|2,0,0]=4 14650 B16R0.224 CCCCCCCCCCCNC(=O)N(C)C 2708a_200011215754_100102631434 [0,2,0,0,0,0|1,0,0]=3 14651 B16R0.224 CCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_200011215754_100000717761 [0,2,0,0,0,0|1,0,0]=3 14652 B16R0.224 CCCCCCCCCCCNC(=O)[C@H](C)O 1626a_200011215754_217856618621 [0,2,0,0,0,0|1,0,0]=3 14653 B16R0.224 CCCCCCCCCCCNC(=O)[C@H](C)O 240690a_200011215754_217856618621 [0,2,0,0,0,0|1,0,0]=3 14654 B16R0.224 CCCCCCCCCCNCC(=O)C(=O)C 34a_100000684558_100011261029 [0,2,0,0,0,0|1,0,0]=3 14655 B16R0.224 CCCCCCCCCCNCC(=O)C(C)C 2230a_100000684558_100000753385 [0,2,0,0,0,0|1,0,0]=3 14656 B16R0.224 CCCCCCCCCCNCC(=O)C(C)C 34a_100000684558_100000753385 [0,2,0,0,0,0|1,0,0]=3 14657 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 2230a_100000684558_100000185267 [0,2,0,0,0,0|1,0,0]=3 14658 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100000210320 [0,2,0,0,0,0|1,0,0]=3 14659 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 34a_100000684558_100000692301 [0,2,0,0,0,0|1,0,0]=3 14660 B16R0.224 CCCCCCCCCCOCC(=O)C(=O)C 34a_100000210711_100011261029 [0,2,0,0,0,0|1,0,0]=3 14661 B16R0.224 CCCCCCCCCCOCC(=O)C(C)C 34a_100000210711_100000753385 [0,2,0,0,0,0|1,0,0]=3 14662 B16R0.224 CCCCCCCCCCOCC(=O)C(C)C 7a_100000210711_100000753385 [0,2,0,0,0,0|1,0,0]=3 14663 B16R0.224 CCCCCCCCCCOCC(=O)N(C)C 34a_100000210711_100000692301 [0,2,0,0,0,0|1,0,0]=3 14664 B16R0.224 CCCCCCCCCCOCC(=O)N(C)C 7a_100000210711_100000692301 [0,2,0,0,0,0|1,0,0]=3 14665 B16R0.224 CCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210320 [0,2,0,0,0,0|1,0,0]=3 14666 B16R0.224 CCCCCCCCCCSCC(=O)C(C)C 62a_100000753385_100000210320 [0,2,0,0,0,0|1,0,0]=3 14667 B16R0.224 CCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100000210320 [0,2,0,0,0,0|1,0,0]=3 14668 B16R0.224 CCCCCCCCCNCCC(=O)N(C)C 2230a_100000212291_100000737620 [0,2,0,0,0,0|1,0,0]=3 14669 B16R0.224 CCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100011214924 [0,2,0,0,0,0|1,0,0]=3 14670 B16R0.224 CCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100011214924 [0,2,0,0,0,0|1,0,0]=3 14671 B16R0.224 CCCCCCCCCOCCC(=O)N(C)C 7a_100000210712_100000737620 [0,2,0,0,0,0|1,0,0]=3 14672 B16R0.224 CCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210670 [0,2,0,0,0,0|1,0,0]=3 14673 B16R0.224 CCCCCCCCCSCOC(=O)C(C)C 62a_100000139345_100000210670 [0,2,0,0,0,0|2,0,0]=4 14674 B16R0.224 CCCCCCCCNCCCC(=O)N(C)C 2230a_100000229939_100000737642 [0,2,0,0,0,0|1,0,0]=3 14675 B16R0.224 CCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210759 [0,2,0,0,0,0|1,0,0]=3 14676 B16R0.224 CCCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100000210759 [0,2,0,0,0,0|2,0,0]=4 14677 B16R0.224 CCCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100000210759 [0,2,0,0,0,0|2,0,0]=4 14678 B16R0.224 CCCCCCCCOCCCC(=O)N(C)C 7a_100000210232_100000737642 [0,2,0,0,0,0|1,0,0]=3 14679 B16R0.224 CCCCCCCCSCCCC(=O)N(C)C 62a_100000210759_100000737642 [0,2,0,0,0,0|1,0,0]=3 14680 B16R0.224 CCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210317 [0,2,0,0,0,0|1,0,0]=3 14681 B16R0.224 CCCCCCCOCCCCC(=O)N(C)C 34a_100000210272_100000752486 [0,2,0,0,0,0|1,0,0]=3 14682 B16R0.224 CCCCCCCOCCCCC(=O)N(C)C 7a_100000210272_100000752486 [0,2,0,0,0,0|1,0,0]=3 14683 B16R0.224 CCCCCCCSCCCCC(=O)N(C)C 62a_100000210614_100000752486 [0,2,0,0,0,0|1,0,0]=3 14684 B16R0.224 CCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210316 [0,2,0,0,0,0|1,0,0]=3 14685 B16R0.224 CCCCCCOCCOCCC(=O)N(C)C 7a_100000691444_100000737620 [0,2,0,0,0,0|2,0,0]=4 14686 B16R0.224 CCCCCOCCOCCCC(=O)N(C)C 7a_100011215259_100000737642 [0,2,0,0,0,0|2,0,0]=4 14687 B16R0.224 CCCCOCCCCOCCC(=O)N(C)C 7a_200000760531_100000737620 [0,2,0,0,0,0|2,0,0]=4 14688 B16R0.224 CCCCOCCCNCCCC(=O)N(C)C 2230a_200000211371_100000737642 [0,2,0,0,0,0|2,0,0]=4 14689 B16R0.224 CCCCOCCCOCCCC(=O)N(C)C 7a_200011215613_100000737642 [0,2,0,0,0,0|2,0,0]=4 14690 B16R0.224 CCCCOCCOCCCCC(=O)N(C)C 34a_100000210238_100000752486 [0,2,0,0,0,0|2,0,0]=4 14691 B16R0.224 CCCCOCCOCCCCC(=O)N(C)C 7a_100000210238_100000752486 [0,2,0,0,0,0|2,0,0]=4 14692 B16R0.224 CCCCOCCSCCCCC(=O)N(C)C 62a_100000743108_100000752486 [0,2,0,0,0,0|2,0,0]=4 14693 B16R0.224 CCCCOCCSCCCCC(=O)N(C)C 62a_100000752486_100000743108 [0,2,0,0,0,0|2,0,0]=4 14694 B16R0.224 CCCCSCCOCCCCC(=O)N(C)C 34a_200000230436_100000752486 [0,2,0,0,0,0|2,0,0]=4 14695 B16R0.224 CCCCSCCOCCCCC(=O)N(C)C 7a_200000230436_100000752486 [0,2,0,0,0,0|2,0,0]=4 14696 B16R0.224 CCCOCCCNCCCCC(=O)N(C)C 34a_100011217757_100000752486 [0,2,0,0,0,0|2,0,0]=4 14697 B16R0.224 CN(C)C(=O)CCCCCCCCCCCO 240690a_100102631434_100000037981 [0,2,0,0,0,0|1,0,0]=3 14698 B16R0.224 CN(C)C(=O)CCCCNCCCCCCO 34a_100000686447_100000752486 [0,2,0,0,0,0|2,0,0]=4 14699 B16R0.224 CN(C)C(=O)CCCCOCCCCCCBr 34a_100011215345_100000752486 [0,2,0,0,0,0|2,0,0]=4 14700 B16R0.224 CN(C)C(=O)CCCCOCCCCCCBr 7a_100011215345_100000752486 [0,2,0,0,0,0|2,0,0]=4 14701 B16R0.224 CN(C)C(=O)CCCCOCCCCCCCl 34a_100000766143_100000752486 [0,2,0,0,0,0|2,0,0]=4 14702 B16R0.224 CN(C)C(=O)CCCCOCCCCCCCl 7a_100000766143_100000752486 [0,2,0,0,0,0|2,0,0]=4 14703 B16R0.224 CN(C)C(=O)CCCCOCCCCCCF 34a_100000732779_100000752486 [0,2,0,0,0,0|2,0,0]=4 14704 B16R0.224 CN(C)C(=O)CCCCOCCCCCCF 7a_100000732779_100000752486 [0,2,0,0,0,0|2,0,0]=4 14705 B16R0.224 CN(C)C(=O)CCCCOCCCCCCN 34a_100000686447_100000752486 [0,2,0,0,0,0|2,0,0]=4 14706 B16R0.224 CN(C)C(=O)CCCCSCCCCCCF 62a_100000752486_100015922095 [0,2,0,0,0,0|2,0,0]=4 14707 B16R0.224 CN(C)C(=O)CCCCSCCCCCCF 62a_100015922095_100000752486 [0,2,0,0,0,0|2,0,0]=4 14708 B16R0.224 CN(C)C(=O)CCCCSCCCCCCO 62a_100000752486_100000766143 [0,2,0,0,0,0|2,0,0]=4 14709 B16R0.224 CN(C)C(=O)CCCCSCCCCCCO 62a_100000766143_100000752486 [0,2,0,0,0,0|2,0,0]=4 14710 B16R0.224 CN(C)C(=O)CCCNCCCCCCCO 2230a_100011996573_100000737642 [0,2,0,0,0,0|2,0,0]=4 14711 B16R0.224 CN(C)C(=O)CCCNCCCCCCCO 2230a_200000744827_100000760002 [0,2,0,0,0,0|2,0,0]=4 14712 B16R0.224 CN(C)C(=O)CCCOCCCCCCCBr 7a_100000760002_100000737642 [0,2,0,0,0,0|2,0,0]=4 14713 B16R0.224 CN(C)C(=O)CCCSCCCCCCCO 62a_100000737642_100000760002 [0,2,0,0,0,0|2,0,0]=4 14714 B16R0.224 CN(C)C(=O)CCCSCCCCCCCO 62a_100000760002_100000737642 [0,2,0,0,0,0|2,0,0]=4 14715 B16R0.224 CN(C)C(=O)CCNCCCCCCCCO 2230a_100000738053_100000033203 [0,2,0,0,0,0|2,0,0]=4 14716 B16R0.224 CN(C)C(=O)CCNCCCCCCCCO 2230a_102515433106_100000737620 [0,2,0,0,0,0|2,0,0]=4 14717 B16R0.224 CN(C)C(=O)CCOCCCCCCCCBr 7a_100009813846_100000737620 [0,2,0,0,0,0|2,0,0]=4 14718 B16R0.224 CN(C)C(=O)CCOCCCCCCCCCl 7a_100000033203_100000737620 [0,2,0,0,0,0|2,0,0]=4 14719 B16R0.224 CN(C)C(=O)CCOCCCCCCCCO 34a_200000747469_100000033203 [0,2,0,0,0,0|2,0,0]=4 14720 B16R0.224 CN(C)C(=O)CCSCCCCCCCCO 62a_100000033203_100000737620 [0,2,0,0,0,0|2,0,0]=4 14721 B16R0.224 CN(C)C(=O)CCSCCCCCCCCO 62a_100000737620_100000033203 [0,2,0,0,0,0|2,0,0]=4 14722 B16R0.224 CN(C)C(=O)CNCCCCCCCCCO 2230a_100000078944_100000185267 [0,2,0,0,0,0|2,0,0]=4 14723 B16R0.224 CN(C)C(=O)CNCCCCCCCCCO 2230a_100015183351_100009813782 [0,2,0,0,0,0|2,0,0]=4 14724 B16R0.224 CN(C)C(=O)CNCCCCCCCCCO 34a_100000078944_100000692301 [0,2,0,0,0,0|2,0,0]=4 14725 B16R0.224 CN(C)C(=O)COCCCCCCCCCBr 34a_100009813782_100000692301 [0,2,0,0,0,0|2,0,0]=4 14726 B16R0.224 CN(C)C(=O)COCCCCCCCCCBr 7a_100009813782_100000692301 [0,2,0,0,0,0|2,0,0]=4 14727 B16R0.224 CN(C)C(=O)COCCCCCCCCCCl 34a_100009868337_100000692301 [0,2,0,0,0,0|2,0,0]=4 14728 B16R0.224 CN(C)C(=O)COCCCCCCCCCCl 7a_100009868337_100000692301 [0,2,0,0,0,0|2,0,0]=4 14729 B16R0.224 CN(C)C(=O)COCCCCCCCCCN 34a_100000078944_100000692301 [0,2,0,0,0,0|2,0,0]=4 14730 B16R0.224 CN(C)C(=O)CSCCCCCCCCCO 62a_100000692301_100009813782 [0,2,0,0,0,0|2,0,0]=4 14731 B16R0.224 CN(C)C(=O)CSCCCCCCCCCO 62a_100009813782_100000692301 [0,2,0,0,0,0|2,0,0]=4 14732 B16R0.224 CN(C)C(=O)NCCCCCCCCCCO 2708a_100000066964_100102631434 [0,2,0,0,0,0|2,0,0]=4 14733 B16R0.224 CNCCCCCOCCCCC(=O)N(C)C 34a_100000722520_100000752486 [0,2,0,0,0,0|2,0,0]=4 14734 B16R0.224 COCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100011998445 [0,2,0,0,0,0|2,0,0]=4 14735 B16R0.224 COCCCCCCOCCCC(=O)N(C)C 7a_200012092642_100000737642 [0,2,0,0,0,0|2,0,0]=4 14736 B16R0.224 COCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100011998445 [0,2,0,0,0,0|2,0,0]=4 14737 B16R0.224 COCCCCCCSCCCC(=O)N(C)C 62a_100011998445_100000737642 [0,2,0,0,0,0|2,0,0]=4 14738 B16R0.224 COCCCCCNCCCCC(=O)N(C)C 34a_100000747528_100000752486 [0,2,0,0,0,0|2,0,0]=4 14739 B16R0.224 C[C@@H](O)C(=O)CCCCCCCCCCCO 1458a_100000717761_100009812471 [0,2,0,0,0,0|1,0,0]=3 14740 B16R0.224 C[C@@H](O)C(=O)NCCCCCCCCCCO 240690a_100000066964_100000717761 [0,2,0,0,0,0|2,0,0]=4 14741 B16R0.224 C[C@H](O)C(=O)CCCCCCCCCCCO 1458a_217856618621_100009812471 [0,2,0,0,0,0|1,0,0]=3 14742 B16R0.224 C[C@H](O)C(=O)NCCCCCCCCCCO 240690a_100000066964_217856618621 [0,2,0,0,0,0|2,0,0]=4 14743 B16R0.224 O=C(CCCCCCCCCCCO)C(O)O 1458a_100000233687_100009812471 [0,2,0,0,0,0|2,0,0]=4 14744 B16R0.806 C#CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000184674 [0,2,0,0,0,0|0,0,2]=4 14745 B16R0.806 C#CCC(=O)CCCCCCCCC(=O)OC 1458a_100011220946_100010282707 [0,2,0,0,0,0|0,0,2]=4 14746 B16R0.806 C#CCC(C)OCCCCCCCC(=O)OC 34a_100000685586_100010004213 [0,2,0,0,0,0|0,0,2]=4 14747 B16R0.806 C#CCC(C)OCCCCCCCC(=O)OC 7a_100000685586_100010004213 [0,2,0,0,0,0|0,0,2]=4 14748 B16R0.806 C#CCN(C)CCCCCCCCC(=O)OC 2230a_100000225692_100010282707 [0,2,0,0,0,0|0,0,2]=4 14749 B16R0.806 C#CCN(C)CCCCCCCCC(=O)OC 34a_100000225692_100010282707 [0,2,0,0,0,0|0,0,2]=4 14750 B16R0.806 C/C=C/C(C)OCCCCCCCC(=O)OC 34a_200102604097_100010004213 [0,2,0,0,0,0|0,0,2]=4 14751 B16R0.806 C=CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210623 [0,2,0,0,0,0|0,0,2]=4 14752 B16R0.806 C=CCC(=O)CCCCCCCCC(=O)OC 1458a_100000210193_100010282707 [0,2,0,0,0,0|0,0,2]=4 14753 B16R0.806 C=CCC(C)COCCCCCCC(=O)OC 34a_100009832082_100009815986 [0,2,0,0,0,0|0,0,2]=4 14754 B16R0.806 C=CCC(C)COCCCCCCC(=O)OC 7a_100009832082_100009815986 [0,2,0,0,0,0|0,0,2]=4 14755 B16R0.806 C=CCN(C)CCCCCCCCC(=O)OC 2230a_100000225617_100010282707 [0,2,0,0,0,0|0,0,2]=4 14756 B16R0.806 C=CCN(C)CCCCCCCCC(=O)OC 269982a_100000225617_100010282707 [0,2,0,0,0,0|0,0,2]=4 14757 B16R0.806 C=CC[C@@H](C)OCCCCCCCC(=O)OC 34a_100000731007_100010004213 [0,2,0,0,0,0|0,0,2]=4 14758 B16R0.806 C=CC[C@@H](C)OCCCCCCCC(=O)OC 7a_100000731007_100010004213 [0,2,0,0,0,0|0,0,2]=4 14759 B16R0.806 C=CC[C@@H](N)COCCCCCCC(=O)OC 34a_100020615467_100009815986 [0,2,0,0,0,0|0,0,2]=4 14760 B16R0.806 CC#CC(=O)CCCCCCCCC(=O)OC 1458a_100000763181_100010282707 [0,2,0,0,0,0|0,0,2]=4 14761 B16R0.806 CC#CC(C)OCCCCCCCC(=O)OC 34a_100011216543_100010004213 [0,2,0,0,0,0|0,0,2]=4 14762 B16R0.806 CC=CC(=O)CCCCCCCCC(=O)OC 1458a_100000210699_100010282707 [0,2,0,0,0,0|0,0,2]=4 14763 B16R0.806 CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210303 [0,2,0,0,0,0|0,0,0]=2 14764 B16R0.806 CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000211992_100010282707 [0,2,0,0,0,0|0,0,0]=2 14765 B16R0.806 CCCC(=O)CCOCCOCCC(=O)OC 1458a_200020673210_100000210303 [0,2,0,0,0,0|1,0,1]=4 14766 B16R0.806 CCCC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000747444 [0,2,0,0,0,0|0,0,1]=3 14767 B16R0.806 CCCC(=O)CSCCCCCCC(=O)OC 62a_100000747444_100009815986 [0,2,0,0,0,0|0,0,1]=3 14768 B16R0.806 CCCC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000747444 [0,2,0,0,0,0|0,0,1]=3 14769 B16R0.806 CCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000211992 [0,2,0,0,0,0|0,0,1]=3 14770 B16R0.806 CCCC(=O)OCOCCCCCC(=O)OC 34a_100000074720_100000034017 [0,2,0,0,0,0|1,0,1]=4 14771 B16R0.806 CCCC(=O)OCSCCCCCC(=O)OC 62a_100009816466_100000034017 [0,2,0,0,0,0|1,0,1]=4 14772 B16R0.806 CCCC(C)CCCOCCCCC(=O)OC 34a_100011713154_100000204269 [0,2,0,0,0,0|0,0,0]=2 14773 B16R0.806 CCCC(C)CCCOCCCCC(=O)OC 7a_100011713154_100000204269 [0,2,0,0,0,0|0,0,0]=2 14774 B16R0.806 CCCC(C)CCCOCCOCC(=O)OC 34a_100011713154_100000090808 [0,2,0,0,0,0|1,0,0]=3 14775 B16R0.806 CCCC(C)CCCOCCOCC(=O)OC 7a_100011713154_100000090808 [0,2,0,0,0,0|1,0,0]=3 14776 B16R0.806 CCCC(C)CCOCCCCCC(=O)OC 34a_100011217855_100009816466 [0,2,0,0,0,0|0,0,0]=2 14777 B16R0.806 CCCC(C)CCOCCCCCC(=O)OC 7a_100011217855_100009816466 [0,2,0,0,0,0|0,0,0]=2 14778 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 34a_100000688023_100009815986 [0,2,0,0,0,0|0,0,0]=2 14779 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 34a_100009863599_100011216630 [0,2,0,0,0,0|0,0,0]=2 14780 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 7a_100000688023_100009815986 [0,2,0,0,0,0|0,0,0]=2 14781 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 7a_100009863599_100011216630 [0,2,0,0,0,0|0,0,0]=2 14782 B16R0.806 CCCC(C)CSCCCCCCC(=O)OC 62a_100009815986_100011216630 [0,2,0,0,0,0|0,0,0]=2 14783 B16R0.806 CCCC(C)CSCCCCCCC(=O)OC 62a_100011216630_100009815986 [0,2,0,0,0,0|0,0,0]=2 14784 B16R0.806 CCCC(C)NCCCCCCCC(=O)OC 2230a_100000741246_100010004213 [0,2,0,0,0,0|0,0,0]=2 14785 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 34a_100000764384_100010004213 [0,2,0,0,0,0|0,0,0]=2 14786 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 34a_100011022521_100000766640 [0,2,0,0,0,0|0,0,0]=2 14787 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 7a_100000764384_100010004213 [0,2,0,0,0,0|0,0,0]=2 14788 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 7a_100011022521_100000766640 [0,2,0,0,0,0|0,0,0]=2 14789 B16R0.806 CCCC(C)OCCOCCOCC(=O)OC 34a_100011023656_100000766640 [0,2,0,0,0,0|2,0,0]=4 14790 B16R0.806 CCCC(C)OCCOCCOCC(=O)OC 7a_100011023656_100000766640 [0,2,0,0,0,0|2,0,0]=4 14791 B16R0.806 CCCC(C)SCCCCCCCC(=O)OC 62a_100000766640_100010004213 [0,2,0,0,0,0|0,0,0]=2 14792 B16R0.806 CCCC(C)SCCCCCCCC(=O)OC 62a_100010004213_100000766640 [0,2,0,0,0,0|0,0,0]=2 14793 B16R0.806 CCCN(C)CCCCCCCCC(=O)OC 2230a_100000747261_100010282707 [0,2,0,0,0,0|0,0,0]=2 14794 B16R0.806 CCCN(C)CCCCCCCCC(=O)OC 269982a_100000747261_100010282707 [0,2,0,0,0,0|0,0,0]=2 14795 B16R0.806 CCC[C@H](N)CCOCCCCCC(=O)OC 34a_100015193777_100009816466 [0,2,0,0,0,0|0,0,0]=2 14796 B16R0.806 CCC[C@H](N)COCCCCCCC(=O)OC 34a_100000732646_100009815986 [0,2,0,0,0,0|0,0,0]=2 14797 B16R0.806 CCNC(=O)CCCCCCCCC(=O)OC 11a_100015525214_100000036616 [0,2,0,0,0,0|0,0,1]=3 14798 B16R0.806 CCNC(=O)CCCCCCCCC(=O)OC 240690a_100015525214_100000036616 [0,2,0,0,0,0|0,0,1]=3 14799 B16R0.806 CCNC(=O)CCNCCCCCC(=O)OC 34a_100025743525_100009816466 [0,2,0,0,0,0|1,0,1]=4 14800 B16R0.806 CCNC(=O)CCOCCCCCC(=O)OC 7a_100000074720_100000737597 [0,2,0,0,0,0|1,0,1]=4 14801 B16R0.806 CCNC(=O)CCOCCCCCC(C)CC 7a_200000035636_100000737597 [0,2,0,0,0,0|2,0,0]=4 14802 B16R0.806 CCNC(=O)CCSCCCCCC(=O)OC 62a_100000737597_100009816466 [0,2,0,0,0,0|1,0,1]=4 14803 B16R0.806 CCNC(=O)CCSCCCCCC(=O)OC 62a_100009816466_100000737597 [0,2,0,0,0,0|1,0,1]=4 14804 B16R0.806 CCNC(=O)CNCCCCCCC(=O)OC 2230a_100016988866_100009815986 [0,2,0,0,0,0|1,0,1]=4 14805 B16R0.806 CCNC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000183381 [0,2,0,0,0,0|1,0,1]=4 14806 B16R0.806 CCNC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000183381 [0,2,0,0,0,0|1,0,1]=4 14807 B16R0.806 CCNC(=O)CSCCCCCCC(=O)OC 62a_100000183381_100009815986 [0,2,0,0,0,0|1,0,1]=4 14808 B16R0.806 CCNC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000183381 [0,2,0,0,0,0|1,0,1]=4 14809 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CC 1458a_100000210414_100010175975 [0,2,0,0,0,0|0,0,1]=3 14810 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CC 1458a_200000016031_100000210202 [0,2,0,0,0,0|0,0,1]=3 14811 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CF 1458a_200000016031_100015361967 [0,2,0,0,0,0|1,0,1]=4 14812 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CO 1458a_100000210174_100010175975 [0,2,0,0,0,0|1,0,1]=4 14813 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 11a_106832991635_200000016031 [0,2,0,0,0,0|1,0,1]=4 14814 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 1626a_100102657272_200000016031 [0,2,0,0,0,0|1,0,1]=4 14815 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 240690a_100102657272_200000016031 [0,2,0,0,0,0|1,0,1]=4 14816 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 527a_100102657272_200000016031 [0,2,0,0,0,0|1,0,1]=4 14817 B16R0.806 CCOC(=O)CCCCCCCCN(C)CC 2230a_100000225621_100010175975 [0,2,0,0,0,0|1,0,0]=3 14818 B16R0.806 CCOC(=O)CCCCCCCCN(C)CC 269982a_100000225621_100010175975 [0,2,0,0,0,0|1,0,0]=3 14819 B16R0.806 CCOC(=O)CCCCCCCNC(C)CC 2230a_100000209981_100009991516 [0,2,0,0,0,0|1,0,0]=3 14820 B16R0.806 CCOC(=O)CCCCCCCN[C@H](C)CO 2230a_100000737577_100009991516 [0,2,0,0,0,0|2,0,0]=4 14821 B16R0.806 CCOC(=O)CCCCCCCOC(C)CC 7a_100000210228_100009991516 [0,2,0,0,0,0|1,0,0]=3 14822 B16R0.806 CCOC(=O)CCCCCCCOC(C)CF 34a_100016041109_100009991516 [0,2,0,0,0,0|2,0,0]=4 14823 B16R0.806 CCOC(=O)CCCCCCCOC(C)CF 7a_100016041109_100009991516 [0,2,0,0,0,0|2,0,0]=4 14824 B16R0.806 CCOC(=O)CCCCCCCOC(C)CN 34a_100000210904_100009991516 [0,2,0,0,0,0|2,0,0]=4 14825 B16R0.806 CCOC(=O)CCCCCCCSC(C)CC 62a_100000758301_100009991516 [0,2,0,0,0,0|1,0,0]=3 14826 B16R0.806 CCOC(=O)CCCCCCCSC(C)CO 62a_100012180447_100009991516 [0,2,0,0,0,0|2,0,0]=4 14827 B16R0.806 CCOC(=O)CCCCCCCSC(C)OC 62a_100009879195_100009991516 [0,2,0,0,0,0|2,0,0]=4 14828 B16R0.806 CCOC(=O)CCCCCCCS[C@H](C)CO 62a_100016084084_100009991516 [0,2,0,0,0,0|2,0,0]=4 14829 B16R0.806 CCOC(=O)CCCCCCNCC(C)CC 2230a_100020588543_100009814379 [0,2,0,0,0,0|1,0,0]=3 14830 B16R0.806 CCOC(=O)CCCCCCNCC(C)CO 34a_100000744482_100009814379 [0,2,0,0,0,0|2,0,0]=4 14831 B16R0.806 CCOC(=O)CCCCCCNCC(O)CC 2230a_100011218483_100009814379 [0,2,0,0,0,0|1,0,0]=3 14832 B16R0.806 CCOC(=O)CCCCCCNC[C@@H](C)OC 2230a_100020591295_100009814379 [0,2,0,0,0,0|2,0,0]=4 14833 B16R0.806 CCOC(=O)CCCCCCNC[C@@H](F)CO 34a_100015665980_100009814379 [0,2,0,0,0,0|2,0,0]=4 14834 B16R0.806 CCOC(=O)CCCCCCNC[C@H](O)CO 2230a_100020644852_100009814379 [0,2,0,0,0,0|2,0,0]=4 14835 B16R0.806 CCOC(=O)CCCCCCOCC(=O)CC 34a_100000725409_100009814379 [0,2,0,0,0,0|1,0,1]=4 14836 B16R0.806 CCOC(=O)CCCCCCOCC(C)CN 34a_100000744482_100009814379 [0,2,0,0,0,0|2,0,0]=4 14837 B16R0.806 CCOC(=O)CCCCCCOCC(C)OC 34a_100000690652_100009814379 [0,2,0,0,0,0|2,0,0]=4 14838 B16R0.806 CCOC(=O)CCCCCCOCC(Cl)CCl 34a_100000033668_100009814379 [0,2,0,0,0,0|2,0,0]=4 14839 B16R0.806 CCOC(=O)CCCCCCOC[C@@H](C)CC 7a_100009816381_100009814379 [0,2,0,0,0,0|1,0,0]=3 14840 B16R0.806 CCOC(=O)CCCCCCOC[C@H](F)CN 34a_100015665980_100009814379 [0,2,0,0,0,0|2,0,0]=4 14841 B16R0.806 CCOC(=O)CCCCCCSCC(=O)CC 62a_100000747405_100009814379 [0,2,0,0,0,0|1,0,1]=4 14842 B16R0.806 CCOC(=O)CCCCCCSCC(=O)OC 62a_100000747449_100009814379 [0,2,0,0,0,0|1,0,1]=4 14843 B16R0.806 CCOC(=O)CCCCCCSCC(C)CC 62a_100000748023_100009814379 [0,2,0,0,0,0|1,0,0]=3 14844 B16R0.806 CCOC(=O)CCCCCCSCC(O)CC 62a_100011218378_100009814379 [0,2,0,0,0,0|1,0,0]=3 14845 B16R0.806 CCOC(=O)CCCCCCSCC(O)CO 62a_100011219619_100009814379 [0,2,0,0,0,0|2,0,0]=4 14846 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](C)CC 62a_100009816398_100009814379 [0,2,0,0,0,0|1,0,0]=3 14847 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](C)CO 62a_100000059175_100009814379 [0,2,0,0,0,0|2,0,0]=4 14848 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](O)CF 62a_100015614560_100009814379 [0,2,0,0,0,0|2,0,0]=4 14849 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](O)CO 62a_100009815848_100009814379 [0,2,0,0,0,0|2,0,0]=4 14850 B16R0.806 CCOC(=O)CCCCCNCCC(C)CC 2230a_100020591266_100000755133 [0,2,0,0,0,0|1,0,0]=3 14851 B16R0.806 CCOC(=O)CCCCCNCCC(C)CO 2230a_106354213184_100000755133 [0,2,0,0,0,0|2,0,0]=4 14852 B16R0.806 CCOC(=O)CCCCCNCCC(C)CO 34a_106354213184_100000755133 [0,2,0,0,0,0|2,0,0]=4 14853 B16R0.806 CCOC(=O)CCCCCOCCC(=O)OC 7a_100011214988_100000204255 [0,2,0,0,0,0|1,0,1]=4 14854 B16R0.806 CCOC(=O)CCCCCOCCC(C)CC 7a_100011215188_100000755133 [0,2,0,0,0,0|1,0,0]=3 14855 B16R0.806 CCOC(=O)CCCCCOCCC(C)OC 7a_100000764861_100000755133 [0,2,0,0,0,0|2,0,0]=4 14856 B16R0.806 CCOC(=O)CCCCCSCCC(=O)OC 62a_100000204255_100000755133 [0,2,0,0,0,0|1,0,1]=4 14857 B16R0.806 CCOC(=O)CCCCCSCCC(=O)OC 62a_100000755133_100000204255 [0,2,0,0,0,0|1,0,1]=4 14858 B16R0.806 CCOC(=O)CCCCOCCCC(C)CC 7a_100011216074_100000750268 [0,2,0,0,0,0|1,0,0]=3 14859 B16R0.806 CCOC(=O)CCCCOCCC[C@@H](C)CN 34a_100160569302_100000750268 [0,2,0,0,0,0|2,0,0]=4 14860 B16R0.806 CCOC(=O)CCCCSCCCC(=O)OC 62a_100000750268_100011218270 [0,2,0,0,0,0|1,0,1]=4 14861 B16R0.806 CCOC(=O)CCCCSCCCC(=O)OC 62a_100011218270_100000750268 [0,2,0,0,0,0|1,0,1]=4 14862 B16R0.806 CCOC(=O)CCCCSCCCN(C)CC 62a_100000750268_100015186262 [0,2,0,0,0,0|2,0,0]=4 14863 B16R0.806 CCOC(=O)CCCOCCCCC(=O)OC 34a_100000059025_100009991533 [0,2,0,0,0,0|1,0,1]=4 14864 B16R0.806 CCOC(=O)CCCOCCCCC(=O)OC 7a_100000059025_100011215271 [0,2,0,0,0,0|1,0,1]=4 14865 B16R0.806 CCOC(=O)CCCOCCCCC(=O)OC 7a_100012001163_100000204269 [0,2,0,0,0,0|1,0,1]=4 14866 B16R0.806 CCOC(=O)CCCSCCCCC(=O)OC 62a_100000204269_100009991533 [0,2,0,0,0,0|1,0,1]=4 14867 B16R0.806 CCOC(=O)CCCSCCCCC(=O)OC 62a_100009991533_100000204269 [0,2,0,0,0,0|1,0,1]=4 14868 B16R0.806 CCOC(=O)CCOCCCCCC(=O)OC 34a_100000074720_100000765890 [0,2,0,0,0,0|1,0,1]=4 14869 B16R0.806 CCOC(=O)CCOCCCCCC(=O)OC 7a_100000074720_100011206558 [0,2,0,0,0,0|1,0,1]=4 14870 B16R0.806 CCOC(=O)CCOCCCCCC(C)CC 7a_200000035636_100011206558 [0,2,0,0,0,0|1,0,0]=3 14871 B16R0.806 CCOC(=O)CCSCCCCCC(=O)OC 62a_100000765890_100009816466 [0,2,0,0,0,0|1,0,1]=4 14872 B16R0.806 CCOC(=O)CCSCCCCCC(=O)OC 62a_100009816466_100000765890 [0,2,0,0,0,0|1,0,1]=4 14873 B16R0.806 CCOC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000188475 [0,2,0,0,0,0|1,0,1]=4 14874 B16R0.806 CCOC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000188475 [0,2,0,0,0,0|1,0,1]=4 14875 B16R0.806 CCOC(=O)COCCCNCCC(C)CC 2230a_100020591266_100009893628 [0,2,0,0,0,0|2,0,0]=4 14876 B16R0.806 CCOC(=O)COCCCOCCC(C)CC 7a_100011215188_100009893628 [0,2,0,0,0,0|2,0,0]=4 14877 B16R0.806 CCOC(=O)COCCOCCCC(C)CC 7a_100011216074_100000088970 [0,2,0,0,0,0|2,0,0]=4 14878 B16R0.806 CCOC(=O)CSCCCCCCC(=O)OC 62a_100000188475_100009815986 [0,2,0,0,0,0|1,0,1]=4 14879 B16R0.806 CCOC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000188475 [0,2,0,0,0,0|1,0,1]=4 14880 B16R0.806 COC(=O)CCCCCCCCC(=O)CC#N 1458a_100000036616_100011214920 [0,2,0,0,0,0|0,0,2]=4 14881 B16R0.806 COC(=O)CCCCCCCCC(=O)CC#N 1458a_100051588842_100010282707 [0,2,0,0,0,0|0,0,2]=4 14882 B16R0.806 COC(=O)CCCCCCCCC(=O)CCF 1458a_100000036616_100011217306 [0,2,0,0,0,0|0,0,1]=3 14883 B16R0.806 COC(=O)CCCCCCCCC(=O)CCO 1458a_100000036616_100000211926 [0,2,0,0,0,0|0,0,1]=3 14884 B16R0.806 COC(=O)CCCCCCCCC(=O)CCO 1458a_100011216618_100010282707 [0,2,0,0,0,0|0,0,1]=3 14885 B16R0.806 COC(=O)CCCCCCCCC(=O)CSC 1458a_100000184570_100010282707 [0,2,0,0,0,0|0,0,1]=3 14886 B16R0.806 COC(=O)CCCCCCCCN(C)CC#N 2230a_100000748184_100010282707 [0,2,0,0,0,0|1,0,1]=4 14887 B16R0.806 COC(=O)CCCCCCCCN(C)CCO 2230a_100000210263_100010282707 [0,2,0,0,0,0|1,0,0]=3 14888 B16R0.806 COC(=O)CCCCCCCCN(C)CCO 269982a_100000210263_100010282707 [0,2,0,0,0,0|1,0,0]=3 14889 B16R0.806 COC(=O)CCCCCCCNC(=O)CSC 188690a_100000687944_100000184570 [0,2,0,0,0,0|1,0,1]=4 14890 B16R0.806 COC(=O)CCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100010004213 [0,2,0,0,0,0|1,0,1]=4 14891 B16R0.806 COC(=O)CCCCCCCN[C@H](C)CCO 2230a_100000706166_100010004213 [0,2,0,0,0,0|1,0,0]=3 14892 B16R0.806 COC(=O)CCCCCCCN[C@H](C)CCO 34a_100000706166_100010004213 [0,2,0,0,0,0|1,0,0]=3 14893 B16R0.806 COC(=O)CCCCCCCOC(C)CC#N 7a_100011022521_100009813641 [0,2,0,0,0,0|1,0,1]=4 14894 B16R0.806 COC(=O)CCCCCCCOC(C)CCBr 34a_100012276601_100010004213 [0,2,0,0,0,0|1,0,0]=3 14895 B16R0.806 COC(=O)CCCCCCCOC(C)CCO 34a_100011022521_100009893172 [0,2,0,0,0,0|1,0,0]=3 14896 B16R0.806 COC(=O)CCCCCCCOC(C)CCO 7a_100011022521_100009893172 [0,2,0,0,0,0|1,0,0]=3 14897 B16R0.806 COC(=O)CCCCCCCSC(C)CC#N 62a_100009813641_100010004213 [0,2,0,0,0,0|1,0,1]=4 14898 B16R0.806 COC(=O)CCCCCCCSC(C)CC#N 62a_100010004213_100009813641 [0,2,0,0,0,0|1,0,1]=4 14899 B16R0.806 COC(=O)CCCCCCCSC(C)CCO 62a_100009893172_100010004213 [0,2,0,0,0,0|1,0,0]=3 14900 B16R0.806 COC(=O)CCCCCCCSC(C)CCO 62a_100010004213_100009893172 [0,2,0,0,0,0|1,0,0]=3 14901 B16R0.806 COC(=O)CCCCCCOCC(C)CCN 34a_106354213184_100009815986 [0,2,0,0,0,0|1,0,0]=3 14902 B16R0.806 COC(=O)CCCCCCOC[C@@H](O)CC#N 7a_100009863599_100000001066 [0,2,0,0,0,0|1,0,1]=4 14903 B16R0.806 COC(=O)CCCCCCSC[C@@H](O)CC#N 62a_100000001066_100009815986 [0,2,0,0,0,0|1,0,1]=4 14904 B16R0.806 COC(=O)CCCCCCSC[C@@H](O)CC#N 62a_100009815986_100000001066 [0,2,0,0,0,0|1,0,1]=4 14905 B16R0.806 COCC(=O)CCCCCCCCC(=O)OC 1458a_100000210968_100010282707 [0,2,0,0,0,0|0,0,1]=3 14906 B16R0.806 COCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000210968 [0,2,0,0,0,0|1,0,1]=4 14907 B16R0.806 COCC(C)OCCCCCCCC(=O)OC 34a_100011022521_100000765312 [0,2,0,0,0,0|1,0,0]=3 14908 B16R0.806 COCC(C)OCCCCCCCC(=O)OC 7a_100011022521_100000765312 [0,2,0,0,0,0|1,0,0]=3 14909 B16R0.806 COCC(C)SCCCCCCCC(=O)OC 62a_100000765312_100010004213 [0,2,0,0,0,0|1,0,0]=3 14910 B16R0.806 COCC(C)SCCCCCCCC(=O)OC 62a_100010004213_100000765312 [0,2,0,0,0,0|1,0,0]=3 14911 B16R0.806 COCC(N)COCCCCCCC(=O)OC 34a_100000724102_100009815986 [0,2,0,0,0,0|1,0,0]=3 14912 B16R0.806 COCC(O)CNCCCCCCC(=O)OC 2230a_100000756049_100009815986 [0,2,0,0,0,0|1,0,0]=3 14913 B16R0.806 COCC(O)CNCCCCCCC(=O)OC 34a_100000756049_100009815986 [0,2,0,0,0,0|1,0,0]=3 14914 B16R0.806 COCC(O)COCCCCCCC(=O)OC 34a_100009863599_100011215053 [0,2,0,0,0,0|1,0,0]=3 14915 B16R0.806 COCC(O)COCCCCCCC(=O)OC 7a_100009863599_100011215053 [0,2,0,0,0,0|1,0,0]=3 14916 B16R0.806 COCC(O)CSCCCCCCC(=O)OC 62a_100009815986_100011215053 [0,2,0,0,0,0|1,0,0]=3 14917 B16R0.806 COCC(O)CSCCCCCCC(=O)OC 62a_100011215053_100009815986 [0,2,0,0,0,0|1,0,0]=3 14918 B16R0.806 COC[C@@H](C)NCCCCCCCC(=O)OC 2230a_100000764878_100010004213 [0,2,0,0,0,0|1,0,0]=3 14919 B16R0.806 COC[C@@H](C)OCCCCCCCC(=O)OC 34a_100011934205_100010004213 [0,2,0,0,0,0|1,0,0]=3 14920 B16R0.1182 C#CCCCCCCCCC(=O)CC(=O)OC 1458a_100000029693_100000747449 [0,2,0,0,0,0|0,0,2]=4 14921 B16R0.1182 C#CCCCCCCCOC(C)CC(=O)OC 34a_100000054614_100009817358 [0,2,0,0,0,0|0,0,2]=4 14922 B16R0.1182 C#CCCCCCCCOC(C)CC(=O)OC 7a_100000054614_100009817358 [0,2,0,0,0,0|0,0,2]=4 14923 B16R0.1182 C#CCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100153394163 [0,2,0,0,0,0|0,0,2]=4 14924 B16R0.1182 C#CCCCCCCCSC(C)CC(=O)OC 62a_100153394163_100009817358 [0,2,0,0,0,0|0,0,2]=4 14925 B16R0.1182 C#CCCCCCCOC[C@H](O)CC(=O)OC 34a_100011217361_100000754131 [0,2,0,0,0,0|0,0,2]=4 14926 B16R0.1182 C#CCCCCCCOC[C@H](O)CC(=O)OC 7a_100011217361_100000754131 [0,2,0,0,0,0|0,0,2]=4 14927 B16R0.1182 C#CCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100012276617 [0,2,0,0,0,0|0,0,2]=4 14928 B16R0.1182 C#CCCCCCCSC[C@H](O)CC(=O)OC 62a_100012276617_100000754131 [0,2,0,0,0,0|0,0,2]=4 14929 B16R0.1182 C=CCCCCCCCCC(=O)CC(=O)OC 1458a_100000211349_100000747449 [0,2,0,0,0,0|0,0,2]=4 14930 B16R0.1182 C=CCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100011933949 [0,2,0,0,0,0|0,0,2]=4 14931 B16R0.1182 C=CCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011933949 [0,2,0,0,0,0|0,0,2]=4 14932 B16R0.1182 C=CCCCCCCCOC(C)CC(=O)OC 34a_100000730831_100009817358 [0,2,0,0,0,0|0,0,2]=4 14933 B16R0.1182 C=CCCCCCCCOC(C)CC(=O)OC 7a_100000730831_100009817358 [0,2,0,0,0,0|0,0,2]=4 14934 B16R0.1182 C=CCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100012355270 [0,2,0,0,0,0|0,0,2]=4 14935 B16R0.1182 C=CCCCCCCCSC(C)CC(=O)OC 62a_100012355270_100009817358 [0,2,0,0,0,0|0,0,2]=4 14936 B16R0.1182 C=CCCCCCCOC[C@H](O)CC(=O)OC 34a_200011216477_100000754131 [0,2,0,0,0,0|0,0,2]=4 14937 B16R0.1182 C=CCCCCCCOC[C@H](O)CC(=O)OC 7a_200011216477_100000754131 [0,2,0,0,0,0|0,0,2]=4 14938 B16R0.1182 C=CCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011215473 [0,2,0,0,0,0|0,0,2]=4 14939 B16R0.1182 C=CCCCCCCSC[C@H](O)CC(=O)OC 62a_100011215473_100000754131 [0,2,0,0,0,0|0,0,2]=4 14940 B16R0.1182 CC#CCCCCCCCC(=O)CC(=O)OC 1458a_100000066323_100000747449 [0,2,0,0,0,0|0,0,2]=4 14941 B16R0.1182 CC/C=C\CCCCCOC(C)CC(=O)OC 34a_100016268722_100009817358 [0,2,0,0,0,0|0,0,2]=4 14942 B16R0.1182 CC/C=C\CCCCCOC(C)CC(=O)OC 7a_100016268722_100009817358 [0,2,0,0,0,0|0,0,2]=4 14943 B16R0.1182 CC/C=C\CCCCOC[C@H](O)CC(=O)OC 34a_100016287862_100000754131 [0,2,0,0,0,0|0,0,2]=4 14944 B16R0.1182 CC/C=C\CCCCOC[C@H](O)CC(=O)OC 7a_100016287862_100000754131 [0,2,0,0,0,0|0,0,2]=4 14945 B16R0.1182 CCC#CCCCCCCC(=O)CC(=O)OC 1458a_100000211351_200000036426 [0,2,0,0,0,0|0,0,2]=4 14946 B16R0.1182 CCC#CCCCCCCN(C)CC(=O)OC 2230a_100000198492_200000036426 [0,2,0,0,0,0|0,0,2]=4 14947 B16R0.1182 CCC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100000747405 [0,2,0,0,0,0|1,0,1]=4 14948 B16R0.1182 CCCC/C=C\CCOC[C@H](O)CC(=O)OC 34a_200016286491_100000754131 [0,2,0,0,0,0|0,0,2]=4 14949 B16R0.1182 CCCC/C=C\CCOC[C@H](O)CC(=O)OC 7a_200016286491_100000754131 [0,2,0,0,0,0|0,0,2]=4 14950 B16R0.1182 CCCCC#CCCCSC(C)CC(=O)OC 62a_100009817358_200000047210 [0,2,0,0,0,0|0,0,2]=4 14951 B16R0.1182 CCCCC#CCCCSC(C)CC(=O)OC 62a_200000047210_100009817358 [0,2,0,0,0,0|0,0,2]=4 14952 B16R0.1182 CCCCC#CCCOC[C@H](O)CC(=O)OC 34a_100000037610_100000754131 [0,2,0,0,0,0|0,0,2]=4 14953 B16R0.1182 CCCCC#CCCOC[C@H](O)CC(=O)OC 7a_100000037610_100000754131 [0,2,0,0,0,0|0,0,2]=4 14954 B16R0.1182 CCCCC/C=C/COC[C@H](O)CC(=O)OC 34a_100016258190_100000754131 [0,2,0,0,0,0|0,0,2]=4 14955 B16R0.1182 CCCCC/C=C/COC[C@H](O)CC(=O)OC 7a_100016258190_100000754131 [0,2,0,0,0,0|0,0,2]=4 14956 B16R0.1182 CCCCC/C=C\CCOC(C)CC(=O)OC 34a_100016277358_100009817358 [0,2,0,0,0,0|0,0,2]=4 14957 B16R0.1182 CCCCC/C=C\CCOC(C)CC(=O)OC 7a_100016277358_100009817358 [0,2,0,0,0,0|0,0,2]=4 14958 B16R0.1182 CCCCCC#CCCOC(C)CC(=O)OC 34a_200000042877_100009817358 [0,2,0,0,0,0|0,0,2]=4 14959 B16R0.1182 CCCCCC#CCCOC(C)CC(=O)OC 7a_200000042877_100009817358 [0,2,0,0,0,0|0,0,2]=4 14960 B16R0.1182 CCCCCC#CCOC[C@H](O)CC(=O)OC 34a_200000033628_100000754131 [0,2,0,0,0,0|0,0,2]=4 14961 B16R0.1182 CCCCCC#CCOC[C@H](O)CC(=O)OC 7a_200000033628_100000754131 [0,2,0,0,0,0|0,0,2]=4 14962 B16R0.1182 CCCCCC#CCSC[C@H](O)CC(=O)OC 62a_100000754131_100009816472 [0,2,0,0,0,0|0,0,2]=4 14963 B16R0.1182 CCCCCC#CCSC[C@H](O)CC(=O)OC 62a_100009816472_100000754131 [0,2,0,0,0,0|0,0,2]=4 14964 B16R0.1182 CCCCCC/C=C/COC(C)CC(=O)OC 34a_200016276170_100009817358 [0,2,0,0,0,0|0,0,2]=4 14965 B16R0.1182 CCCCCC/C=C/COC(C)CC(=O)OC 7a_200016276170_100009817358 [0,2,0,0,0,0|0,0,2]=4 14966 B16R0.1182 CCCCCCC#CCOC(C)CC(=O)OC 34a_200000037284_100009817358 [0,2,0,0,0,0|0,0,2]=4 14967 B16R0.1182 CCCCCCC#CCOC(C)CC(=O)OC 7a_200000037284_100009817358 [0,2,0,0,0,0|0,0,2]=4 14968 B16R0.1182 CCCCCCCCC=CC(=O)CC(=O)OC 1458a_100015345288_100000747449 [0,2,0,0,0,0|0,0,2]=4 14969 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)CC 1458a_100000210375_100000747405 [0,2,0,0,0,0|1,0,0]=3 14970 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)NC 1458a_100000210375_100000183359 [0,2,0,0,0,0|1,0,0]=3 14971 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000210375_100000747449 [0,2,0,0,0,0|0,0,0]=2 14972 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210319 [0,2,0,0,0,0|0,0,0]=2 14973 B16R0.1182 CCCCCCCCCCN(C)CC(=O)CC 269982a_100000207566_100000747405 [0,2,0,0,0,0|1,0,0]=3 14974 B16R0.1182 CCCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100000210320 [0,2,0,0,0,0|1,0,0]=3 14975 B16R0.1182 CCCCCCCCCCN(C)CC(=O)NC 2230a_100000207566_100000183359 [0,2,0,0,0,0|1,0,0]=3 14976 B16R0.1182 CCCCCCCCCCN(C)CC(=O)NC 269982a_100000207566_100000183359 [0,2,0,0,0,0|1,0,0]=3 14977 B16R0.1182 CCCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210320 [0,2,0,0,0,0|0,0,0]=2 14978 B16R0.1182 CCCCCCCCCCN(C)CC(=O)OC 2230a_100000207566_100000747449 [0,2,0,0,0,0|0,0,0]=2 14979 B16R0.1182 CCCCCCCCCCN(C)CC(=O)OC 269982a_100000207566_100000747449 [0,2,0,0,0,0|0,0,0]=2 14980 B16R0.1182 CCCCCCCCCNC(=O)CC(=O)OC 240690a_100000212291_100000211351 [0,2,0,0,0,0|0,0,1]=3 14981 B16R0.1182 CCCCCCCCCNC(C)CC(=O)OC 2230a_100000212291_100009817358 [0,2,0,0,0,0|0,0,0]=2 14982 B16R0.1182 CCCCCCCCCNC(C)CC(=O)OC 34a_100000212291_100009817358 [0,2,0,0,0,0|0,0,0]=2 14983 B16R0.1182 CCCCCCCCCOC(C)CC(=O)OC 34a_100000210712_100009817358 [0,2,0,0,0,0|0,0,0]=2 14984 B16R0.1182 CCCCCCCCCOC(C)CC(=O)OC 7a_100000210712_100009817358 [0,2,0,0,0,0|0,0,0]=2 14985 B16R0.1182 CCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210670 [0,2,0,0,0,0|0,0,0]=2 14986 B16R0.1182 CCCCCCCCNC[C@H](O)CC(=O)OC 34a_100000229939_100000754131 [0,2,0,0,0,0|0,0,0]=2 14987 B16R0.1182 CCCCCCCCOCC(=O)CC(=O)CC 1458a_100000759886_100000747405 [0,2,0,0,0,0|1,0,1]=4 14988 B16R0.1182 CCCCCCCCOCC(=O)CC(=O)NC 1458a_100000759886_100000183359 [0,2,0,0,0,0|1,0,1]=4 14989 B16R0.1182 CCCCCCCCOCC(=O)CC(=O)OC 1458a_100000759886_100000747449 [0,2,0,0,0,0|0,0,1]=3 14990 B16R0.1182 CCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000210232_100000754131 [0,2,0,0,0,0|0,0,0]=2 14991 B16R0.1182 CCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000210232_100000754131 [0,2,0,0,0,0|0,0,0]=2 14992 B16R0.1182 CCCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210317 [0,2,0,0,0,0|0,0,1]=3 14993 B16R0.1182 CCCCCCCCSCC(=O)CC(=O)OC 62a_100000210759_100000210525 [0,2,0,0,0,0|0,0,1]=3 14994 B16R0.1182 CCCCCCCCSCC(=O)NC(=O)OC 62a_100000210759_100000010850 [0,2,0,0,0,0|1,0,1]=4 14995 B16R0.1182 CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000210759_100000754131 [0,2,0,0,0,0|0,0,0]=2 14996 B16R0.1182 CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210317 [0,2,0,0,0,0|0,0,0]=2 14997 B16R0.1182 CCCCCCOCCOC(C)CC(=O)OC 34a_100000691444_100009817358 [0,2,0,0,0,0|1,0,0]=3 14998 B16R0.1182 CCCCCCOCCOC(C)CC(=O)OC 7a_100000691444_100009817358 [0,2,0,0,0,0|1,0,0]=3 14999 B16R0.1182 CCCCCNCCOC[C@H](O)CC(=O)OC 34a_100000224656_100000754131 [0,2,0,0,0,0|1,0,0]=3 15000 B16R0.1182 CCCCCOCCOC[C@H](O)CC(=O)OC 34a_100011215259_100000754131 [0,2,0,0,0,0|1,0,0]=3 15001 B16R0.1182 CCCCCOCCOC[C@H](O)CC(=O)OC 7a_100011215259_100000754131 [0,2,0,0,0,0|1,0,0]=3 15002 B16R0.1182 CCCCNCCCCOC(C)CC(=O)OC 34a_200011216965_100009817358 [0,2,0,0,0,0|1,0,0]=3 15003 B16R0.1182 CCCCOCCCCOC(C)CC(=O)OC 34a_200000760531_100009817358 [0,2,0,0,0,0|1,0,0]=3 15004 B16R0.1182 CCCCOCCCCOC(C)CC(=O)OC 7a_200000760531_100009817358 [0,2,0,0,0,0|1,0,0]=3 15005 B16R0.1182 CCCCOCCCNC[C@H](O)CC(=O)OC 34a_200000211371_100000754131 [0,2,0,0,0,0|1,0,0]=3 15006 B16R0.1182 CCCCOCCCOC[C@H](O)CC(=O)OC 34a_200011215613_100000754131 [0,2,0,0,0,0|1,0,0]=3 15007 B16R0.1182 CCCCOCCCOC[C@H](O)CC(=O)OC 7a_200011215613_100000754131 [0,2,0,0,0,0|1,0,0]=3 15008 B16R0.1182 CCCOCCOCCNC(C)CC(=O)OC 2230a_200011904461_100009817358 [0,2,0,0,0,0|2,0,0]=4 15009 B16R0.1182 CCCOCCOCCNC(C)CC(=O)OC 34a_200011904461_100009817358 [0,2,0,0,0,0|2,0,0]=4 15010 B16R0.1182 CCOCCOCCNC[C@H](O)CC(=O)OC 34a_100102712874_100000754131 [0,2,0,0,0,0|2,0,0]=4 15011 B16R0.1182 CCOCCOCCOC[C@H](O)CC(=O)OC 34a_100000210240_100000754131 [0,2,0,0,0,0|2,0,0]=4 15012 B16R0.1182 CCOCCOCCOC[C@H](O)CC(=O)OC 7a_100000210240_100000754131 [0,2,0,0,0,0|2,0,0]=4 15013 B16R0.1182 CCOCCOCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011211534 [0,2,0,0,0,0|2,0,0]=4 15014 B16R0.1182 CCOCCOCCSC[C@H](O)CC(=O)OC 62a_100011211534_100000754131 [0,2,0,0,0,0|2,0,0]=4 15015 B16R0.1182 CNC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100000183359 [0,2,0,0,0,0|1,0,1]=4 15016 B16R0.1182 CNC(=O)CN(C)CCCCCCCCCO 2230a_100000189611_100009813782 [0,2,0,0,0,0|2,0,0]=4 15017 B16R0.1182 COC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100000747449 [0,2,0,0,0,0|0,0,1]=3 15018 B16R0.1182 COC(=O)CC(=O)CCCCCCCCCO 1458a_100000211351_100009813782 [0,2,0,0,0,0|0,0,1]=3 15019 B16R0.1182 COC(=O)CC(=O)CSCCCCCCCO 62a_100000210525_100000760002 [0,2,0,0,0,0|1,0,1]=4 15020 B16R0.1182 COC(=O)CC(=O)CSCCCCCCCO 62a_100000760002_100000210525 [0,2,0,0,0,0|1,0,1]=4 15021 B16R0.1182 COC(=O)CC(=O)NCCCCCCCCO 240690a_102515433106_100000211351 [0,2,0,0,0,0|1,0,1]=4 15022 B16R0.1182 COC(=O)CC(C)NCCCCCCCCO 2230a_102515433106_100009817358 [0,2,0,0,0,0|1,0,0]=3 15023 B16R0.1182 COC(=O)CC(C)NCCCCCCCCO 34a_102515433106_100009817358 [0,2,0,0,0,0|1,0,0]=3 15024 B16R0.1182 COC(=O)CC(C)OCCCCCCCCBr 34a_100009813846_100009817358 [0,2,0,0,0,0|1,0,0]=3 15025 B16R0.1182 COC(=O)CC(C)OCCCCCCCCBr 7a_100009813846_100009817358 [0,2,0,0,0,0|1,0,0]=3 15026 B16R0.1182 COC(=O)CC(C)OCCCCCCCCCl 34a_100000033203_100009817358 [0,2,0,0,0,0|1,0,0]=3 15027 B16R0.1182 COC(=O)CC(C)OCCCCCCCCCl 7a_100000033203_100009817358 [0,2,0,0,0,0|1,0,0]=3 15028 B16R0.1182 COC(=O)CC(C)OCCCCCCCCN 34a_102515433106_100009817358 [0,2,0,0,0,0|1,0,0]=3 15029 B16R0.1182 COC(=O)CC(C)OCCCCCNCCN 34a_103619048469_100009817358 [0,2,0,0,0,0|2,0,0]=4 15030 B16R0.1182 COC(=O)CC(C)SCCCCCCCCO 62a_100000033203_100009817358 [0,2,0,0,0,0|1,0,0]=3 15031 B16R0.1182 COC(=O)CC(C)SCCCCCCCCO 62a_100009817358_100000033203 [0,2,0,0,0,0|1,0,0]=3 15032 B16R0.1182 COC(=O)CN(C)CCCCCCCCCO 2230a_100000198492_100009813782 [0,2,0,0,0,0|1,0,0]=3 15033 B16R0.1182 COC(=O)C[C@@H](O)CNCCCCCCCO 34a_100011996573_100000754131 [0,2,0,0,0,0|1,0,0]=3 15034 B16R0.1182 COC(=O)C[C@@H](O)CNCCCOCCCO 34a_100011310245_100000754131 [0,2,0,0,0,0|2,0,0]=4 15035 B16R0.1182 COC(=O)C[C@@H](O)COCCCCCCCBr 34a_100000760002_100000754131 [0,2,0,0,0,0|1,0,0]=3 15036 B16R0.1182 COC(=O)C[C@@H](O)COCCCCCCCBr 7a_100000760002_100000754131 [0,2,0,0,0,0|1,0,0]=3 15037 B16R0.1182 COC(=O)C[C@@H](O)COCCCCCCCN 34a_100011996573_100000754131 [0,2,0,0,0,0|1,0,0]=3 15038 B16R0.1182 COC(=O)C[C@@H](O)COCCCOCCCN 34a_100011310245_100000754131 [0,2,0,0,0,0|2,0,0]=4 15039 B16R0.1182 COC(=O)C[C@@H](O)CSCCCCCCC#N 62a_100000754131_100009813337 [0,2,0,0,0,0|1,0,1]=4 15040 B16R0.1182 COC(=O)C[C@@H](O)CSCCCCCCC#N 62a_100009813337_100000754131 [0,2,0,0,0,0|1,0,1]=4 15041 B16R0.1182 COC(=O)C[C@@H](O)CSCCCCCCCO 62a_100000754131_100000760002 [0,2,0,0,0,0|1,0,0]=3 15042 B16R0.1182 COC(=O)C[C@@H](O)CSCCCCCCCO 62a_100000760002_100000754131 [0,2,0,0,0,0|1,0,0]=3 15043 B16R0.1182 COCCCCCCOC[C@H](O)CC(=O)OC 34a_200012092642_100000754131 [0,2,0,0,0,0|1,0,0]=3 15044 B16R0.1182 COCCCCCCOC[C@H](O)CC(=O)OC 7a_200012092642_100000754131 [0,2,0,0,0,0|1,0,0]=3 15045 B16R0.1182 COCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100011998445 [0,2,0,0,0,0|1,0,1]=4 15046 B16R0.1182 COCCCCCCSCC(=O)CC(=O)OC 62a_100011998445_100000210525 [0,2,0,0,0,0|1,0,1]=4 15047 B16R0.1182 COCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011998445 [0,2,0,0,0,0|1,0,0]=3 15048 B16R0.1182 COCCCCCCSC[C@H](O)CC(=O)OC 62a_100011998445_100000754131 [0,2,0,0,0,0|1,0,0]=3 15049 B16R0.1182 COCCCOCCCOC(C)CC(=O)OC 34a_200011215475_100009817358 [0,2,0,0,0,0|2,0,0]=4 15050 B16R0.1182 COCCCOCCCOC(C)CC(=O)OC 7a_200011215475_100009817358 [0,2,0,0,0,0|2,0,0]=4 15051 B16R0.1182 COCCOCCCNC[C@H](O)CC(=O)OC 34a_100000206027_100000754131 [0,2,0,0,0,0|2,0,0]=4 15052 B16R0.1182 COCCOCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011216529 [0,2,0,0,0,0|2,0,0]=4 15053 B16R0.1182 COCCOCCCSC[C@H](O)CC(=O)OC 62a_100011216529_100000754131 [0,2,0,0,0,0|2,0,0]=4 15054 B16R0.1817 C#CCCCCCCC(=O)CCCC(=O)OC 1458a_100000034748_100011218270 [0,2,0,0,0,0|0,0,2]=4 15055 B16R0.1817 C#CCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100012276617 [0,2,0,0,0,0|0,0,2]=4 15056 B16R0.1817 C#CCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100012276617 [0,2,0,0,0,0|0,0,2]=4 15057 B16R0.1817 C=CCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100011215473 [0,2,0,0,0,0|0,0,2]=4 15058 B16R0.1817 C=CCCCCCCC(=O)CCCC(=O)OC 1458a_100011809334_100011218270 [0,2,0,0,0,0|0,0,2]=4 15059 B16R0.1817 C=CCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100011215473 [0,2,0,0,0,0|0,0,2]=4 15060 B16R0.1817 CCCCC/C=C/CC(=O)CCCC(=O)OC 1458a_100020675968_100011218270 [0,2,0,0,0,0|0,0,2]=4 15061 B16R0.1817 CCCCCC#CCC(=O)CCCC(=O)OC 1458a_100000239890_100009816472 [0,2,0,0,0,0|0,0,2]=4 15062 B16R0.1817 CCCCCC#CCN(C)CCCC(=O)OC 269982a_100000739225_100009816472 [0,2,0,0,0,0|0,0,2]=4 15063 B16R0.1817 CCCCCCC=CC(=O)CCCC(=O)OC 1458a_200015324643_100011218270 [0,2,0,0,0,0|0,0,2]=4 15064 B16R0.1817 CCCCCCCCC(=O)CCCC(=O)NC 1458a_100000210188_100000741757 [0,2,0,0,0,0|1,0,0]=3 15065 B16R0.1817 CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000210188_100011218270 [0,2,0,0,0,0|0,0,0]=2 15066 B16R0.1817 CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210759 [0,2,0,0,0,0|0,0,0]=2 15067 B16R0.1817 CCCCCCCCC(=O)CCOC(=O)NC 1458a_100000210188_200011997002 [0,2,0,0,0,0|1,0,1]=4 15068 B16R0.1817 CCCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210759 [0,2,0,0,0,0|0,0,1]=3 15069 B16R0.1817 CCCCCCCCC(=O)NCCC(=O)NC 11a_100000738227_100000210188 [0,2,0,0,0,0|1,0,1]=4 15070 B16R0.1817 CCCCCCCCC(=O)NCCC(=O)NC 240690a_100000738227_100000210188 [0,2,0,0,0,0|1,0,1]=4 15071 B16R0.1817 CCCCCCCCC(=O)NCCC(=O)NC 527a_100000738227_100000210188 [0,2,0,0,0,0|1,0,1]=4 15072 B16R0.1817 CCCCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000210188 [0,2,0,0,0,0|0,0,1]=3 15073 B16R0.1817 CCCCCCCCC(C)CNCC(=O)NC 270004a_100000693194_100011995885 [0,2,0,0,0,0|1,0,0]=3 15074 B16R0.1817 CCCCCCCCC(C)CNC[C@@H](C)OC 270004a_100020591295_100011995885 [0,2,0,0,0,0|1,0,1]=4 15075 B16R0.1817 CCCCCCCCC(C)COCC(=O)CC 7a_200012125181_100000747405 [0,2,0,0,0,0|1,0,0]=3 15076 B16R0.1817 CCCCCCCCC(C)COCC(=O)NC 34a_200012125181_100000183359 [0,2,0,0,0,0|1,0,0]=3 15077 B16R0.1817 CCCCCCCCC(C)COCC(=O)NC 7a_200012125181_100000183359 [0,2,0,0,0,0|1,0,0]=3 15078 B16R0.1817 CCCCCCCCC(C)COCC(=O)OC 34a_200012125181_100000747449 [0,2,0,0,0,0|0,0,0]=2 15079 B16R0.1817 CCCCCCCCC(C)COCC(=O)OC 7a_200012125181_100000747449 [0,2,0,0,0,0|0,0,0]=2 15080 B16R0.1817 CCCCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100011216694 [0,2,0,0,0,0|1,0,0]=3 15081 B16R0.1817 CCCCCCCCC(C)OCCC(=O)NC 34a_100000210740_100012179268 [0,2,0,0,0,0|1,0,0]=3 15082 B16R0.1817 CCCCCCCCC(C)OCCC(=O)NC 7a_100000210740_100000737683 [0,2,0,0,0,0|1,0,0]=3 15083 B16R0.1817 CCCCCCCCC(C)OCCC(=O)OC 34a_100000210740_100000742370 [0,2,0,0,0,0|0,0,0]=2 15084 B16R0.1817 CCCCCCCCC(C)OCCC(=O)OC 7a_100000210740_100000204255 [0,2,0,0,0,0|0,0,0]=2 15085 B16R0.1817 CCCCCCCCN(C)C/C=C/C(=O)OC 2230a_100000207567_100000742655 [0,2,0,0,0,0|0,0,2]=4 15086 B16R0.1817 CCCCCCCCN(C)C/C=C/C(=O)OC 269982a_100000207567_100000742655 [0,2,0,0,0,0|0,0,2]=4 15087 B16R0.1817 CCCCCCCCN(C)CCCC(=O)NC 2230a_100000207567_100000741757 [0,2,0,0,0,0|1,0,0]=3 15088 B16R0.1817 CCCCCCCCN(C)CCCC(=O)NC 269982a_100000207567_100000741757 [0,2,0,0,0,0|1,0,0]=3 15089 B16R0.1817 CCCCCCCCN(C)CCCC(=O)OC 2230a_100000207567_100011218270 [0,2,0,0,0,0|0,0,0]=2 15090 B16R0.1817 CCCCCCCCN(C)CCCC(=O)OC 269982a_100000207567_100011218270 [0,2,0,0,0,0|0,0,0]=2 15091 B16R0.1817 CCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210759 [0,2,0,0,0,0|0,0,0]=2 15092 B16R0.1817 CCCCCCCCN(C)CCOC(=O)NC 269982a_100000207567_200011997002 [0,2,0,0,0,0|2,0,0]=4 15093 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 11a_100000229938_100000239890 [0,2,0,0,0,0|0,0,1]=3 15094 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 1626a_100000229938_100000239890 [0,2,0,0,0,0|0,0,1]=3 15095 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 240690a_100000229938_100000239890 [0,2,0,0,0,0|0,0,1]=3 15096 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 527a_100000229938_100000239890 [0,2,0,0,0,0|0,0,1]=3 15097 B16R0.1817 CCCCCCCNC(=O)CSCC(=O)OC 11a_100000229938_100000191316 [0,2,0,0,0,0|1,0,1]=4 15098 B16R0.1817 CCCCCCCNC(=O)CSCC(=O)OC 1626a_100000229938_100000191316 [0,2,0,0,0,0|1,0,1]=4 15099 B16R0.1817 CCCCCCCNC(=O)CSCC(=O)OC 240690a_100000229938_100000191316 [0,2,0,0,0,0|1,0,1]=4 15100 B16R0.1817 CCCCCCNCC(=O)NCCC(=O)OC 2230a_100000210581_100000230212 [0,2,0,0,0,0|1,0,1]=4 15101 B16R0.1817 CCCCCCOCC(=O)NCCC(=O)OC 34a_100000210259_100000230212 [0,2,0,0,0,0|1,0,1]=4 15102 B16R0.1817 CCCCCCOCC(=O)NCCC(=O)OC 7a_100000210259_100000230212 [0,2,0,0,0,0|1,0,1]=4 15103 B16R0.1817 CCCCCCSCC(=O)NCCC(=O)OC 62a_100000210314_100000230212 [0,2,0,0,0,0|1,0,1]=4 15104 B16R0.1817 CCCCCCSCC(=O)NCCC(=O)OC 62a_100000230212_100000210757 [0,2,0,0,0,0|1,0,1]=4 15105 B16R0.1817 CCCCSCCNC(=O)CCCC(=O)OC 11a_100025743550_100000239890 [0,2,0,0,0,0|1,0,1]=4 15106 B16R0.1817 CCCCSCCNC(=O)CCCC(=O)OC 1626a_100025743550_100000239890 [0,2,0,0,0,0|1,0,1]=4 15107 B16R0.1817 CCCCSCCNC(=O)CCCC(=O)OC 240690a_100025743550_100000239890 [0,2,0,0,0,0|1,0,1]=4 15108 B16R0.1817 CCCCSCCNC(=O)CCCC(=O)OC 527a_100025743550_100000239890 [0,2,0,0,0,0|1,0,1]=4 15109 B16R0.1817 CCCOCCCNC(=O)CCCC(=O)OC 1626a_100011217757_100000239890 [0,2,0,0,0,0|1,0,1]=4 15110 B16R0.1817 CCCOCCCNC(=O)CCCC(=O)OC 240690a_100011217757_100000239890 [0,2,0,0,0,0|1,0,1]=4 15111 B16R0.1817 CCCOCCCNC(=O)CCCC(=O)OC 527a_100011217757_100000239890 [0,2,0,0,0,0|1,0,1]=4 15112 B16R0.1817 CCOCCOCCC(=O)CCCC(=O)OC 1458a_100000239890_100011211534 [0,2,0,0,0,0|1,0,1]=4 15113 B16R0.1817 CCOCCOCCN(C)CCCC(=O)OC 269982a_100000739225_100011211534 [0,2,0,0,0,0|2,0,0]=4 15114 B16R0.1817 CNC(=O)CCCC(=O)CCCCCCCO 1458a_100011219782_100000741757 [0,2,0,0,0,0|1,0,1]=4 15115 B16R0.1817 COC(=O)CCCC(=O)CCCCCCC#N 1458a_100000239890_100009813337 [0,2,0,0,0,0|0,0,2]=4 15116 B16R0.1817 COC(=O)CCCC(=O)CCCCCCCO 1458a_100000239890_100000760002 [0,2,0,0,0,0|0,0,1]=3 15117 B16R0.1817 COC(=O)CCCC(=O)CCCCCCCO 1458a_100011219782_100011218270 [0,2,0,0,0,0|0,0,1]=3 15118 B16R0.1817 COC(=O)CCCC(=O)NCCCCCCO 240690a_100000686447_100000239890 [0,2,0,0,0,0|1,0,1]=4 15119 B16R0.1817 COC(=O)CCCC(=O)NCCCCCCO 527a_100000686447_100000239890 [0,2,0,0,0,0|1,0,1]=4 15120 B16R0.1817 COC(=O)CCCN(C)CCCCCCC#N 269982a_100000739225_100009813337 [0,2,0,0,0,0|1,0,1]=4 15121 B16R0.1817 COC(=O)CCCN(C)CCCCCCCO 269982a_100000739225_100000760002 [0,2,0,0,0,0|1,0,0]=3 15122 B16R0.1817 COC(=O)CCNC(=O)CCCCCCCO 188690a_100000683876_100011219782 [0,2,0,0,0,0|1,0,1]=4 15123 B16R0.1817 COC(=O)CSCC(=O)CCCCCCCO 1458a_100000191316_100000760002 [0,2,0,0,0,0|1,0,1]=4 15124 B16R0.1817 COCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100011998445 [0,2,0,0,0,0|0,0,1]=3 15125 B16R0.1817 COCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100011998445 [0,2,0,0,0,0|1,0,1]=4 15126 B16R0.1817 COCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100011998445 [0,2,0,0,0,0|1,0,0]=3 15127 B16R0.1817 COCCCCCNC(=O)CCCC(=O)OC 11a_100000747528_100000239890 [0,2,0,0,0,0|1,0,1]=4 15128 B16R0.1817 COCCCCCNC(=O)CCCC(=O)OC 1626a_100000747528_100000239890 [0,2,0,0,0,0|1,0,1]=4 15129 B16R0.1817 COCCCCCNC(=O)CCCC(=O)OC 240690a_100000747528_100000239890 [0,2,0,0,0,0|1,0,1]=4 15130 B16R0.1817 COCCCCCNC(=O)CCCC(=O)OC 527a_100000747528_100000239890 [0,2,0,0,0,0|1,0,1]=4 15131 B16R0.1817 COCCOCCCC(=O)CCCC(=O)OC 1458a_100000239890_100011216529 [0,2,0,0,0,0|1,0,1]=4 15132 B16R0.1817 COCCOCCCN(C)CCCC(=O)OC 269982a_100000739225_100011216529 [0,2,0,0,0,0|2,0,0]=4 15133 B16R0.3257 C#CCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000731252 [0,2,0,0,0,0|0,0,2]=4 15134 B16R0.3257 C#CCCCC(=O)CCCCCCC(=O)OC 1458a_100000690238_100009815986 [0,2,0,0,0,0|0,0,2]=4 15135 B16R0.3257 C=CCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000757094 [0,2,0,0,0,0|0,0,2]=4 15136 B16R0.3257 C=CCCCC(=O)CCCCCCC(=O)OC 1458a_100000766728_100009815986 [0,2,0,0,0,0|0,0,2]=4 15137 B16R0.3257 CC/C=C/CC(=O)CCCCCCC(=O)OC 1458a_100016274230_100009815986 [0,2,0,0,0,0|0,0,2]=4 15138 B16R0.3257 CC/C=C\CC(=O)CCCCCCC(=O)OC 1458a_100000036694_100103147603 [0,2,0,0,0,0|0,0,2]=4 15139 B16R0.3257 CCC#CCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100009813939 [0,2,0,0,0,0|0,0,2]=4 15140 B16R0.3257 CCC#CCC(C)OCCCCCC(=O)OC 34a_200000035118_100009816466 [0,2,0,0,0,0|0,0,2]=4 15141 B16R0.3257 CCC#CCC(C)OCCCCCC(=O)OC 7a_200000035118_100009816466 [0,2,0,0,0,0|0,0,2]=4 15142 B16R0.3257 CCCC#CC(=O)CCCCCCC(=O)OC 1458a_200011218047_100009815986 [0,2,0,0,0,0|0,0,2]=4 15143 B16R0.3257 CCCC=CC(=O)CCCCCCC(=O)OC 1458a_100000212230_100009815986 [0,2,0,0,0,0|0,0,2]=4 15144 B16R0.3257 CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210326 [0,2,0,0,0,0|0,0,0]=2 15145 B16R0.3257 CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000212188_100009815986 [0,2,0,0,0,0|0,0,0]=2 15146 B16R0.3257 CCCCCC(=O)COCCCCC(=O)OC 34a_100000059025_200012276598 [0,2,0,0,0,0|0,0,1]=3 15147 B16R0.3257 CCCCCC(=O)COCCCCC(=O)OC 7a_100000059025_200012276598 [0,2,0,0,0,0|0,0,1]=3 15148 B16R0.3257 CCCCCC(=O)CSCCCCC(=O)OC 62a_100000204269_200012276598 [0,2,0,0,0,0|0,0,1]=3 15149 B16R0.3257 CCCCCC(=O)CSCCCCC(=O)OC 62a_200012276598_100000204269 [0,2,0,0,0,0|0,0,1]=3 15150 B16R0.3257 CCCCCC(=O)CSCCOCC(=O)OC 62a_100000090808_200012276598 [0,2,0,0,0,0|1,0,1]=4 15151 B16R0.3257 CCCCCC(=O)CSCCOCC(=O)OC 62a_200012276598_100000090808 [0,2,0,0,0,0|1,0,1]=4 15152 B16R0.3257 CCCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000212188 [0,2,0,0,0,0|0,0,1]=3 15153 B16R0.3257 CCCCCC(=O)NCCOCCC(=O)OC 188690a_100102954618_100000212188 [0,2,0,0,0,0|1,0,1]=4 15154 B16R0.3257 CCCCCC(C)NCCCCCC(=O)OC 2230a_100000211957_100009816466 [0,2,0,0,0,0|0,0,0]=2 15155 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 34a_100000074720_200011218191 [0,2,0,0,0,0|0,0,0]=2 15156 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 34a_100011215632_100009816466 [0,2,0,0,0,0|0,0,0]=2 15157 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 7a_100000074720_200011218191 [0,2,0,0,0,0|0,0,0]=2 15158 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 7a_100011215632_100009816466 [0,2,0,0,0,0|0,0,0]=2 15159 B16R0.3257 CCCCCC(C)SCCCCCC(=O)OC 62a_100009816466_200011218191 [0,2,0,0,0,0|0,0,0]=2 15160 B16R0.3257 CCCCCC(C)SCCCCCC(=O)OC 62a_200011218191_100009816466 [0,2,0,0,0,0|0,0,0]=2 15161 B16R0.3257 CCCCCN(C)CCCCCCC(=O)OC 2230a_100000223495_100009815986 [0,2,0,0,0,0|0,0,0]=2 15162 B16R0.3257 CCCCCN(C)CCCCCCC(=O)OC 269982a_100000223495_100009815986 [0,2,0,0,0,0|0,0,0]=2 15163 B16R0.3257 CCCCNC(=O)CCCCCCC(=O)OC 11a_100000102301_100000036694 [0,2,0,0,0,0|0,0,1]=3 15164 B16R0.3257 CCCCNC(=O)CCCCCCC(=O)OC 1626a_100000102301_100000036694 [0,2,0,0,0,0|0,0,1]=3 15165 B16R0.3257 CCCCNC(=O)CCCCCCC(=O)OC 240690a_100000102301_100000036694 [0,2,0,0,0,0|0,0,1]=3 15166 B16R0.3257 CCCCNC(=O)COCCCCC(=O)OC 34a_100000059025_100000182744 [0,2,0,0,0,0|1,0,1]=4 15167 B16R0.3257 CCCCNC(=O)COCCCCC(=O)OC 7a_100000059025_100000182744 [0,2,0,0,0,0|1,0,1]=4 15168 B16R0.3257 CCCCNC(=O)CSCCCCC(=O)OC 62a_100000182744_100000204269 [0,2,0,0,0,0|1,0,1]=4 15169 B16R0.3257 CCCCNC(=O)CSCCCCC(=O)OC 62a_100000204269_100000182744 [0,2,0,0,0,0|1,0,1]=4 15170 B16R0.3257 CCCCOC(=O)COCCCCC(=O)OC 34a_100000059025_100000211628 [0,2,0,0,0,0|1,0,1]=4 15171 B16R0.3257 CCCCOC(=O)COCCCCC(=O)OC 7a_100000059025_100000211628 [0,2,0,0,0,0|1,0,1]=4 15172 B16R0.3257 CCCCOC(=O)CSCCCCC(=O)OC 62a_100000204269_100000211628 [0,2,0,0,0,0|1,0,1]=4 15173 B16R0.3257 CCCCOC(=O)CSCCCCC(=O)OC 62a_100000211628_100000204269 [0,2,0,0,0,0|1,0,1]=4 15174 B16R0.3257 CCCNNC(=O)CCCCCCC(=O)OC 22a_100000740057_100000036694 [0,2,0,0,0,0|1,0,1]=4 15175 B16R0.3257 CCCOCC(=O)CCCCCCC(=O)OC 1458a_100000745993_100009815986 [0,2,0,0,0,0|0,0,1]=3 15176 B16R0.3257 CCCOCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000745993 [0,2,0,0,0,0|1,0,1]=4 15177 B16R0.3257 CCCSCC(=O)CCCCCCC(=O)OC 1458a_100000217233_100009815986 [0,2,0,0,0,0|0,0,1]=3 15178 B16R0.3257 CCCSCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000217233 [0,2,0,0,0,0|1,0,1]=4 15179 B16R0.3257 CCOCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011215890 [0,2,0,0,0,0|0,0,1]=3 15180 B16R0.3257 CCOCCC(=O)CCCCCCC(=O)OC 1458a_100000749530_100009815986 [0,2,0,0,0,0|0,0,1]=3 15181 B16R0.3257 CCOCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000749530 [0,2,0,0,0,0|1,0,1]=4 15182 B16R0.3257 CCSCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000757381 [0,2,0,0,0,0|0,0,1]=3 15183 B16R0.3257 CCSCCC(=O)CCCCCCC(=O)OC 1458a_100000230768_100009815986 [0,2,0,0,0,0|0,0,1]=3 15184 B16R0.3257 CCSCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000230768 [0,2,0,0,0,0|1,0,1]=4 15185 B16R0.3257 COC(=O)CCCCCCC(=O)CCCC#N 1458a_100000036694_100000211468 [0,2,0,0,0,0|0,0,2]=4 15186 B16R0.3257 COC(=O)CCCCCCC(=O)CCCC#N 1458a_100000075515_100009815986 [0,2,0,0,0,0|0,0,2]=4 15187 B16R0.3257 COC(=O)CCCCCCC(=O)CCCCF 1458a_100000036694_100000729493 [0,2,0,0,0,0|0,0,1]=3 15188 B16R0.3257 COC(=O)CCCCCCC(=O)CCCCO 1458a_100000036694_100000210776 [0,2,0,0,0,0|0,0,1]=3 15189 B16R0.3257 COC(=O)CCCCCCC(=O)CCCCO 1458a_100000695505_100009815986 [0,2,0,0,0,0|0,0,1]=3 15190 B16R0.3257 COC(=O)CCCCCCC(=O)CCCSC 1458a_100000173376_100009815986 [0,2,0,0,0,0|0,0,1]=3 15191 B16R0.3257 COC(=O)CCCCCCC(=O)COCCO 1458a_100000708028_100009815986 [0,2,0,0,0,0|1,0,1]=4 15192 B16R0.3257 COC(=O)CCCCCCC(=O)NCCCF 11a_100015189416_100000036694 [0,2,0,0,0,0|1,0,1]=4 15193 B16R0.3257 COC(=O)CCCCCCC(=O)NCCCF 1626a_100015189416_100000036694 [0,2,0,0,0,0|1,0,1]=4 15194 B16R0.3257 COC(=O)CCCCCCC(=O)NCCCF 240690a_100015189416_100000036694 [0,2,0,0,0,0|1,0,1]=4 15195 B16R0.3257 COC(=O)CCCCCCC(=O)NCCCO 240690a_100000182051_100000036694 [0,2,0,0,0,0|1,0,1]=4 15196 B16R0.3257 COC(=O)CCCCCCC(=O)NCCSC 11a_100020590264_100000036694 [0,2,0,0,0,0|1,0,1]=4 15197 B16R0.3257 COC(=O)CCCCCCC(=O)NCCSC 1626a_100020590264_100000036694 [0,2,0,0,0,0|1,0,1]=4 15198 B16R0.3257 COC(=O)CCCCCCC(=O)NCCSC 240690a_100020590264_100000036694 [0,2,0,0,0,0|1,0,1]=4 15199 B16R0.3257 COC(=O)CCCCCCN(C)CCCCO 2230a_100000717598_100009815986 [0,2,0,0,0,0|1,0,0]=3 15200 B16R0.3257 COC(=O)CCCCCCN(C)CCCCO 269982a_100000717598_100009815986 [0,2,0,0,0,0|1,0,0]=3 15201 B16R0.3257 COC(=O)CCCCCNC(=O)CCCCO 188690a_100000184999_100000695505 [0,2,0,0,0,0|1,0,1]=4 15202 B16R0.3257 COC(=O)CCCCCNC(=O)CCCSC 188690a_100000184999_100000173376 [0,2,0,0,0,0|1,0,1]=4 15203 B16R0.3257 COC(=O)CCCCOC[C@@H](N)CCCCN 34a_100016993712_100000204269 [0,2,0,0,0,0|1,0,0]=3 15204 B16R0.3257 COC(=O)COCCOC[C@@H](N)CCCCN 34a_100016993712_100000090808 [0,2,0,0,0,0|2,0,0]=4 15205 B16R0.3257 COCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000740836 [0,2,0,0,0,0|0,0,1]=3 15206 B16R0.3257 COCCCC(=O)CCCCCCC(=O)OC 1458a_100000741012_100009815986 [0,2,0,0,0,0|0,0,1]=3 15207 B16R0.3257 COCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000741012 [0,2,0,0,0,0|1,0,1]=4 15208 B16R0.3257 COCCCC(C)OCCCCCC(=O)OC 34a_200011539412_100009816466 [0,2,0,0,0,0|1,0,0]=3 15209 B16R0.3257 COCCCC(C)OCCCCCC(=O)OC 7a_200011539412_100009816466 [0,2,0,0,0,0|1,0,0]=3 15210 B16R0.3257 COCCCN(C)CCCCCCC(=O)OC 2230a_100000224831_100009815986 [0,2,0,0,0,0|1,0,0]=3 15211 B16R0.3257 COCCCN(C)CCCCCCC(=O)OC 269982a_100000224831_100009815986 [0,2,0,0,0,0|1,0,0]=3 15212 B16R0.3257 COCCNC(=O)CCCCCCC(=O)OC 1626a_100000209980_100000036694 [0,2,0,0,0,0|1,0,1]=4 15213 B16R0.3257 COCCNC(=O)CCCCCCC(=O)OC 240690a_100000209980_100000036694 [0,2,0,0,0,0|1,0,1]=4 15214 B16R0.3292 CCCCCCCCCCCCS(=O)(=O)NC 270084a_100102657272_100011216125 [0,2,0,0,0,0|2,0,0]=4 15215 B16R0.3292 CCCCCCCCCCCCS(=O)(=O)NC 274078a_100102657272_100011216125 [0,2,0,0,0,0|2,0,0]=4 15216 B16R0.3292 CCCCCCCCCCCNS(=O)(=O)CC 270084a_200011215754_100000211323 [0,2,0,0,0,0|2,0,0]=4 15217 B16R0.3292 CCCCCCCCCCCNS(=O)(=O)CC 274078a_200011215754_100000211323 [0,2,0,0,0,0|2,0,0]=4 15218 B16R0.3292 CCCCCCCCCCCNS(=O)(=O)CC 40a_200011215754_100000053943 [0,2,0,0,0,0|2,0,0]=4 15219 B16R0.3292 CCCCCCCCCCNCC(C)(C)OC 2230a_100000763424_100000210320 [0,2,0,0,0,0|1,0,1]=4 15220 B16R0.3292 CCCCCCCCCCNCC(C)(C)OC 34a_100000684558_100000701081 [0,2,0,0,0,0|1,0,1]=4 15221 B16R0.3292 CCCCCCCCCCOCC(C)(C)OC 34a_100000210711_100000701081 [0,2,0,0,0,0|1,0,1]=4 15222 B16R0.3292 CCCCCCCCCCSCC(C)(C)OC 62a_100000701081_100000210320 [0,2,0,0,0,0|1,0,1]=4 15223 B16R0.3292 CCCCCCCCCNCCS(=O)(=O)CC 2230a_100000212291_100000756660 [0,2,0,0,0,0|2,0,0]=4 15224 B16R0.3292 CCCCCCCCCNCCS(=O)(=O)CC 2230a_100000751051_100011214924 [0,2,0,0,0,0|2,0,0]=4 15225 B16R0.3292 CCCCCCCCCNCCS(=O)(=O)CC 34a_100000212291_100000756660 [0,2,0,0,0,0|2,0,0]=4 15226 B16R0.3292 CCCCCCCCCNCCS(=O)(=O)CC 34a_100000751051_100011214924 [0,2,0,0,0,0|2,0,0]=4 15227 B16R0.3292 CCCCCCCCCNCCS(=O)(=O)NC 2230a_100000710037_100011214924 [0,2,0,0,0,0|2,0,0]=4 15228 B16R0.3292 CCCCCCCCCNCCS(=O)(=O)NC 34a_100000710037_100011214924 [0,2,0,0,0,0|2,0,0]=4 15229 B16R0.3292 CCCCCCCCCOCCC(C)(C)OC 7a_100000699976_100000210328 [0,2,0,0,0,0|1,0,1]=4 15230 B16R0.3292 CCCCCCCCCOCCS(=O)(=O)CC 34a_100000210712_100000756660 [0,2,0,0,0,0|2,0,0]=4 15231 B16R0.3292 CCCCCCCCCOCCS(=O)(=O)CC 34a_200011216379_100011214924 [0,2,0,0,0,0|2,0,0]=4 15232 B16R0.3292 CCCCCCCCCOCCS(=O)(=O)CC 7a_100000210712_100000756660 [0,2,0,0,0,0|2,0,0]=4 15233 B16R0.3292 CCCCCCCCCOCCS(=O)(=O)CC 7a_200011216379_100000210328 [0,2,0,0,0,0|2,0,0]=4 15234 B16R0.3292 CCCCCCCCCSCCS(=O)(=O)CC 62a_100000756660_100000210670 [0,2,0,0,0,0|2,0,0]=4 15235 B16R0.6606 C#CCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100153394163 [0,2,0,0,0,0|0,0,2]=4 15236 B16R0.6606 C#CCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100153394163 [0,2,0,0,0,0|0,0,2]=4 15237 B16R0.6606 C=CCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100012355270 [0,2,0,0,0,0|0,0,2]=4 15238 B16R0.6606 C=CCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100012355270 [0,2,0,0,0,0|0,0,2]=4 15239 B16R0.6606 CCCCC#CCCCC(=O)CCC(=O)OC 1458a_100000187943_200000047210 [0,2,0,0,0,0|0,0,2]=4 15240 B16R0.6606 CCCCC#CCCCN(C)CCC(=O)OC 269982a_100025711912_200000047210 [0,2,0,0,0,0|0,0,2]=4 15241 B16R0.6606 CCCCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210670 [0,2,0,0,0,0|1,0,0]=3 15242 B16R0.6606 CCCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210670 [0,2,0,0,0,0|0,0,0]=2 15243 B16R0.6606 CCCCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100000210670 [0,2,0,0,0,0|2,0,0]=4 15244 B16R0.6606 CCCCCCCCCC(=O)CNC(=O)CC 1458a_100000194589_100000210670 [0,2,0,0,0,0|1,0,1]=4 15245 B16R0.6606 CCCCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210670 [0,2,0,0,0,0|0,0,1]=3 15246 B16R0.6606 CCCCCCCCCC(=O)NCC(=O)NC 11a_100000693194_100000210558 [0,2,0,0,0,0|1,0,1]=4 15247 B16R0.6606 CCCCCCCCCC(=O)NCC(=O)NC 240690a_100000693194_100000210558 [0,2,0,0,0,0|1,0,1]=4 15248 B16R0.6606 CCCCCCCCCC(=O)NCC(=O)NC 527a_100000693194_100000210558 [0,2,0,0,0,0|1,0,1]=4 15249 B16R0.6606 CCCCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000210558 [0,2,0,0,0,0|0,0,1]=3 15250 B16R0.6606 CCCCCCCCCC(=O)OCC(=O)CC 1458a_100000210414_200010990708 [0,2,0,0,0,0|1,0,1]=4 15251 B16R0.6606 CCCCCCCCCC(C)NCC(=O)NC 270004a_100000693194_100011215753 [0,2,0,0,0,0|1,0,0]=3 15252 B16R0.6606 CCCCCCCCCC(C)NC[C@@H](C)OC 270004a_100020591295_100011215753 [0,2,0,0,0,0|1,0,1]=4 15253 B16R0.6606 CCCCCCCCCC(C)OCC(=O)CC 7a_100011218016_100000747405 [0,2,0,0,0,0|1,0,0]=3 15254 B16R0.6606 CCCCCCCCCC(C)OCC(=O)NC 34a_100011218016_100000183359 [0,2,0,0,0,0|1,0,0]=3 15255 B16R0.6606 CCCCCCCCCC(C)OCC(=O)NC 7a_100011218016_100000183359 [0,2,0,0,0,0|1,0,0]=3 15256 B16R0.6606 CCCCCCCCCC(C)OCC(=O)OC 34a_100011218016_100000747449 [0,2,0,0,0,0|0,0,0]=2 15257 B16R0.6606 CCCCCCCCCC(C)OCC(=O)OC 7a_100011218016_100000747449 [0,2,0,0,0,0|0,0,0]=2 15258 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 2230a_100000232482_100000737683 [0,2,0,0,0,0|1,0,0]=3 15259 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100011214924 [0,2,0,0,0,0|1,0,0]=3 15260 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 269982a_100000232482_100000737683 [0,2,0,0,0,0|1,0,0]=3 15261 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100000210670 [0,2,0,0,0,0|1,0,0]=3 15262 B16R0.6606 CCCCCCCCCN(C)CCC(=O)OC 2230a_100000232482_100000204255 [0,2,0,0,0,0|0,0,0]=2 15263 B16R0.6606 CCCCCCCCCN(C)CCC(=O)OC 269982a_100000232482_100000204255 [0,2,0,0,0,0|0,0,0]=2 15264 B16R0.6606 CCCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210670 [0,2,0,0,0,0|0,0,0]=2 15265 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)NC 11a_100000229939_100011309844 [0,2,0,0,0,0|1,0,1]=4 15266 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)NC 1626a_100000229939_100011309844 [0,2,0,0,0,0|1,0,1]=4 15267 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)NC 240690a_100000229939_100011309844 [0,2,0,0,0,0|1,0,1]=4 15268 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)NC 527a_100000229939_100011309844 [0,2,0,0,0,0|1,0,1]=4 15269 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 11a_100000229939_100000187943 [0,2,0,0,0,0|0,0,1]=3 15270 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 1626a_100000229939_100000187943 [0,2,0,0,0,0|0,0,1]=3 15271 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 240690a_100000229939_100000187943 [0,2,0,0,0,0|0,0,1]=3 15272 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 527a_100000229939_100000187943 [0,2,0,0,0,0|0,0,1]=3 15273 B16R0.6606 CCCCCCCCNC(=O)CNC(=O)OC 11a_100000229939_100000215747 [0,2,0,0,0,0|1,0,1]=4 15274 B16R0.6606 CCCCCCCCNC(=O)CNC(=O)OC 1626a_100000229939_100000215747 [0,2,0,0,0,0|1,0,1]=4 15275 B16R0.6606 CCCCCCCCNC(=O)CNC(=O)OC 240690a_100000229939_100000215747 [0,2,0,0,0,0|1,0,1]=4 15276 B16R0.6606 CCCCCCCCNC(=O)CNC(=O)OC 527a_100000229939_100000215747 [0,2,0,0,0,0|1,0,1]=4 15277 B16R0.6606 CCCCCCCNCC(=O)CCC(=O)OC 2230a_100000229938_100000691467 [0,2,0,0,0,0|0,0,1]=3 15278 B16R0.6606 CCCCCCCNCC(=O)NCC(=O)OC 2230a_100000229938_100000182966 [0,2,0,0,0,0|1,0,1]=4 15279 B16R0.6606 CCCCCCCOCC(=O)CCC(=O)OC 34a_100000210272_100000691467 [0,2,0,0,0,0|0,0,1]=3 15280 B16R0.6606 CCCCCCCOCC(=O)CCC(=O)OC 7a_100000210272_100000691467 [0,2,0,0,0,0|0,0,1]=3 15281 B16R0.6606 CCCCCCCOCC(=O)NCC(=O)OC 34a_100000210272_100000182966 [0,2,0,0,0,0|1,0,1]=4 15282 B16R0.6606 CCCCCCCOCC(=O)NCC(=O)OC 7a_100000210272_100000182966 [0,2,0,0,0,0|1,0,1]=4 15283 B16R0.6606 CCCCCCCSCC(=O)CCC(=O)OC 62a_100000210614_100000691467 [0,2,0,0,0,0|0,0,1]=3 15284 B16R0.6606 CCCCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210316 [0,2,0,0,0,0|0,0,1]=3 15285 B16R0.6606 CCCCCCCSCC(=O)NCC(=O)OC 62a_100000182966_100000210316 [0,2,0,0,0,0|1,0,1]=4 15286 B16R0.6606 CCCCCCCSCC(=O)NCC(=O)OC 62a_100000210614_100000182966 [0,2,0,0,0,0|1,0,1]=4 15287 B16R0.6606 CCCCOCCCNC(=O)CCC(=O)OC 1626a_200000211371_100000187943 [0,2,0,0,0,0|1,0,1]=4 15288 B16R0.6606 CCCCOCCCNC(=O)CCC(=O)OC 240690a_200000211371_100000187943 [0,2,0,0,0,0|1,0,1]=4 15289 B16R0.6606 CCCCOCCCNC(=O)CCC(=O)OC 527a_200000211371_100000187943 [0,2,0,0,0,0|1,0,1]=4 15290 B16R0.6606 CCCCOCCOCC(=O)CCC(=O)OC 34a_100000210238_100000691467 [0,2,0,0,0,0|1,0,1]=4 15291 B16R0.6606 CCCCOCCOCC(=O)CCC(=O)OC 7a_100000210238_100000691467 [0,2,0,0,0,0|1,0,1]=4 15292 B16R0.6606 CCCCOCCSCC(=O)CCC(=O)OC 62a_100000691467_100000743108 [0,2,0,0,0,0|1,0,1]=4 15293 B16R0.6606 CCCCOCCSCC(=O)CCC(=O)OC 62a_100000743108_100000691467 [0,2,0,0,0,0|1,0,1]=4 15294 B16R0.6606 CCCCSCCNCC(=O)CCC(=O)OC 2230a_100025743550_100000691467 [0,2,0,0,0,0|1,0,1]=4 15295 B16R0.6606 CCCCSCCOCC(=O)CCC(=O)OC 34a_200000230436_100000691467 [0,2,0,0,0,0|1,0,1]=4 15296 B16R0.6606 CCCCSCCOCC(=O)CCC(=O)OC 7a_200000230436_100000691467 [0,2,0,0,0,0|1,0,1]=4 15297 B16R0.6606 CCCOCCCNCC(=O)CCC(=O)OC 2230a_100011217757_100000691467 [0,2,0,0,0,0|1,0,1]=4 15298 B16R0.6606 CCCOCCCNCC(=O)CCC(=O)OC 34a_100011217757_100000691467 [0,2,0,0,0,0|1,0,1]=4 15299 B16R0.6606 CNC(=O)CCC(=O)CCCCCCCCO 1458a_100011309844_100000033203 [0,2,0,0,0,0|1,0,1]=4 15300 B16R0.6606 CNC(=O)CCN(C)CCCCCCCCO 2230a_100000750875_100000033203 [0,2,0,0,0,0|2,0,0]=4 15301 B16R0.6606 CNC(=O)CCN(C)CCCCCCCCO 269982a_100000750875_100000033203 [0,2,0,0,0,0|2,0,0]=4 15302 B16R0.6606 CNCCCCCOCC(=O)CCC(=O)OC 34a_100000722520_100000691467 [0,2,0,0,0,0|1,0,1]=4 15303 B16R0.6606 COC(=O)CCC(=O)CCCCCCCCO 1458a_100000187943_100000033203 [0,2,0,0,0,0|0,0,1]=3 15304 B16R0.6606 COC(=O)CCC(=O)CNCCCCCCO 2230a_100000686447_100000691467 [0,2,0,0,0,0|1,0,1]=4 15305 B16R0.6606 COC(=O)CCC(=O)CNCCCCCCO 34a_100000686447_100000691467 [0,2,0,0,0,0|1,0,1]=4 15306 B16R0.6606 COC(=O)CCC(=O)COCCCCCCBr 34a_100011215345_100000691467 [0,2,0,0,0,0|1,0,1]=4 15307 B16R0.6606 COC(=O)CCC(=O)COCCCCCCBr 7a_100011215345_100000691467 [0,2,0,0,0,0|1,0,1]=4 15308 B16R0.6606 COC(=O)CCC(=O)COCCCCCCCl 34a_100000766143_100000691467 [0,2,0,0,0,0|1,0,1]=4 15309 B16R0.6606 COC(=O)CCC(=O)COCCCCCCCl 7a_100000766143_100000691467 [0,2,0,0,0,0|1,0,1]=4 15310 B16R0.6606 COC(=O)CCC(=O)COCCCCCCF 34a_100000732779_100000691467 [0,2,0,0,0,0|1,0,1]=4 15311 B16R0.6606 COC(=O)CCC(=O)COCCCCCCF 7a_100000732779_100000691467 [0,2,0,0,0,0|1,0,1]=4 15312 B16R0.6606 COC(=O)CCC(=O)COCCCCCCN 34a_100000686447_100000691467 [0,2,0,0,0,0|1,0,1]=4 15313 B16R0.6606 COC(=O)CCC(=O)CSCCCCCCF 62a_100000691467_100015922095 [0,2,0,0,0,0|1,0,1]=4 15314 B16R0.6606 COC(=O)CCC(=O)CSCCCCCCF 62a_100015922095_100000691467 [0,2,0,0,0,0|1,0,1]=4 15315 B16R0.6606 COC(=O)CCC(=O)CSCCCCCCO 62a_100000691467_100000766143 [0,2,0,0,0,0|1,0,1]=4 15316 B16R0.6606 COC(=O)CCC(=O)CSCCCCCCO 62a_100000766143_100000691467 [0,2,0,0,0,0|1,0,1]=4 15317 B16R0.6606 COC(=O)CCC(=O)NCCCCCCCO 240690a_100011996573_100000187943 [0,2,0,0,0,0|1,0,1]=4 15318 B16R0.6606 COC(=O)CCN(C)CCCCCCCCO 269982a_100025711912_100000033203 [0,2,0,0,0,0|1,0,0]=3 15319 B16R0.6606 COC(=O)CNC(=O)CCCCCCCCO 188690a_100000185156_100000015970 [0,2,0,0,0,0|1,0,1]=4 15320 B16R0.6606 COC(=O)NCC(=O)CCCCCCCCO 1458a_100000215747_100000033203 [0,2,0,0,0,0|1,0,1]=4 15321 B16R0.6606 COCCCCCNCC(=O)CCC(=O)OC 2230a_100000747528_100000691467 [0,2,0,0,0,0|1,0,1]=4 15322 B16R0.6606 COCCCCCNCC(=O)CCC(=O)OC 34a_100000747528_100000691467 [0,2,0,0,0,0|1,0,1]=4 15323 B16R0.11 CCCCC(C)CCCCOCC(=O)C(=O)C 34a_200011021034_100011261029 [0,2,0,0,0,0|2,0,0]=4 15324 B16R0.11 CCCCC(C)CCCCOCC(=O)C(C)C 34a_200011021034_100000753385 [0,2,0,0,0,0|2,0,0]=4 15325 B16R0.11 CCCCC(C)CCCCOCC(=O)C(C)C 7a_200011021034_100000753385 [0,2,0,0,0,0|2,0,0]=4 15326 B16R0.11 CCCCC(C)CCCCOCC(=O)N(C)C 34a_200011021034_100000692301 [0,2,0,0,0,0|2,0,0]=4 15327 B16R0.11 CCCCC(C)CCCCOCC(=O)N(C)C 7a_200011021034_100000692301 [0,2,0,0,0,0|2,0,0]=4 15328 B16R0.11 CCCCC(C)COCCCCC(=O)N(C)C 34a_100011995851_100000752486 [0,2,0,0,0,0|2,0,0]=4 15329 B16R0.11 CCCCC(C)COCCCCC(=O)N(C)C 7a_100011995851_100000752486 [0,2,0,0,0,0|2,0,0]=4 15330 B16R0.11 CCCC[C@H](N)COCCCCC(=O)N(C)C 34a_100011934283_100000752486 [0,2,0,0,0,0|2,0,0]=4 15331 B16R0.67 C=C(C)C(=O)N(C)CCCCCCCCCC 11a_100000207566_100000185857 [0,2,0,0,0,0|2,0,0]=4 15332 B16R0.67 C=C(C)C(=O)N(C)CCCCCCCCCC 1626a_100000207566_100000185857 [0,2,0,0,0,0|2,0,0]=4 15333 B16R0.67 CCCCCCCCCCC(=O)C(=O)N(C)C 1458a_100011218876_100000210319 [0,2,0,0,0,0|1,0,1]=4 15334 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)C 11a_100000207566_100000210198 [0,2,0,0,0,0|2,0,0]=4 15335 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)C 1626a_100000207566_100000210198 [0,2,0,0,0,0|2,0,0]=4 15336 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)C 240690a_100000207566_100000210198 [0,2,0,0,0,0|2,0,0]=4 15337 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)C 527a_100000207566_100000210198 [0,2,0,0,0,0|2,0,0]=4 15338 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)F 11a_100000207566_100000062450 [0,2,0,0,0,0|2,0,0]=4 15339 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)F 1626a_100000207566_100000062450 [0,2,0,0,0,0|2,0,0]=4 15340 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)F 240690a_100000207566_100000062450 [0,2,0,0,0,0|2,0,0]=4 15341 B16R0.67 CCCCCCCCCCN(C)C(=O)C(C)F 527a_100000207566_100000062450 [0,2,0,0,0,0|2,0,0]=4 15342 B16R0.67 CCCCCCCCCCN(C)C(=O)[C@@H](C)O 240690a_100000207566_100000717761 [0,2,0,0,0,0|2,0,0]=4 15343 B16R0.67 CCCCCCCCCCN(C)C(=O)[C@H](C)O 1626a_100000207566_217856618621 [0,2,0,0,0,0|2,0,0]=4 15344 B16R0.67 CCCCCCCCCCN(C)C(=O)[C@H](C)O 240690a_100000207566_217856618621 [0,2,0,0,0,0|2,0,0]=4 15345 B16R0.67 CCCCCCCCCNC(C)C(=O)C(C)C 2230a_100000212291_100009893295 [0,2,0,0,0,0|2,0,0]=4 15346 B16R0.67 CCCCCCCCCNC(C)C(=O)N(C)C 2230a_100000212291_100000209910 [0,2,0,0,0,0|2,0,0]=4 15347 B16R0.67 CCCCCCCCCN[C@@H](C)C(=O)N(C)C 2230a_100000697320_100011214924 [0,2,0,0,0,0|2,0,0]=4 15348 B16R0.67 CCCCCCCCCN[C@@H](C)C(=O)N(C)C 34a_100000697320_100011214924 [0,2,0,0,0,0|2,0,0]=4 15349 B16R0.67 CCCCCCCCCOC(C)C(=O)C(C)C 7a_100000210712_100009893295 [0,2,0,0,0,0|2,0,0]=4 15350 B16R0.67 CCCCCCCCCOC(C)C(=O)N(C)C 7a_100000210712_100000209910 [0,2,0,0,0,0|2,0,0]=4 15351 B16R0.67 CCCCCCCCCSC(C)C(=O)C(C)C 62a_100009893295_100000210670 [0,2,0,0,0,0|2,0,0]=4 15352 B16R0.67 CCCCCCCCCSC(C)C(=O)N(C)C 62a_100000209910_100000210670 [0,2,0,0,0,0|2,0,0]=4 15353 B16R0.69 CCCCCCCCC(=O)CCC(=O)N(C)C 1458a_100011200748_100000210759 [0,2,0,0,0,0|1,0,1]=4 15354 B16R0.69 CCCCCCCCC(C)NCC(=O)N(C)C 270004a_100015183351_100011216694 [0,2,0,0,0,0|2,0,0]=4 15355 B16R0.69 CCCCCCCCC(C)OCC(=O)C(=O)C 34a_100000210740_100011261029 [0,2,0,0,0,0|2,0,0]=4 15356 B16R0.69 CCCCCCCCC(C)OCC(=O)C(C)C 34a_100000210740_100000753385 [0,2,0,0,0,0|2,0,0]=4 15357 B16R0.69 CCCCCCCCC(C)OCC(=O)C(C)C 7a_100000210740_100000753385 [0,2,0,0,0,0|2,0,0]=4 15358 B16R0.69 CCCCCCCCC(C)OCC(=O)N(C)C 34a_100000210740_100000692301 [0,2,0,0,0,0|2,0,0]=4 15359 B16R0.69 CCCCCCCCC(C)OCC(=O)N(C)C 7a_100000210740_100000692301 [0,2,0,0,0,0|2,0,0]=4 15360 B16R0.69 CCCCCCCCN(C)CCC(=O)N(C)C 2230a_100000207567_100000737620 [0,2,0,0,0,0|2,0,0]=4 15361 B16R0.69 CCCCCCCCN(C)CCC(=O)N(C)C 269982a_100000207567_100000737620 [0,2,0,0,0,0|2,0,0]=4 15362 B16R0.112 CCCCCCCC(=O)CCCC(=O)N(C)C 1458a_100000211969_100000737642 [0,2,0,0,0,0|1,0,1]=4 15363 B16R0.112 CCCCCCCC(C)NCCC(=O)N(C)C 2230a_100000738053_200011218727 [0,2,0,0,0,0|2,0,0]=4 15364 B16R0.112 CCCCCCCC(C)NCCC(=O)N(C)C 270004a_100000738053_100000210596 [0,2,0,0,0,0|2,0,0]=4 15365 B16R0.112 CCCCCCCC(C)OCCC(=O)N(C)C 34a_200000747469_200011218727 [0,2,0,0,0,0|2,0,0]=4 15366 B16R0.112 CCCCCCCC(C)OCCC(=O)N(C)C 7a_200011215852_100000737620 [0,2,0,0,0,0|2,0,0]=4 15367 B16R0.112 CCCCCCCC(C)SCCC(=O)N(C)C 62a_100000737620_200011218727 [0,2,0,0,0,0|2,0,0]=4 15368 B16R0.112 CCCCCCCC(C)SCCC(=O)N(C)C 62a_200011218727_100000737620 [0,2,0,0,0,0|2,0,0]=4 15369 B16R0.112 CCCCCCCN(C)CCCC(=O)N(C)C 2230a_100000228206_100000737642 [0,2,0,0,0,0|2,0,0]=4 15370 B16R0.112 CCCCCCCN(C)CCCC(=O)N(C)C 269982a_100000228206_100000737642 [0,2,0,0,0,0|2,0,0]=4 15371 B16R0.167 C=C(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000185857_100010282707 [0,2,0,0,0,0|0,0,2]=4 15372 B16R0.167 CCC(C)CCCCCOCCC(=O)N(C)C 7a_200000035636_100000737620 [0,2,0,0,0,0|2,0,0]=4 15373 B16R0.167 CCC(C)CCCOCCCCC(=O)N(C)C 7a_100011216074_100000752486 [0,2,0,0,0,0|2,0,0]=4 15374 B16R0.167 COC(=O)CCCCCCCCC(=O)C(C)C 1458a_100000036616_100000210206 [0,2,0,0,0,0|0,0,1]=3 15375 B16R0.167 COC(=O)CCCCCCCCC(=O)C(C)C 1458a_100000210198_100010282707 [0,2,0,0,0,0|0,0,1]=3 15376 B16R0.167 COC(=O)CCCCCCCCC(=O)C(C)F 1458a_100000062450_100010282707 [0,2,0,0,0,0|0,0,1]=3 15377 B16R0.167 COC(=O)CCCCCCCCC(=O)C(O)O 1458a_100000233687_100010282707 [0,2,0,0,0,0|1,0,1]=4 15378 B16R0.167 COC(=O)CCCCCCCCC(=O)N(C)C 11a_100102631434_100000036616 [0,2,0,0,0,0|1,0,1]=4 15379 B16R0.167 COC(=O)CCCCCCCCC(=O)N(C)C 1626a_100102631434_100000036616 [0,2,0,0,0,0|1,0,1]=4 15380 B16R0.167 COC(=O)CCCCCCCCC(=O)N(C)C 240690a_100102631434_100000036616 [0,2,0,0,0,0|1,0,1]=4 15381 B16R0.167 COC(=O)CCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100010282707 [0,2,0,0,0,0|0,0,1]=3 15382 B16R0.167 COC(=O)CCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100010282707 [0,2,0,0,0,0|0,0,1]=3 15383 B16R0.167 COC(=O)CCCCCCCCN(C)C(C)C 269982a_200000211004_100010282707 [0,2,0,0,0,0|1,0,0]=3 15384 B16R0.167 COC(=O)CCCCCCCNC(=O)C(C)C 188690a_100000687944_100000210198 [0,2,0,0,0,0|1,0,1]=4 15385 B16R0.167 COC(=O)CCCCCCCNC(=O)C(C)F 188690a_100000687944_100000062450 [0,2,0,0,0,0|1,0,1]=4 15386 B16R0.167 COC(=O)CCCCCCCNC(=O)[C@@H](C)O 188690a_100000687944_100000717761 [0,2,0,0,0,0|1,0,1]=4 15387 B16R0.167 COC(=O)CCCCCCCNC(=O)[C@H](C)O 188690a_100000687944_217856618621 [0,2,0,0,0,0|1,0,1]=4 15388 B16R0.167 COC(=O)CCCCCCCNC(C)C(C)C 2230a_100000211541_100010004213 [0,2,0,0,0,0|1,0,0]=3 15389 B16R0.167 COC(=O)CCCCCCCOC(C)C(=O)C 34a_100000212229_100010004213 [0,2,0,0,0,0|1,0,1]=4 15390 B16R0.167 COC(=O)CCCCCCCOC(C)C(=O)C 7a_100011022521_100000179758 [0,2,0,0,0,0|1,0,1]=4 15391 B16R0.167 COC(=O)CCCCCCCOC(C)C(C)C 7a_100000748068_100010004213 [0,2,0,0,0,0|1,0,0]=3 15392 B16R0.167 COC(=O)CCCCCCCSC(C)C(=O)C 62a_100009814033_100010004213 [0,2,0,0,0,0|1,0,1]=4 15393 B16R0.167 COC(=O)CCCCCCCSC(C)C(=O)C 62a_100010004213_100009814033 [0,2,0,0,0,0|1,0,1]=4 15394 B16R0.167 COC(=O)CCCCCCNCC(O)C(C)C 2230a_100000759067_100009815986 [0,2,0,0,0,0|1,0,0]=3 15395 B16R0.167 COC(=O)CCCCCCNCC(O)C(C)C 34a_100000759067_100009815986 [0,2,0,0,0,0|1,0,0]=3 15396 B16R0.167 COC(=O)CCCCCCOCC(=O)C(C)C 34a_100009863599_100000753385 [0,2,0,0,0,0|1,0,1]=4 15397 B16R0.167 COC(=O)CCCCCCOCC(=O)C(C)C 7a_100009863599_100000753385 [0,2,0,0,0,0|1,0,1]=4 15398 B16R0.167 COC(=O)CCCCCCOCC(C)C(=O)C 34a_100000032740_100009815986 [0,2,0,0,0,0|1,0,1]=4 15399 B16R0.167 COC(=O)CCCCCCOCC(C)C(=O)C 7a_100000032740_100009815986 [0,2,0,0,0,0|1,0,1]=4 15400 B16R0.167 COC(=O)CCCCCCOC[C@H](N)C(C)C 34a_100011830312_100009815986 [0,2,0,0,0,0|1,0,0]=3 15401 B16R0.167 COC(=O)CCCCCCSCC(=O)C(C)C 62a_100000753385_100009815986 [0,2,0,0,0,0|1,0,1]=4 15402 B16R0.167 COC(=O)CCCCCCSCC(=O)C(C)C 62a_100009815986_100000753385 [0,2,0,0,0,0|1,0,1]=4 15403 B16R0.167 COC(=O)CCCCCOCCC(N)C(C)C 34a_100161115045_100009816466 [0,2,0,0,0,0|1,0,0]=3 15404 B16R0.277 CC(C)(C)C(=O)CCCCCCCCCCO 1458a_106744555173_100009813290 [0,2,0,0,0,0|2,0,0]=4 15405 B16R0.277 CC(C)(F)C(=O)CCCCCCCCCCO 1458a_100000765255_100009813290 [0,2,0,0,0,0|2,0,0]=4 15406 B16R0.277 CC(C)(O)C(=O)CCCCCCCCCCO 1458a_100000242741_100009813290 [0,2,0,0,0,0|2,0,0]=4 15407 B16R0.277 CCCCCCCCCCCC(=O)C(C)(C)C 1458a_106744555173_100011215454 [0,2,0,0,0,0|1,0,0]=3 15408 B16R0.277 CCCCCCCCCCCC(=O)C(C)(C)F 1458a_100000765255_100011215454 [0,2,0,0,0,0|1,0,0]=3 15409 B16R0.277 CCCCCCCCCCCC(=O)C(C)(C)O 1458a_100000242741_100011215454 [0,2,0,0,0,0|1,0,0]=3 15410 B16R0.277 CCCCCCCCCCCC(=O)C(F)(F)F 1458a_100000210736_200000243211 [0,2,0,0,0,0|2,0,0]=4 15411 B16R0.277 CCCCCCCCCCCC(=O)C(F)(F)F 1458a_100015355933_100011215454 [0,2,0,0,0,0|2,0,0]=4 15412 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)C 11a_100000684558_106744555173 [0,2,0,0,0,0|2,0,0]=4 15413 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)C 1626a_100000684558_106744555173 [0,2,0,0,0,0|2,0,0]=4 15414 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)C 240690a_100000684558_106744555173 [0,2,0,0,0,0|2,0,0]=4 15415 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)C 527a_100000684558_106744555173 [0,2,0,0,0,0|2,0,0]=4 15416 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)F 11a_100000684558_100000765255 [0,2,0,0,0,0|2,0,0]=4 15417 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)F 1626a_100000684558_100000765255 [0,2,0,0,0,0|2,0,0]=4 15418 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)F 240690a_100000684558_100000765255 [0,2,0,0,0,0|2,0,0]=4 15419 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)F 527a_100000684558_100000765255 [0,2,0,0,0,0|2,0,0]=4 15420 B16R0.277 CCCCCCCCCCNC(=O)C(C)(C)O 240690a_100000684558_100000242741 [0,2,0,0,0,0|2,0,0]=4 15421 B16R0.277 CCCCCCCCCCNC(=O)C(C)(F)F 11a_100000684558_100000042251 [0,2,0,0,0,0|2,0,0]=4 15422 B16R0.277 CCCCCCCCCCNC(=O)C(C)(F)F 1626a_100000684558_100000042251 [0,2,0,0,0,0|2,0,0]=4 15423 B16R0.277 CCCCCCCCCCNC(=O)C(C)(F)F 240690a_100000684558_100000042251 [0,2,0,0,0,0|2,0,0]=4 15424 B16R0.277 CCCCCCCCCCNC(=O)C(C)(F)F 527a_100000684558_100000042251 [0,2,0,0,0,0|2,0,0]=4 15425 B16R0.277 CCCCCCCCCNCC(=O)C(C)(C)C 34a_100000212291_100000229897 [0,2,0,0,0,0|2,0,0]=4 15426 B16R0.277 CCCCCCCCCOCC(=O)C(C)(C)C 34a_100000210712_100000229897 [0,2,0,0,0,0|2,0,0]=4 15427 B16R0.277 CCCCCCCCCOCC(=O)C(C)(C)C 34a_200011592769_100011214924 [0,2,0,0,0,0|2,0,0]=4 15428 B16R0.277 CCCCCCCCCOCC(=O)C(C)(C)C 7a_100000210712_100000210923 [0,2,0,0,0,0|2,0,0]=4 15429 B16R0.277 CCCCCCCCCOCC(=O)C(C)(C)C 7a_200011592769_100000210328 [0,2,0,0,0,0|2,0,0]=4 15430 B16R0.277 CCCCCCCCCSCC(=O)C(C)(C)C 62a_100000210923_100000210670 [0,2,0,0,0,0|2,0,0]=4 15431 B16R0.808 CCCC(C)CCCOCCCC(=O)N(C)C 7a_100011713154_100000737642 [0,2,0,0,0,0|2,0,0]=4 15432 B16R0.808 CCCC(C)CCOCCCCC(=O)N(C)C 34a_100011217855_100000752486 [0,2,0,0,0,0|2,0,0]=4 15433 B16R0.808 CCCC(C)CCOCCCCC(=O)N(C)C 7a_100011217855_100000752486 [0,2,0,0,0,0|2,0,0]=4 15434 B16R0.808 CCC[C@H](N)CCOCCCCC(=O)N(C)C 34a_100015193777_100000752486 [0,2,0,0,0,0|2,0,0]=4 15435 B16R0.1191 CCCCCCCCCC(=O)CC(=O)C(=O)C 1458a_100000210558_100011261029 [0,2,0,0,0,0|1,0,1]=4 15436 B16R0.1191 CCCCCCCCCC(=O)CC(=O)C(C)C 1458a_100000210558_100000753385 [0,2,0,0,0,0|1,0,1]=4 15437 B16R0.1191 CCCCCCCCCC(=O)CC(=O)N(C)C 1458a_100000210558_100000185267 [0,2,0,0,0,0|1,0,1]=4 15438 B16R0.1191 CCCCCCCCCC(O)CC(=O)N(C)C 1626a_100102631434_200012339438 [0,2,0,0,0,0|1,0,0]=3 15439 B16R0.1191 CCCCCCCCCC(O)CC(=O)N(C)C 240690a_100102631434_200012339438 [0,2,0,0,0,0|1,0,0]=3 15440 B16R0.1191 CCCCCCCCCN(C)CC(=O)C(=O)C 269982a_100000232482_100011261029 [0,2,0,0,0,0|2,0,0]=4 15441 B16R0.1191 CCCCCCCCCN(C)CC(=O)C(C)C 2230a_100000232482_100000753385 [0,2,0,0,0,0|2,0,0]=4 15442 B16R0.1191 CCCCCCCCCN(C)CC(=O)C(C)C 269982a_100000232482_100000753385 [0,2,0,0,0,0|2,0,0]=4 15443 B16R0.1191 CCCCCCCCCN(C)CC(=O)N(C)C 2230a_100000185065_100011214924 [0,2,0,0,0,0|2,0,0]=4 15444 B16R0.1191 CCCCCCCCCN(C)CC(=O)N(C)C 2230a_100000232482_100000185267 [0,2,0,0,0,0|2,0,0]=4 15445 B16R0.1191 CCCCCCCCCN(C)CC(=O)N(C)C 269982a_100000232482_100000185267 [0,2,0,0,0,0|2,0,0]=4 15446 B16R0.2265 CC(=O)C(=O)COCCCCCCCC(C)C 34a_200000210741_100011261029 [0,2,0,0,0,0|2,0,0]=4 15447 B16R0.2265 CC(C)CCCCCCCOCC(=O)C(C)C 34a_200000210741_100000753385 [0,2,0,0,0,0|2,0,0]=4 15448 B16R0.2265 CC(C)CCCCCCCOCC(=O)C(C)C 7a_200000210741_100000753385 [0,2,0,0,0,0|2,0,0]=4 15449 B16R0.2265 CC(C)CCCCCCCOCC(=O)N(C)C 34a_200000210741_100000692301 [0,2,0,0,0,0|2,0,0]=4 15450 B16R0.2265 CC(C)CCCCCCCOCC(=O)N(C)C 7a_200000210741_100000692301 [0,2,0,0,0,0|2,0,0]=4 15451 B16R0.2265 CC(C)CCCCCCNCCC(=O)N(C)C 2230a_100000211014_100000737620 [0,2,0,0,0,0|2,0,0]=4 15452 B16R0.2265 CC(C)CCCCCNCCCC(=O)N(C)C 2230a_100011290863_100000737642 [0,2,0,0,0,0|2,0,0]=4 15453 B16R0.2265 CC(C)CCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210682 [0,2,0,0,0,0|2,0,0]=4 15454 B16R0.2265 CC(C)CCCCCOCCCC(=O)N(C)C 7a_100011995859_100000737642 [0,2,0,0,0,0|2,0,0]=4 15455 B16R0.2265 CC(C)CCCCCSCCCC(=O)N(C)C 62a_100000210682_100000737642 [0,2,0,0,0,0|2,0,0]=4 15456 B16R0.2265 CC(C)CCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210682 [0,2,0,0,0,0|2,0,0]=4 15457 B16R0.2265 CC(C)CCCCOCCCCC(=O)N(C)C 34a_100011214890_100000752486 [0,2,0,0,0,0|2,0,0]=4 15458 B16R0.2265 CC(C)CCCCOCCCCC(=O)N(C)C 7a_100011214890_100000752486 [0,2,0,0,0,0|2,0,0]=4 15459 B16R0.2265 CC(C)CCCCSCCCCC(=O)N(C)C 62a_100000752486_100011216152 [0,2,0,0,0,0|2,0,0]=4 15460 B16R0.2265 CC(C)CCCCSCCCCC(=O)N(C)C 62a_100011216152_100000752486 [0,2,0,0,0,0|2,0,0]=4 15461 B16R0.3261 CCCCCC(C)OCCCCC(=O)N(C)C 34a_100011215632_100000752486 [0,2,0,0,0,0|2,0,0]=4 15462 B16R0.3261 CCCCCC(C)OCCCCC(=O)N(C)C 7a_100011215632_100000752486 [0,2,0,0,0,0|2,0,0]=4 15463 B16R0.3261 CCCCCC(C)SCCCCC(=O)N(C)C 62a_100000752486_200011218191 [0,2,0,0,0,0|2,0,0]=4 15464 B16R0.3261 CCCCCC(C)SCCCCC(=O)N(C)C 62a_200011218191_100000752486 [0,2,0,0,0,0|2,0,0]=4 15465 B16R0.3281 CCCCCCC(=O)CCCCC(=O)N(C)C 1458a_100102632555_100000752486 [0,2,0,0,0,0|1,0,1]=4 15466 B16R0.3281 CCCCCCC(C)CCOCC(=O)C(=O)C 34a_200011024964_100011261029 [0,2,0,0,0,0|2,0,0]=4 15467 B16R0.3281 CCCCCCC(C)CCOCC(=O)C(C)C 34a_200011024964_100000753385 [0,2,0,0,0,0|2,0,0]=4 15468 B16R0.3281 CCCCCCC(C)CCOCC(=O)C(C)C 7a_200011024964_100000753385 [0,2,0,0,0,0|2,0,0]=4 15469 B16R0.3281 CCCCCCC(C)CCOCC(=O)N(C)C 34a_200011024964_100000692301 [0,2,0,0,0,0|2,0,0]=4 15470 B16R0.3281 CCCCCCC(C)CCOCC(=O)N(C)C 7a_200011024964_100000692301 [0,2,0,0,0,0|2,0,0]=4 15471 B16R0.3281 CCCCCCC(C)NCCCC(=O)N(C)C 2230a_100000210919_100000737642 [0,2,0,0,0,0|2,0,0]=4 15472 B16R0.3281 CCCCCCC(C)NCCCC(=O)N(C)C 2230a_200000744827_100011215978 [0,2,0,0,0,0|2,0,0]=4 15473 B16R0.3281 CCCCCCC(C)NCCCC(=O)N(C)C 270004a_200000744827_100000210826 [0,2,0,0,0,0|2,0,0]=4 15474 B16R0.3281 CCCCCCC(C)OCCCC(=O)N(C)C 7a_100000210265_100000737642 [0,2,0,0,0,0|2,0,0]=4 15475 B16R0.3281 CCCCCCC(C)SCCCC(=O)N(C)C 62a_100000737642_100011215978 [0,2,0,0,0,0|2,0,0]=4 15476 B16R0.3281 CCCCCCC(C)SCCCC(=O)N(C)C 62a_100011215978_100000737642 [0,2,0,0,0,0|2,0,0]=4 15477 B16R0.3281 CCCCCCN(C)CCCCC(=O)N(C)C 269982a_106256046315_100000752486 [0,2,0,0,0,0|2,0,0]=4 15478 B16R0.25 CNC(=O)CCCC(=O)CCCCCC(C)C 1458a_100000766313_100000741757 [0,2,0,0,0,0|1,0,1]=4 15479 B16R0.25 COC(=O)CCCC(=O)CCCCCC(C)C 1458a_100000239890_100000210682 [0,2,0,0,0,0|0,0,1]=3 15480 B16R0.25 COC(=O)CCCC(=O)CCCCCC(C)C 1458a_100000766313_100011218270 [0,2,0,0,0,0|0,0,1]=3 15481 B16R0.25 COC(=O)CCCN(C)CCCCCC(C)C 269982a_100000739225_100000210682 [0,2,0,0,0,0|1,0,0]=3 15482 B16R0.25 COC(=O)CCNC(=O)CCCCCC(C)C 188690a_100000683876_100000766313 [0,2,0,0,0,0|1,0,1]=4 15483 B16R0.25 COC(=O)CSCC(=O)CCCCCC(C)C 1458a_100000191316_100000210682 [0,2,0,0,0,0|1,0,1]=4 15484 B16R0.113 CCCCCCCC(=O)CC(C)CC(=O)OC 1458a_100000732146_100000210614 [0,2,0,0,0,0|0,0,1]=3 15485 B16R0.113 CCCCCCCC(=O)N[C@H](C)CC(=O)OC 188690a_100016994721_100000211969 [0,2,0,0,0,0|1,0,1]=4 15486 B16R0.113 CCCCCCCC(C)OC(C)CC(=O)OC 34a_200011215852_100009817358 [0,2,0,0,0,0|1,0,0]=3 15487 B16R0.113 CCCCCCCC(C)OC(C)CC(=O)OC 7a_200011215852_100009817358 [0,2,0,0,0,0|1,0,0]=3 15488 B16R0.113 CCCCCCCC(C)SC(C)CC(=O)OC 62a_100009817358_200011218727 [0,2,0,0,0,0|1,0,0]=3 15489 B16R0.113 CCCCCCCC(C)SC(C)CC(=O)OC 62a_200011218727_100009817358 [0,2,0,0,0,0|1,0,0]=3 15490 B16R0.113 CCCCCCCC(O)CC(=O)CC(=O)CC 1458a_200011667753_100000747405 [0,2,0,0,0,0|1,0,1]=4 15491 B16R0.113 CCCCCCCC(O)CC(=O)CC(=O)NC 1458a_200011667753_100000183359 [0,2,0,0,0,0|1,0,1]=4 15492 B16R0.113 CCCCCCCC(O)CC(=O)CC(=O)OC 1458a_200011667753_100000747449 [0,2,0,0,0,0|0,0,1]=3 15493 B16R0.113 CCCCCCNC(=O)CC(C)CC(=O)OC 11a_100000210581_100000732146 [0,2,0,0,0,0|1,0,1]=4 15494 B16R0.113 CCCCCCNC(=O)CC(C)CC(=O)OC 1626a_100000210581_100000732146 [0,2,0,0,0,0|1,0,1]=4 15495 B16R0.113 CCCCCCNC(=O)CC(C)CC(=O)OC 240690a_100000210581_100000732146 [0,2,0,0,0,0|1,0,1]=4 15496 B16R0.113 CCCCCCNC(=O)CC(C)CC(=O)OC 527a_100000210581_100000732146 [0,2,0,0,0,0|1,0,1]=4 15497 B16R0.113 CCCCOCCC(=O)CC(C)CC(=O)OC 1458a_100000732146_100000743108 [0,2,0,0,0,0|1,0,1]=4 15498 B16R0.113 COC(=O)CC(C)CC(=O)CCCCCCF 1458a_100000732146_100015922095 [0,2,0,0,0,0|1,0,1]=4 15499 B16R0.113 COC(=O)CC(C)CC(=O)CCCCCCO 1458a_100000732146_100000766143 [0,2,0,0,0,0|1,0,1]=4 15500 B16R0.127 C=C(COC(C)CCCCCCC)C(=O)OC 34a_200011215852_100009813391 [0,2,0,0,0,0|1,0,1]=4 15501 B16R0.127 C=C(CSC(C)CCCCCCC)C(=O)OC 62a_100009813391_200011218727 [0,2,0,0,0,0|1,0,1]=4 15502 B16R0.127 C=C(CSC(C)CCCCCCC)C(=O)OC 62a_200011218727_100009813391 [0,2,0,0,0,0|1,0,1]=4 15503 B16R0.127 CCCCCCCC(=O)CCC(C)C(=O)OC 1458a_100000211969_100000034942 [0,2,0,0,0,0|0,0,1]=3 15504 B16R0.127 CCCCCCCC(=O)NCC(O)C(=O)OC 188690a_100000695228_100000211969 [0,2,0,0,0,0|1,0,1]=4 15505 B16R0.127 CCCCCCCC(C)NCC(C)C(=O)NC 2230a_100015187722_200011218727 [0,2,0,0,0,0|2,0,0]=4 15506 B16R0.127 CCCCCCCC(C)NCC(C)C(=O)NC 270004a_100015187722_100000210596 [0,2,0,0,0,0|2,0,0]=4 15507 B16R0.127 CCCCCCCC(C)NCC(C)C(=O)NC 34a_100015187722_200011218727 [0,2,0,0,0,0|2,0,0]=4 15508 B16R0.127 CCCCCCCC(C)OCC(=O)C(=O)OC 34a_200011215852_100011610305 [0,2,0,0,0,0|1,0,1]=4 15509 B16R0.127 CCCCCCCC(C)OCC(C)C(=O)OC 34a_100000749362_200011218727 [0,2,0,0,0,0|1,0,0]=3 15510 B16R0.127 CCCCCCCC(C)OCC(C)C(=O)OC 34a_200011215852_100000698445 [0,2,0,0,0,0|1,0,0]=3 15511 B16R0.127 CCCCCCCC(C)OCC(C)C(=O)OC 7a_100000749362_200011218727 [0,2,0,0,0,0|1,0,0]=3 15512 B16R0.127 CCCCCCCC(C)OCC(F)C(=O)OC 34a_200009849844_200011218727 [0,2,0,0,0,0|1,0,0]=3 15513 B16R0.127 CCCCCCCC(C)OC[C@@H](N)C(=O)OC 34a_100000003586_200011218727 [0,2,0,0,0,0|1,0,0]=3 15514 B16R0.127 CCCCCCCC(C)SCC(=O)C(=O)OC 62a_100011610305_200011218727 [0,2,0,0,0,0|1,0,1]=4 15515 B16R0.127 CCCCCCCC(C)SCC(=O)C(=O)OC 62a_200011218727_100011610305 [0,2,0,0,0,0|1,0,1]=4 15516 B16R0.127 CCCCCCCC(C)SCC(C)C(=O)OC 62a_100000698445_200011218727 [0,2,0,0,0,0|1,0,0]=3 15517 B16R0.127 CCCCCCCC(C)SCC(C)C(=O)OC 62a_200011218727_100000698445 [0,2,0,0,0,0|1,0,0]=3 15518 B16R0.127 CCCCCCCN(C)CCC(C)C(=O)OC 2230a_100000228206_100000034942 [0,2,0,0,0,0|1,0,0]=3 15519 B16R0.127 CCCCCCCN(C)CCC(C)C(=O)OC 269982a_100000228206_100000034942 [0,2,0,0,0,0|1,0,0]=3 15520 B16R0.127 COC(=O)C(C)CCC(=O)CCCCCCO 1458a_100011996774_100000034942 [0,2,0,0,0,0|1,0,1]=4 15521 B16R0.127 COCCCCCC(=O)CCC(C)C(=O)OC 1458a_100011935119_100000034942 [0,2,0,0,0,0|1,0,1]=4 15522 B16R0.586 CCCCCCCC(=O)N(C)CCC(=O)OC 11a_100025711912_100000211969 [0,2,0,0,0,0|1,0,1]=4 15523 B16R0.586 CCCCCCCC(=O)N(C)CCC(=O)OC 1626a_100025711912_100000211969 [0,2,0,0,0,0|1,0,1]=4 15524 B16R0.586 CCCCCCCC(=O)N(C)CCC(=O)OC 240690a_100025711912_100000211969 [0,2,0,0,0,0|1,0,1]=4 15525 B16R0.586 CCCCCCCC(=O)N(C)CCC(=O)OC 527a_100025711912_100000211969 [0,2,0,0,0,0|1,0,1]=4 15526 B16R0.586 CCCCCCCC(C)C(=O)CCC(=O)NC 1458a_100011309844_200011218727 [0,2,0,0,0,0|1,0,1]=4 15527 B16R0.586 CCCCCCCC(C)C(=O)CCC(=O)OC 1458a_100000187943_200011218727 [0,2,0,0,0,0|0,0,1]=3 15528 B16R0.586 CCCCCCCC(C)C(=O)CNC(=O)OC 1458a_100000215747_200011218727 [0,2,0,0,0,0|1,0,1]=4 15529 B16R0.586 CCCCCCCC(C)N(C)CCC(=O)NC 2230a_100000750875_200011218727 [0,2,0,0,0,0|2,0,0]=4 15530 B16R0.586 CCCCCCCC(C)N(C)CCC(=O)NC 269982a_100000750875_200011218727 [0,2,0,0,0,0|2,0,0]=4 15531 B16R0.586 CCCCCCCC(C)N(C)CCC(=O)NC 270004a_100000750875_100000210596 [0,2,0,0,0,0|2,0,0]=4 15532 B16R0.586 CCCCCCCC(C)N(C)CCC(=O)OC 269982a_100025711912_200011218727 [0,2,0,0,0,0|1,0,0]=3 15533 B16R0.586 CCCCCCCN(C)C(=O)CCC(=O)OC 11a_100000228206_100000187943 [0,2,0,0,0,0|1,0,1]=4 15534 B16R0.586 CCCCCCCN(C)C(=O)CCC(=O)OC 1626a_100000228206_100000187943 [0,2,0,0,0,0|1,0,1]=4 15535 B16R0.586 CCCCCCCN(C)C(=O)CCC(=O)OC 240690a_100000228206_100000187943 [0,2,0,0,0,0|1,0,1]=4 15536 B16R0.586 CCCCCCCN(C)C(=O)CCC(=O)OC 527a_100000228206_100000187943 [0,2,0,0,0,0|1,0,1]=4 15537 B16R0.1134 CCCCCCC(=O)N(C)CCCC(=O)OC 240690a_100000739225_100102632555 [0,2,0,0,0,0|1,0,1]=4 15538 B16R0.1134 CCCCCCC(=O)N(C)CCCC(=O)OC 527a_100000739225_100102632555 [0,2,0,0,0,0|1,0,1]=4 15539 B16R0.1134 CCCCCCC(C)C(=O)CCCC(=O)OC 1458a_100000239890_100011215978 [0,2,0,0,0,0|0,0,1]=3 15540 B16R0.1134 CCCCCCC(C)C(=O)CSCC(=O)OC 1458a_100000191316_100011215978 [0,2,0,0,0,0|1,0,1]=4 15541 B16R0.1134 CCCCCCC(C)N(C)CCCC(=O)OC 269982a_100000739225_100011215978 [0,2,0,0,0,0|1,0,0]=3 15542 B16R0.1134 CCCCCCC(O)C(=O)CCCC(=O)NC 1458a_100011215828_100000741757 [0,2,0,0,0,0|1,0,1]=4 15543 B16R0.1134 CCCCCCC(O)C(=O)CCCC(=O)OC 1458a_100011215828_100011218270 [0,2,0,0,0,0|0,0,1]=3 15544 B16R0.1134 CCCCCCC(O)C(=O)NCCC(=O)OC 188690a_100000683876_100011215828 [0,2,0,0,0,0|1,0,1]=4 15545 B16R0.1134 CCCCCCN(C)C(=O)CCCC(=O)OC 11a_106256046315_100000239890 [0,2,0,0,0,0|1,0,1]=4 15546 B16R0.1134 CCCCCCN(C)C(=O)CCCC(=O)OC 1626a_106256046315_100000239890 [0,2,0,0,0,0|1,0,1]=4 15547 B16R0.1134 CCCCCCN(C)C(=O)CCCC(=O)OC 240690a_106256046315_100000239890 [0,2,0,0,0,0|1,0,1]=4 15548 B16R0.1134 CCCCCCN(C)C(=O)CCCC(=O)OC 527a_106256046315_100000239890 [0,2,0,0,0,0|1,0,1]=4 15549 B16R0.1517 C=CC(CCCCCCC)OCCC(=O)NC 34a_200011934235_100012179268 [0,2,0,0,0,0|2,0,0]=4 15550 B16R0.1517 C=CC(CCCCCCC)OCCC(=O)NC 7a_200011934235_100000737683 [0,2,0,0,0,0|2,0,0]=4 15551 B16R0.1517 C=CC(CCCCCCC)OCCC(=O)OC 34a_200011934235_100000742370 [0,2,0,0,0,0|1,0,0]=3 15552 B16R0.1517 C=CC(CCCCCCC)OCCC(=O)OC 7a_200011934235_100000204255 [0,2,0,0,0,0|1,0,0]=3 15553 B16R0.1517 CCCCCCCC(CC)NCCC(=O)NC 270004a_100000738227_200011217162 [0,2,0,0,0,0|2,0,0]=4 15554 B16R0.1517 CCCCCCCC(CC)OCCC(=O)NC 34a_200011217053_100012179268 [0,2,0,0,0,0|2,0,0]=4 15555 B16R0.1517 CCCCCCCC(CC)OCCC(=O)NC 7a_200011217053_100000737683 [0,2,0,0,0,0|2,0,0]=4 15556 B16R0.1517 CCCCCCCC(CC)OCCC(=O)OC 34a_200011217053_100000742370 [0,2,0,0,0,0|1,0,0]=3 15557 B16R0.1517 CCCCCCCC(CC)OCCC(=O)OC 7a_200011217053_100000204255 [0,2,0,0,0,0|1,0,0]=3 15558 B16R0.1517 CCCCCCCN(CC)CCCC(=O)NC 2230a_100000228213_100000741757 [0,2,0,0,0,0|2,0,0]=4 15559 B16R0.1517 CCCCCCCN(CC)CCCC(=O)NC 269982a_100000228213_100000741757 [0,2,0,0,0,0|2,0,0]=4 15560 B16R0.1517 CCCCCCCN(CC)CCCC(=O)OC 2230a_100000228213_100011218270 [0,2,0,0,0,0|1,0,0]=3 15561 B16R0.1517 CCCCCCCN(CC)CCCC(=O)OC 269982a_100000228213_100011218270 [0,2,0,0,0,0|1,0,0]=3 15562 B16R0.5006 CCCCCCCC(C)(C)NCCC(=O)NC 34a_100000738227_200000046972 [0,2,0,0,0,0|2,0,0]=4 15563 B16R0.5006 CCCCCCCC(C)(C)OCCC(=O)NC 34a_100000754576_200000046972 [0,2,0,0,0,0|2,0,0]=4 15564 B16R0.5006 CCCCCCCC(C)(C)SCCC(=O)NC 62a_100000737683_200000046972 [0,2,0,0,0,0|2,0,0]=4 15565 B16R0.5006 CCCCCCCC(C)(C)SCCC(=O)NC 62a_200000046972_100000737683 [0,2,0,0,0,0|2,0,0]=4 15566 B16R0.5006 CCCCCCCC(C)(C)SCCC(=O)OC 62a_100000204255_200000046972 [0,2,0,0,0,0|1,0,0]=3 15567 B16R0.5006 CCCCCCCC(C)(C)SCCC(=O)OC 62a_200000046972_100000204255 [0,2,0,0,0,0|1,0,0]=3 15568 B16R0.5006 CCCCCCCC(C)(C)SCOC(=O)OC 62a_200000046972_100000139417 [0,2,0,0,0,0|2,0,0]=4 15569 B16R0.5205 CCCCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210614 [0,2,0,0,0,0|1,0,1]=4 15570 B16R0.5205 CCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210614 [0,2,0,0,0,0|0,0,1]=3 15571 B16R0.5205 CCCCCCCC(=O)CCCC(=O)OCC 1458a_100000211969_100011215271 [0,2,0,0,0,0|0,0,1]=3 15572 B16R0.5205 CCCCCCCC(=O)CCNC(=O)OCC 1458a_100000211969_200011445536 [0,2,0,0,0,0|1,0,1]=4 15573 B16R0.5205 CCCCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100000211969 [0,2,0,0,0,0|1,0,1]=4 15574 B16R0.5205 CCCCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100000210596 [0,2,0,0,0,0|2,0,0]=4 15575 B16R0.5205 CCCCCCCC(C)NCCC(=O)NCC 34a_100025743525_200011218727 [0,2,0,0,0,0|2,0,0]=4 15576 B16R0.5205 CCCCCCCC(C)OCCC(=O)NCC 7a_200011215852_100000737597 [0,2,0,0,0,0|2,0,0]=4 15577 B16R0.5205 CCCCCCCC(C)OCCC(=O)OCC 34a_200011215852_100000765890 [0,2,0,0,0,0|1,0,0]=3 15578 B16R0.5205 CCCCCCCC(C)OCCC(=O)OCC 7a_200011215852_100011206558 [0,2,0,0,0,0|1,0,0]=3 15579 B16R0.5205 CCCCCCCC(C)SCCC(=O)NCC 62a_100000737597_200011218727 [0,2,0,0,0,0|2,0,0]=4 15580 B16R0.5205 CCCCCCCC(C)SCCC(=O)NCC 62a_200011218727_100000737597 [0,2,0,0,0,0|2,0,0]=4 15581 B16R0.5205 CCCCCCCC(C)SCCC(=O)OCC 62a_100000765890_200011218727 [0,2,0,0,0,0|1,0,0]=3 15582 B16R0.5205 CCCCCCCC(C)SCCC(=O)OCC 62a_200011218727_100000765890 [0,2,0,0,0,0|1,0,0]=3 15583 B16R0.5205 CCCCCCCC(C)SCOC(=O)OCC 62a_200011218727_100000075025 [0,2,0,0,0,0|2,0,0]=4 15584 B16R0.5205 CCCCCCCN(C)CCCC(=O)OCC 2230a_100000228206_100009991533 [0,2,0,0,0,0|1,0,0]=3 15585 B16R0.5205 CCCCCCCN(C)CCCC(=O)OCC 269982a_100000228206_100009991533 [0,2,0,0,0,0|1,0,0]=3 15586 B16R0.5205 CCCCCCCN(C)CCNC(=O)OCC 269982a_100000228206_200011445536 [0,2,0,0,0,0|2,0,0]=4 15587 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 11a_100000210581_100000210991 [0,2,0,0,0,0|1,0,1]=4 15588 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 1626a_100000210581_100000210991 [0,2,0,0,0,0|1,0,1]=4 15589 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 240690a_100000210581_100000210991 [0,2,0,0,0,0|1,0,1]=4 15590 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 527a_100000210581_100000210991 [0,2,0,0,0,0|1,0,1]=4 15591 B16R0.5205 CCCCOCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000743108 [0,2,0,0,0,0|1,0,1]=4 15592 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCCF 1458a_100000210991_100015922095 [0,2,0,0,0,0|1,0,1]=4 15593 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCCO 1458a_100000210991_100000766143 [0,2,0,0,0,0|1,0,1]=4 15594 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCCO 1458a_100011996774_100011215271 [0,2,0,0,0,0|1,0,1]=4 15595 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCOC 1458a_100011935119_100011215271 [0,2,0,0,0,0|1,0,1]=4 15596 B16R0.6229 CCCCC(C)CCC(=O)CCCC(=O)NC 1458a_100000033779_100000741757 [0,2,0,0,0,0|1,0,1]=4 15597 B16R0.6229 CCCCC(C)CCC(=O)CCCC(=O)OC 1458a_100000033779_100011218270 [0,2,0,0,0,0|0,0,1]=3 15598 B16R0.6229 CCCCC(C)CCC(=O)NCCC(=O)OC 188690a_100000683876_100000033779 [0,2,0,0,0,0|1,0,1]=4 15599 B16R0.6965 CCCCCC(=O)CC(=O)CCCC(=O)OC 1458a_100000239890_200012276598 [0,2,0,0,0,0|0,0,2]=4 15600 B16R0.6965 CCCCCC(=O)CN(C)CCCC(=O)OC 269982a_100000739225_200012276598 [0,2,0,0,0,0|1,0,1]=4 15601 B16R0.6965 CCCCCC(C)NC(=O)CCCC(=O)OC 11a_100000211957_100000239890 [0,2,0,0,0,0|1,0,1]=4 15602 B16R0.6965 CCCCCC(C)NC(=O)CCCC(=O)OC 1626a_100000211957_100000239890 [0,2,0,0,0,0|1,0,1]=4 15603 B16R0.6965 CCCCCC(C)NC(=O)CCCC(=O)OC 240690a_100000211957_100000239890 [0,2,0,0,0,0|1,0,1]=4 15604 B16R0.6965 CCCCCC(C)NC(=O)CCCC(=O)OC 527a_100000211957_100000239890 [0,2,0,0,0,0|1,0,1]=4 15605 B16R0.8229 CCC(C)CCNC(=O)CCCCC(=O)OC 11a_100020591266_100000695723 [0,2,0,0,0,0|1,0,1]=4 15606 B16R0.8229 CCC(C)CCNC(=O)CCCCC(=O)OC 1626a_100020591266_100000695723 [0,2,0,0,0,0|1,0,1]=4 15607 B16R0.8229 CCC(C)CCNC(=O)CCCCC(=O)OC 240690a_100020591266_100000695723 [0,2,0,0,0,0|1,0,1]=4 15608 B16R0.8229 CCC(C)CCNC(=O)CCCCC(=O)OC 527a_100020591266_100000695723 [0,2,0,0,0,0|1,0,1]=4 15609 B16R0.8229 CCN(C)CCCC(=O)CCCCC(=O)OC 1458a_100000695723_100015186262 [0,2,0,0,0,0|1,0,1]=4 15610 B16R0.1284 CCC(=O)C(C)OCCCCCCC(=O)OC 7a_100009863599_100000742827 [0,2,0,0,0,0|1,0,1]=4 15611 B16R0.1284 CCC(=O)C(C)SCCCCCCC(=O)OC 62a_100000742827_100009815986 [0,2,0,0,0,0|1,0,1]=4 15612 B16R0.1284 CCC(=O)C(C)SCCCCCCC(=O)OC 62a_100009815986_100000742827 [0,2,0,0,0,0|1,0,1]=4 15613 B16R0.1284 CCC(C)C(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000758301 [0,2,0,0,0,0|0,0,1]=3 15614 B16R0.1284 CCC(C)C(=O)CCCCCCCC(=O)OC 1458a_100011192722_100010004213 [0,2,0,0,0,0|0,0,1]=3 15615 B16R0.1284 CCC(C)C(=O)NCCCCCCC(=O)OC 188690a_100000739044_100011192722 [0,2,0,0,0,0|1,0,1]=4 15616 B16R0.1284 CCC(C)C(C)OCCCCCCC(=O)OC 7a_100011215189_100009815986 [0,2,0,0,0,0|1,0,0]=3 15617 B16R0.1284 CCC(C)N(C)CCCCCCCC(=O)OC 2230a_100000741768_100010004213 [0,2,0,0,0,0|1,0,0]=3 15618 B16R0.1284 CCC(C)N(C)CCCCCCCC(=O)OC 269982a_100000741768_100010004213 [0,2,0,0,0,0|1,0,0]=3 15619 B16R0.1284 CCC(O)C(=O)CCCCCCCC(=O)OC 1458a_100011196387_100010004213 [0,2,0,0,0,0|0,0,1]=3 15620 B16R0.1284 CCC(O)C(=O)NCCCCCCC(=O)OC 188690a_100000739044_100011196387 [0,2,0,0,0,0|1,0,1]=4 15621 B16R0.1284 CCN(C)C(=O)CCCCCCCC(=O)OC 11a_100000225621_100000033222 [0,2,0,0,0,0|1,0,1]=4 15622 B16R0.1284 CCN(C)C(=O)CCCCCCCC(=O)OC 1626a_100000225621_100000033222 [0,2,0,0,0,0|1,0,1]=4 15623 B16R0.1284 CCN(C)C(=O)CCCCCCCC(=O)OC 240690a_100000225621_100000033222 [0,2,0,0,0,0|1,0,1]=4 15624 B16R0.1284 CCN(C)C(C)COCCCCCC(=O)OC 7a_100000732741_100009816466 [0,2,0,0,0,0|2,0,0]=4 15625 B16R0.1284 COC(=O)CCCCCCCC(=O)C(C)OC 1458a_100000743197_100010004213 [0,2,0,0,0,0|1,0,1]=4 15626 B16R0.1284 COC(=O)CCCCCCCC(=O)C(C)SC 1458a_100000149566_100010004213 [0,2,0,0,0,0|1,0,1]=4 15627 B16R0.1284 COC(=O)CCCCCCCC(=O)C(O)CO 1458a_100011215603_100010004213 [0,2,0,0,0,0|1,0,1]=4 15628 B16R0.1284 COC(=O)CCCCCCCN(C)C(C)CO 2230a_100000693034_100010004213 [0,2,0,0,0,0|2,0,0]=4 15629 B16R0.1284 COC(=O)CCCCCCCN(C)C(C)CO 269982a_100000693034_100010004213 [0,2,0,0,0,0|2,0,0]=4 15630 B16R0.7311 CCC(C)CCC(=O)CCCCCC(=O)OC 1458a_100000701222_100009816466 [0,2,0,0,0,0|0,0,1]=3 15631 B16R0.7311 CCC(C)CCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000701222 [0,2,0,0,0,0|1,0,1]=4 15632 B16R0.7311 CCC(C)CCC(C)OCCCCC(=O)OC 7a_200011216552_100000204269 [0,2,0,0,0,0|1,0,0]=3 15633 B16R0.7311 CCC(C)CCC(C)OCCOCC(=O)OC 7a_200011216552_100000090808 [0,2,0,0,0,0|2,0,0]=4 15634 B16R0.7311 CCC(C)CCCOCC(=O)CCC(=O)OC 7a_100011216074_100000691467 [0,2,0,0,0,0|1,0,1]=4 15635 B16R0.7311 CCC(C)CNC(=O)CCCCCC(=O)OC 11a_100020588543_100009848860 [0,2,0,0,0,0|1,0,1]=4 15636 B16R0.7311 CCC(C)CNC(=O)CCCCCC(=O)OC 1626a_100020588543_100009848860 [0,2,0,0,0,0|1,0,1]=4 15637 B16R0.7311 CCC(C)CNC(=O)CCCCCC(=O)OC 240690a_100020588543_100009848860 [0,2,0,0,0,0|1,0,1]=4 15638 B16R0.7311 CCC(O)CCC(=O)NCCCCC(=O)OC 188690a_100000746077_203496584001 [0,2,0,0,0,0|1,0,1]=4 15639 B16R0.7311 CCC(O)CNC(=O)CCCCCC(=O)OC 11a_100011218483_100009848860 [0,2,0,0,0,0|1,0,1]=4 15640 B16R0.7311 CCC(O)CNC(=O)CCCCCC(=O)OC 240690a_100011218483_100009848860 [0,2,0,0,0,0|1,0,1]=4 15641 B16R0.7311 CCN(C)CCC(=O)CCCCCC(=O)OC 1458a_100000755305_100009816466 [0,2,0,0,0,0|1,0,1]=4 15642 B16R0.7311 CCS(=O)CCC(=O)CCCCCC(=O)OC 1458a_100011387550_100009816466 [0,2,0,0,0,0|1,0,1]=4 15643 B16R0.7916 CCC(C)(C)COCCCCCCC(=O)OC 7a_100000765029_100009815986 [0,2,0,0,0,0|1,0,0]=3 15644 B16R0.7916 CCC(C)(C)NCCCCCCCC(=O)OC 2230a_100000211385_100010004213 [0,2,0,0,0,0|1,0,0]=3 15645 B16R0.7916 CCC(C)(C)OCCCCCCCC(=O)OC 7a_100000210230_100010004213 [0,2,0,0,0,0|1,0,0]=3 15646 B16R0.7916 CCC(C)(C)OCCCCCCCC(=O)OC 7a_100011022521_100000210677 [0,2,0,0,0,0|1,0,0]=3 15647 B16R0.7916 CCC(C)(C)SCCCCCCCC(=O)OC 62a_100000032637_100010004213 [0,2,0,0,0,0|1,0,0]=3 15648 B16R0.7916 CCC(C)(C)SCCCCCCCC(=O)OC 62a_100010004213_100000032637 [0,2,0,0,0,0|1,0,0]=3 15649 B16R0.7916 CCS(=O)(=O)CCNCCCCCC(=O)OC 2230a_100000751051_100009816466 [0,2,0,0,0,0|2,0,0]=4 15650 B16R0.7916 CCS(=O)(=O)CCNCCCCCC(=O)OC 34a_100000751051_100009816466 [0,2,0,0,0,0|2,0,0]=4 15651 B16R0.7916 CCS(=O)(=O)CCOCCCCCC(=O)OC 34a_100000074720_100000756660 [0,2,0,0,0,0|2,0,0]=4 15652 B16R0.7916 CCS(=O)(=O)CCOCCCCCC(=O)OC 34a_200011216379_100009816466 [0,2,0,0,0,0|2,0,0]=4 15653 B16R0.7916 CCS(=O)(=O)CCOCCCCCC(=O)OC 7a_100000074720_100000756660 [0,2,0,0,0,0|2,0,0]=4 15654 B16R0.7916 CCS(=O)(=O)CCOCCCCCC(=O)OC 7a_200011216379_100009816466 [0,2,0,0,0,0|2,0,0]=4 15655 B16R0.7916 CCS(=O)(=O)CCSCCCCCC(=O)OC 62a_100000756660_100009816466 [0,2,0,0,0,0|2,0,0]=4 15656 B16R0.7916 CCS(=O)(=O)CCSCCCCCC(=O)OC 62a_100009816466_100000756660 [0,2,0,0,0,0|2,0,0]=4 15657 B16R0.7916 COC(=O)CCCCCCCNC(C)(C)CO 2230a_100000210608_100010004213 [0,2,0,0,0,0|2,0,0]=4 15658 B16R0.7916 COC(=O)CCCCCCCOC(C)(C)CCl 7a_100000764493_100010004213 [0,2,0,0,0,0|2,0,0]=4 15659 B16R0.7916 COC(=O)CCCCCCCSC(F)(F)CO 62a_100010004213_100011217949 [0,2,0,0,0,0|2,0,0]=4 15660 B16R0.7916 COC(=O)CCCCCCCSC(F)(F)CO 62a_100011217949_100010004213 [0,2,0,0,0,0|2,0,0]=4 15661 B16R0.7916 COC(=O)CCCCCCNCC(C)(C)CO 2230a_100020635058_100009815986 [0,2,0,0,0,0|2,0,0]=4 15662 B16R0.7916 COC(=O)CCCCCCNCC(C)(C)OC 2230a_100000763424_100009815986 [0,2,0,0,0,0|2,0,0]=4 15663 B16R0.7916 COC(=O)CCCCCCOCC(C)(C)CCl 7a_100011217199_100009815986 [0,2,0,0,0,0|2,0,0]=4 15664 B16R0.7916 COC(=O)CCCCCCOCC(C)(C)CO 34a_100009863599_100009813988 [0,2,0,0,0,0|2,0,0]=4 15665 B16R0.7916 COC(=O)CCCCCCOCC(C)(C)CO 7a_100009863599_100009813988 [0,2,0,0,0,0|2,0,0]=4 15666 B16R0.7916 COC(=O)CCCCCCOCC(C)(C)OC 34a_100009863599_100000701081 [0,2,0,0,0,0|2,0,0]=4 15667 B16R0.7916 COC(=O)CCCCCCOCC(F)(F)CN 34a_100000703232_100009815986 [0,2,0,0,0,0|2,0,0]=4 15668 B16R0.7916 COC(=O)CCCCCCSCC(C)(C)CO 62a_100009813988_100009815986 [0,2,0,0,0,0|2,0,0]=4 15669 B16R0.7916 COC(=O)CCCCCCSCC(C)(C)CO 62a_100009815986_100009813988 [0,2,0,0,0,0|2,0,0]=4 15670 B16R0.7916 COC(=O)CCCCCCSCC(C)(C)OC 62a_100000701081_100009815986 [0,2,0,0,0,0|2,0,0]=4 15671 B16R0.7916 COC(=O)CCCCCCSCC(C)(C)OC 62a_100009815986_100000701081 [0,2,0,0,0,0|2,0,0]=4 15672 B16R0.7916 COC(=O)CCCCCOCCC(C)(C)OC 7a_100000699976_100009816466 [0,2,0,0,0,0|2,0,0]=4 15673 B16R0.7916 COC(=O)CCCCNCCCC(C)(C)CO 2230a_100000039164_100000204269 [0,2,0,0,0,0|2,0,0]=4 15674 B16R0.8115 C#CC(CC)OCCCCCCCC(=O)OC 34a_100000758843_100010004213 [0,2,0,0,0,0|1,0,0]=3 15675 B16R0.8115 C#CC(CC)OCCCCCCCC(=O)OC 7a_100000758843_100010004213 [0,2,0,0,0,0|1,0,0]=3 15676 B16R0.8115 C=CC(CC)OCCCCCCCC(=O)OC 34a_100000766422_100010004213 [0,2,0,0,0,0|1,0,0]=3 15677 B16R0.8115 C=CC(CC)OCCCCCCCC(=O)OC 7a_100000766422_100010004213 [0,2,0,0,0,0|1,0,0]=3 15678 B16R0.8115 C=C[C@@H](CO)NCCCCCCCC(=O)OC 2230a_100016989147_100010004213 [0,2,0,0,0,0|2,0,0]=4 15679 B16R0.8115 C=C[C@@H](CO)NCCCCCCCC(=O)OC 34a_100016989147_100010004213 [0,2,0,0,0,0|2,0,0]=4 15680 B16R0.8115 CCC(CC)CNCCCCCCC(=O)OC 2230a_100102946423_100009815986 [0,2,0,0,0,0|1,0,0]=3 15681 B16R0.8115 CCC(CC)COCCCCCCC(=O)OC 34a_100009863599_100011215472 [0,2,0,0,0,0|1,0,0]=3 15682 B16R0.8115 CCC(CC)COCCCCCCC(=O)OC 7a_100000703878_100009815986 [0,2,0,0,0,0|1,0,0]=3 15683 B16R0.8115 CCC(CC)COCCCCCCC(=O)OC 7a_100009863599_100011215472 [0,2,0,0,0,0|1,0,0]=3 15684 B16R0.8115 CCC(CC)CSCCCCCCC(=O)OC 62a_100009815986_100011215472 [0,2,0,0,0,0|1,0,0]=3 15685 B16R0.8115 CCC(CC)CSCCCCCCC(=O)OC 62a_100011215472_100009815986 [0,2,0,0,0,0|1,0,0]=3 15686 B16R0.8115 CCC(CC)NCCCCCCCC(=O)OC 2230a_100000199018_100010004213 [0,2,0,0,0,0|1,0,0]=3 15687 B16R0.8115 CCC(CC)OCCCCCCCC(=O)OC 7a_100000688536_100010004213 [0,2,0,0,0,0|1,0,0]=3 15688 B16R0.8115 CCC(CC)OCCCCCCCC(=O)OC 7a_100011022521_100000210505 [0,2,0,0,0,0|1,0,0]=3 15689 B16R0.8115 CCC(CC)SCCCCCCCC(=O)OC 62a_100000210505_100010004213 [0,2,0,0,0,0|1,0,0]=3 15690 B16R0.8115 CCC(CC)SCCCCCCCC(=O)OC 62a_100010004213_100000210505 [0,2,0,0,0,0|1,0,0]=3 15691 B16R0.8115 CCC(COCCCCCCC(=O)OC)OC 34a_100011934954_100009815986 [0,2,0,0,0,0|1,0,0]=3 15692 B16R0.8115 CCC(COCCCCCCC(=O)OC)OC 7a_100011934954_100009815986 [0,2,0,0,0,0|1,0,0]=3 15693 B16R0.8115 CCN(CC)CCCCCCCCC(=O)OC 2230a_100000724800_100010282707 [0,2,0,0,0,0|1,0,0]=3 15694 B16R0.8115 CCN(CC)CCCCCCCCC(=O)OC 269956a_100000042499_100010282707 [0,2,0,0,0,0|1,0,0]=3 15695 B16R0.8115 CCN(CC)CCCCCCCCC(=O)OC 269982a_100000724800_100010282707 [0,2,0,0,0,0|1,0,0]=3 15696 B16R0.8115 CCN(CC)CCCCCCOCC(=O)OC 7a_100011632896_100000747449 [0,2,0,0,0,0|2,0,0]=4 15697 B16R0.8115 CCN(CC)CCCCCNCCC(=O)OC 2230a_100011491781_100000204255 [0,2,0,0,0,0|2,0,0]=4 15698 B16R0.8115 CCN(CC)CCCCCOCCC(=O)OC 7a_200011629222_100000204255 [0,2,0,0,0,0|2,0,0]=4 15699 B16R0.8115 CCN(CC)CCCCNCCCC(=O)OC 2230a_100000743895_100011218270 [0,2,0,0,0,0|2,0,0]=4 15700 B16R0.8115 CCN(CC)CCCCOCCCC(=O)OC 7a_100011305530_100011218270 [0,2,0,0,0,0|2,0,0]=4 15701 B16R0.8115 CCN(CC)CCCOCCCCC(=O)OC 7a_100000059025_100000709985 [0,2,0,0,0,0|2,0,0]=4 15702 B16R0.8115 CCN(CC)CCCOCCCCC(=O)OC 7a_100000212844_100000204269 [0,2,0,0,0,0|2,0,0]=4 15703 B16R0.8115 CCN(CC)CCCSCCCCC(=O)OC 62a_100000204269_100000709985 [0,2,0,0,0,0|2,0,0]=4 15704 B16R0.8115 CCN(CC)CCNCCCCCC(=O)OC 2230a_100015382049_100009816466 [0,2,0,0,0,0|2,0,0]=4 15705 B16R0.8115 CCN(CC)CCOCCCCCC(=O)OC 7a_100000074720_100000700428 [0,2,0,0,0,0|2,0,0]=4 15706 B16R0.8115 CCN(CC)CCOCCCCCC(=O)OC 7a_100016990331_100009816466 [0,2,0,0,0,0|2,0,0]=4 15707 B16R0.8115 CCN(CC)CCSCCCCCC(=O)OC 62a_100009816466_100000700428 [0,2,0,0,0,0|2,0,0]=4 15708 B16R0.8115 CCN(CC)COCCCCCCC(=O)OC 7a_200015374951_100009815986 [0,2,0,0,0,0|2,0,0]=4 15709 B16R0.8115 CCN(CCCCOCCCC(=O)OC)N=O 34a_200000035056_100000742333 [0,2,0,0,0,0|2,0,0]=4 15710 B16R0.8115 CC[C@@H](CO)NCCCCCCCC(=O)OC 2230a_100000709445_100010004213 [0,2,0,0,0,0|1,0,0]=3 15711 B16R0.8115 COC(=O)CCCCCCCNC(CO)CO 2230a_100000759517_100010004213 [0,2,0,0,0,0|2,0,0]=4 15712 B16R0.8115 COC(=O)CCCCCCCOC(CCl)CCl 7a_100000737055_100010004213 [0,2,0,0,0,0|2,0,0]=4 15713 B16R0.8115 COC(=O)CCCCCCCOC(CF)CF 34a_100000032261_100010004213 [0,2,0,0,0,0|2,0,0]=4 15714 B16R0.8115 COC(=O)CCCCCCCOC(CF)CF 7a_100000032261_100010004213 [0,2,0,0,0,0|2,0,0]=4 15715 B16R0.8115 COC(=O)CCCCCCCOC(CN)CN 34a_100000031598_100010004213 [0,2,0,0,0,0|2,0,0]=4 15716 B16R0.8115 COC(=O)CCCCCCCO[C@@H](CF)CCl 34a_100015614560_100010004213 [0,2,0,0,0,0|2,0,0]=4 15717 B16R0.8115 COC(=O)CCCCCCCO[C@@H](CF)CCl 7a_100015614560_100010004213 [0,2,0,0,0,0|2,0,0]=4 15718 B16R0.8115 COC(=O)CCCCCCOCC(OC)OC 34a_100009863599_100000211822 [0,2,0,0,0,0|2,0,0]=4 15719 B16R0.8115 COC(=O)CCCCCCOCC(OC)OC 34a_100011216393_100009815986 [0,2,0,0,0,0|2,0,0]=4 15720 B16R0.8115 COC(=O)CCCCCCOCC(OC)OC 7a_100009863599_100000751394 [0,2,0,0,0,0|2,0,0]=4 15721 B16R0.8115 COC(=O)CCCCCCSCC(OC)OC 62a_100000751394_100009815986 [0,2,0,0,0,0|2,0,0]=4 15722 B16R0.8115 COC(=O)CCCCCCSCC(OC)OC 62a_100009815986_100000751394 [0,2,0,0,0,0|2,0,0]=4 15723 B16R0.8115 COC(=O)CCCCCOCCC(OC)OC 34a_100000074720_100000139399 [0,2,0,0,0,0|2,0,0]=4 15724 B16R0.8115 COC(=O)CCCCCOCCC(OC)OC 7a_100000074720_100009813347 [0,2,0,0,0,0|2,0,0]=4 15725 B16R0.8115 COC(=O)CCCCCSCCC(OC)OC 62a_100000139399_100009816466 [0,2,0,0,0,0|2,0,0]=4 15726 B16R0.8115 COC(=O)CCCCCSCCC(OC)OC 62a_100009816466_100000139399 [0,2,0,0,0,0|2,0,0]=4 15727 B16R0.8115 COC(=O)CCCCOCCCC(OC)OC 34a_100000059025_100000069011 [0,2,0,0,0,0|2,0,0]=4 15728 B16R0.8115 COC(=O)CCCCOCCCC(OC)OC 7a_100000059025_100000069011 [0,2,0,0,0,0|2,0,0]=4 15729 B16R0.8115 COC(=O)CCCCSCCCC(OC)OC 62a_100000069011_100000204269 [0,2,0,0,0,0|2,0,0]=4 15730 B16R0.8115 COC(=O)CCCCSCCCC(OC)OC 62a_100000204269_100000069011 [0,2,0,0,0,0|2,0,0]=4 15731 B16R0.8180 CCC(=O)CC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000747405 [0,2,0,0,0,0|0,0,2]=4 15732 B16R0.8180 CCC(C)CC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000748023 [0,2,0,0,0,0|0,0,1]=3 15733 B16R0.8180 CCC(C)CC(=O)CCCCCCC(=O)OC 1458a_100000708755_100009815986 [0,2,0,0,0,0|0,0,1]=3 15734 B16R0.8180 CCC(C)CC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000708755 [0,2,0,0,0,0|1,0,1]=4 15735 B16R0.8180 CCC(C)CC(C)NCCCCCC(=O)OC 2230a_100000763565_100009816466 [0,2,0,0,0,0|1,0,0]=3 15736 B16R0.8180 CCC(C)CCCCCOC(C)CC(=O)OC 7a_200000035636_100009817358 [0,2,0,0,0,0|1,0,0]=3 15737 B16R0.8180 CCC(C)CN(C)CCCCCCC(=O)OC 2230a_100000753921_100009815986 [0,2,0,0,0,0|1,0,0]=3 15738 B16R0.8180 CCC(C)CN(C)CCCCCCC(=O)OC 269982a_100000753921_100009815986 [0,2,0,0,0,0|1,0,0]=3 15739 B16R0.8180 CCC(C)NC(=O)CCCCCCC(=O)OC 11a_100000209981_100000036694 [0,2,0,0,0,0|1,0,1]=4 15740 B16R0.8180 CCC(C)NC(=O)CCCCCCC(=O)OC 1626a_100000209981_100000036694 [0,2,0,0,0,0|1,0,1]=4 15741 B16R0.8180 CCC(C)NC(=O)CCCCCCC(=O)OC 240690a_100000209981_100000036694 [0,2,0,0,0,0|1,0,1]=4 15742 B16R0.8180 CCC(O)CC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011218378 [0,2,0,0,0,0|0,0,1]=3 15743 B16R0.8180 CCC(O)CC(=O)CCCCCCC(=O)OC 1458a_100011667805_100009815986 [0,2,0,0,0,0|0,0,1]=3 15744 B16R0.8180 CCC(O)CC(=O)NCCCCCC(=O)OC 188690a_100000184999_100011667805 [0,2,0,0,0,0|1,0,1]=4 15745 B16R0.8180 CCN(C)CC(=O)CCCCCCC(=O)OC 1458a_100116209913_100009815986 [0,2,0,0,0,0|1,0,1]=4 15746 B16R0.8180 CC[C@H](C)CC(=O)CCCCCCC(=O)OC 1458a_100000036694_100009816398 [0,2,0,0,0,0|0,0,1]=3 15747 B16R0.8180 COC(=O)CCCCCCC(=O)C[C@@H](C)CO 1458a_100000036694_100000059175 [0,2,0,0,0,0|1,0,1]=4 15748 B16R0.8180 COC(=O)CCCCCCN(C)CC(O)CO 2230a_100011216503_100009815986 [0,2,0,0,0,0|2,0,0]=4 15749 B16R0.8180 COC(=O)CCCCCCN(C)CC(O)CO 269982a_100011216503_100009815986 [0,2,0,0,0,0|2,0,0]=4 15750 B16R0.183 C=COC(=O)COCCC(C)CCCCCC 34a_200011024964_100000036128 [0,2,0,0,0,0|1,0,1]=4 15751 B16R0.183 CCCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210757 [0,2,0,0,0,0|0,0,1]=3 15752 B16R0.183 CCCCCCC(=O)CCCCC(=O)OCC 1458a_100102632555_100000750268 [0,2,0,0,0,0|0,0,1]=3 15753 B16R0.183 CCCCCCC(=O)CCOCC(=O)OCC 1458a_100102632555_100000088970 [0,2,0,0,0,0|1,0,1]=4 15754 B16R0.183 CCCCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100102632555 [0,2,0,0,0,0|1,0,1]=4 15755 B16R0.183 CCCCCCC(C)CCOCC(=O)CCC 7a_200011024964_100000747444 [0,2,0,0,0,0|2,0,0]=4 15756 B16R0.183 CCCCCCC(C)CCOCC(=O)NCC 34a_200011024964_100000183381 [0,2,0,0,0,0|2,0,0]=4 15757 B16R0.183 CCCCCCC(C)CCOCC(=O)NCC 7a_200011024964_100000183381 [0,2,0,0,0,0|2,0,0]=4 15758 B16R0.183 CCCCCCC(C)CCOCC(=O)NCO 34a_200011024964_100000185155 [0,2,0,0,0,0|2,0,0]=4 15759 B16R0.183 CCCCCCC(C)CCOCC(=O)NCO 7a_200011024964_100000185155 [0,2,0,0,0,0|2,0,0]=4 15760 B16R0.183 CCCCCCC(C)CCOCC(=O)OCC 34a_200011024964_100000188475 [0,2,0,0,0,0|1,0,0]=3 15761 B16R0.183 CCCCCCC(C)CCOCC(=O)OCC 7a_200011024964_100000188475 [0,2,0,0,0,0|1,0,0]=3 15762 B16R0.183 CCCCCCC(C)NCCCC(=O)OCC 2230a_100000210919_100009991533 [0,2,0,0,0,0|1,0,0]=3 15763 B16R0.183 CCCCCCC(C)NCCCC(=O)OCC 34a_100000210919_100009991533 [0,2,0,0,0,0|1,0,0]=3 15764 B16R0.183 CCCCCCC(C)OCCCC(=O)OCC 34a_100000210265_100009991533 [0,2,0,0,0,0|1,0,0]=3 15765 B16R0.183 CCCCCCC(C)OCCCC(=O)OCC 7a_100000210265_100011215271 [0,2,0,0,0,0|1,0,0]=3 15766 B16R0.183 CCCCCCC(C)OCCCC(=O)OCC 7a_100012001163_100011215978 [0,2,0,0,0,0|1,0,0]=3 15767 B16R0.183 CCCCCCC(C)OCCNC(=O)OCC 34a_100000158857_100011215978 [0,2,0,0,0,0|2,0,0]=4 15768 B16R0.183 CCCCCCC(C)OCCNC(=O)OCC 7a_100000210265_200011445536 [0,2,0,0,0,0|2,0,0]=4 15769 B16R0.183 CCCCCCC(C)SCCCC(=O)OCC 62a_100009991533_100011215978 [0,2,0,0,0,0|1,0,0]=3 15770 B16R0.183 CCCCCCC(C)SCCCC(=O)OCC 62a_100011215978_100009991533 [0,2,0,0,0,0|1,0,0]=3 15771 B16R0.183 CCCCCCC(C)SCCNC(=O)OCC 62a_100011215978_200011445536 [0,2,0,0,0,0|2,0,0]=4 15772 B16R0.183 CCCCCCN(C)CCCCC(=O)OCC 2230a_106256046315_100000750268 [0,2,0,0,0,0|1,0,0]=3 15773 B16R0.183 CCCCCCN(C)CCCCC(=O)OCC 269982a_106256046315_100000750268 [0,2,0,0,0,0|1,0,0]=3 15774 B16R0.183 CCCCCCN(C)CCOCC(=O)OCC 2230a_106256046315_100000088970 [0,2,0,0,0,0|2,0,0]=4 15775 B16R0.183 CCCCCCN(C)CCOCC(=O)OCC 269982a_106256046315_100000088970 [0,2,0,0,0,0|2,0,0]=4 15776 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 11a_100000209983_100011217402 [0,2,0,0,0,0|1,0,1]=4 15777 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 1626a_100000209983_100011217402 [0,2,0,0,0,0|1,0,1]=4 15778 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 240690a_100000209983_100011217402 [0,2,0,0,0,0|1,0,1]=4 15779 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 527a_100000209983_100011217402 [0,2,0,0,0,0|1,0,1]=4 15780 B16R0.183 CCCCOCC(=O)CCCCC(=O)OCC 1458a_100000757543_100000750268 [0,2,0,0,0,0|1,0,1]=4 15781 B16R0.183 CCCCOCC(=O)CCCCC(=O)OCC 1458a_100011217402_100011995733 [0,2,0,0,0,0|1,0,1]=4 15782 B16R0.183 CCCCOCC(C)OCCCC(=O)OCC 34a_100011217071_100009991533 [0,2,0,0,0,0|2,0,0]=4 15783 B16R0.183 CCCCOCC(C)OCCCC(=O)OCC 7a_100011217071_100011215271 [0,2,0,0,0,0|2,0,0]=4 15784 B16R0.183 CCCCSCC(=O)CCCCC(=O)OCC 1458a_100000191162_100000750268 [0,2,0,0,0,0|1,0,1]=4 15785 B16R0.183 CCCOCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100011215938 [0,2,0,0,0,0|1,0,1]=4 15786 B16R0.183 CCOC(=O)CCCCC(=O)CCCCCF 1458a_100011217402_100000729378 [0,2,0,0,0,0|1,0,1]=4 15787 B16R0.183 CCOC(=O)CCCCC(=O)CCCCCO 1458a_100011217402_100000746330 [0,2,0,0,0,0|1,0,1]=4 15788 B16R0.183 CCOC(=O)CCCCC(=O)CCCCCO 1458a_100102619762_100000750268 [0,2,0,0,0,0|1,0,1]=4 15789 B16R0.183 CCOC(=O)CCCCC(=O)CCCCOC 1458a_100011217402_100000755781 [0,2,0,0,0,0|1,0,1]=4 15790 B16R0.183 CCOC(=O)CCCCN(C)CCCCCO 2230a_100000722520_100000750268 [0,2,0,0,0,0|2,0,0]=4 15791 B16R0.183 CCOC(=O)CCCCN(C)CCCCCO 269982a_100000722520_100000750268 [0,2,0,0,0,0|2,0,0]=4 15792 B16R0.183 CCOCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100012232248 [0,2,0,0,0,0|1,0,1]=4 15793 B16R0.188 CCCCCCC(=O)CC(=O)CCC(=O)OC 1458a_100102632555_100000691467 [0,2,0,0,0,0|0,0,2]=4 15794 B16R0.188 CCCCCCC(C)NC(=O)CCC(=O)OC 11a_100000210919_100000187943 [0,2,0,0,0,0|1,0,1]=4 15795 B16R0.188 CCCCCCC(C)NC(=O)CCC(=O)OC 1626a_100000210919_100000187943 [0,2,0,0,0,0|1,0,1]=4 15796 B16R0.188 CCCCCCC(C)NC(=O)CCC(=O)OC 240690a_100000210919_100000187943 [0,2,0,0,0,0|1,0,1]=4 15797 B16R0.188 CCCCCCC(C)NC(=O)CCC(=O)OC 527a_100000210919_100000187943 [0,2,0,0,0,0|1,0,1]=4 15798 B16R0.188 CCCCCCN(C)CC(=O)CCC(=O)OC 2230a_106256046315_100000691467 [0,2,0,0,0,0|1,0,1]=4 15799 B16R0.188 CCCCCCN(C)CC(=O)CCC(=O)OC 269982a_106256046315_100000691467 [0,2,0,0,0,0|1,0,1]=4 15800 B16R0.360 CCCCC(C)NC(=O)CCCCC(=O)OC 11a_100000126638_100000695723 [0,2,0,0,0,0|1,0,1]=4 15801 B16R0.360 CCCCC(C)NC(=O)CCCCC(=O)OC 1626a_100000126638_100000695723 [0,2,0,0,0,0|1,0,1]=4 15802 B16R0.360 CCCCC(C)NC(=O)CCCCC(=O)OC 240690a_100000126638_100000695723 [0,2,0,0,0,0|1,0,1]=4 15803 B16R0.360 CCCCC(C)NC(=O)CCCCC(=O)OC 527a_100000126638_100000695723 [0,2,0,0,0,0|1,0,1]=4 15804 B16R0.857 CCCCCCC(C)(C)OCCCC(=O)NC 7a_200011995690_100000741757 [0,2,0,0,0,0|2,0,0]=4 15805 B16R0.857 CCCCCCC(C)(C)OCCCC(=O)OC 7a_200011995690_100011218270 [0,2,0,0,0,0|1,0,0]=3 15806 B16R0.857 CCCCCNS(=O)(=O)CCCCC(=O)OC 270084a_100000209983_100000055593 [0,2,0,0,0,0|2,0,0]=4 15807 B16R0.857 CCCCCNS(=O)(=O)CCCCC(=O)OC 274078a_100000209983_100000055593 [0,2,0,0,0,0|2,0,0]=4 15808 B16R0.857 COC(=O)CCCOC(C)(C)CCCCCBr 7a_100010402123_100011218270 [0,2,0,0,0,0|2,0,0]=4 15809 B16R0.1096 CCCCCCC(=O)CCCN(C)C(=O)OC 1458a_100000752137_100000210757 [0,2,0,0,0,0|1,0,1]=4 15810 B16R0.1096 CCCCCCC(C)CCOC(C)C(=O)CC 7a_200011024964_100000742827 [0,2,0,0,0,0|2,0,0]=4 15811 B16R0.1096 CCCCCCC(C)CCOC(C)C(=O)NC 34a_200011024964_100000731044 [0,2,0,0,0,0|2,0,0]=4 15812 B16R0.1096 CCCCCCC(C)CCOC(C)C(=O)NC 7a_200011024964_100000209862 [0,2,0,0,0,0|2,0,0]=4 15813 B16R0.1096 CCCCCCC(C)CCOC(C)C(=O)OC 34a_200011024964_100000211248 [0,2,0,0,0,0|1,0,0]=3 15814 B16R0.1096 CCCCCCC(C)CCOC(C)C(=O)OC 7a_200011024964_100000211248 [0,2,0,0,0,0|1,0,0]=3 15815 B16R0.1096 CCCCCCC(C)CCOC(F)C(=O)NC 34a_200011024964_100009813575 [0,2,0,0,0,0|2,0,0]=4 15816 B16R0.1096 CCCCCCC(C)CCOC(F)C(=O)NC 7a_200011024964_100009813575 [0,2,0,0,0,0|2,0,0]=4 15817 B16R0.1096 CCCCCCC(C)NCCC(C)C(=O)OC 2230a_100000210919_100000034942 [0,2,0,0,0,0|1,0,0]=3 15818 B16R0.1096 CCCCCCC(C)NCCC(C)C(=O)OC 34a_100000210919_100000034942 [0,2,0,0,0,0|1,0,0]=3 15819 B16R0.1096 CCCCCCC(C)OCCC(C)C(=O)OC 34a_100000210265_100000034942 [0,2,0,0,0,0|1,0,0]=3 15820 B16R0.1096 CCCCCCC(C)OCCC(C)C(=O)OC 7a_100000210265_100000034942 [0,2,0,0,0,0|1,0,0]=3 15821 B16R0.1096 CCCCCCC(C)SCCC(C)C(=O)OC 62a_100000034942_100011215978 [0,2,0,0,0,0|1,0,0]=3 15822 B16R0.1096 CCCCCCC(C)SCCC(C)C(=O)OC 62a_100011215978_100000034942 [0,2,0,0,0,0|1,0,0]=3 15823 B16R0.1096 CCCCOCC(C)OCCC(C)C(=O)OC 34a_100011217071_100000034942 [0,2,0,0,0,0|2,0,0]=4 15824 B16R0.1096 CCCCOCC(C)OCCC(C)C(=O)OC 7a_100011217071_100000034942 [0,2,0,0,0,0|2,0,0]=4 15825 B16R0.1262 CCCCCCC(=O)NCC(O)CC(=O)OC 188690a_100025770978_100102632555 [0,2,0,0,0,0|1,0,1]=4 15826 B16R0.1262 CCCCCCC(C)NC[C@H](O)CC(=O)OC 34a_100000210919_100000754131 [0,2,0,0,0,0|1,0,0]=3 15827 B16R0.1262 CCCCCCC(C)OC[C@H](O)CC(=O)OC 34a_100000210265_100000754131 [0,2,0,0,0,0|1,0,0]=3 15828 B16R0.1262 CCCCCCC(C)OC[C@H](O)CC(=O)OC 7a_100000210265_100000754131 [0,2,0,0,0,0|1,0,0]=3 15829 B16R0.1262 CCCCCCC(C)SCC(=O)CC(=O)OC 62a_100000210525_100011215978 [0,2,0,0,0,0|1,0,1]=4 15830 B16R0.1262 CCCCCCC(C)SCC(=O)CC(=O)OC 62a_100011215978_100000210525 [0,2,0,0,0,0|1,0,1]=4 15831 B16R0.1262 CCCCCCC(C)SC[C@H](O)CC(=O)OC 62a_100000754131_100011215978 [0,2,0,0,0,0|1,0,0]=3 15832 B16R0.1262 CCCCCCC(C)SC[C@H](O)CC(=O)OC 62a_100011215978_100000754131 [0,2,0,0,0,0|1,0,0]=3 15833 B16R0.1262 CCCCOCC(C)OC[C@H](O)CC(=O)OC 34a_100011217071_100000754131 [0,2,0,0,0,0|2,0,0]=4 15834 B16R0.1262 CCCCOCC(C)OC[C@H](O)CC(=O)OC 7a_100011217071_100000754131 [0,2,0,0,0,0|2,0,0]=4 15835 B16R0.3151 CCCCCC(C)C(=O)CCCCC(=O)OC 1458a_100000695723_200011218191 [0,2,0,0,0,0|0,0,1]=3 15836 B16R0.3151 CCCCCC(C)C(=O)CCCCC(=O)OC 1458a_100011215998_100000204269 [0,2,0,0,0,0|0,0,1]=3 15837 B16R0.3151 CCCCCC(C)C(=O)CCCNC(=O)OC 1458a_100000753017_200011218191 [0,2,0,0,0,0|1,0,1]=4 15838 B16R0.3151 CCCCCC(C)C(=O)CCOCC(=O)OC 1458a_100011215998_100000090808 [0,2,0,0,0,0|1,0,1]=4 15839 B16R0.3151 CCCCCC(C)C(=O)NCCCC(=O)OC 188690a_100000184769_100011215998 [0,2,0,0,0,0|1,0,1]=4 15840 B16R0.3151 CCCCCN(C)C(=O)CCCCC(=O)OC 11a_100000223495_100000695723 [0,2,0,0,0,0|1,0,1]=4 15841 B16R0.3151 CCCCCN(C)C(=O)CCCCC(=O)OC 1626a_100000223495_100000695723 [0,2,0,0,0,0|1,0,1]=4 15842 B16R0.3151 CCCCCN(C)C(=O)CCCCC(=O)OC 240690a_100000223495_100000695723 [0,2,0,0,0,0|1,0,1]=4 15843 B16R0.3151 CCCCCN(C)C(=O)CCCCC(=O)OC 527a_100000223495_100000695723 [0,2,0,0,0,0|1,0,1]=4 15844 B16R0.3151 CCCCSC(C)C(=O)CCCCC(=O)OC 1458a_100000191163_100000204269 [0,2,0,0,0,0|1,0,1]=4 15845 B16R0.4706 C#CC(CCCCCBr)OCCCC(=O)OC 34a_200010408556_100000742333 [0,2,0,0,0,0|2,0,0]=4 15846 B16R0.4706 C#CC(CCCCCBr)OCCCC(=O)OC 7a_200010408556_100011218270 [0,2,0,0,0,0|2,0,0]=4 15847 B16R0.4706 C=CC(CCCCCC)OCCCC(=O)NC 34a_200011215977_100000741757 [0,2,0,0,0,0|2,0,0]=4 15848 B16R0.4706 C=CC(CCCCCC)OCCCC(=O)NC 7a_200011215977_100000741757 [0,2,0,0,0,0|2,0,0]=4 15849 B16R0.4706 C=CC(CCCCCC)OCCCC(=O)OC 34a_200011215977_100000742333 [0,2,0,0,0,0|1,0,0]=3 15850 B16R0.4706 C=CC(CCCCCC)OCCCC(=O)OC 7a_200011215977_100011218270 [0,2,0,0,0,0|1,0,0]=3 15851 B16R0.4706 CCCCCCC(CC)NCCCC(=O)NC 270004a_100000740002_100011219640 [0,2,0,0,0,0|2,0,0]=4 15852 B16R0.4706 CCCCCCC(CC)OCCCC(=O)NC 34a_100011215785_100000741757 [0,2,0,0,0,0|2,0,0]=4 15853 B16R0.4706 CCCCCCC(CC)OCCCC(=O)NC 7a_100011215785_100000741757 [0,2,0,0,0,0|2,0,0]=4 15854 B16R0.4706 CCCCCCC(CC)OCCCC(=O)OC 34a_100011215785_100000742333 [0,2,0,0,0,0|1,0,0]=3 15855 B16R0.4706 CCCCCCC(CC)OCCCC(=O)OC 7a_100011215785_100011218270 [0,2,0,0,0,0|1,0,0]=3 15856 B16R0.5760 CCCC(C)CCC(C)NCCCC(=O)NC 270004a_100000740002_200011216527 [0,2,0,0,0,0|2,0,0]=4 15857 B16R0.8231 COC(=O)CCCCC(=O)CCCCC(=O)C 1458a_100000695723_100000735457 [0,2,0,0,0,0|0,0,2]=4 15858 B16R0.8231 COC(=O)CCCCC(=O)CCCCC(C)C 1458a_100000695723_100011216152 [0,2,0,0,0,0|0,0,1]=3 15859 B16R0.8231 COC(=O)CCCCC(=O)CCCCC(C)C 1458a_100011933920_100000204269 [0,2,0,0,0,0|0,0,1]=3 15860 B16R0.8231 COC(=O)CCCCC(=O)NCCCC(C)C 11a_200000737386_100000695723 [0,2,0,0,0,0|1,0,1]=4 15861 B16R0.8231 COC(=O)CCCCC(=O)NCCCC(C)C 1626a_200000737386_100000695723 [0,2,0,0,0,0|1,0,1]=4 15862 B16R0.8231 COC(=O)CCCCC(=O)NCCCC(C)C 240690a_200000737386_100000695723 [0,2,0,0,0,0|1,0,1]=4 15863 B16R0.8231 COC(=O)CCCCC(=O)NCCCC(C)C 527a_200000737386_100000695723 [0,2,0,0,0,0|1,0,1]=4 15864 B16R0.8231 COC(=O)CCCNC(=O)CCCCC(C)C 188690a_100000184769_100011933920 [0,2,0,0,0,0|1,0,1]=4 15865 B16R0.8231 COC(=O)COCCC(=O)CCCCC(C)C 1458a_100011933920_100000090808 [0,2,0,0,0,0|1,0,1]=4 15866 B16R0.8231 COC(=O)NCCCC(=O)CCCCC(C)C 1458a_100000753017_100011216152 [0,2,0,0,0,0|1,0,1]=4 15867 B16R0.171 C=C(C)CCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000730704 [0,2,0,0,0,0|0,0,2]=4 15868 B16R0.171 C=C(C)CCC(=O)CCCCCCC(=O)OC 1458a_200000688413_100009815986 [0,2,0,0,0,0|0,0,2]=4 15869 B16R0.171 COC(=O)CCCCCCC(=O)CCC(C)C 1458a_100000036694_100000210312 [0,2,0,0,0,0|0,0,1]=3 15870 B16R0.171 COC(=O)CCCCCCC(=O)CCC(C)C 1458a_100000181311_100009815986 [0,2,0,0,0,0|0,0,1]=3 15871 B16R0.171 COC(=O)CCCCCCC(=O)CCC(C)O 1458a_100000036694_100012276601 [0,2,0,0,0,0|0,0,1]=3 15872 B16R0.171 COC(=O)CCCCCCC(=O)CC[S+](C)C 1458a_100009452791_100009815986 [0,2,0,0,0,0|1,0,1]=4 15873 B16R0.171 COC(=O)CCCCCCC(=O)COC(C)C 1458a_100000745533_100009815986 [0,2,0,0,0,0|1,0,1]=4 15874 B16R0.171 COC(=O)CCCCCCC(=O)CSC(C)C 1458a_100000241585_100009815986 [0,2,0,0,0,0|1,0,1]=4 15875 B16R0.171 COC(=O)CCCCCCC(=O)NCC(C)C 11a_100000210953_100000036694 [0,2,0,0,0,0|1,0,1]=4 15876 B16R0.171 COC(=O)CCCCCCC(=O)NCC(C)C 1626a_100000210953_100000036694 [0,2,0,0,0,0|1,0,1]=4 15877 B16R0.171 COC(=O)CCCCCCC(=O)NCC(C)C 240690a_100000210953_100000036694 [0,2,0,0,0,0|1,0,1]=4 15878 B16R0.171 COC(=O)CCCCCCC(=O)NCC(C)O 11a_100000210904_100000036694 [0,2,0,0,0,0|1,0,1]=4 15879 B16R0.171 COC(=O)CCCCCCC(=O)NCC(C)O 240690a_100000210904_100000036694 [0,2,0,0,0,0|1,0,1]=4 15880 B16R0.171 COC(=O)CCCCCCN(C)CCC(C)C 2230a_100000742789_100009815986 [0,2,0,0,0,0|1,0,0]=3 15881 B16R0.171 COC(=O)CCCCCCN(C)CCC(C)C 269982a_100000742789_100009815986 [0,2,0,0,0,0|1,0,0]=3 15882 B16R0.171 COC(=O)CCCCCCN(C)CCN(C)C 269982a_100000225618_100009815986 [0,2,0,0,0,0|2,0,0]=4 15883 B16R0.171 COC(=O)CCCCCNC(=O)CCC(C)C 188690a_100000184999_100000181311 [0,2,0,0,0,0|1,0,1]=4 15884 B16R0.171 COC(=O)CCCCCNC(=O)CCC(C)O 188690a_100000184999_100000718519 [0,2,0,0,0,0|1,0,1]=4 15885 B16R0.171 COC(=O)CCCCCNC(C)CCC(C)C 2230a_100138410893_100009816466 [0,2,0,0,0,0|1,0,0]=3 15886 B16R0.171 COC(=O)CCCCCOC(C)CCC(C)C 34a_100000074720_100011261404 [0,2,0,0,0,0|1,0,0]=3 15887 B16R0.171 COC(=O)CCCCCOC(C)CCC(C)C 34a_100011215350_100009816466 [0,2,0,0,0,0|1,0,0]=3 15888 B16R0.171 COC(=O)CCCCCOC(C)CCC(C)C 7a_100011215350_100009816466 [0,2,0,0,0,0|1,0,0]=3 15889 B16R0.171 COC(=O)CCCCCSC(C)CCC(C)C 62a_100009816466_100011261404 [0,2,0,0,0,0|1,0,0]=3 15890 B16R0.171 COC(=O)CCCCCSC(C)CCC(C)C 62a_100011261404_100009816466 [0,2,0,0,0,0|1,0,0]=3 15891 B16R0.195 C=COC(=O)COCCCCC(C)CCCC 34a_200011021034_100000036128 [0,2,0,0,0,0|1,0,1]=4 15892 B16R0.195 CCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210211 [0,2,0,0,0,0|0,0,1]=3 15893 B16R0.195 CCCCC(=O)CCCCCCC(=O)OCC 1458a_100000210183_100009814379 [0,2,0,0,0,0|0,0,1]=3 15894 B16R0.195 CCCCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100000210183 [0,2,0,0,0,0|1,0,1]=4 15895 B16R0.195 CCCCC(C)CCCCOCC(=O)CCC 7a_200011021034_100000747444 [0,2,0,0,0,0|2,0,0]=4 15896 B16R0.195 CCCCC(C)CCCCOCC(=O)NCC 34a_200011021034_100000183381 [0,2,0,0,0,0|2,0,0]=4 15897 B16R0.195 CCCCC(C)CCCCOCC(=O)NCC 7a_200011021034_100000183381 [0,2,0,0,0,0|2,0,0]=4 15898 B16R0.195 CCCCC(C)CCCCOCC(=O)NCO 34a_200011021034_100000185155 [0,2,0,0,0,0|2,0,0]=4 15899 B16R0.195 CCCCC(C)CCCCOCC(=O)NCO 7a_200011021034_100000185155 [0,2,0,0,0,0|2,0,0]=4 15900 B16R0.195 CCCCC(C)CCCCOCC(=O)OCC 34a_200011021034_100000188475 [0,2,0,0,0,0|1,0,0]=3 15901 B16R0.195 CCCCC(C)CCCCOCC(=O)OCC 7a_200011021034_100000188475 [0,2,0,0,0,0|1,0,0]=3 15902 B16R0.195 CCCCC(C)COCCCCC(=O)OCC 34a_100011995851_100000750268 [0,2,0,0,0,0|1,0,0]=3 15903 B16R0.195 CCCCC(C)COCCCCC(=O)OCC 7a_100011995851_100000750268 [0,2,0,0,0,0|1,0,0]=3 15904 B16R0.195 CCCCC(C)COCCOCC(=O)OCC 34a_100011995851_100000088970 [0,2,0,0,0,0|2,0,0]=4 15905 B16R0.195 CCCCC(C)COCCOCC(=O)OCC 7a_100011995851_100000088970 [0,2,0,0,0,0|2,0,0]=4 15906 B16R0.195 CCCCC(C)NCCCCCC(=O)OCC 2230a_100000126638_100000755133 [0,2,0,0,0,0|1,0,0]=3 15907 B16R0.195 CCCCC(C)NCCCOCC(=O)OCC 2230a_100000126638_100009893628 [0,2,0,0,0,0|2,0,0]=4 15908 B16R0.195 CCCCC(C)OCCCCCC(=O)OCC 34a_100000687866_100000755133 [0,2,0,0,0,0|1,0,0]=3 15909 B16R0.195 CCCCC(C)OCCCCCC(=O)OCC 7a_100000687866_100000755133 [0,2,0,0,0,0|1,0,0]=3 15910 B16R0.195 CCCCC(C)OCCCCCC(=O)OCC 7a_100011214988_200011215066 [0,2,0,0,0,0|1,0,0]=3 15911 B16R0.195 CCCCC(C)OCCCOCC(=O)OCC 34a_100000687866_100009893628 [0,2,0,0,0,0|2,0,0]=4 15912 B16R0.195 CCCCC(C)OCCCOCC(=O)OCC 7a_100000687866_100009893628 [0,2,0,0,0,0|2,0,0]=4 15913 B16R0.195 CCCCC(C)SCCCCCC(=O)OCC 62a_100000755133_200011215066 [0,2,0,0,0,0|1,0,0]=3 15914 B16R0.195 CCCCC(C)SCCCCCC(=O)OCC 62a_200011215066_100000755133 [0,2,0,0,0,0|1,0,0]=3 15915 B16R0.195 CCCCC(C)SCCCOCC(=O)OCC 62a_100009893628_200011215066 [0,2,0,0,0,0|2,0,0]=4 15916 B16R0.195 CCCCC(C)SCCCOCC(=O)OCC 62a_200011215066_100009893628 [0,2,0,0,0,0|2,0,0]=4 15917 B16R0.195 CCCCN(C)CCCCCCC(=O)OCC 2230a_100000207549_100009814379 [0,2,0,0,0,0|1,0,0]=3 15918 B16R0.195 CCCCN(C)CCCCCCC(=O)OCC 269982a_100000207549_100009814379 [0,2,0,0,0,0|1,0,0]=3 15919 B16R0.195 CCCC[C@H](N)COCCCCC(=O)OCC 34a_100011934283_100000750268 [0,2,0,0,0,0|1,0,0]=3 15920 B16R0.195 CCCC[C@H](N)COCCOCC(=O)OCC 34a_100011934283_100000088970 [0,2,0,0,0,0|2,0,0]=4 15921 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 11a_100020643023_100000031895 [0,2,0,0,0,0|1,0,1]=4 15922 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 1626a_100020643023_100000031895 [0,2,0,0,0,0|1,0,1]=4 15923 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 240690a_100020643023_100000031895 [0,2,0,0,0,0|1,0,1]=4 15924 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 527a_100020643023_100000031895 [0,2,0,0,0,0|1,0,1]=4 15925 B16R0.195 CCCOC(C)CNCCCCC(=O)OCC 2230a_100015185124_100000750268 [0,2,0,0,0,0|2,0,0]=4 15926 B16R0.195 CCCOC(C)CNCCCCC(=O)OCC 34a_100015185124_100000750268 [0,2,0,0,0,0|2,0,0]=4 15927 B16R0.195 CCOC(=O)CCCCCCC(=O)CCCF 1458a_100000031895_100011934791 [0,2,0,0,0,0|1,0,1]=4 15928 B16R0.195 CCOC(=O)CCCCCCC(=O)CCCO 1458a_100000031895_100011215043 [0,2,0,0,0,0|1,0,1]=4 15929 B16R0.195 CCOC(=O)CCCCCCC(=O)CCOC 1458a_100000031895_100000233755 [0,2,0,0,0,0|1,0,1]=4 15930 B16R0.195 CCOC(=O)CCCCCCC(=O)CCOC 1458a_100000749529_100009814379 [0,2,0,0,0,0|1,0,1]=4 15931 B16R0.195 CCOC(=O)CCCCCCC(=O)CCSC 1458a_100000031895_100000751147 [0,2,0,0,0,0|1,0,1]=4 15932 B16R0.195 CCOC(=O)CCCCCCC(=O)CCSC 1458a_100000174002_100009814379 [0,2,0,0,0,0|1,0,1]=4 15933 B16R0.195 CCOC(=O)CCCCCCC(=O)CSCC 1458a_100000230394_100009814379 [0,2,0,0,0,0|1,0,1]=4 15934 B16R0.195 CCOC(=O)CCCCCCN(C)CCCO 2230a_100000213112_100009814379 [0,2,0,0,0,0|2,0,0]=4 15935 B16R0.195 CCOC(=O)CCCCCCN(C)CCCO 269982a_100000213112_100009814379 [0,2,0,0,0,0|2,0,0]=4 15936 B16R0.195 CCOC(=O)CCCCCCN(C)CCOC 2230a_100000743101_100009814379 [0,2,0,0,0,0|2,0,0]=4 15937 B16R0.195 CCOC(=O)CCCCCCN(C)CCOC 269982a_100000743101_100009814379 [0,2,0,0,0,0|2,0,0]=4 15938 B16R0.195 CCOC(=O)CCCCCCN(C)CCSC 2230a_100000686725_100009814379 [0,2,0,0,0,0|2,0,0]=4 15939 B16R0.195 CCOC(=O)CCCCCCN(C)CCSC 269982a_100000686725_100009814379 [0,2,0,0,0,0|2,0,0]=4 15940 B16R0.195 CCOC(=O)CCCCCOC(C)CCCCl 34a_200000718107_100000755133 [0,2,0,0,0,0|2,0,0]=4 15941 B16R0.195 CCOC(=O)CCCCCOC(C)CCCCl 7a_200000718107_100000755133 [0,2,0,0,0,0|2,0,0]=4 15942 B16R0.195 CCOC(=O)CCCCNC[C@H](C)CCCO 2230a_100160569302_100000750268 [0,2,0,0,0,0|2,0,0]=4 15943 B16R0.195 CCOC(=O)CCCCNC[C@H](C)CCCO 34a_100160569302_100000750268 [0,2,0,0,0,0|2,0,0]=4 15944 B16R0.195 CCOC(=O)CCCCOC[C@@H](N)CCSC 34a_100011827619_100000750268 [0,2,0,0,0,0|2,0,0]=4 15945 B16R0.195 CCOCC(=O)CCCCCCC(=O)OCC 1458a_100000211967_100009814379 [0,2,0,0,0,0|1,0,1]=4 15946 B16R0.195 CCOCC(C)OCCCCCC(=O)OCC 34a_100000718985_100000755133 [0,2,0,0,0,0|2,0,0]=4 15947 B16R0.195 CCOCC(C)OCCCCCC(=O)OCC 7a_100000718985_100000755133 [0,2,0,0,0,0|2,0,0]=4 15948 B16R0.195 CCOCC(O)CNCCCCC(=O)OCC 2230a_102515437182_100000750268 [0,2,0,0,0,0|2,0,0]=4 15949 B16R0.195 CCOCC(O)CNCCCCC(=O)OCC 34a_102515437182_100000750268 [0,2,0,0,0,0|2,0,0]=4 15950 B16R0.198 CCCCC(C)CCCCOC(C)C(=O)CC 7a_200011021034_100000742827 [0,2,0,0,0,0|2,0,0]=4 15951 B16R0.198 CCCCC(C)CCCCOC(C)C(=O)NC 34a_200011021034_100000731044 [0,2,0,0,0,0|2,0,0]=4 15952 B16R0.198 CCCCC(C)CCCCOC(C)C(=O)NC 7a_200011021034_100000209862 [0,2,0,0,0,0|2,0,0]=4 15953 B16R0.198 CCCCC(C)CCCCOC(C)C(=O)OC 34a_200011021034_100000211248 [0,2,0,0,0,0|1,0,0]=3 15954 B16R0.198 CCCCC(C)CCCCOC(C)C(=O)OC 7a_200011021034_100000211248 [0,2,0,0,0,0|1,0,0]=3 15955 B16R0.198 CCCCC(C)CCCCOC(F)C(=O)NC 34a_200011021034_100009813575 [0,2,0,0,0,0|2,0,0]=4 15956 B16R0.198 CCCCC(C)CCCCOC(F)C(=O)NC 7a_200011021034_100009813575 [0,2,0,0,0,0|2,0,0]=4 15957 B16R0.251 CCCC(C)C(=O)CCCCCCC(=O)OC 1458a_100000036694_100000766640 [0,2,0,0,0,0|0,0,1]=3 15958 B16R0.251 CCCC(C)C(=O)CCCCCCC(=O)OC 1458a_100000210906_100009815986 [0,2,0,0,0,0|0,0,1]=3 15959 B16R0.251 CCCC(C)C(=O)NCCCCCC(=O)OC 188690a_100000184999_100000210906 [0,2,0,0,0,0|1,0,1]=4 15960 B16R0.251 CCCC(C)C(C)OCCCCCC(=O)OC 34a_100000708338_100009816466 [0,2,0,0,0,0|1,0,0]=3 15961 B16R0.251 CCCC(C)C(C)OCCCCCC(=O)OC 7a_100000708338_100009816466 [0,2,0,0,0,0|1,0,0]=3 15962 B16R0.251 CCCN(C)C(=O)CCCCCCC(=O)OC 11a_100000747261_100000036694 [0,2,0,0,0,0|1,0,1]=4 15963 B16R0.251 CCCN(C)C(=O)CCCCCCC(=O)OC 1626a_100000747261_100000036694 [0,2,0,0,0,0|1,0,1]=4 15964 B16R0.251 CCCN(C)C(=O)CCCCCCC(=O)OC 240690a_100000747261_100000036694 [0,2,0,0,0,0|1,0,1]=4 15965 B16R0.251 CCC[C@H](O)C(=O)CCCCCCC(=O)OC 1458a_100009822183_100009815986 [0,2,0,0,0,0|0,0,1]=3 15966 B16R0.251 CCC[C@H](O)C(=O)NCCCCCC(=O)OC 188690a_100000184999_100009822183 [0,2,0,0,0,0|1,0,1]=4 15967 B16R0.251 CCOC(C)C(=O)CCCCCCC(=O)OC 1458a_100000739345_100009815986 [0,2,0,0,0,0|1,0,1]=4 15968 B16R0.251 CCSC(C)C(=O)CCCCCCC(=O)OC 1458a_100000230601_100009815986 [0,2,0,0,0,0|1,0,1]=4 15969 B16R0.251 COC(=O)CCCCCCC(=O)C(C)CCO 1458a_100000036694_100009893172 [0,2,0,0,0,0|1,0,1]=4 15970 B16R0.251 COC(=O)CCCCCCC(=O)C(C)CSC 1458a_100000753918_100009815986 [0,2,0,0,0,0|1,0,1]=4 15971 B16R0.251 COC(=O)CCCCCCN(C)C(C)CCO 2230a_100000731037_100009815986 [0,2,0,0,0,0|2,0,0]=4 15972 B16R0.251 COC(=O)CCCCCCN(C)C(C)CCO 269982a_100000731037_100009815986 [0,2,0,0,0,0|2,0,0]=4 15973 B16R0.251 COCC(C)C(=O)CCCCCCC(=O)OC 1458a_100000036694_100000765312 [0,2,0,0,0,0|1,0,1]=4 15974 B16R0.251 COCC(C)C(=O)CCCCCCC(=O)OC 1458a_100000751857_100009815986 [0,2,0,0,0,0|1,0,1]=4 15975 B16R0.1768 CCCCC(C)(C)COCCCCC(=O)OC 7a_200011995781_100000204269 [0,2,0,0,0,0|1,0,0]=3 15976 B16R0.1768 CCCCC(C)(C)COCCOCC(=O)OC 7a_200011995781_100000090808 [0,2,0,0,0,0|2,0,0]=4 15977 B16R0.1768 CCCCC(C)(C)OCCCCCC(=O)OC 7a_100011219641_100009816466 [0,2,0,0,0,0|1,0,0]=3 15978 B16R0.1768 CCCC[Si](C)(C)COCCCCC(=O)OC 7a_100000059025_200000073895 [0,2,0,0,0,0|1,1,0]=4 15979 B16R0.1768 CCCC[Si](C)(C)CSCCCCC(=O)OC 62a_100000204269_200000073895 [0,2,0,0,0,0|1,1,0]=4 15980 B16R0.1768 CCCC[Si](C)(C)CSCCCCC(=O)OC 62a_200000073895_100000204269 [0,2,0,0,0,0|1,1,0]=4 15981 B16R0.1768 COC(=O)CCCCCOC(C)(C)CCCBr 7a_100009888830_100009816466 [0,2,0,0,0,0|2,0,0]=4 15982 B16R0.3355 CCCCC(C)C(=O)CCCCCC(=O)OC 1458a_100000725509_100009816466 [0,2,0,0,0,0|0,0,1]=3 15983 B16R0.3355 CCCCC(C)C(=O)CCCCCC(=O)OC 1458a_100009848860_200011215066 [0,2,0,0,0,0|0,0,1]=3 15984 B16R0.3355 CCCCC(C)C(=O)NCCCCC(=O)OC 188690a_100000746077_100000725509 [0,2,0,0,0,0|1,0,1]=4 15985 B16R0.3355 CCCCC(O)C(=O)CCCCCC(=O)OC 1458a_100000720857_100009816466 [0,2,0,0,0,0|0,0,1]=3 15986 B16R0.3355 CCCCC(O)C(=O)NCCCCC(=O)OC 188690a_100000746077_100000720857 [0,2,0,0,0,0|1,0,1]=4 15987 B16R0.3355 CCCCN(C)C(=O)CCCCCC(=O)OC 11a_100000207549_100009848860 [0,2,0,0,0,0|1,0,1]=4 15988 B16R0.3355 CCCCN(C)C(=O)CCCCCC(=O)OC 1626a_100000207549_100009848860 [0,2,0,0,0,0|1,0,1]=4 15989 B16R0.3355 CCCCN(C)C(=O)CCCCCC(=O)OC 240690a_100000207549_100009848860 [0,2,0,0,0,0|1,0,1]=4 15990 B16R0.3355 COC(=O)CCCCCC(=O)C(O)CCSC 1458a_100000685904_100009816466 [0,2,0,0,0,0|1,0,1]=4 15991 B16R0.4829 C#CC(CCCC)OCCCCCC(=O)OC 34a_200011217967_100009816466 [0,2,0,0,0,0|1,0,0]=3 15992 B16R0.4829 C#CC(CCCC)OCCCCCC(=O)OC 7a_200011217967_100009816466 [0,2,0,0,0,0|1,0,0]=3 15993 B16R0.4829 C=CC(CCCC)OCCCCCC(=O)OC 34a_200011215037_100009816466 [0,2,0,0,0,0|1,0,0]=3 15994 B16R0.4829 C=CC(CCCC)OCCCCCC(=O)OC 7a_200011215037_100009816466 [0,2,0,0,0,0|1,0,0]=3 15995 B16R0.4829 CCCCC(CC)CCCCNCC(=O)NC 2230a_100000693194_200012094884 [0,2,0,0,0,0|2,0,0]=4 15996 B16R0.4829 CCCCC(CC)CCCCOCC(=O)CC 34a_100000725409_200012094884 [0,2,0,0,0,0|2,0,0]=4 15997 B16R0.4829 CCCCC(CC)CCCCOCC(=O)NC 34a_100000750040_200012094884 [0,2,0,0,0,0|2,0,0]=4 15998 B16R0.4829 CCCCC(CC)CCCCSCC(=O)CC 62a_100000747405_200012094884 [0,2,0,0,0,0|2,0,0]=4 15999 B16R0.4829 CCCCC(CC)CCCCSCC(=O)CC 62a_200012094884_100000747405 [0,2,0,0,0,0|2,0,0]=4 16000 B16R0.4829 CCCCC(CC)CCCCSCC(=O)NC 62a_100000183359_200012094884 [0,2,0,0,0,0|2,0,0]=4 16001 B16R0.4829 CCCCC(CC)CCCCSCC(=O)NC 62a_200012094884_100000183359 [0,2,0,0,0,0|2,0,0]=4 16002 B16R0.4829 CCCCC(CC)CCCCSCC(=O)OC 62a_100000747449_200012094884 [0,2,0,0,0,0|1,0,0]=3 16003 B16R0.4829 CCCCC(CC)CCCCSCC(=O)OC 62a_200012094884_100000747449 [0,2,0,0,0,0|1,0,0]=3 16004 B16R0.4829 CCCCC(CC)CNCCCCC(=O)OC 2230a_100000209976_100000204269 [0,2,0,0,0,0|1,0,0]=3 16005 B16R0.4829 CCCCC(CC)CNCCOCC(=O)OC 2230a_100000209976_100000090808 [0,2,0,0,0,0|2,0,0]=4 16006 B16R0.4829 CCCCC(CC)COCCCCC(=O)OC 34a_100000059025_100000211942 [0,2,0,0,0,0|1,0,0]=3 16007 B16R0.4829 CCCCC(CC)COCCCCC(=O)OC 34a_100000210273_100000204269 [0,2,0,0,0,0|1,0,0]=3 16008 B16R0.4829 CCCCC(CC)COCCCCC(=O)OC 7a_100000059025_100000211942 [0,2,0,0,0,0|1,0,0]=3 16009 B16R0.4829 CCCCC(CC)COCCCCC(=O)OC 7a_100000210273_100000204269 [0,2,0,0,0,0|1,0,0]=3 16010 B16R0.4829 CCCCC(CC)COCCOCC(=O)OC 34a_100000210273_100000090808 [0,2,0,0,0,0|2,0,0]=4 16011 B16R0.4829 CCCCC(CC)COCCOCC(=O)OC 7a_100000210273_100000090808 [0,2,0,0,0,0|2,0,0]=4 16012 B16R0.4829 CCCCC(CC)CSCCCCC(=O)OC 62a_100000204269_100000211942 [0,2,0,0,0,0|1,0,0]=3 16013 B16R0.4829 CCCCC(CC)CSCCCCC(=O)OC 62a_100000211942_100000204269 [0,2,0,0,0,0|1,0,0]=3 16014 B16R0.4829 CCCCC(CC)CSCCOCC(=O)OC 62a_100000090808_100000211942 [0,2,0,0,0,0|2,0,0]=4 16015 B16R0.4829 CCCCC(CC)CSCCOCC(=O)OC 62a_100000211942_100000090808 [0,2,0,0,0,0|2,0,0]=4 16016 B16R0.4829 CCCCC(CC)OCCCCCC(=O)OC 34a_100000074720_200011216223 [0,2,0,0,0,0|1,0,0]=3 16017 B16R0.4829 CCCCC(CC)OCCCCCC(=O)OC 34a_100011215227_100009816466 [0,2,0,0,0,0|1,0,0]=3 16018 B16R0.4829 CCCCC(CC)OCCCCCC(=O)OC 7a_100000074720_200011216223 [0,2,0,0,0,0|1,0,0]=3 16019 B16R0.4829 CCCCC(CC)OCCCCCC(=O)OC 7a_100011215227_100009816466 [0,2,0,0,0,0|1,0,0]=3 16020 B16R0.4829 CCCCC(CC)SCCCCCC(=O)OC 62a_100009816466_200011216223 [0,2,0,0,0,0|1,0,0]=3 16021 B16R0.4829 CCCCC(CC)SCCCCCC(=O)OC 62a_200011216223_100009816466 [0,2,0,0,0,0|1,0,0]=3 16022 B16R0.4829 CCCCN(CC)CCCCCCC(=O)OC 2230a_100000207695_100009815986 [0,2,0,0,0,0|1,0,0]=3 16023 B16R0.4829 CCCCN(CC)CCCCCCC(=O)OC 269982a_100000207695_100009815986 [0,2,0,0,0,0|1,0,0]=3 16024 B16R0.4829 CCCCN(CC)CCNCCCC(=O)OC 2230a_200011208488_100011218270 [0,2,0,0,0,0|2,0,0]=4 16025 B16R0.4829 CCCCN(CCCCOCC(=O)OC)N=O 34a_200000034022_100000747449 [0,2,0,0,0,0|2,0,0]=4 16026 B16R0.4829 CCCCN(CCCCOCC(=O)OC)N=O 7a_200000034022_100000747449 [0,2,0,0,0,0|2,0,0]=4 16027 B16R0.4829 CCCC[C@@H](CO)NCCCCCC(=O)OC 2230a_100011934283_100009816466 [0,2,0,0,0,0|1,0,0]=3 16028 B16R0.4829 CCCC[C@@H](CO)NCCCCCC(=O)OC 34a_100011934283_100009816466 [0,2,0,0,0,0|1,0,0]=3 16029 B16R0.4829 CCN(CCCCCCC(=O)OC)CCOC 2230a_100000731262_100009815986 [0,2,0,0,0,0|2,0,0]=4 16030 B16R0.4829 CCN(CCCCCCC(=O)OC)CCOC 269982a_100000731262_100009815986 [0,2,0,0,0,0|2,0,0]=4 16031 B16R0.4829 CCOCC(CN)OCCCCCC(=O)OC 34a_102515437182_100009816466 [0,2,0,0,0,0|2,0,0]=4 16032 B16R0.4829 COC(=O)CCCCCN[C@H](CO)CCSC 2230a_100011827619_100009816466 [0,2,0,0,0,0|2,0,0]=4 16033 B16R0.6855 CCCCC(C)COCC(=O)CCC(=O)OC 34a_100011995851_100000691467 [0,2,0,0,0,0|1,0,1]=4 16034 B16R0.6855 CCCCC(C)COCC(=O)CCC(=O)OC 7a_100011995851_100000691467 [0,2,0,0,0,0|1,0,1]=4 16035 B16R0.6855 CCCC[C@H](N)COCC(=O)CCC(=O)OC 34a_100011934283_100000691467 [0,2,0,0,0,0|1,0,1]=4 16036 B16R0.210 CCCCCC(=O)CSCCC(C)C(=O)OC 62a_100000034942_200012276598 [0,2,0,0,0,0|1,0,1]=4 16037 B16R0.210 CCCCCC(=O)CSCCC(C)C(=O)OC 62a_200012276598_100000034942 [0,2,0,0,0,0|1,0,1]=4 16038 B16R0.210 COC(=O)C(C)CCOC[C@@H](N)CCCCN 34a_100016993712_100000034942 [0,2,0,0,0,0|2,0,0]=4 16039 B16R0.299 CCCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210326 [0,2,0,0,0,0|0,0,1]=3 16040 B16R0.299 CCCCCC(=O)CCCCCC(=O)OCC 1458a_100000212188_100000755133 [0,2,0,0,0,0|0,0,1]=3 16041 B16R0.299 CCCCCC(=O)CCCOCC(=O)OCC 1458a_100000212188_100009893628 [0,2,0,0,0,0|1,0,1]=4 16042 B16R0.299 CCCCCC(=O)COCCCC(=O)OCC 7a_100012001163_200012276598 [0,2,0,0,0,0|1,0,1]=4 16043 B16R0.299 CCCCCC(=O)CSCCCC(=O)OCC 62a_100009991533_200012276598 [0,2,0,0,0,0|1,0,1]=4 16044 B16R0.299 CCCCCC(=O)CSCCCC(=O)OCC 62a_200012276598_100009991533 [0,2,0,0,0,0|1,0,1]=4 16045 B16R0.299 CCCCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000212188 [0,2,0,0,0,0|1,0,1]=4 16046 B16R0.299 CCCCCC(C)NCCCCC(=O)OCC 2230a_100000211957_100000750268 [0,2,0,0,0,0|1,0,0]=3 16047 B16R0.299 CCCCCC(C)NCCOCC(=O)OCC 2230a_100000211957_100000088970 [0,2,0,0,0,0|2,0,0]=4 16048 B16R0.299 CCCCCC(C)OCCCCC(=O)OCC 34a_100011215632_100000750268 [0,2,0,0,0,0|1,0,0]=3 16049 B16R0.299 CCCCCC(C)OCCCCC(=O)OCC 7a_100011215632_100000750268 [0,2,0,0,0,0|1,0,0]=3 16050 B16R0.299 CCCCCC(C)OCCOCC(=O)OCC 34a_100011215632_100000088970 [0,2,0,0,0,0|2,0,0]=4 16051 B16R0.299 CCCCCC(C)OCCOCC(=O)OCC 7a_100011215632_100000088970 [0,2,0,0,0,0|2,0,0]=4 16052 B16R0.299 CCCCCC(C)OCCSCC(=O)OCC 7a_200000230590_200011218191 [0,2,0,0,0,0|2,0,0]=4 16053 B16R0.299 CCCCCC(C)SCCCCC(=O)OCC 62a_100000750268_200011218191 [0,2,0,0,0,0|1,0,0]=3 16054 B16R0.299 CCCCCC(C)SCCCCC(=O)OCC 62a_200011218191_100000750268 [0,2,0,0,0,0|1,0,0]=3 16055 B16R0.299 CCCCCC(C)SCCOCC(=O)OCC 62a_100000088970_200011218191 [0,2,0,0,0,0|2,0,0]=4 16056 B16R0.299 CCCCCC(C)SCCOCC(=O)OCC 62a_200011218191_100000088970 [0,2,0,0,0,0|2,0,0]=4 16057 B16R0.299 CCCCCN(C)CCCCCC(=O)OCC 2230a_100000223495_100000755133 [0,2,0,0,0,0|1,0,0]=3 16058 B16R0.299 CCCCCN(C)CCCCCC(=O)OCC 269982a_100000223495_100000755133 [0,2,0,0,0,0|1,0,0]=3 16059 B16R0.299 CCCCCN(C)CCCOCC(=O)OCC 2230a_100000223495_100009893628 [0,2,0,0,0,0|2,0,0]=4 16060 B16R0.299 CCCCCN(C)CCCOCC(=O)OCC 269982a_100000223495_100009893628 [0,2,0,0,0,0|2,0,0]=4 16061 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 11a_100000102301_100000037472 [0,2,0,0,0,0|1,0,1]=4 16062 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 1626a_100000102301_100000037472 [0,2,0,0,0,0|1,0,1]=4 16063 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 240690a_100000102301_100000037472 [0,2,0,0,0,0|1,0,1]=4 16064 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 527a_100000102301_100000037472 [0,2,0,0,0,0|1,0,1]=4 16065 B16R0.299 CCCOCC(=O)CCCCCC(=O)OCC 1458a_100000745993_100000755133 [0,2,0,0,0,0|1,0,1]=4 16066 B16R0.299 CCCSCC(=O)CCCCCC(=O)OCC 1458a_100000217233_100000755133 [0,2,0,0,0,0|1,0,1]=4 16067 B16R0.299 CCOC(=O)CCCCCC(=O)CCCCF 1458a_100000037472_100000729493 [0,2,0,0,0,0|1,0,1]=4 16068 B16R0.299 CCOC(=O)CCCCCC(=O)CCCCO 1458a_100000037472_100000210776 [0,2,0,0,0,0|1,0,1]=4 16069 B16R0.299 CCOC(=O)CCCCCC(=O)CCCCO 1458a_100000695505_100000755133 [0,2,0,0,0,0|1,0,1]=4 16070 B16R0.299 CCOC(=O)CCCCCC(=O)CCCOC 1458a_100000037472_100000740836 [0,2,0,0,0,0|1,0,1]=4 16071 B16R0.299 CCOC(=O)CCCCCC(=O)CCCOC 1458a_100000741012_100000755133 [0,2,0,0,0,0|1,0,1]=4 16072 B16R0.299 CCOC(=O)CCCCCC(=O)CCCSC 1458a_100000173376_100000755133 [0,2,0,0,0,0|1,0,1]=4 16073 B16R0.299 CCOC(=O)CCCCCC(=O)CCSCC 1458a_100000037472_100000757381 [0,2,0,0,0,0|1,0,1]=4 16074 B16R0.299 CCOC(=O)CCCCCC(=O)CCSCC 1458a_100000230768_100000755133 [0,2,0,0,0,0|1,0,1]=4 16075 B16R0.299 CCOC(=O)CCCCCN(C)CCCCO 2230a_100000717598_100000755133 [0,2,0,0,0,0|2,0,0]=4 16076 B16R0.299 CCOC(=O)CCCCCN(C)CCCCO 269982a_100000717598_100000755133 [0,2,0,0,0,0|2,0,0]=4 16077 B16R0.299 CCOC(=O)CCCCCN(C)CCCOC 2230a_100000224831_100000755133 [0,2,0,0,0,0|2,0,0]=4 16078 B16R0.299 CCOC(=O)CCCCCN(C)CCCOC 269982a_100000224831_100000755133 [0,2,0,0,0,0|2,0,0]=4 16079 B16R0.299 CCOC(=O)CCCCOC(C)CCCOC 34a_200011539412_100000750268 [0,2,0,0,0,0|2,0,0]=4 16080 B16R0.299 CCOC(=O)CCCCOC(C)CCCOC 7a_200011539412_100000750268 [0,2,0,0,0,0|2,0,0]=4 16081 B16R0.299 CCOC(=O)CCCOC[C@@H](N)CCCCN 34a_100016993712_100009991533 [0,2,0,0,0,0|2,0,0]=4 16082 B16R0.299 CCOCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100011215890 [0,2,0,0,0,0|1,0,1]=4 16083 B16R0.299 CCOCCC(=O)CCCCCC(=O)OCC 1458a_100000749530_100000755133 [0,2,0,0,0,0|1,0,1]=4 16084 B16R0.329 C=C(CCC)CC(=O)CCCCCC(=O)OC 1458a_100000138376_100009816466 [0,2,0,0,0,0|0,0,2]=4 16085 B16R0.329 CCCC(=O)CC(=O)CCCCCC(=O)OC 1458a_100009848860_100000747444 [0,2,0,0,0,0|0,0,2]=4 16086 B16R0.329 CCCC(C)CC(=O)CCCCCC(=O)OC 1458a_100000748435_100009816466 [0,2,0,0,0,0|0,0,1]=3 16087 B16R0.329 CCCC(C)CC(=O)CCCCCC(=O)OC 1458a_100009848860_100011216630 [0,2,0,0,0,0|0,0,1]=3 16088 B16R0.329 CCCC(C)CC(=O)NCCCCC(=O)OC 188690a_100000746077_100000748435 [0,2,0,0,0,0|1,0,1]=4 16089 B16R0.329 CCCC(C)NC(=O)CCCCCC(=O)OC 11a_100000741246_100009848860 [0,2,0,0,0,0|1,0,1]=4 16090 B16R0.329 CCCC(C)NC(=O)CCCCCC(=O)OC 1626a_100000741246_100009848860 [0,2,0,0,0,0|1,0,1]=4 16091 B16R0.329 CCCC(C)NC(=O)CCCCCC(=O)OC 240690a_100000741246_100009848860 [0,2,0,0,0,0|1,0,1]=4 16092 B16R0.329 CCCS(=O)CC(=O)CCCCCC(=O)OC 1458a_100011387404_100009816466 [0,2,0,0,0,0|1,0,1]=4 16093 B16R0.329 CCSC(C)CC(=O)CCCCCC(=O)OC 1458a_200011311441_100009816466 [0,2,0,0,0,0|1,0,1]=4 16094 B16R0.329 COCC(O)CN(C)CCCCCC(=O)OC 2230a_100000739405_100009816466 [0,2,0,0,0,0|2,0,0]=4 16095 B16R0.329 COCC(O)CN(C)CCCCCC(=O)OC 269982a_100000739405_100009816466 [0,2,0,0,0,0|2,0,0]=4 16096 B16R0.3113 CCCCCC(=O)CSC[C@H](O)CC(=O)OC 62a_100000754131_200012276598 [0,2,0,0,0,0|1,0,1]=4 16097 B16R0.3113 CCCCCC(=O)CSC[C@H](O)CC(=O)OC 62a_200012276598_100000754131 [0,2,0,0,0,0|1,0,1]=4 16098 B16R0.3113 COC(=O)C[C@@H](O)COC[C@@H](N)CCCCN 34a_100016993712_100000754131 [0,2,0,0,0,0|2,0,0]=4 16099 B16R0.3268 CNC(=O)CCNCCC(C)CCCC(C)C 2230a_100000738227_100009816328 [0,2,0,0,0,0|2,0,0]=4 16100 B16R0.3268 CNC(=O)CCNCCC(C)CCCC(C)C 2230a_102516457229_100000737683 [0,2,0,0,0,0|2,0,0]=4 16101 B16R0.3268 CNC(=O)CCNCCC(C)CCCC(C)C 34a_100000738227_100009816328 [0,2,0,0,0,0|2,0,0]=4 16102 B16R0.3268 CNC(=O)CCOCCC(C)CCCC(C)C 34a_100000015991_100012179268 [0,2,0,0,0,0|2,0,0]=4 16103 B16R0.3268 CNC(=O)CCOCCC(C)CCCC(C)C 34a_100000754576_100009816328 [0,2,0,0,0,0|2,0,0]=4 16104 B16R0.3268 CNC(=O)CCOCCC(C)CCCC(C)C 7a_100000015991_100000737683 [0,2,0,0,0,0|2,0,0]=4 16105 B16R0.3268 CNC(=O)CCSCCC(C)CCCC(C)C 62a_100000737683_100009816328 [0,2,0,0,0,0|2,0,0]=4 16106 B16R0.3268 CNC(=O)CCSCCC(C)CCCC(C)C 62a_100009816328_100000737683 [0,2,0,0,0,0|2,0,0]=4 16107 B16R0.3268 COC(=O)CCCCCC(=O)CCCC(=O)C 1458a_100009848860_100011215641 [0,2,0,0,0,0|0,0,2]=4 16108 B16R0.3268 COC(=O)CCCCCC(=O)CCCC(C)C 1458a_100009848860_100011214892 [0,2,0,0,0,0|0,0,1]=3 16109 B16R0.3268 COC(=O)CCCCCC(=O)CCCC(C)C 1458a_100011216857_100009816466 [0,2,0,0,0,0|0,0,1]=3 16110 B16R0.3268 COC(=O)CCCCCC(=O)CCCC(C)O 1458a_100009848860_200000718107 [0,2,0,0,0,0|0,0,1]=3 16111 B16R0.3268 COC(=O)CCCCCC(=O)CCCN(C)C 1458a_100009848860_100000695564 [0,2,0,0,0,0|1,0,1]=4 16112 B16R0.3268 COC(=O)CCCCCC(=O)CCOC(C)C 1458a_100009848860_100000211751 [0,2,0,0,0,0|1,0,1]=4 16113 B16R0.3268 COC(=O)CCCCCC(=O)CCSC(C)C 1458a_100009848860_100000730970 [0,2,0,0,0,0|1,0,1]=4 16114 B16R0.3268 COC(=O)CCCCCC(=O)COCC(C)C 1458a_100011223364_100009816466 [0,2,0,0,0,0|1,0,1]=4 16115 B16R0.3268 COC(=O)CCCCCC(=O)NCCC(C)C 11a_100000210545_100009848860 [0,2,0,0,0,0|1,0,1]=4 16116 B16R0.3268 COC(=O)CCCCCC(=O)NCCC(C)C 1626a_100000210545_100009848860 [0,2,0,0,0,0|1,0,1]=4 16117 B16R0.3268 COC(=O)CCCCCC(=O)NCCC(C)C 240690a_100000210545_100009848860 [0,2,0,0,0,0|1,0,1]=4 16118 B16R0.3268 COC(=O)CCCCCC(=O)NCCC(C)O 240690a_200000755665_100009848860 [0,2,0,0,0,0|1,0,1]=4 16119 B16R0.3268 COC(=O)CCCCCN(C)CCCN(C)C 269982a_100000225831_100009816466 [0,2,0,0,0,0|2,0,0]=4 16120 B16R0.3268 COC(=O)CCCCNC(=O)CCCC(C)C 188690a_100000746077_100011216857 [0,2,0,0,0,0|1,0,1]=4 16121 B16R0.3268 COC(=O)CCCCNC(=O)CCCC(C)O 188690a_100000746077_100000761597 [0,2,0,0,0,0|1,0,1]=4 16122 B16R0.3268 COC(=O)CCCCNC(C)CCCC(C)C 2230a_100000210607_100000204269 [0,2,0,0,0,0|1,0,0]=3 16123 B16R0.3268 COC(=O)CCCCOC(C)CCCC(C)C 34a_200011218570_100000204269 [0,2,0,0,0,0|1,0,0]=3 16124 B16R0.3268 COC(=O)CCCCOC(C)CCCC(C)C 7a_200011218570_100000204269 [0,2,0,0,0,0|1,0,0]=3 16125 B16R0.3268 COC(=O)CCNCCC(C)CCCC(C)C 2230a_102516457229_100000204255 [0,2,0,0,0,0|1,0,0]=3 16126 B16R0.3268 COC(=O)CCOCCC(C)CCCC(C)C 34a_100000015991_100000742370 [0,2,0,0,0,0|1,0,0]=3 16127 B16R0.3268 COC(=O)CCOCCC(C)CCCC(C)C 7a_100000015991_100000204255 [0,2,0,0,0,0|1,0,0]=3 16128 B16R0.3268 COC(=O)CCSCCC(C)CCCC(C)C 62a_100000204255_100009816328 [0,2,0,0,0,0|1,0,0]=3 16129 B16R0.3268 COC(=O)CCSCCC(C)CCCC(C)C 62a_100009816328_100000204255 [0,2,0,0,0,0|1,0,0]=3 16130 B16R0.3268 COC(=O)COCCNC(C)CCCC(C)C 2230a_100000210607_100000090808 [0,2,0,0,0,0|2,0,0]=4 16131 B16R0.3268 COC(=O)COCCOC(C)CCCC(C)C 34a_200011218570_100000090808 [0,2,0,0,0,0|2,0,0]=4 16132 B16R0.3268 COC(=O)COCCOC(C)CCCC(C)C 7a_200011218570_100000090808 [0,2,0,0,0,0|2,0,0]=4 16133 B16R0.3268 COC(=O)OCSCCC(C)CCCC(C)C 62a_100009816328_100000139417 [0,2,0,0,0,0|2,0,0]=4 16134 B16R0.3379 C#CC(CCCCC)OCCCCC(=O)OC 34a_100011216489_100000204269 [0,2,0,0,0,0|1,0,0]=3 16135 B16R0.3379 C#CC(CCCCC)OCCCCC(=O)OC 7a_100011216489_100000204269 [0,2,0,0,0,0|1,0,0]=3 16136 B16R0.3379 C#CC(CCCCC)OCCOCC(=O)OC 34a_100011216489_100000090808 [0,2,0,0,0,0|2,0,0]=4 16137 B16R0.3379 C#CC(CCCCC)OCCOCC(=O)OC 7a_100011216489_100000090808 [0,2,0,0,0,0|2,0,0]=4 16138 B16R0.3379 C=CC(CCCCC)OCCCCC(=O)OC 34a_100011216863_100000204269 [0,2,0,0,0,0|1,0,0]=3 16139 B16R0.3379 C=CC(CCCCC)OCCCCC(=O)OC 7a_100011216863_100000204269 [0,2,0,0,0,0|1,0,0]=3 16140 B16R0.3379 C=CC(CCCCC)OCCOCC(=O)OC 34a_100011216863_100000090808 [0,2,0,0,0,0|2,0,0]=4 16141 B16R0.3379 C=CC(CCCCC)OCCOCC(=O)OC 7a_100011216863_100000090808 [0,2,0,0,0,0|2,0,0]=4 16142 B16R0.3379 CCCCCC(CC)OCCCCC(=O)OC 34a_100011215405_100000204269 [0,2,0,0,0,0|1,0,0]=3 16143 B16R0.3379 CCCCCC(CC)OCCCCC(=O)OC 7a_100011215405_100000204269 [0,2,0,0,0,0|1,0,0]=3 16144 B16R0.3379 CCCCCC(CC)OCCOCC(=O)OC 34a_100011215405_100000090808 [0,2,0,0,0,0|2,0,0]=4 16145 B16R0.3379 CCCCCC(CC)OCCOCC(=O)OC 7a_100011215405_100000090808 [0,2,0,0,0,0|2,0,0]=4 16146 B16R0.3379 CCN(CCCCO)CCCCCC(=O)OC 2230a_100011217355_100009816466 [0,2,0,0,0,0|2,0,0]=4 16147 B16R0.3379 CCN(CCCCO)CCCCCC(=O)OC 269982a_100011217355_100009816466 [0,2,0,0,0,0|2,0,0]=4 16148 B16R0.7062 CCCCCC(C)CCC(=O)NCC(=O)OC 188690a_100000185156_100000034243 [0,2,0,0,0,0|1,0,1]=4 16149 B16R0.7062 CCCCCC(C)NCC(=O)CCC(=O)OC 2230a_100000211957_100000691467 [0,2,0,0,0,0|1,0,1]=4 16150 B16R0.7062 CCCCCC(C)OCC(=O)CCC(=O)OC 34a_100011215632_100000691467 [0,2,0,0,0,0|1,0,1]=4 16151 B16R0.7062 CCCCCC(C)OCC(=O)CCC(=O)OC 7a_100011215632_100000691467 [0,2,0,0,0,0|1,0,1]=4 16152 B16R0.7062 CCCCCC(C)SCC(=O)CCC(=O)OC 62a_100000691467_200011218191 [0,2,0,0,0,0|1,0,1]=4 16153 B16R0.7062 CCCCCC(C)SCC(=O)CCC(=O)OC 62a_200011218191_100000691467 [0,2,0,0,0,0|1,0,1]=4 16154 B16R0.41 C=C(C)CCOCCCCCCC(=O)OCC 34a_100000764851_100009814379 [0,2,0,0,0,0|1,0,1]=4 16155 B16R0.41 C=C(C)CCSCCCCCCC(=O)OCC 62a_100000730704_100009814379 [0,2,0,0,0,0|1,0,1]=4 16156 B16R0.41 C=C(C)COCCCCCCCC(=O)OCC 34a_100000210245_100009991516 [0,2,0,0,0,0|1,0,1]=4 16157 B16R0.41 C=C(C)CSCCCCCCCC(=O)OCC 62a_100000748629_100009991516 [0,2,0,0,0,0|1,0,1]=4 16158 B16R0.41 C=COC(=O)COCCCCCCCC(C)C 34a_200000210741_100000036128 [0,2,0,0,0,0|1,0,1]=4 16159 B16R0.41 CC(C)CCCCCCCOCC(=O)NCO 34a_200000210741_100000185155 [0,2,0,0,0,0|2,0,0]=4 16160 B16R0.41 CC(C)CCCCCCCOCC(=O)NCO 7a_200000210741_100000185155 [0,2,0,0,0,0|2,0,0]=4 16161 B16R0.41 CCCC(=O)COCCCCCCCC(C)C 7a_200000210741_100000747444 [0,2,0,0,0,0|2,0,0]=4 16162 B16R0.41 CCNC(=O)CCNCCCCCCC(C)C 2230a_100000211014_100000737597 [0,2,0,0,0,0|2,0,0]=4 16163 B16R0.41 CCNC(=O)COCCCCCCCC(C)C 34a_200000210741_100000183381 [0,2,0,0,0,0|2,0,0]=4 16164 B16R0.41 CCNC(=O)COCCCCCCCC(C)C 7a_200000210741_100000183381 [0,2,0,0,0,0|2,0,0]=4 16165 B16R0.41 CCOC(=O)CCCCCCCCCC(=O)C 1458a_100000070787_100009828014 [0,2,0,0,0,0|0,0,1]=3 16166 B16R0.41 CCOC(=O)CCCCCCCCCN(C)C 2230a_100102631434_100009828014 [0,2,0,0,0,0|1,0,0]=3 16167 B16R0.41 CCOC(=O)CCCCCCCCCN(C)C 269982a_100102631434_100009828014 [0,2,0,0,0,0|1,0,0]=3 16168 B16R0.41 CCOC(=O)CCCCCCCCNC(C)C 2230a_100138425928_100010175975 [0,2,0,0,0,0|1,0,0]=3 16169 B16R0.41 CCOC(=O)CCCCCCCCNC(C)C 34a_100138425928_100010175975 [0,2,0,0,0,0|1,0,0]=3 16170 B16R0.41 CCOC(=O)CCCCCCCCOC(C)C 34a_100000212225_100010175975 [0,2,0,0,0,0|1,0,0]=3 16171 B16R0.41 CCOC(=O)CCCCCCCCSC(C)C 62a_100000210206_100010175975 [0,2,0,0,0,0|1,0,0]=3 16172 B16R0.41 CCOC(=O)CCCCCCCNCC(C)C 2230a_100000210953_100009991516 [0,2,0,0,0,0|1,0,0]=3 16173 B16R0.41 CCOC(=O)CCCCCCCNCC(C)C 34a_100000210953_100009991516 [0,2,0,0,0,0|1,0,0]=3 16174 B16R0.41 CCOC(=O)CCCCCCCNCC(C)O 2230a_100000210904_100009991516 [0,2,0,0,0,0|1,0,0]=3 16175 B16R0.41 CCOC(=O)CCCCCCCNCC(C)O 34a_100000210904_100009991516 [0,2,0,0,0,0|1,0,0]=3 16176 B16R0.41 CCOC(=O)CCCCCCCNCC(F)F 34a_100000765723_100009991516 [0,2,0,0,0,0|2,0,0]=4 16177 B16R0.41 CCOC(=O)CCCCCCCOCC(=O)C 34a_100000211253_100009991516 [0,2,0,0,0,0|1,0,1]=4 16178 B16R0.41 CCOC(=O)CCCCCCCOCC(C)Br 34a_100012180447_100009991516 [0,2,0,0,0,0|1,0,0]=3 16179 B16R0.41 CCOC(=O)CCCCCCCOCC(C)C 34a_100000210257_100009991516 [0,2,0,0,0,0|1,0,0]=3 16180 B16R0.41 CCOC(=O)CCCCCCCOCC(C)F 34a_100015925927_100009991516 [0,2,0,0,0,0|1,0,0]=3 16181 B16R0.41 CCOC(=O)CCCCCCCOCC(F)F 34a_100000743014_100009991516 [0,2,0,0,0,0|2,0,0]=4 16182 B16R0.41 CCOC(=O)CCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009991516 [0,2,0,0,0,0|1,0,0]=3 16183 B16R0.41 CCOC(=O)CCCCCCCOC[C@@H](C)N 34a_100000737577_100009991516 [0,2,0,0,0,0|1,0,0]=3 16184 B16R0.41 CCOC(=O)CCCCCCCSCC(C)C 62a_100000210624_100009991516 [0,2,0,0,0,0|1,0,0]=3 16185 B16R0.41 CCOC(=O)CCCCCCCSCC(C)O 62a_100011218427_100009991516 [0,2,0,0,0,0|1,0,0]=3 16186 B16R0.41 CCOC(=O)CCCCCCCSCC(F)F 62a_100011934356_100009991516 [0,2,0,0,0,0|2,0,0]=4 16187 B16R0.41 CCOC(=O)CCCCCCCSC[C@@H](C)O 62a_100009817552_100009991516 [0,2,0,0,0,0|1,0,0]=3 16188 B16R0.41 CCOC(=O)CCCCCCNCCC(C)O 2230a_200000755665_100009814379 [0,2,0,0,0,0|1,0,0]=3 16189 B16R0.41 CCOC(=O)CCCCCCOCCC(=O)C 34a_100000759926_100009814379 [0,2,0,0,0,0|1,0,1]=4 16190 B16R0.41 CCOC(=O)CCCCCCOCCC(=O)C 7a_100000759926_100009814379 [0,2,0,0,0,0|1,0,1]=4 16191 B16R0.41 CCOC(=O)CCCCCCOCCC(C)Br 34a_100009893172_100009814379 [0,2,0,0,0,0|1,0,0]=3 16192 B16R0.41 CCOC(=O)CCCCCCOCCC(C)C 34a_100000210254_100009814379 [0,2,0,0,0,0|1,0,0]=3 16193 B16R0.41 CCOC(=O)CCCCCCOCCC(C)C 7a_100000210254_100009814379 [0,2,0,0,0,0|1,0,0]=3 16194 B16R0.41 CCOC(=O)CCCCCCOCCC(F)F 34a_100103093639_100009814379 [0,2,0,0,0,0|2,0,0]=4 16195 B16R0.41 CCOC(=O)CCCCCCOCC[C@@H](C)N 34a_100000706166_100009814379 [0,2,0,0,0,0|1,0,0]=3 16196 B16R0.41 CCOC(=O)CCCCCCSCCC(=O)C 62a_100000053229_100009814379 [0,2,0,0,0,0|1,0,1]=4 16197 B16R0.41 CCOC(=O)CCCCCCSCCC(C)C 62a_100000210312_100009814379 [0,2,0,0,0,0|1,0,0]=3 16198 B16R0.41 CCOC(=O)CCCCCCSCCC(C)O 62a_100012276601_100009814379 [0,2,0,0,0,0|1,0,0]=3 16199 B16R0.41 CCOC(=O)CCCCCCSCOC(C)C 62a_100000709892_100009814379 [0,2,0,0,0,0|2,0,0]=4 16200 B16R0.41 CCOC(=O)CCCCCNCCCC(C)C 2230a_200000737386_100000755133 [0,2,0,0,0,0|1,0,0]=3 16201 B16R0.41 CCOC(=O)CCCCCNCCCC(C)C 34a_200000737386_100000755133 [0,2,0,0,0,0|1,0,0]=3 16202 B16R0.41 CCOC(=O)CCCCCNCCCS(=O)C 2230a_200000753449_100000755133 [0,2,0,0,0,0|2,0,0]=4 16203 B16R0.41 CCOC(=O)CCCCCNCCOC(C)C 2230a_100000701111_100000755133 [0,2,0,0,0,0|2,0,0]=4 16204 B16R0.41 CCOC(=O)CCCCCNCCOC(C)C 34a_100000701111_100000755133 [0,2,0,0,0,0|2,0,0]=4 16205 B16R0.41 CCOC(=O)CCCCCNCCSC(C)C 2230a_100000731138_100000755133 [0,2,0,0,0,0|2,0,0]=4 16206 B16R0.41 CCOC(=O)CCCCCNCCSC(C)C 34a_100000731138_100000755133 [0,2,0,0,0,0|2,0,0]=4 16207 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)C 34a_100000759063_100000755133 [0,2,0,0,0,0|1,0,1]=4 16208 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)C 7a_100000759063_100000755133 [0,2,0,0,0,0|1,0,1]=4 16209 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)C 7a_100011214988_100011215641 [0,2,0,0,0,0|1,0,1]=4 16210 B16R0.41 CCOC(=O)CCCCCOCCCC(C)C 34a_100000210774_100000755133 [0,2,0,0,0,0|1,0,0]=3 16211 B16R0.41 CCOC(=O)CCCCCOCCCC(C)C 7a_100000210774_100000755133 [0,2,0,0,0,0|1,0,0]=3 16212 B16R0.41 CCOC(=O)CCCCCOCCCC(C)C 7a_100011214988_100011214892 [0,2,0,0,0,0|1,0,0]=3 16213 B16R0.41 CCOC(=O)CCCCCOCCCC(C)O 7a_100011214988_200000718107 [0,2,0,0,0,0|1,0,0]=3 16214 B16R0.41 CCOC(=O)CCCCCOCCCN(C)C 7a_100011214988_100000757444 [0,2,0,0,0,0|2,0,0]=4 16215 B16R0.41 CCOC(=O)CCCCCOCCNC(C)C 34a_100000224655_100000755133 [0,2,0,0,0,0|2,0,0]=4 16216 B16R0.41 CCOC(=O)CCCCCOCCOC(C)C 34a_100000211219_100000755133 [0,2,0,0,0,0|2,0,0]=4 16217 B16R0.41 CCOC(=O)CCCCCOCCOC(C)C 7a_100000211219_100000755133 [0,2,0,0,0,0|2,0,0]=4 16218 B16R0.41 CCOC(=O)CCCCCOCCOC(C)C 7a_100011214988_100000211751 [0,2,0,0,0,0|2,0,0]=4 16219 B16R0.41 CCOC(=O)CCCCCOCCSC(C)C 34a_200011212901_100000755133 [0,2,0,0,0,0|2,0,0]=4 16220 B16R0.41 CCOC(=O)CCCCCOCCSC(C)C 7a_100011214988_100000730970 [0,2,0,0,0,0|2,0,0]=4 16221 B16R0.41 CCOC(=O)CCCCCOCCSC(C)C 7a_200011212901_100000755133 [0,2,0,0,0,0|2,0,0]=4 16222 B16R0.41 CCOC(=O)CCCCCSCCCC(=O)C 62a_100000755133_100011215641 [0,2,0,0,0,0|1,0,1]=4 16223 B16R0.41 CCOC(=O)CCCCCSCCCC(=O)C 62a_100011215641_100000755133 [0,2,0,0,0,0|1,0,1]=4 16224 B16R0.41 CCOC(=O)CCCCCSCCCC(C)C 62a_100000755133_100011214892 [0,2,0,0,0,0|1,0,0]=3 16225 B16R0.41 CCOC(=O)CCCCCSCCCC(C)C 62a_100011214892_100000755133 [0,2,0,0,0,0|1,0,0]=3 16226 B16R0.41 CCOC(=O)CCCCCSCCCC(C)O 62a_100000755133_200000718107 [0,2,0,0,0,0|1,0,0]=3 16227 B16R0.41 CCOC(=O)CCCCCSCCCC(C)O 62a_200000718107_100000755133 [0,2,0,0,0,0|1,0,0]=3 16228 B16R0.41 CCOC(=O)CCCCCSCCCN(C)C 62a_100000755133_100000757444 [0,2,0,0,0,0|2,0,0]=4 16229 B16R0.41 CCOC(=O)CCCCCSCCOC(C)C 62a_100000211751_100000755133 [0,2,0,0,0,0|2,0,0]=4 16230 B16R0.41 CCOC(=O)CCCCCSCCOC(C)C 62a_100000755133_100000211751 [0,2,0,0,0,0|2,0,0]=4 16231 B16R0.41 CCOC(=O)CCCCCSCCSC(C)C 62a_100000730970_100000755133 [0,2,0,0,0,0|2,0,0]=4 16232 B16R0.41 CCOC(=O)CCCCCSCCSC(C)C 62a_100000755133_100000730970 [0,2,0,0,0,0|2,0,0]=4 16233 B16R0.41 CCOC(=O)CCCCNCCCOC(C)C 2230a_100000737246_100000750268 [0,2,0,0,0,0|2,0,0]=4 16234 B16R0.41 CCOC(=O)CCCCNCCCOC(C)C 34a_100000737246_100000750268 [0,2,0,0,0,0|2,0,0]=4 16235 B16R0.41 CCOC(=O)CCCCOCCCCC(C)C 34a_100011214890_100000750268 [0,2,0,0,0,0|1,0,0]=3 16236 B16R0.41 CCOC(=O)CCCCOCCCCC(C)C 7a_100011214890_100000750268 [0,2,0,0,0,0|1,0,0]=3 16237 B16R0.41 CCOC(=O)CCCCOCCCNC(C)C 34a_100000182298_100000750268 [0,2,0,0,0,0|2,0,0]=4 16238 B16R0.41 CCOC(=O)CCCCOCCNCC(C)C 34a_100015185251_100000750268 [0,2,0,0,0,0|2,0,0]=4 16239 B16R0.41 CCOC(=O)CCCCOCCOCC(C)C 34a_100000703358_100000750268 [0,2,0,0,0,0|2,0,0]=4 16240 B16R0.41 CCOC(=O)CCCCOCCOCC(C)C 7a_100000703358_100000750268 [0,2,0,0,0,0|2,0,0]=4 16241 B16R0.41 CCOC(=O)CCCCOCCSCC(C)C 34a_200000230437_100000750268 [0,2,0,0,0,0|2,0,0]=4 16242 B16R0.41 CCOC(=O)CCCCOCCSCC(C)C 7a_200000230437_100000750268 [0,2,0,0,0,0|2,0,0]=4 16243 B16R0.41 CCOC(=O)CCCCSCCCCC(=O)C 62a_100000735457_100000750268 [0,2,0,0,0,0|1,0,1]=4 16244 B16R0.41 CCOC(=O)CCCCSCCCCC(=O)C 62a_100000750268_100000735457 [0,2,0,0,0,0|1,0,1]=4 16245 B16R0.41 CCOC(=O)CCCCSCCCCC(C)C 62a_100000750268_100011216152 [0,2,0,0,0,0|1,0,0]=3 16246 B16R0.41 CCOC(=O)CCCCSCCCCC(C)C 62a_100011216152_100000750268 [0,2,0,0,0,0|1,0,0]=3 16247 B16R0.41 CCOC(=O)CCCCSCCCCN(C)C 62a_100000750268_100000690147 [0,2,0,0,0,0|2,0,0]=4 16248 B16R0.41 CCOC(=O)CCCNCCCCCC(C)C 2230a_100011290863_100009991533 [0,2,0,0,0,0|1,0,0]=3 16249 B16R0.41 CCOC(=O)CCCNCCCCCC(C)C 34a_100011290863_100009991533 [0,2,0,0,0,0|1,0,0]=3 16250 B16R0.41 CCOC(=O)CCCNCCCOCC(C)C 2230a_100000205972_100009991533 [0,2,0,0,0,0|2,0,0]=4 16251 B16R0.41 CCOC(=O)CCCNCCCOCC(C)C 34a_100000205972_100009991533 [0,2,0,0,0,0|2,0,0]=4 16252 B16R0.41 CCOC(=O)CCCOCCCCCC(C)C 34a_100011995859_100009991533 [0,2,0,0,0,0|1,0,0]=3 16253 B16R0.41 CCOC(=O)CCCOCCCCCC(C)C 7a_100011995859_100011215271 [0,2,0,0,0,0|1,0,0]=3 16254 B16R0.41 CCOC(=O)CCCOCCCCCC(C)C 7a_100012001163_100000210682 [0,2,0,0,0,0|1,0,0]=3 16255 B16R0.41 CCOC(=O)CCCOCCCCNC(C)C 34a_100011521146_100009991533 [0,2,0,0,0,0|2,0,0]=4 16256 B16R0.41 CCOC(=O)CCCSCCCCCC(C)C 62a_100000210682_100009991533 [0,2,0,0,0,0|1,0,0]=3 16257 B16R0.41 CCOC(=O)CCCSCCCCCC(C)C 62a_100009991533_100000210682 [0,2,0,0,0,0|1,0,0]=3 16258 B16R0.41 CCOC(=O)CCNCCCCCCC(C)C 2230a_100000211014_100011206558 [0,2,0,0,0,0|1,0,0]=3 16259 B16R0.41 CCOC(=O)CCNCCCCCCC(C)C 34a_100000211014_100000765890 [0,2,0,0,0,0|1,0,0]=3 16260 B16R0.41 CCOC(=O)CCOCCCCCNC(C)C 34a_100011629493_100000765890 [0,2,0,0,0,0|2,0,0]=4 16261 B16R0.41 CCOC(=O)COCCCCCCCC(C)C 34a_200000210741_100000188475 [0,2,0,0,0,0|1,0,0]=3 16262 B16R0.41 CCOC(=O)COCCCCCCCC(C)C 7a_200000210741_100000188475 [0,2,0,0,0,0|1,0,0]=3 16263 B16R0.41 CCOC(=O)COCCCNCCCC(C)C 2230a_200000737386_100009893628 [0,2,0,0,0,0|2,0,0]=4 16264 B16R0.41 CCOC(=O)COCCCNCCCC(C)C 34a_200000737386_100009893628 [0,2,0,0,0,0|2,0,0]=4 16265 B16R0.41 CCOC(=O)COCCCOCCCC(C)C 34a_100000210774_100009893628 [0,2,0,0,0,0|2,0,0]=4 16266 B16R0.41 CCOC(=O)COCCCOCCCC(C)C 7a_100000210774_100009893628 [0,2,0,0,0,0|2,0,0]=4 16267 B16R0.41 CCOC(=O)COCCCSCCCC(C)C 62a_100009893628_100011214892 [0,2,0,0,0,0|2,0,0]=4 16268 B16R0.41 CCOC(=O)COCCCSCCCC(C)C 62a_100011214892_100009893628 [0,2,0,0,0,0|2,0,0]=4 16269 B16R0.41 CCOC(=O)COCCCSCCCC(C)O 62a_100009893628_200000718107 [0,2,0,0,0,0|2,0,0]=4 16270 B16R0.41 CCOC(=O)COCCCSCCCC(C)O 62a_200000718107_100009893628 [0,2,0,0,0,0|2,0,0]=4 16271 B16R0.41 CCOC(=O)COCCOCCCCC(C)C 34a_100011214890_100000088970 [0,2,0,0,0,0|2,0,0]=4 16272 B16R0.41 CCOC(=O)COCCOCCCCC(C)C 7a_100011214890_100000088970 [0,2,0,0,0,0|2,0,0]=4 16273 B16R0.41 CCOC(=O)COCCSCCCCC(C)C 62a_100000088970_100011216152 [0,2,0,0,0,0|2,0,0]=4 16274 B16R0.41 CCOC(=O)COCCSCCCCC(C)C 62a_100011216152_100000088970 [0,2,0,0,0,0|2,0,0]=4 16275 B16R0.41 CCOC(=O)CSCCOCCCCC(C)C 7a_200000230590_100011216152 [0,2,0,0,0,0|2,0,0]=4 16276 B16R0.41 CCOC(=O)NCCOCCCCCC(C)C 34a_100000158857_100000210682 [0,2,0,0,0,0|2,0,0]=4 16277 B16R0.41 CCOC(=O)NCCOCCCCCC(C)C 7a_100011995859_200011445536 [0,2,0,0,0,0|2,0,0]=4 16278 B16R0.41 CCOC(=O)NCCSCCCCCC(C)C 62a_100000210682_200011445536 [0,2,0,0,0,0|2,0,0]=4 16279 B16R0.103 C=C(CNCCCCCCC(C)C)C(=O)OC 34a_100000211014_100009813391 [0,2,0,0,0,0|1,0,1]=4 16280 B16R0.103 CCC(=O)C(C)OCCCCCCCC(C)C 7a_200000210741_100000742827 [0,2,0,0,0,0|2,0,0]=4 16281 B16R0.103 CNC(=O)C(C)OCCCCCCCC(C)C 34a_200000210741_100000731044 [0,2,0,0,0,0|2,0,0]=4 16282 B16R0.103 CNC(=O)C(C)OCCCCCCCC(C)C 7a_200000210741_100000209862 [0,2,0,0,0,0|2,0,0]=4 16283 B16R0.103 CNC(=O)C(F)OCCCCCCCC(C)C 34a_200000210741_100009813575 [0,2,0,0,0,0|2,0,0]=4 16284 B16R0.103 CNC(=O)C(F)OCCCCCCCC(C)C 7a_200000210741_100009813575 [0,2,0,0,0,0|2,0,0]=4 16285 B16R0.103 COC(=O)C(=O)CNCCCCCCC(C)C 34a_100000211014_100011610305 [0,2,0,0,0,0|1,0,1]=4 16286 B16R0.103 COC(=O)C(C)CCNCCCCCC(C)C 2230a_100011290863_100000034942 [0,2,0,0,0,0|1,0,0]=3 16287 B16R0.103 COC(=O)C(C)CCNCCCCCC(C)C 34a_100011290863_100000034942 [0,2,0,0,0,0|1,0,0]=3 16288 B16R0.103 COC(=O)C(C)CCNCCCOCC(C)C 2230a_100000205972_100000034942 [0,2,0,0,0,0|2,0,0]=4 16289 B16R0.103 COC(=O)C(C)CCNCCCOCC(C)C 34a_100000205972_100000034942 [0,2,0,0,0,0|2,0,0]=4 16290 B16R0.103 COC(=O)C(C)CCOCCCCCC(C)C 34a_100011995859_100000034942 [0,2,0,0,0,0|1,0,0]=3 16291 B16R0.103 COC(=O)C(C)CCOCCCCCC(C)C 7a_100011995859_100000034942 [0,2,0,0,0,0|1,0,0]=3 16292 B16R0.103 COC(=O)C(C)CCOCCCCNC(C)C 34a_100011521146_100000034942 [0,2,0,0,0,0|2,0,0]=4 16293 B16R0.103 COC(=O)C(C)CCSCCCCCC(C)C 62a_100000034942_100000210682 [0,2,0,0,0,0|1,0,0]=3 16294 B16R0.103 COC(=O)C(C)CCSCCCCCC(C)C 62a_100000210682_100000034942 [0,2,0,0,0,0|1,0,0]=3 16295 B16R0.103 COC(=O)C(C)CNCCCCCCC(C)C 34a_100000211014_100000698445 [0,2,0,0,0,0|1,0,0]=3 16296 B16R0.103 COC(=O)C(C)COCCCCCNC(C)C 34a_100011629493_100000698445 [0,2,0,0,0,0|2,0,0]=4 16297 B16R0.103 COC(=O)C(C)OCCCCCCCC(C)C 34a_200000210741_100000211248 [0,2,0,0,0,0|1,0,0]=3 16298 B16R0.103 COC(=O)C(C)OCCCCCCCC(C)C 7a_200000210741_100000211248 [0,2,0,0,0,0|1,0,0]=3 16299 B16R0.263 C=C(C)CC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000748629 [0,2,0,0,0,0|0,0,2]=4 16300 B16R0.263 C=C(C)CN(C)CCCCCCCC(=O)OC 2230a_100000225649_100010004213 [0,2,0,0,0,0|1,0,1]=4 16301 B16R0.263 C=C(C)CN(C)CCCCCCCC(=O)OC 269982a_100000225649_100010004213 [0,2,0,0,0,0|1,0,1]=4 16302 B16R0.263 COC(=O)CCCCCCCC(=O)CC(C)C 1458a_100000033222_100000210624 [0,2,0,0,0,0|0,0,1]=3 16303 B16R0.263 COC(=O)CCCCCCCC(=O)CC(C)C 1458a_100000210554_100010004213 [0,2,0,0,0,0|0,0,1]=3 16304 B16R0.263 COC(=O)CCCCCCCC(=O)CC(C)O 1458a_100000033222_100011218427 [0,2,0,0,0,0|0,0,1]=3 16305 B16R0.263 COC(=O)CCCCCCCC(=O)CC(F)F 1458a_100000033222_100011934356 [0,2,0,0,0,0|1,0,1]=4 16306 B16R0.263 COC(=O)CCCCCCCC(=O)CN(C)C 1458a_100000750896_100010004213 [0,2,0,0,0,0|1,0,1]=4 16307 B16R0.263 COC(=O)CCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100010004213 [0,2,0,0,0,0|0,0,1]=3 16308 B16R0.263 COC(=O)CCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100010004213 [0,2,0,0,0,0|1,0,1]=4 16309 B16R0.263 COC(=O)CCCCCCCC(=O)NC(C)C 11a_100138425928_100000033222 [0,2,0,0,0,0|1,0,1]=4 16310 B16R0.263 COC(=O)CCCCCCCC(=O)NC(C)C 1626a_100138425928_100000033222 [0,2,0,0,0,0|1,0,1]=4 16311 B16R0.263 COC(=O)CCCCCCCC(=O)NC(C)C 240690a_100138425928_100000033222 [0,2,0,0,0,0|1,0,1]=4 16312 B16R0.263 COC(=O)CCCCCCCN(C)CC(C)C 2230a_100000747067_100010004213 [0,2,0,0,0,0|1,0,0]=3 16313 B16R0.263 COC(=O)CCCCCCCN(C)CC(C)C 269982a_100000747067_100010004213 [0,2,0,0,0,0|1,0,0]=3 16314 B16R0.263 COC(=O)CCCCCCCN(C)CC(C)O 2230a_100000227577_100010004213 [0,2,0,0,0,0|1,0,0]=3 16315 B16R0.263 COC(=O)CCCCCCCN(C)CC(C)O 269982a_100000227577_100010004213 [0,2,0,0,0,0|1,0,0]=3 16316 B16R0.263 COC(=O)CCCCCCNC(=O)CC(C)C 188690a_100000739044_100000210554 [0,2,0,0,0,0|1,0,1]=4 16317 B16R0.263 COC(=O)CCCCCCNC(=O)C[C@@H](C)O 188690a_100000739044_100011933948 [0,2,0,0,0,0|1,0,1]=4 16318 B16R0.263 COC(=O)CCCCCCNC(C)CC(C)C 2230a_100000692259_100009815986 [0,2,0,0,0,0|1,0,0]=3 16319 B16R0.263 COC(=O)CCCCCCOC(C)CC(C)C 34a_100000211805_100009815986 [0,2,0,0,0,0|1,0,0]=3 16320 B16R0.263 COC(=O)CCCCCCOC(C)CC(C)C 34a_100009863599_100000731052 [0,2,0,0,0,0|1,0,0]=3 16321 B16R0.263 COC(=O)CCCCCCOC(C)CC(C)C 7a_100000211805_100009815986 [0,2,0,0,0,0|1,0,0]=3 16322 B16R0.263 COC(=O)CCCCCCOC(C)CC(C)C 7a_100009863599_100000731052 [0,2,0,0,0,0|1,0,0]=3 16323 B16R0.263 COC(=O)CCCCCCSC(C)CC(C)C 62a_100000731052_100009815986 [0,2,0,0,0,0|1,0,0]=3 16324 B16R0.263 COC(=O)CCCCCCSC(C)CC(C)C 62a_100009815986_100000731052 [0,2,0,0,0,0|1,0,0]=3 16325 B16R0.263 COC(=O)CCCCCCSC(C)CN(C)C 62a_100009815986_100020606517 [0,2,0,0,0,0|2,0,0]=4 16326 B16R0.263 COC(=O)CCCCCCSC(C)CN(C)C 62a_100020606517_100009815986 [0,2,0,0,0,0|2,0,0]=4 16327 B16R0.263 COC(=O)CCCCCOCC(C)CN(C)C 7a_100000074720_100015348159 [0,2,0,0,0,0|2,0,0]=4 16328 B16R0.263 COC(=O)CCCCCOC[C@@H](N)CC(C)C 34a_100011830311_100009816466 [0,2,0,0,0,0|1,0,0]=3 16329 B16R0.263 COC(=O)CCCCCSCC(C)CN(C)C 62a_100009816466_100015348159 [0,2,0,0,0,0|2,0,0]=4 16330 B16R0.263 COC(=O)CCCCCSCC(C)CN(C)C 62a_100015348159_100009816466 [0,2,0,0,0,0|2,0,0]=4 16331 B16R0.263 COC(=O)CCCCOCC[C@@H](N)CC(C)C 34a_100161151251_100000204269 [0,2,0,0,0,0|1,0,0]=3 16332 B16R0.263 COC(=O)COCCOCC[C@@H](N)CC(C)C 34a_100161151251_100000090808 [0,2,0,0,0,0|2,0,0]=4 16333 B16R0.3394 COC(=O)CCC(=O)COCCCCC(C)C 34a_100011214890_100000691467 [0,2,0,0,0,0|1,0,1]=4 16334 B16R0.3394 COC(=O)CCC(=O)COCCCCC(C)C 7a_100011214890_100000691467 [0,2,0,0,0,0|1,0,1]=4 16335 B16R0.3394 COC(=O)CCC(=O)CSCCCCC(C)C 62a_100000691467_100011216152 [0,2,0,0,0,0|1,0,1]=4 16336 B16R0.3394 COC(=O)CCC(=O)CSCCCCC(C)C 62a_100011216152_100000691467 [0,2,0,0,0,0|1,0,1]=4 16337 B16R0.3394 COC(=O)CCC(=O)NCCCCCC(C)C 1626a_100011290863_100000187943 [0,2,0,0,0,0|1,0,1]=4 16338 B16R0.3394 COC(=O)CCC(=O)NCCCCCC(C)C 240690a_100011290863_100000187943 [0,2,0,0,0,0|1,0,1]=4 16339 B16R0.3394 COC(=O)CCC(=O)NCCCCCC(C)C 527a_100011290863_100000187943 [0,2,0,0,0,0|1,0,1]=4 16340 B16R0.3394 COC(=O)CNC(=O)CCCCCCC(C)C 188690a_100000185156_100000040743 [0,2,0,0,0,0|1,0,1]=4 16341 B16R0.7985 COC(=O)CC(=O)CSCCCCCC(C)C 62a_100000210525_100000210682 [0,2,0,0,0,0|1,0,1]=4 16342 B16R0.7985 COC(=O)CC(=O)CSCCCCCC(C)C 62a_100000210682_100000210525 [0,2,0,0,0,0|1,0,1]=4 16343 B16R0.7985 COC(=O)CC(=O)NCCCCCCC(C)C 240690a_100000211014_100000211351 [0,2,0,0,0,0|1,0,1]=4 16344 B16R0.7985 COC(=O)CC(C)NCCCCCCC(C)C 2230a_100000211014_100009817358 [0,2,0,0,0,0|1,0,0]=3 16345 B16R0.7985 COC(=O)CC(C)NCCCCCCC(C)C 34a_100000211014_100009817358 [0,2,0,0,0,0|1,0,0]=3 16346 B16R0.7985 COC(=O)CC(C)OCCCCCNC(C)C 34a_100011629493_100009817358 [0,2,0,0,0,0|2,0,0]=4 16347 B16R0.7985 COC(=O)C[C@@H](O)CNCCCCCC(C)C 34a_100011290863_100000754131 [0,2,0,0,0,0|1,0,0]=3 16348 B16R0.7985 COC(=O)C[C@@H](O)CNCCCOCC(C)C 34a_100000205972_100000754131 [0,2,0,0,0,0|2,0,0]=4 16349 B16R0.7985 COC(=O)C[C@@H](O)COCCCCCC(C)C 34a_100011995859_100000754131 [0,2,0,0,0,0|1,0,0]=3 16350 B16R0.7985 COC(=O)C[C@@H](O)COCCCCCC(C)C 7a_100011995859_100000754131 [0,2,0,0,0,0|1,0,0]=3 16351 B16R0.7985 COC(=O)C[C@@H](O)COCCCCNC(C)C 34a_100011521146_100000754131 [0,2,0,0,0,0|2,0,0]=4 16352 B16R0.7985 COC(=O)C[C@@H](O)CSCCCCCC(C)C 62a_100000210682_100000754131 [0,2,0,0,0,0|1,0,0]=3 16353 B16R0.7985 COC(=O)C[C@@H](O)CSCCCCCC(C)C 62a_100000754131_100000210682 [0,2,0,0,0,0|1,0,0]=3 16354 B16R0.8183 CCC(=O)CCCCCCCCCC(F)(F)F 1458a_100000210414_200041927475 [0,2,0,0,0,0|2,0,0]=4 16355 B16R0.8183 CNC(=O)CCCNCCCCCC(C)(C)O 2230a_100000740002_100010402123 [0,2,0,0,0,0|2,0,0]=4 16356 B16R0.8183 CNC(=O)CCCNCCCCCC(C)(C)O 34a_100000740002_100010402123 [0,2,0,0,0,0|2,0,0]=4 16357 B16R0.8183 CNC(=O)CCCSCCCCCC(C)(C)O 62a_100000741757_100010402123 [0,2,0,0,0,0|2,0,0]=4 16358 B16R0.8183 CNC(=O)CCCSCCCCCC(C)(C)O 62a_100010402123_100000741757 [0,2,0,0,0,0|2,0,0]=4 16359 B16R0.8183 COC(=O)CCCCCCCCNC(C)(C)C 2230a_100000715429_100010282707 [0,2,0,0,0,0|1,0,0]=3 16360 B16R0.8183 COC(=O)CCCCCCCCOC(C)(C)C 34a_100000035544_100000210625 [0,2,0,0,0,0|1,0,0]=3 16361 B16R0.8183 COC(=O)CCCCCCCCOC(C)(C)C 34a_100015890283_100010282707 [0,2,0,0,0,0|1,0,0]=3 16362 B16R0.8183 COC(=O)CCCCCCCCOC(C)(C)C 7a_100015890283_100010282707 [0,2,0,0,0,0|1,0,0]=3 16363 B16R0.8183 COC(=O)CCCCCCCCOC(F)(F)F 34a_100000035544_200103152311 [0,2,0,0,0,0|2,0,0]=4 16364 B16R0.8183 COC(=O)CCCCCCCCOC(F)(F)F 7a_100000035544_200000243211 [0,2,0,0,0,0|2,0,0]=4 16365 B16R0.8183 COC(=O)CCCCCCCCSC(C)(C)C 62a_100000211941_100010282707 [0,2,0,0,0,0|1,0,0]=3 16366 B16R0.8183 COC(=O)CCCCCCCCSC(C)(C)C 62a_100010282707_100000211941 [0,2,0,0,0,0|1,0,0]=3 16367 B16R0.8183 COC(=O)CCCCCCCCSC(F)(F)F 62a_100010282707_200103152311 [0,2,0,0,0,0|2,0,0]=4 16368 B16R0.8183 COC(=O)CCCCCCCCSC(F)(F)F 62a_200000243211_100010282707 [0,2,0,0,0,0|2,0,0]=4 16369 B16R0.8183 COC(=O)CCCCCCCNCC(C)(C)C 2230a_100000743828_100010004213 [0,2,0,0,0,0|1,0,0]=3 16370 B16R0.8183 COC(=O)CCCCCCCNCC(C)(C)F 2230a_100020643315_100010004213 [0,2,0,0,0,0|1,0,0]=3 16371 B16R0.8183 COC(=O)CCCCCCCNCC(C)(C)O 2230a_100000751335_100010004213 [0,2,0,0,0,0|1,0,0]=3 16372 B16R0.8183 COC(=O)CCCCCCCNCC(F)(F)F 34a_100000717047_100010004213 [0,2,0,0,0,0|2,0,0]=4 16373 B16R0.8183 COC(=O)CCCCCCCOCC(C)(C)C 34a_100011022521_100011219605 [0,2,0,0,0,0|1,0,0]=3 16374 B16R0.8183 COC(=O)CCCCCCCOCC(C)(C)F 34a_100000716592_100010004213 [0,2,0,0,0,0|1,0,0]=3 16375 B16R0.8183 COC(=O)CCCCCCCOCC(C)(C)F 34a_100011022521_100011997219 [0,2,0,0,0,0|1,0,0]=3 16376 B16R0.8183 COC(=O)CCCCCCCOCC(C)(C)O 34a_100011022521_100000764493 [0,2,0,0,0,0|1,0,0]=3 16377 B16R0.8183 COC(=O)CCCCCCCOCC(C)(C)O 7a_100011022521_100000764493 [0,2,0,0,0,0|1,0,0]=3 16378 B16R0.8183 COC(=O)CCCCCCCOCC(C)(F)F 34a_100000068830_100010004213 [0,2,0,0,0,0|1,0,0]=3 16379 B16R0.8183 COC(=O)CCCCCCCOCC(F)(F)Br 34a_100011217949_100010004213 [0,2,0,0,0,0|2,0,0]=4 16380 B16R0.8183 COC(=O)CCCCCCCOCC(F)(F)Cl 34a_100000734434_100010004213 [0,2,0,0,0,0|2,0,0]=4 16381 B16R0.8183 COC(=O)CCCCCCCOCC(F)(F)F 34a_100000210435_100010004213 [0,2,0,0,0,0|2,0,0]=4 16382 B16R0.8183 COC(=O)CCCCCCCOC[Si](C)(C)C 7a_100011022521_100000233785 [0,2,0,0,0,0|1,1,0]=4 16383 B16R0.8183 COC(=O)CCCCCCCSCC(C)(C)C 62a_100010004213_100011219605 [0,2,0,0,0,0|1,0,0]=3 16384 B16R0.8183 COC(=O)CCCCCCCSCC(C)(C)C 62a_100011219605_100010004213 [0,2,0,0,0,0|1,0,0]=3 16385 B16R0.8183 COC(=O)CCCCCCCSCC(C)(C)F 62a_100010004213_100011997219 [0,2,0,0,0,0|1,0,0]=3 16386 B16R0.8183 COC(=O)CCCCCCCSCC(C)(C)F 62a_100011997219_100010004213 [0,2,0,0,0,0|1,0,0]=3 16387 B16R0.8183 COC(=O)CCCCCCCSCC(C)(C)O 62a_100000764493_100010004213 [0,2,0,0,0,0|1,0,0]=3 16388 B16R0.8183 COC(=O)CCCCCCCSCC(C)(C)O 62a_100010004213_100000764493 [0,2,0,0,0,0|1,0,0]=3 16389 B16R0.8183 COC(=O)CCCCCCCSCC(F)(F)F 62a_100000763148_100010004213 [0,2,0,0,0,0|2,0,0]=4 16390 B16R0.8183 COC(=O)CCCCCCCSCC(F)(F)F 62a_100010004213_100000763148 [0,2,0,0,0,0|2,0,0]=4 16391 B16R0.8183 COC(=O)CCCCCCCSC[N+](C)(C)C 62a_100010004213_200000036245 [0,2,0,0,0,0|2,0,0]=4 16392 B16R0.8183 COC(=O)CCCCCCCSC[N+](C)(C)C 62a_200000036245_100010004213 [0,2,0,0,0,0|2,0,0]=4 16393 B16R0.8183 COC(=O)CCCCCCCSC[Si](C)(C)C 62a_100000037933_100010004213 [0,2,0,0,0,0|1,1,0]=4 16394 B16R0.8183 COC(=O)CCCCCCCSC[Si](C)(C)C 62a_100010004213_100000037933 [0,2,0,0,0,0|1,1,0]=4 16395 B16R0.8183 COC(=O)CCCCCCNCCC(C)(C)C 2230a_100000738805_100009815986 [0,2,0,0,0,0|1,0,0]=3 16396 B16R0.8183 COC(=O)CCCCCCNCCC(C)(C)F 2230a_100016253952_100009815986 [0,2,0,0,0,0|1,0,0]=3 16397 B16R0.8183 COC(=O)CCCCCCNCCC(F)(F)F 2230a_100000740434_100009815986 [0,2,0,0,0,0|2,0,0]=4 16398 B16R0.8183 COC(=O)CCCCCCNCCC(F)(F)F 34a_100000740434_100009815986 [0,2,0,0,0,0|2,0,0]=4 16399 B16R0.8183 COC(=O)CCCCCCNCCS(=O)(=O)C 2230a_100000740961_100009815986 [0,2,0,0,0,0|2,0,0]=4 16400 B16R0.8183 COC(=O)CCCCCCNCCS(=O)(=O)C 34a_100000740961_100009815986 [0,2,0,0,0,0|2,0,0]=4 16401 B16R0.8183 COC(=O)CCCCCCOCCC(C)(C)C 34a_100009863599_100000755188 [0,2,0,0,0,0|1,0,0]=3 16402 B16R0.8183 COC(=O)CCCCCCOCCC(C)(C)C 7a_100000765024_100009815986 [0,2,0,0,0,0|1,0,0]=3 16403 B16R0.8183 COC(=O)CCCCCCOCCC(C)(C)C 7a_100009863599_100000755188 [0,2,0,0,0,0|1,0,0]=3 16404 B16R0.8183 COC(=O)CCCCCCOCCC(C)(C)O 34a_100009863599_100000702414 [0,2,0,0,0,0|1,0,0]=3 16405 B16R0.8183 COC(=O)CCCCCCOCCC(C)(C)O 7a_100009863599_100000702414 [0,2,0,0,0,0|1,0,0]=3 16406 B16R0.8183 COC(=O)CCCCCCOCCC(F)(F)F 34a_100000752437_100009815986 [0,2,0,0,0,0|2,0,0]=4 16407 B16R0.8183 COC(=O)CCCCCCOCCC(F)(F)F 34a_100009863599_100011219754 [0,2,0,0,0,0|2,0,0]=4 16408 B16R0.8183 COC(=O)CCCCCCOCCC(F)(F)F 7a_100009863599_100011219754 [0,2,0,0,0,0|2,0,0]=4 16409 B16R0.8183 COC(=O)CCCCCCOCCS(=O)(=O)C 34a_100000211924_100009815986 [0,2,0,0,0,0|2,0,0]=4 16410 B16R0.8183 COC(=O)CCCCCCOCCS(=O)(=O)C 34a_100009863599_100000731031 [0,2,0,0,0,0|2,0,0]=4 16411 B16R0.8183 COC(=O)CCCCCCOCCS(=O)(=O)C 7a_100000211924_100009815986 [0,2,0,0,0,0|2,0,0]=4 16412 B16R0.8183 COC(=O)CCCCCCOCCS(=O)(=O)C 7a_100009863599_100000230027 [0,2,0,0,0,0|2,0,0]=4 16413 B16R0.8183 COC(=O)CCCCCCOCC[N+](C)(C)C 34a_100009863599_100000085578 [0,2,0,0,0,0|2,0,0]=4 16414 B16R0.8183 COC(=O)CCCCCCOCC[N+](C)(C)C 7a_100009863599_100000085578 [0,2,0,0,0,0|2,0,0]=4 16415 B16R0.8183 COC(=O)CCCCCCOCC[N+](C)(C)C 7a_200020618287_100009815986 [0,2,0,0,0,0|2,0,0]=4 16416 B16R0.8183 COC(=O)CCCCCCOCC[Si](C)(C)C 34a_100009863599_200000733723 [0,2,0,0,0,0|1,1,0]=4 16417 B16R0.8183 COC(=O)CCCCCCOCC[Si](C)(C)C 7a_100000039746_100009815986 [0,2,0,0,0,0|1,1,0]=4 16418 B16R0.8183 COC(=O)CCCCCCOCC[Si](C)(C)C 7a_100009863599_200000733723 [0,2,0,0,0,0|1,1,0]=4 16419 B16R0.8183 COC(=O)CCCCCCSCCC(C)(C)C 62a_100000755188_100009815986 [0,2,0,0,0,0|1,0,0]=3 16420 B16R0.8183 COC(=O)CCCCCCSCCC(C)(C)C 62a_100009815986_100000755188 [0,2,0,0,0,0|1,0,0]=3 16421 B16R0.8183 COC(=O)CCCCCCSCCC(C)(C)O 62a_100000702414_100009815986 [0,2,0,0,0,0|1,0,0]=3 16422 B16R0.8183 COC(=O)CCCCCCSCCC(C)(C)O 62a_100009815986_100000702414 [0,2,0,0,0,0|1,0,0]=3 16423 B16R0.8183 COC(=O)CCCCCCSCCC(F)(F)F 62a_100009815986_100011219754 [0,2,0,0,0,0|2,0,0]=4 16424 B16R0.8183 COC(=O)CCCCCCSCCC(F)(F)F 62a_100011219754_100009815986 [0,2,0,0,0,0|2,0,0]=4 16425 B16R0.8183 COC(=O)CCCCCCSCCS(=O)(=O)C 62a_100000731031_100009815986 [0,2,0,0,0,0|2,0,0]=4 16426 B16R0.8183 COC(=O)CCCCCCSCCS(=O)(=O)C 62a_100009815986_100000230027 [0,2,0,0,0,0|2,0,0]=4 16427 B16R0.8183 COC(=O)CCCCCCSCC[N+](C)(C)C 62a_100000085578_100009815986 [0,2,0,0,0,0|2,0,0]=4 16428 B16R0.8183 COC(=O)CCCCCCSCC[N+](C)(C)C 62a_100009815986_100000085578 [0,2,0,0,0,0|2,0,0]=4 16429 B16R0.8183 COC(=O)CCCCCCSCC[Si](C)(C)C 62a_100009815986_200000733723 [0,2,0,0,0,0|1,1,0]=4 16430 B16R0.8183 COC(=O)CCCCCCSCC[Si](C)(C)C 62a_200000733723_100009815986 [0,2,0,0,0,0|1,1,0]=4 16431 B16R0.8183 COC(=O)CCCCCNCCCC(F)(F)F 2230a_100000727188_100009816466 [0,2,0,0,0,0|2,0,0]=4 16432 B16R0.8183 COC(=O)CCCCCNCCCC(F)(F)F 34a_100000727188_100009816466 [0,2,0,0,0,0|2,0,0]=4 16433 B16R0.8183 COC(=O)CCCCCNCCCS(=O)(=O)C 2230a_100000742409_100009816466 [0,2,0,0,0,0|2,0,0]=4 16434 B16R0.8183 COC(=O)CCCCCNCCCS(=O)(=O)C 34a_100000742409_100009816466 [0,2,0,0,0,0|2,0,0]=4 16435 B16R0.8183 COC(=O)CCCCCNCCOC(C)(C)C 2230a_100000747557_100009816466 [0,2,0,0,0,0|2,0,0]=4 16436 B16R0.8183 COC(=O)CCCCCNCCSC(C)(C)C 2230a_100000689375_100009816466 [0,2,0,0,0,0|2,0,0]=4 16437 B16R0.8183 COC(=O)CCCCCOCCCC(C)(C)O 34a_100000074720_100009888830 [0,2,0,0,0,0|1,0,0]=3 16438 B16R0.8183 COC(=O)CCCCCOCCCC(C)(C)O 7a_100000074720_100009888830 [0,2,0,0,0,0|1,0,0]=3 16439 B16R0.8183 COC(=O)CCCCCOCCCC(F)(F)F 34a_100000074720_100011215983 [0,2,0,0,0,0|2,0,0]=4 16440 B16R0.8183 COC(=O)CCCCCOCCCC(F)(F)F 34a_100000749235_100009816466 [0,2,0,0,0,0|2,0,0]=4 16441 B16R0.8183 COC(=O)CCCCCOCCCC(F)(F)F 7a_100000074720_100011216173 [0,2,0,0,0,0|2,0,0]=4 16442 B16R0.8183 COC(=O)CCCCCOCCCS(=O)(=O)C 34a_100000074720_100000754308 [0,2,0,0,0,0|2,0,0]=4 16443 B16R0.8183 COC(=O)CCCCCOCCCS(=O)(=O)C 34a_100000689940_100009816466 [0,2,0,0,0,0|2,0,0]=4 16444 B16R0.8183 COC(=O)CCCCCOCCCS(=O)(=O)C 7a_100000074720_100000754308 [0,2,0,0,0,0|2,0,0]=4 16445 B16R0.8183 COC(=O)CCCCCOCCCS(=O)(=O)C 7a_100000689940_100009816466 [0,2,0,0,0,0|2,0,0]=4 16446 B16R0.8183 COC(=O)CCCCCOCCC[N+](C)(C)C 34a_100000074720_100016990835 [0,2,0,0,0,0|2,0,0]=4 16447 B16R0.8183 COC(=O)CCCCCOCCC[N+](C)(C)C 7a_100000074720_100016990835 [0,2,0,0,0,0|2,0,0]=4 16448 B16R0.8183 COC(=O)CCCCCOCCC[Si](C)(C)C 34a_100000074720_100011219597 [0,2,0,0,0,0|1,1,0]=4 16449 B16R0.8183 COC(=O)CCCCCOCCC[Si](C)(C)C 7a_100000074720_100011219597 [0,2,0,0,0,0|1,1,0]=4 16450 B16R0.8183 COC(=O)CCCCCOCCC[Si](C)(C)C 7a_200011215415_100009816466 [0,2,0,0,0,0|1,1,0]=4 16451 B16R0.8183 COC(=O)CCCCCOCCOC(C)(C)C 34a_100000693234_100009816466 [0,2,0,0,0,0|2,0,0]=4 16452 B16R0.8183 COC(=O)CCCCCOCCOC(C)(C)C 7a_100000693234_100009816466 [0,2,0,0,0,0|2,0,0]=4 16453 B16R0.8183 COC(=O)CCCCCSCCCC(C)(C)O 62a_100009816466_100009888830 [0,2,0,0,0,0|1,0,0]=3 16454 B16R0.8183 COC(=O)CCCCCSCCCC(C)(C)O 62a_100009888830_100009816466 [0,2,0,0,0,0|1,0,0]=3 16455 B16R0.8183 COC(=O)CCCCCSCCCC(F)(F)F 62a_100009816466_100011216173 [0,2,0,0,0,0|2,0,0]=4 16456 B16R0.8183 COC(=O)CCCCCSCCCC(F)(F)F 62a_100011216173_100009816466 [0,2,0,0,0,0|2,0,0]=4 16457 B16R0.8183 COC(=O)CCCCCSCCCS(=O)(=O)C 62a_100000754308_100009816466 [0,2,0,0,0,0|2,0,0]=4 16458 B16R0.8183 COC(=O)CCCCCSCCCS(=O)(=O)C 62a_100009816466_100000754308 [0,2,0,0,0,0|2,0,0]=4 16459 B16R0.8183 COC(=O)CCCCCSCCC[N+](C)(C)C 62a_100009816466_100016990835 [0,2,0,0,0,0|2,0,0]=4 16460 B16R0.8183 COC(=O)CCCCCSCCC[N+](C)(C)C 62a_100016990835_100009816466 [0,2,0,0,0,0|2,0,0]=4 16461 B16R0.8183 COC(=O)CCCCCSCCC[Si](C)(C)C 62a_100009816466_100011219597 [0,2,0,0,0,0|1,1,0]=4 16462 B16R0.8183 COC(=O)CCCCCSCCC[Si](C)(C)C 62a_100011219597_100009816466 [0,2,0,0,0,0|1,1,0]=4 16463 B16R0.8183 COC(=O)CCCCNCCCOC(C)(C)C 2230a_100011250582_100000204269 [0,2,0,0,0,0|2,0,0]=4 16464 B16R0.8183 COC(=O)CCCCOCCCCC(F)(F)F 34a_100000059025_100000692467 [0,2,0,0,0,0|2,0,0]=4 16465 B16R0.8183 COC(=O)CCCCOCCCCC(F)(F)F 34a_100000749236_100000204269 [0,2,0,0,0,0|2,0,0]=4 16466 B16R0.8183 COC(=O)CCCCOCCCCC(F)(F)F 7a_100000059025_100000692467 [0,2,0,0,0,0|2,0,0]=4 16467 B16R0.8183 COC(=O)CCCCOCCCCC(F)(F)F 7a_100000749236_100000204269 [0,2,0,0,0,0|2,0,0]=4 16468 B16R0.8183 COC(=O)CCCCOCCCC[Si](C)(C)C 7a_200009881916_100000204269 [0,2,0,0,0,0|1,1,0]=4 16469 B16R0.8183 COC(=O)CCCCSCCCCC(F)(F)F 62a_100000204269_100000692467 [0,2,0,0,0,0|2,0,0]=4 16470 B16R0.8183 COC(=O)CCCCSCCCCC(F)(F)F 62a_100000692467_100000204269 [0,2,0,0,0,0|2,0,0]=4 16471 B16R0.8183 COC(=O)CCCSCCCCCC(C)(C)O 62a_100010402123_100011218270 [0,2,0,0,0,0|1,0,0]=3 16472 B16R0.8183 COC(=O)CCCSCCCCCC(C)(C)O 62a_100011218270_100010402123 [0,2,0,0,0,0|1,0,0]=3 16473 B16R0.8183 COC(=O)CCCSCCCCCC(F)(F)F 62a_100010187589_100011218270 [0,2,0,0,0,0|2,0,0]=4 16474 B16R0.8183 COC(=O)CCCSCCCCCC(F)(F)F 62a_100011218270_100010187589 [0,2,0,0,0,0|2,0,0]=4 16475 B16R0.8183 COC(=O)CCCSCCCCC[N+](C)(C)C 62a_100009813293_100011218270 [0,2,0,0,0,0|2,0,0]=4 16476 B16R0.8183 COC(=O)CCCSCCCCC[N+](C)(C)C 62a_100011218270_100009813293 [0,2,0,0,0,0|2,0,0]=4 16477 B16R0.8183 COC(=O)CCSCCCCCC[N+](C)(C)C 62a_100000204255_100009996864 [0,2,0,0,0,0|2,0,0]=4 16478 B16R0.8183 COC(=O)CCSCCCCCC[N+](C)(C)C 62a_100009996864_100000204255 [0,2,0,0,0,0|2,0,0]=4 16479 B16R0.8183 COC(=O)NCCOCCCCCC(C)(C)O 34a_100000757965_100010402123 [0,2,0,0,0,0|2,0,0]=4 16480 B16R0.8183 COC(=O)OCCOCCCCCC(C)(C)O 34a_100010262106_100010402123 [0,2,0,0,0,0|2,0,0]=4 16481 B16R0.5309 CCCCCCCCCOCP(=O)(OC)OC 34a_100000101693_100011214924 [0,2,0,0,0,0|2,0,0]=4 16482 B16R0.5309 CCCCCCCCOCCP(=O)(OC)OC 34a_200000043213_100000210759 [0,2,0,0,0,0|2,0,0]=4 16483 B16R0.312 CCCC(C)CCCOCCC(C)C(=O)OC 34a_100011713154_100000034942 [0,2,0,0,0,0|1,0,0]=3 16484 B16R0.312 CCCC(C)CCCOCCC(C)C(=O)OC 7a_100011713154_100000034942 [0,2,0,0,0,0|1,0,0]=3 16485 B16R0.655 CCC(NCCCCCCCCO)C(=O)OC 2230a_102515433106_100000235869 [0,2,0,0,0,0|2,0,0]=4 16486 B16R0.655 CCC(NCCCCCCCCO)C(=O)OC 34a_102515433106_100000235869 [0,2,0,0,0,0|2,0,0]=4 16487 B16R0.655 CCC(OCCCCCCCCBr)C(=O)OC 34a_100009813846_100000235869 [0,2,0,0,0,0|2,0,0]=4 16488 B16R0.655 CCC(OCCCCCCCCBr)C(=O)OC 7a_100009813846_100000742303 [0,2,0,0,0,0|2,0,0]=4 16489 B16R0.655 CCC(OCCCCCCCCCl)C(=O)OC 34a_100000033203_100000235869 [0,2,0,0,0,0|2,0,0]=4 16490 B16R0.655 CCC(OCCCCCCCCCl)C(=O)OC 7a_100000033203_100000742303 [0,2,0,0,0,0|2,0,0]=4 16491 B16R0.655 CCC(OCCCCCCCCN)C(=O)OC 34a_102515433106_100000235869 [0,2,0,0,0,0|2,0,0]=4 16492 B16R0.655 CCC(OCCCCCCCCO)C(=O)OC 34a_100000695916_100000033203 [0,2,0,0,0,0|2,0,0]=4 16493 B16R0.655 CCC(OCCCCCCCCO)C(=O)OC 7a_100000695916_100000033203 [0,2,0,0,0,0|2,0,0]=4 16494 B16R0.655 CCC(SCCCCCCCCO)C(=O)OC 62a_100000033203_100000235869 [0,2,0,0,0,0|2,0,0]=4 16495 B16R0.655 CCC(SCCCCCCCCO)C(=O)OC 62a_100000235869_100000033203 [0,2,0,0,0,0|2,0,0]=4 16496 B16R0.655 CCCCCCCCCNC(C=O)C(=O)OC 34a_100000212291_100000046368 [0,2,0,0,0,0|1,0,0]=3 16497 B16R0.655 CCCCCCCCCNC(CC)C(=O)OC 2230a_100000212291_100000235869 [0,2,0,0,0,0|1,0,0]=3 16498 B16R0.655 CCCCCCCCCNC(CC)C(=O)OC 34a_100000212291_100000235869 [0,2,0,0,0,0|1,0,0]=3 16499 B16R0.655 CCCCCCCCCNC(CO)C(=O)OC 34a_100000212291_100012276630 [0,2,0,0,0,0|1,0,0]=3 16500 B16R0.655 CCCCCCCCCNC(OC)C(=O)OC 34a_100000212291_100000101307 [0,2,0,0,0,0|1,0,0]=3 16501 B16R0.655 CCCCCCCCCN[C@@H](CC)C(=O)NC 2230a_106657271573_100011214924 [0,2,0,0,0,0|2,0,0]=4 16502 B16R0.655 CCCCCCCCCN[C@@H](CC)C(=O)NC 34a_106657271573_100011214924 [0,2,0,0,0,0|2,0,0]=4 16503 B16R0.655 CCCCCCCCCOC(C=O)C(=O)OC 34a_100000210712_100000046368 [0,2,0,0,0,0|1,0,0]=3 16504 B16R0.655 CCCCCCCCCOC(CC)C(=O)CC 34a_200011218131_100011214924 [0,2,0,0,0,0|2,0,0]=4 16505 B16R0.655 CCCCCCCCCOC(CC)C(=O)CC 7a_200011218131_100000210328 [0,2,0,0,0,0|2,0,0]=4 16506 B16R0.655 CCCCCCCCCOC(CC)C(=O)OC 34a_100000210712_100000235869 [0,2,0,0,0,0|1,0,0]=3 16507 B16R0.655 CCCCCCCCCOC(CC)C(=O)OC 34a_100000695916_100011214924 [0,2,0,0,0,0|1,0,0]=3 16508 B16R0.655 CCCCCCCCCOC(CC)C(=O)OC 7a_100000210712_100000742303 [0,2,0,0,0,0|1,0,0]=3 16509 B16R0.655 CCCCCCCCCOC(CC)C(=O)OC 7a_100000695916_100000210328 [0,2,0,0,0,0|1,0,0]=3 16510 B16R0.655 CCCCCCCCCOC(CN)C(=O)OC 34a_100000695228_100011214924 [0,2,0,0,0,0|1,0,0]=3 16511 B16R0.655 CCCCCCCCCOC(CO)C(=O)OC 34a_100000210712_100012276630 [0,2,0,0,0,0|1,0,0]=3 16512 B16R0.655 CCCCCCCCCOC(OC)C(=O)OC 34a_100000036821_100011214924 [0,2,0,0,0,0|1,0,0]=3 16513 B16R0.655 CCCCCCCCCOC(OC)C(=O)OC 34a_100000210712_100000101307 [0,2,0,0,0,0|1,0,0]=3 16514 B16R0.655 CCCCCCCCCSC(C=O)C(=O)OC 62a_100000046368_100000210670 [0,2,0,0,0,0|1,0,0]=3 16515 B16R0.655 CCCCCCCCCSC(CC)C(=O)OC 62a_100000235869_100000210670 [0,2,0,0,0,0|1,0,0]=3 16516 B16R0.655 CCCCCCCCCSC(CO)C(=O)OC 62a_100012276630_100000210670 [0,2,0,0,0,0|1,0,0]=3 16517 B16R0.655 CCCCCCCCCSC(OC)C(=O)OC 62a_100000101307_100000210670 [0,2,0,0,0,0|1,0,0]=3 16518 B16R0.655 CCCCCCOCCOC(C=O)C(=O)OC 34a_100000691444_100000046368 [0,2,0,0,0,0|2,0,0]=4 16519 B16R0.655 CCCCCCOCCOC(CC)C(=O)OC 34a_100000691444_100000235869 [0,2,0,0,0,0|2,0,0]=4 16520 B16R0.655 CCCCCCOCCOC(CC)C(=O)OC 7a_100000691444_100000742303 [0,2,0,0,0,0|2,0,0]=4 16521 B16R0.655 CCCCCCOCCOC(CO)C(=O)OC 34a_100000691444_100012276630 [0,2,0,0,0,0|2,0,0]=4 16522 B16R0.655 CCCCCCOCCOC(OC)C(=O)OC 34a_100000691444_100000101307 [0,2,0,0,0,0|2,0,0]=4 16523 B16R0.655 CCCCNCCCCOC(C=O)C(=O)OC 34a_200011216965_100000046368 [0,2,0,0,0,0|2,0,0]=4 16524 B16R0.655 CCCCNCCCCOC(CC)C(=O)OC 34a_200011216965_100000235869 [0,2,0,0,0,0|2,0,0]=4 16525 B16R0.655 CCCCNCCCCOC(CO)C(=O)OC 34a_200011216965_100012276630 [0,2,0,0,0,0|2,0,0]=4 16526 B16R0.655 CCCCNCCCCOC(OC)C(=O)OC 34a_200011216965_100000101307 [0,2,0,0,0,0|2,0,0]=4 16527 B16R0.655 CCCCOCCCCOC(C=O)C(=O)OC 34a_200000760531_100000046368 [0,2,0,0,0,0|2,0,0]=4 16528 B16R0.655 CCCCOCCCCOC(CC)C(=O)OC 34a_200000760531_100000235869 [0,2,0,0,0,0|2,0,0]=4 16529 B16R0.655 CCCCOCCCCOC(CC)C(=O)OC 7a_200000760531_100000742303 [0,2,0,0,0,0|2,0,0]=4 16530 B16R0.655 CCCCOCCCCOC(CO)C(=O)OC 34a_200000760531_100012276630 [0,2,0,0,0,0|2,0,0]=4 16531 B16R0.655 CCCCOCCCCOC(OC)C(=O)OC 34a_200000760531_100000101307 [0,2,0,0,0,0|2,0,0]=4 16532 B16R0.655 COC(=O)C(C=O)NCCCCCCCCO 34a_102515433106_100000046368 [0,2,0,0,0,0|2,0,0]=4 16533 B16R0.655 COC(=O)C(C=O)OCCCCCCCCBr 34a_100009813846_100000046368 [0,2,0,0,0,0|2,0,0]=4 16534 B16R0.655 COC(=O)C(C=O)OCCCCCCCCCl 34a_100000033203_100000046368 [0,2,0,0,0,0|2,0,0]=4 16535 B16R0.655 COC(=O)C(C=O)OCCCCCCCCN 34a_102515433106_100000046368 [0,2,0,0,0,0|2,0,0]=4 16536 B16R0.655 COC(=O)C(C=O)SCCCCCCCCO 62a_100000033203_100000046368 [0,2,0,0,0,0|2,0,0]=4 16537 B16R0.655 COC(=O)C(C=O)SCCCCCCCCO 62a_100000046368_100000033203 [0,2,0,0,0,0|2,0,0]=4 16538 B16R0.655 COC(=O)C(CN)OCCCCCCCCO 34a_100000695228_100000033203 [0,2,0,0,0,0|2,0,0]=4 16539 B16R0.655 COC(=O)C(CO)NCCCCCCCCO 34a_102515433106_100012276630 [0,2,0,0,0,0|2,0,0]=4 16540 B16R0.655 COC(=O)C(CO)OCCCCCCCCBr 34a_100009813846_100012276630 [0,2,0,0,0,0|2,0,0]=4 16541 B16R0.655 COC(=O)C(CO)OCCCCCCCCCl 34a_100000033203_100012276630 [0,2,0,0,0,0|2,0,0]=4 16542 B16R0.655 COC(=O)C(CO)OCCCCCCCCN 34a_102515433106_100012276630 [0,2,0,0,0,0|2,0,0]=4 16543 B16R0.655 COC(=O)C(CO)SCCCCCCCCO 62a_100000033203_100012276630 [0,2,0,0,0,0|2,0,0]=4 16544 B16R0.655 COC(=O)C(CO)SCCCCCCCCO 62a_100012276630_100000033203 [0,2,0,0,0,0|2,0,0]=4 16545 B16R0.655 COC(=O)C(NCCCCCCCCO)OC 34a_102515433106_100000101307 [0,2,0,0,0,0|2,0,0]=4 16546 B16R0.655 COC(=O)C(OC)OCCCCCCCCBr 34a_100009813846_100000101307 [0,2,0,0,0,0|2,0,0]=4 16547 B16R0.655 COC(=O)C(OC)OCCCCCCCCCl 34a_100000033203_100000101307 [0,2,0,0,0,0|2,0,0]=4 16548 B16R0.655 COC(=O)C(OC)OCCCCCCCCN 34a_102515433106_100000101307 [0,2,0,0,0,0|2,0,0]=4 16549 B16R0.655 COC(=O)C(OC)OCCCCCCCCO 34a_100000036821_100000033203 [0,2,0,0,0,0|2,0,0]=4 16550 B16R0.655 COC(=O)C(OC)SCCCCCCCCO 62a_100000033203_100000101307 [0,2,0,0,0,0|2,0,0]=4 16551 B16R0.655 COC(=O)C(OC)SCCCCCCCCO 62a_100000101307_100000033203 [0,2,0,0,0,0|2,0,0]=4 16552 B16R0.1183 C=C(CNCCCCCCCC)C(=O)OCC 34a_100000229939_100000755967 [0,2,0,0,0,0|1,0,1]=4 16553 B16R0.1183 C=C(COCCCCCCCC)C(=O)OCC 34a_100000210232_100000755967 [0,2,0,0,0,0|1,0,1]=4 16554 B16R0.1183 C=C(COCCCCCCCC)C(=O)OCC 7a_100000210232_100000755967 [0,2,0,0,0,0|1,0,1]=4 16555 B16R0.1183 C=C(CSCCCCCCCC)C(=O)OCC 62a_100000210759_100000755967 [0,2,0,0,0,0|1,0,1]=4 16556 B16R0.1183 C=C(CSCCCCCCCC)C(=O)OCC 62a_100000755967_100000210317 [0,2,0,0,0,0|1,0,1]=4 16557 B16R0.1183 CC=CC(=O)N(C)CCCCCCCCCC 11a_100000207566_100000210699 [0,2,0,0,0,0|2,0,0]=4 16558 B16R0.1183 CC=CC(=O)N(C)CCCCCCCCCC 1626a_100000207566_100000210699 [0,2,0,0,0,0|2,0,0]=4 16559 B16R0.1183 CC=CC(=O)N(C)CCCCCCCCCC 240690a_100000207566_100000210699 [0,2,0,0,0,0|2,0,0]=4 16560 B16R0.1183 CCCCCCCCCCC(=O)/C(=N/OC)/C 1458a_100160996864_100000210319 [0,2,0,0,0,0|1,0,1]=4 16561 B16R0.1183 CCCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210319 [0,2,0,0,0,0|1,0,1]=4 16562 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 11a_100000207566_100000211992 [0,2,0,0,0,0|2,0,0]=4 16563 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 1626a_100000207566_100000211992 [0,2,0,0,0,0|2,0,0]=4 16564 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 240690a_100000207566_100000211992 [0,2,0,0,0,0|2,0,0]=4 16565 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 527a_100000207566_100000211992 [0,2,0,0,0,0|2,0,0]=4 16566 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCO 240690a_100000207566_100011216618 [0,2,0,0,0,0|2,0,0]=4 16567 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 11a_100000207566_100000210968 [0,2,0,0,0,0|1,0,0]=3 16568 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 1626a_100000207566_100000210968 [0,2,0,0,0,0|1,0,0]=3 16569 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 240690a_100000207566_100000210968 [0,2,0,0,0,0|1,0,0]=3 16570 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 527a_100000207566_100000210968 [0,2,0,0,0,0|1,0,0]=3 16571 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 11a_100000207566_100000184570 [0,2,0,0,0,0|1,1,0]=4 16572 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 1626a_100000207566_100000184570 [0,2,0,0,0,0|1,1,0]=4 16573 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 240690a_100000207566_100000184570 [0,2,0,0,0,0|1,1,0]=4 16574 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 527a_100000207566_100000184570 [0,2,0,0,0,0|1,1,0]=4 16575 B16R0.1183 CCCCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000207566 [0,2,0,0,0,0|2,0,0]=4 16576 B16R0.1183 CCCCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000207566 [0,2,0,0,0,0|2,0,0]=4 16577 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC 11a_100000212291_100014798877 [0,2,0,0,0,0|1,0,1]=4 16578 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC 1626a_100000212291_100014798877 [0,2,0,0,0,0|1,0,1]=4 16579 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC 240690a_100000212291_100014798877 [0,2,0,0,0,0|1,0,1]=4 16580 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 2230a_100000212291_100000230173 [0,2,0,0,0,0|2,0,0]=4 16581 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100011214924 [0,2,0,0,0,0|2,0,0]=4 16582 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 34a_100000212291_100000230173 [0,2,0,0,0,0|2,0,0]=4 16583 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 34a_100000736553_100011214924 [0,2,0,0,0,0|2,0,0]=4 16584 B16R0.1183 CCCCCCCCCNC(C)C(=O)OCC 2230a_100000212291_100011215307 [0,2,0,0,0,0|1,0,0]=3 16585 B16R0.1183 CCCCCCCCCNC(C)C(=O)OCC 34a_100000212291_100011216346 [0,2,0,0,0,0|1,0,0]=3 16586 B16R0.1183 CCCCCCCCCNC(F)C(=O)OCC 2230a_100000212291_100000760018 [0,2,0,0,0,0|1,0,0]=3 16587 B16R0.1183 CCCCCCCCCNC(F)C(=O)OCC 34a_100000212291_100000760018 [0,2,0,0,0,0|1,0,0]=3 16588 B16R0.1183 CCCCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100011214924 [0,2,0,0,0,0|1,1,0]=4 16589 B16R0.1183 CCCCCCCCCOC(C)C(=O)NCC 34a_100000210712_100000230173 [0,2,0,0,0,0|2,0,0]=4 16590 B16R0.1183 CCCCCCCCCOC(C)C(=O)NCC 7a_100000210712_100000230173 [0,2,0,0,0,0|2,0,0]=4 16591 B16R0.1183 CCCCCCCCCOC(C)C(=O)OCC 34a_100000210712_100011216346 [0,2,0,0,0,0|1,0,0]=3 16592 B16R0.1183 CCCCCCCCCOC(C)C(=O)OCC 7a_100000210712_100011216346 [0,2,0,0,0,0|1,0,0]=3 16593 B16R0.1183 CCCCCCCCCOC(F)C(=O)OCC 34a_100000210712_100000760018 [0,2,0,0,0,0|1,0,0]=3 16594 B16R0.1183 CCCCCCCCCOC(F)C(=O)OCC 7a_100000210712_100000040065 [0,2,0,0,0,0|1,0,0]=3 16595 B16R0.1183 CCCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210328 [0,2,0,0,0,0|1,0,0]=3 16596 B16R0.1183 CCCCCCCCCSC(C)C(=O)NCC 62a_100000230173_100000210670 [0,2,0,0,0,0|2,0,0]=4 16597 B16R0.1183 CCCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100000210670 [0,2,0,0,0,0|1,0,0]=3 16598 B16R0.1183 CCCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100000210670 [0,2,0,0,0,0|1,0,0]=3 16599 B16R0.1183 CCCCCCCCSCC(=O)C(=O)OCC 62a_100000210759_100000211299 [0,2,0,0,0,0|1,0,1]=4 16600 B16R0.1183 CCCCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210317 [0,2,0,0,0,0|1,0,1]=4 16601 B16R0.1183 CCCCCCOCCOC(C)C(=O)OCC 34a_100000691444_100011216346 [0,2,0,0,0,0|2,0,0]=4 16602 B16R0.1183 CCCCCCOCCOC(C)C(=O)OCC 7a_100000691444_100011216346 [0,2,0,0,0,0|2,0,0]=4 16603 B16R0.1183 CCCCCCOCCOC(F)C(=O)OCC 34a_100000691444_100000760018 [0,2,0,0,0,0|2,0,0]=4 16604 B16R0.1183 CCCCCCOCCOC(F)C(=O)OCC 7a_100000691444_100000040065 [0,2,0,0,0,0|2,0,0]=4 16605 B16R0.1183 CCCCNCCCCCC(=O)C(=O)OCC 2230a_100000102301_100000068741 [0,2,0,0,0,0|1,0,1]=4 16606 B16R0.1183 CCCCNCCCCOC(C)C(=O)OCC 34a_200011216965_100011216346 [0,2,0,0,0,0|2,0,0]=4 16607 B16R0.1183 CCCCNCCCCOC(F)C(=O)OCC 34a_200011216965_100000760018 [0,2,0,0,0,0|2,0,0]=4 16608 B16R0.1183 CCCCOCCCCOC(C)C(=O)OCC 34a_200000760531_100011216346 [0,2,0,0,0,0|2,0,0]=4 16609 B16R0.1183 CCCCOCCCCOC(C)C(=O)OCC 7a_200000760531_100011216346 [0,2,0,0,0,0|2,0,0]=4 16610 B16R0.1183 CCCCOCCCCOC(F)C(=O)OCC 34a_200000760531_100000760018 [0,2,0,0,0,0|2,0,0]=4 16611 B16R0.1183 CCCCOCCCCOC(F)C(=O)OCC 7a_200000760531_100000040065 [0,2,0,0,0,0|2,0,0]=4 16612 B16R0.1183 CCCCSCCCCCC(=O)C(=O)OCC 62a_100000210211_100000068741 [0,2,0,0,0,0|1,0,1]=4 16613 B16R0.1183 CCOC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100011215307 [0,2,0,0,0,0|2,0,0]=4 16614 B16R0.1183 CCOC(=O)C(C)NCCCCCCCCO 34a_102515433106_100011216346 [0,2,0,0,0,0|2,0,0]=4 16615 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCBr 34a_100009813846_100011216346 [0,2,0,0,0,0|2,0,0]=4 16616 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100011216346 [0,2,0,0,0,0|2,0,0]=4 16617 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCCl 34a_100000033203_100011216346 [0,2,0,0,0,0|2,0,0]=4 16618 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100011216346 [0,2,0,0,0,0|2,0,0]=4 16619 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCN 34a_102515433106_100011216346 [0,2,0,0,0,0|2,0,0]=4 16620 B16R0.1183 CCOC(=O)C(C)SCCCCCCCCO 62a_100000033203_100011216346 [0,2,0,0,0,0|2,0,0]=4 16621 B16R0.1183 CCOC(=O)C(C)SCCCCCCCCO 62a_100011216346_100000033203 [0,2,0,0,0,0|2,0,0]=4 16622 B16R0.1183 CCOC(=O)C(F)NCCCCCCCCO 2230a_102515433106_100000760018 [0,2,0,0,0,0|2,0,0]=4 16623 B16R0.1183 CCOC(=O)C(F)NCCCCCCCCO 34a_102515433106_100000760018 [0,2,0,0,0,0|2,0,0]=4 16624 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCBr 34a_100009813846_100000760018 [0,2,0,0,0,0|2,0,0]=4 16625 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCBr 7a_100009813846_100000040065 [0,2,0,0,0,0|2,0,0]=4 16626 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCCl 34a_100000033203_100000760018 [0,2,0,0,0,0|2,0,0]=4 16627 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCCl 7a_100000033203_100000040065 [0,2,0,0,0,0|2,0,0]=4 16628 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCN 34a_102515433106_100000760018 [0,2,0,0,0,0|2,0,0]=4 16629 B16R0.1183 CCOC(=O)C(F)SCCCCCCCCO 62a_100000033203_100000760018 [0,2,0,0,0,0|2,0,0]=4 16630 B16R0.1183 CCOC(=O)C(F)SCCCCCCCCO 62a_100000760018_100000033203 [0,2,0,0,0,0|2,0,0]=4 16631 B16R0.1183 CCOC(=O)[C@H](C)OCCCCCCCCO 7a_100000751109_100000033203 [0,2,0,0,0,0|2,0,0]=4 16632 B16R0.1831 CCCCCCCCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210188 [0,2,0,0,0,0|1,0,1]=4 16633 B16R0.1831 CCCCCCCCC(C)OC(C)C(=O)CC 7a_100000210740_100000742827 [0,2,0,0,0,0|2,0,0]=4 16634 B16R0.1831 CCCCCCCCC(C)OC(C)C(=O)NC 34a_100000210740_100000731044 [0,2,0,0,0,0|2,0,0]=4 16635 B16R0.1831 CCCCCCCCC(C)OC(C)C(=O)NC 7a_100000210740_100000209862 [0,2,0,0,0,0|2,0,0]=4 16636 B16R0.1831 CCCCCCCCC(C)OC(C)C(=O)OC 34a_100000210740_100000211248 [0,2,0,0,0,0|1,0,0]=3 16637 B16R0.1831 CCCCCCCCC(C)OC(C)C(=O)OC 7a_100000210740_100000211248 [0,2,0,0,0,0|1,0,0]=3 16638 B16R0.1831 CCCCCCCCC(C)OC(F)C(=O)NC 34a_100000210740_100009813575 [0,2,0,0,0,0|2,0,0]=4 16639 B16R0.1831 CCCCCCCCC(C)OC(F)C(=O)NC 7a_100000210740_100009813575 [0,2,0,0,0,0|2,0,0]=4 16640 B16R0.1831 CCCCCCCCN(C)CC(C)C(=O)OC 269982a_100000207567_100000698445 [0,2,0,0,0,0|1,0,0]=3 16641 B16R0.4852 CCCCCCCCCC(=O)C(C)C(=O)CC 1458a_100000210558_100000742827 [0,2,0,0,0,0|1,0,1]=4 16642 B16R0.4852 CCCCCCCCCC(=O)C(C)C(=O)NC 1458a_100000210558_100000209862 [0,2,0,0,0,0|1,0,1]=4 16643 B16R0.4852 CCCCCCCCCC(=O)C(C)C(=O)OC 1458a_100000210558_100000211248 [0,2,0,0,0,0|0,0,1]=3 16644 B16R0.4852 CCCCCCCCCC(=O)C(C)C(=O)OC 1458a_100012027023_100000210670 [0,2,0,0,0,0|0,0,1]=3 16645 B16R0.4852 CCCCCCCCCC(=O)C(F)C(=O)NC 1458a_100000210558_100009813575 [0,2,0,0,0,0|1,0,1]=4 16646 B16R0.4852 CCCCCCCCCN(C)C(=O)C(=O)OC 11a_100000232482_100000024059 [0,2,0,0,0,0|1,0,1]=4 16647 B16R0.4852 CCCCCCCCCN(C)C(=O)C(=O)OC 1626a_100000232482_100000024059 [0,2,0,0,0,0|1,0,1]=4 16648 B16R0.4852 CCCCCCCCCN(C)C(=O)C(=O)OC 240690a_100000232482_100000024059 [0,2,0,0,0,0|1,0,1]=4 16649 B16R0.4852 CCCCCCCCCN(C)C(=O)C(=O)OC 527a_100000232482_100000024059 [0,2,0,0,0,0|1,0,1]=4 16650 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)CC 2230a_100000232482_100000742827 [0,2,0,0,0,0|2,0,0]=4 16651 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)CC 269982a_100000232482_100000742827 [0,2,0,0,0,0|2,0,0]=4 16652 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)NC 2230a_100000232482_100000731044 [0,2,0,0,0,0|2,0,0]=4 16653 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)NC 269982a_100000232482_100000209862 [0,2,0,0,0,0|2,0,0]=4 16654 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)OC 2230a_100000232482_100000211248 [0,2,0,0,0,0|1,0,0]=3 16655 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)OC 2230a_100000725243_100011214924 [0,2,0,0,0,0|1,0,0]=3 16656 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)OC 269982a_100000232482_100000211248 [0,2,0,0,0,0|1,0,0]=3 16657 B16R0.4852 CCCCCCCCCN(C)C(C)C(=O)OC 269982a_100000725243_100000210670 [0,2,0,0,0,0|1,0,0]=3 16658 B16R0.4852 CCCCCCCCCN(C)C(F)C(=O)NC 2230a_100000232482_100009813575 [0,2,0,0,0,0|2,0,0]=4 16659 B16R0.4852 CCCCCCCCCN(C)C(F)C(=O)NC 269982a_100000232482_100009813575 [0,2,0,0,0,0|2,0,0]=4 16660 B16R0.4852 CCCCCCCCNC(=O)C(C)C(=O)OC 11a_100000229939_100012027023 [0,2,0,0,0,0|1,0,1]=4 16661 B16R0.4852 CCCCCCCCNC(=O)C(C)C(=O)OC 1626a_100000229939_100012027023 [0,2,0,0,0,0|1,0,1]=4 16662 B16R0.4852 CCCCCCCCNC(=O)C(C)C(=O)OC 240690a_100000229939_100012027023 [0,2,0,0,0,0|1,0,1]=4 16663 B16R0.4852 CCCCCCCCNC(=O)C(C)C(=O)OC 527a_100000229939_100012027023 [0,2,0,0,0,0|1,0,1]=4 16664 B16R0.4852 CCCCCCCCNC(C)C(=O)C(=O)OC 2230a_100000229939_100000692041 [0,2,0,0,0,0|1,0,1]=4 16665 B16R0.4852 CCCCCCCCNC(C)C(=O)C(=O)OC 34a_100000229939_100000692041 [0,2,0,0,0,0|1,0,1]=4 16666 B16R0.4852 CCCCCCCCOC(C)C(=O)C(=O)OC 34a_100000210232_100000692041 [0,2,0,0,0,0|1,0,1]=4 16667 B16R0.4852 CCCCCCCCO[C@H](C)[C@H](N)C(=O)NC 34a_100102634413_100000210759 [0,2,0,0,0,0|2,0,0]=4 16668 B16R0.4852 CCCCCCCCO[C@H](C)[C@H](N)C(=O)OC 34a_100000004424_100000210759 [0,2,0,0,0,0|1,0,0]=3 16669 B16R0.4852 CCCCCCCCSC(C)C(=O)C(=O)OC 62a_100000210759_100000692041 [0,2,0,0,0,0|1,0,1]=4 16670 B16R0.4852 CCCCCCCCSC(C)C(=O)C(=O)OC 62a_100000692041_100000210317 [0,2,0,0,0,0|1,0,1]=4 16671 B16R0.4852 COC(=O)C(C)C(=O)CCCCCCCCO 1458a_100012027023_100000033203 [0,2,0,0,0,0|1,0,1]=4 16672 B16R0.4852 COC(=O)C(C)N(C)CCCCCCCCO 2230a_100000725243_100000033203 [0,2,0,0,0,0|2,0,0]=4 16673 B16R0.4852 COC(=O)C(C)N(C)CCCCCCCCO 269982a_100000725243_100000033203 [0,2,0,0,0,0|2,0,0]=4 16674 B16R0.4852 COC(=O)[C@@H](N)[C@@H](C)OCCCCCCCO 34a_100000004424_100000760002 [0,2,0,0,0,0|2,0,0]=4 16675 B16R0.4852 COCCCCCCO[C@H](C)[C@H](N)C(=O)OC 34a_100000004424_100011998445 [0,2,0,0,0,0|2,0,0]=4 16676 B16R0.8619 CCCCCCCCCNC(C)(C)C(=O)NC 2230a_100000212291_100000732697 [0,2,0,0,0,0|2,0,0]=4 16677 B16R0.8619 CCCCCCCCCNC(C)(C)C(=O)NC 34a_100000212291_100000732697 [0,2,0,0,0,0|2,0,0]=4 16678 B16R0.8619 CCCCCCCCCNC(C)(C)C(=O)OC 2230a_100000212291_100000689032 [0,2,0,0,0,0|1,0,0]=3 16679 B16R0.8619 CCCCCCCCCNC(C)(F)C(=O)OC 2230a_100000212291_200009867631 [0,2,0,0,0,0|1,0,0]=3 16680 B16R0.8619 CCCCCCCCCNC(C)(F)C(=O)OC 34a_100000212291_200009867631 [0,2,0,0,0,0|1,0,0]=3 16681 B16R0.8619 CCCCCCCCCNC(F)(F)C(=O)OC 34a_100000212291_100000211177 [0,2,0,0,0,0|1,0,0]=3 16682 B16R0.8619 CCCCCCCCCOC(C)(C)C(=O)NC 34a_100000210712_100000732697 [0,2,0,0,0,0|2,0,0]=4 16683 B16R0.8619 CCCCCCCCCOC(C)(C)C(=O)OC 34a_100011217581_100011214924 [0,2,0,0,0,0|1,0,0]=3 16684 B16R0.8619 CCCCCCCCCOC(C)(C)C(=O)OC 7a_100011217581_100000210328 [0,2,0,0,0,0|1,0,0]=3 16685 B16R0.8619 CCCCCCCCCOC(C)(F)C(=O)OC 34a_100000210712_200009867631 [0,2,0,0,0,0|1,0,0]=3 16686 B16R0.8619 CCCCCCCCCOC(F)(F)C(=O)OC 34a_100000210712_100000211177 [0,2,0,0,0,0|1,0,0]=3 16687 B16R0.8619 CCCCCCCCCOC(F)(F)C(=O)OC 7a_100000210712_100000211177 [0,2,0,0,0,0|1,0,0]=3 16688 B16R0.8619 CCCCCCCCCSC(C)(C)C(=O)NC 62a_100000732697_100000210670 [0,2,0,0,0,0|2,0,0]=4 16689 B16R0.8619 CCCCCCCCCSC(C)(C)C(=O)OC 62a_100000689032_100000210670 [0,2,0,0,0,0|1,0,0]=3 16690 B16R0.8619 CCCCCCCCCSC(C)(F)C(=O)OC 62a_200009867631_100000210670 [0,2,0,0,0,0|1,0,0]=3 16691 B16R0.8619 CCCCCCCCCSC(F)(F)C(=O)OC 62a_100000211177_100000210670 [0,2,0,0,0,0|1,0,0]=3 16692 B16R0.8619 CCCCCCCCNCC(C)(C)C(=O)NC 34a_100000229939_100000702813 [0,2,0,0,0,0|2,0,0]=4 16693 B16R0.8619 CCCCCCCCNCC(F)(F)C(=O)OC 34a_100000229939_100010295740 [0,2,0,0,0,0|1,0,0]=3 16694 B16R0.8619 CCCCCCCCOCC(C)(C)C(=O)NC 34a_100000210232_100000702813 [0,2,0,0,0,0|2,0,0]=4 16695 B16R0.8619 CCCCCCCCOCC(C)(C)C(=O)OC 34a_100000709632_100000210759 [0,2,0,0,0,0|1,0,0]=3 16696 B16R0.8619 CCCCCCCCOCC(C)(C)C(=O)OC 7a_100000709632_100000210759 [0,2,0,0,0,0|1,0,0]=3 16697 B16R0.8619 CCCCCCCCOCC(F)(F)C(=O)OC 34a_100000210232_100010295740 [0,2,0,0,0,0|1,0,0]=3 16698 B16R0.8619 CCCCCCCCSCC(C)(C)C(=O)NC 62a_100000210759_100000702813 [0,2,0,0,0,0|2,0,0]=4 16699 B16R0.8619 CCCCCCCCSCC(C)(C)C(=O)NC 62a_100000702813_100000210317 [0,2,0,0,0,0|2,0,0]=4 16700 B16R0.8619 CCCCCCCCSCC(C)(C)C(=O)OC 62a_100000210759_100000684552 [0,2,0,0,0,0|1,0,0]=3 16701 B16R0.8619 CCCCCCCCSCC(C)(C)C(=O)OC 62a_100000684552_100000210317 [0,2,0,0,0,0|1,0,0]=3 16702 B16R0.8619 CCCCCCCCSCC(F)(F)C(=O)OC 62a_100000210759_100010295740 [0,2,0,0,0,0|1,0,0]=3 16703 B16R0.8619 CCCCCCCCSCC(F)(F)C(=O)OC 62a_100010295740_100000210317 [0,2,0,0,0,0|1,0,0]=3 16704 B16R0.8619 CCCCCCNCCCC(C)(C)C(=O)OC 2230a_100000210581_100010114820 [0,2,0,0,0,0|1,0,0]=3 16705 B16R0.8619 CCCCCCOCCCC(C)(C)C(=O)OC 34a_100000210259_100010114820 [0,2,0,0,0,0|1,0,0]=3 16706 B16R0.8619 CCCCCCOCCCC(C)(C)C(=O)OC 7a_100000210259_100010114820 [0,2,0,0,0,0|1,0,0]=3 16707 B16R0.8619 CCCCCCOCCOC(C)(F)C(=O)OC 34a_100000691444_200009867631 [0,2,0,0,0,0|2,0,0]=4 16708 B16R0.8619 CCCCCCOCCOC(F)(F)C(=O)OC 34a_100000691444_100000211177 [0,2,0,0,0,0|2,0,0]=4 16709 B16R0.8619 CCCCCCOCCOC(F)(F)C(=O)OC 7a_100000691444_100000211177 [0,2,0,0,0,0|2,0,0]=4 16710 B16R0.8619 CCCCCCSCCCC(C)(C)C(=O)OC 62a_100000210314_100010114820 [0,2,0,0,0,0|1,0,0]=3 16711 B16R0.8619 CCCCCCSCCCC(C)(C)C(=O)OC 62a_100010114820_100000210757 [0,2,0,0,0,0|1,0,0]=3 16712 B16R0.8619 CCCCCNCCOCC(F)(F)C(=O)OC 34a_100000224656_100010295740 [0,2,0,0,0,0|2,0,0]=4 16713 B16R0.8619 CCCCCOCCOCC(F)(F)C(=O)OC 34a_100011215259_100010295740 [0,2,0,0,0,0|2,0,0]=4 16714 B16R0.8619 CCCCNCCCCOC(C)(F)C(=O)OC 34a_200011216965_200009867631 [0,2,0,0,0,0|2,0,0]=4 16715 B16R0.8619 CCCCNCCCCOC(F)(F)C(=O)OC 34a_200011216965_100000211177 [0,2,0,0,0,0|2,0,0]=4 16716 B16R0.8619 CCCCOCCCCOC(C)(F)C(=O)OC 34a_200000760531_200009867631 [0,2,0,0,0,0|2,0,0]=4 16717 B16R0.8619 CCCCOCCCCOC(F)(F)C(=O)OC 34a_200000760531_100000211177 [0,2,0,0,0,0|2,0,0]=4 16718 B16R0.8619 CCCCOCCCCOC(F)(F)C(=O)OC 7a_200000760531_100000211177 [0,2,0,0,0,0|2,0,0]=4 16719 B16R0.8619 CCCCOCCCNCC(F)(F)C(=O)OC 34a_200000211371_100010295740 [0,2,0,0,0,0|2,0,0]=4 16720 B16R0.8619 CCCCOCCCOCC(F)(F)C(=O)OC 34a_200011215613_100010295740 [0,2,0,0,0,0|2,0,0]=4 16721 B16R0.8619 CCCCOCSCCCC(C)(C)C(=O)OC 62a_100010114820_100011995733 [0,2,0,0,0,0|2,0,0]=4 16722 B16R0.8619 CCCCOCSCCCC(C)(C)C(=O)OC 62a_100011995733_100010114820 [0,2,0,0,0,0|2,0,0]=4 16723 B16R0.8619 CCCOCCNCCCC(C)(C)C(=O)OC 2230a_100161115042_100010114820 [0,2,0,0,0,0|2,0,0]=4 16724 B16R0.8619 CCCOCCNCCCC(C)(C)C(=O)OC 34a_100161115042_100010114820 [0,2,0,0,0,0|2,0,0]=4 16725 B16R0.8619 CCCOCCOCCCC(C)(C)C(=O)OC 34a_100000752267_100010114820 [0,2,0,0,0,0|2,0,0]=4 16726 B16R0.8619 CCCOCCOCCCC(C)(C)C(=O)OC 7a_100000752267_100010114820 [0,2,0,0,0,0|2,0,0]=4 16727 B16R0.8619 CCCOCCSCCCC(C)(C)C(=O)OC 62a_100010114820_100011215938 [0,2,0,0,0,0|2,0,0]=4 16728 B16R0.8619 CCCOCCSCCCC(C)(C)C(=O)OC 62a_100011215938_100010114820 [0,2,0,0,0,0|2,0,0]=4 16729 B16R0.8619 CCCSCCNCCCC(C)(C)C(=O)OC 2230a_100020603323_100010114820 [0,2,0,0,0,0|2,0,0]=4 16730 B16R0.8619 CCCSCCOCCCC(C)(C)C(=O)OC 34a_200000230433_100010114820 [0,2,0,0,0,0|2,0,0]=4 16731 B16R0.8619 CCCSCCOCCCC(C)(C)C(=O)OC 7a_200000230433_100010114820 [0,2,0,0,0,0|2,0,0]=4 16732 B16R0.8619 CCOCCCNCCCC(C)(C)C(=O)OC 2230a_100000210961_100010114820 [0,2,0,0,0,0|2,0,0]=4 16733 B16R0.8619 CCOCCCNCCCC(C)(C)C(=O)OC 34a_100000210961_100010114820 [0,2,0,0,0,0|2,0,0]=4 16734 B16R0.8619 CCOCCCOCCCC(C)(C)C(=O)OC 34a_100000757476_100010114820 [0,2,0,0,0,0|2,0,0]=4 16735 B16R0.8619 CCOCCCOCCCC(C)(C)C(=O)OC 7a_100000757476_100010114820 [0,2,0,0,0,0|2,0,0]=4 16736 B16R0.8619 CCOCCCSCCCC(C)(C)C(=O)OC 62a_100010114820_100012232248 [0,2,0,0,0,0|2,0,0]=4 16737 B16R0.8619 CCOCCCSCCCC(C)(C)C(=O)OC 62a_100012232248_100010114820 [0,2,0,0,0,0|2,0,0]=4 16738 B16R0.8619 CCSCCCOCCCC(C)(C)C(=O)OC 34a_100011216438_100010114820 [0,2,0,0,0,0|2,0,0]=4 16739 B16R0.8619 CCSCCCOCCCC(C)(C)C(=O)OC 7a_100011216438_100010114820 [0,2,0,0,0,0|2,0,0]=4 16740 B16R0.8619 COC(=O)C(C)(C)CCCNCCCCCO 2230a_100000762737_100010114820 [0,2,0,0,0,0|2,0,0]=4 16741 B16R0.8619 COC(=O)C(C)(C)CCCNCCCCCO 34a_100000762737_100010114820 [0,2,0,0,0,0|2,0,0]=4 16742 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCBr 34a_100000746331_100010114820 [0,2,0,0,0,0|2,0,0]=4 16743 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCBr 7a_100000746331_100010114820 [0,2,0,0,0,0|2,0,0]=4 16744 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCCl 34a_100000746330_100010114820 [0,2,0,0,0,0|2,0,0]=4 16745 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCCl 7a_100000746330_100010114820 [0,2,0,0,0,0|2,0,0]=4 16746 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCI 34a_200012148887_100010114820 [0,2,0,0,0,0|2,0,0]=4 16747 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCI 7a_200012148887_100010114820 [0,2,0,0,0,0|2,0,0]=4 16748 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCCN 34a_100000762737_100010114820 [0,2,0,0,0,0|2,0,0]=4 16749 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCSC 34a_100011217163_100010114820 [0,2,0,0,0,0|2,0,0]=4 16750 B16R0.8619 COC(=O)C(C)(C)CCCOCCCCSC 7a_100011217163_100010114820 [0,2,0,0,0,0|2,0,0]=4 16751 B16R0.8619 COC(=O)C(C)(C)CCCSCCCCCF 62a_100000729378_100010114820 [0,2,0,0,0,0|2,0,0]=4 16752 B16R0.8619 COC(=O)C(C)(C)CCCSCCCCCF 62a_100010114820_100000729378 [0,2,0,0,0,0|2,0,0]=4 16753 B16R0.8619 COC(=O)C(C)(C)CCCSCCCCCO 62a_100000746330_100010114820 [0,2,0,0,0,0|2,0,0]=4 16754 B16R0.8619 COC(=O)C(C)(C)CCCSCCCCCO 62a_100010114820_100000746330 [0,2,0,0,0,0|2,0,0]=4 16755 B16R0.8619 COC(=O)C(C)(C)COCCCCCCCO 34a_100000709632_100000760002 [0,2,0,0,0,0|2,0,0]=4 16756 B16R0.8619 COC(=O)C(C)(C)COCCCCCCCO 7a_100000709632_100000760002 [0,2,0,0,0,0|2,0,0]=4 16757 B16R0.8619 COC(=O)C(C)(C)CSCCCCCCCO 62a_100000684552_100000760002 [0,2,0,0,0,0|2,0,0]=4 16758 B16R0.8619 COC(=O)C(C)(C)CSCCCCCCCO 62a_100000760002_100000684552 [0,2,0,0,0,0|2,0,0]=4 16759 B16R0.8619 COC(=O)C(C)(C)NCCCCCCCCO 2230a_102515433106_100000689032 [0,2,0,0,0,0|2,0,0]=4 16760 B16R0.8619 COC(=O)C(C)(C)OCCCCCCCCO 34a_100011217581_100000033203 [0,2,0,0,0,0|2,0,0]=4 16761 B16R0.8619 COC(=O)C(C)(C)OCCCCCCCCO 7a_100011217581_100000033203 [0,2,0,0,0,0|2,0,0]=4 16762 B16R0.8619 COC(=O)C(C)(C)SCCCCCCCCO 62a_100000033203_100000689032 [0,2,0,0,0,0|2,0,0]=4 16763 B16R0.8619 COC(=O)C(C)(C)SCCCCCCCCO 62a_100000689032_100000033203 [0,2,0,0,0,0|2,0,0]=4 16764 B16R0.8619 COC(=O)C(C)(F)NCCCCCCCCO 2230a_102515433106_200009867631 [0,2,0,0,0,0|2,0,0]=4 16765 B16R0.8619 COC(=O)C(C)(F)NCCCCCCCCO 34a_102515433106_200009867631 [0,2,0,0,0,0|2,0,0]=4 16766 B16R0.8619 COC(=O)C(C)(F)OCCCCCCCCBr 34a_100009813846_200009867631 [0,2,0,0,0,0|2,0,0]=4 16767 B16R0.8619 COC(=O)C(C)(F)OCCCCCCCCCl 34a_100000033203_200009867631 [0,2,0,0,0,0|2,0,0]=4 16768 B16R0.8619 COC(=O)C(C)(F)OCCCCCCCCN 34a_102515433106_200009867631 [0,2,0,0,0,0|2,0,0]=4 16769 B16R0.8619 COC(=O)C(C)(F)SCCCCCCCCO 62a_100000033203_200009867631 [0,2,0,0,0,0|2,0,0]=4 16770 B16R0.8619 COC(=O)C(C)(F)SCCCCCCCCO 62a_200009867631_100000033203 [0,2,0,0,0,0|2,0,0]=4 16771 B16R0.8619 COC(=O)C(F)(F)CNCCCCCCCO 34a_100011996573_100010295740 [0,2,0,0,0,0|2,0,0]=4 16772 B16R0.8619 COC(=O)C(F)(F)COCCCCCCCBr 34a_100000760002_100010295740 [0,2,0,0,0,0|2,0,0]=4 16773 B16R0.8619 COC(=O)C(F)(F)COCCCCCCCN 34a_100011996573_100010295740 [0,2,0,0,0,0|2,0,0]=4 16774 B16R0.8619 COC(=O)C(F)(F)CSCCCCCCCO 62a_100000760002_100010295740 [0,2,0,0,0,0|2,0,0]=4 16775 B16R0.8619 COC(=O)C(F)(F)CSCCCCCCCO 62a_100010295740_100000760002 [0,2,0,0,0,0|2,0,0]=4 16776 B16R0.8619 COC(=O)C(F)(F)NCCCCCCCCO 34a_102515433106_100000211177 [0,2,0,0,0,0|2,0,0]=4 16777 B16R0.8619 COC(=O)C(F)(F)OCCCCCCCCBr 34a_100009813846_100000211177 [0,2,0,0,0,0|2,0,0]=4 16778 B16R0.8619 COC(=O)C(F)(F)OCCCCCCCCBr 7a_100009813846_100000211177 [0,2,0,0,0,0|2,0,0]=4 16779 B16R0.8619 COC(=O)C(F)(F)OCCCCCCCCCl 34a_100000033203_100000211177 [0,2,0,0,0,0|2,0,0]=4 16780 B16R0.8619 COC(=O)C(F)(F)OCCCCCCCCCl 7a_100000033203_100000211177 [0,2,0,0,0,0|2,0,0]=4 16781 B16R0.8619 COC(=O)C(F)(F)OCCCCCCCCN 34a_102515433106_100000211177 [0,2,0,0,0,0|2,0,0]=4 16782 B16R0.8619 COC(=O)C(F)(F)SCCCCCCCCO 62a_100000033203_100000211177 [0,2,0,0,0,0|2,0,0]=4 16783 B16R0.8619 COC(=O)C(F)(F)SCCCCCCCCO 62a_100000211177_100000033203 [0,2,0,0,0,0|2,0,0]=4 16784 B16R0.8619 COCCCCCCOCC(C)(C)C(=O)OC 34a_100000709632_100011998445 [0,2,0,0,0,0|2,0,0]=4 16785 B16R0.8619 COCCCCCCOCC(C)(C)C(=O)OC 7a_100000709632_100011998445 [0,2,0,0,0,0|2,0,0]=4 16786 B16R0.8619 COCCCCCCOCC(F)(F)C(=O)OC 34a_200012092642_100010295740 [0,2,0,0,0,0|2,0,0]=4 16787 B16R0.8619 COCCCCCCSCC(C)(C)C(=O)OC 62a_100000684552_100011998445 [0,2,0,0,0,0|2,0,0]=4 16788 B16R0.8619 COCCCCCCSCC(C)(C)C(=O)OC 62a_100011998445_100000684552 [0,2,0,0,0,0|2,0,0]=4 16789 B16R0.8619 COCCCCCCSCC(F)(F)C(=O)OC 62a_100010295740_100011998445 [0,2,0,0,0,0|2,0,0]=4 16790 B16R0.8619 COCCCCCCSCC(F)(F)C(=O)OC 62a_100011998445_100010295740 [0,2,0,0,0,0|2,0,0]=4 16791 B16R0.8619 COCCCCOCCCC(C)(C)C(=O)OC 34a_100000740925_100010114820 [0,2,0,0,0,0|2,0,0]=4 16792 B16R0.8619 COCCCCSCCCC(C)(C)C(=O)OC 62a_100000730899_100010114820 [0,2,0,0,0,0|2,0,0]=4 16793 B16R0.8619 COCCCCSCCCC(C)(C)C(=O)OC 62a_100010114820_100000730899 [0,2,0,0,0,0|2,0,0]=4 16794 B16R0.97 CCCC(=O)CCCCCCCC(=O)OCC 1458a_100000211992_100009991516 [0,2,0,0,0,0|0,0,1]=3 16795 B16R0.97 CCCC(=O)COCCCCCC(=O)OCC 7a_100011214988_100000747444 [0,2,0,0,0,0|1,0,1]=4 16796 B16R0.97 CCCC(=O)CSCCCCCC(=O)OCC 62a_100000747444_100000755133 [0,2,0,0,0,0|1,0,1]=4 16797 B16R0.97 CCCC(=O)CSCCCCCC(=O)OCC 62a_100000755133_100000747444 [0,2,0,0,0,0|1,0,1]=4 16798 B16R0.97 CCCC(=O)NCCCCCCC(=O)OCC 188690a_100000741137_100000211992 [0,2,0,0,0,0|1,0,1]=4 16799 B16R0.97 CCCC(C)CCCOCCCC(=O)OCC 34a_100011713154_100009991533 [0,2,0,0,0,0|1,0,0]=3 16800 B16R0.97 CCCC(C)CCCOCCCC(=O)OCC 7a_100011713154_100011215271 [0,2,0,0,0,0|1,0,0]=3 16801 B16R0.97 CCCC(C)CCCOCCNC(=O)OCC 7a_100011713154_200011445536 [0,2,0,0,0,0|2,0,0]=4 16802 B16R0.97 CCCC(C)CCOCCCCC(=O)OCC 34a_100011217855_100000750268 [0,2,0,0,0,0|1,0,0]=3 16803 B16R0.97 CCCC(C)CCOCCCCC(=O)OCC 7a_100011217855_100000750268 [0,2,0,0,0,0|1,0,0]=3 16804 B16R0.97 CCCC(C)CCOCCOCC(=O)OCC 34a_100011217855_100000088970 [0,2,0,0,0,0|2,0,0]=4 16805 B16R0.97 CCCC(C)CCOCCOCC(=O)OCC 7a_100011217855_100000088970 [0,2,0,0,0,0|2,0,0]=4 16806 B16R0.97 CCCC(C)COCCCCCC(=O)OCC 34a_100000688023_100000755133 [0,2,0,0,0,0|1,0,0]=3 16807 B16R0.97 CCCC(C)COCCCCCC(=O)OCC 7a_100000688023_100000755133 [0,2,0,0,0,0|1,0,0]=3 16808 B16R0.97 CCCC(C)COCCCCCC(=O)OCC 7a_100011214988_100011216630 [0,2,0,0,0,0|1,0,0]=3 16809 B16R0.97 CCCC(C)COCCCOCC(=O)OCC 34a_100000688023_100009893628 [0,2,0,0,0,0|2,0,0]=4 16810 B16R0.97 CCCC(C)COCCCOCC(=O)OCC 7a_100000688023_100009893628 [0,2,0,0,0,0|2,0,0]=4 16811 B16R0.97 CCCC(C)CSCCCCCC(=O)OCC 62a_100000755133_100011216630 [0,2,0,0,0,0|1,0,0]=3 16812 B16R0.97 CCCC(C)CSCCCCCC(=O)OCC 62a_100011216630_100000755133 [0,2,0,0,0,0|1,0,0]=3 16813 B16R0.97 CCCC(C)CSCCCOCC(=O)OCC 62a_100009893628_100011216630 [0,2,0,0,0,0|2,0,0]=4 16814 B16R0.97 CCCC(C)CSCCCOCC(=O)OCC 62a_100011216630_100009893628 [0,2,0,0,0,0|2,0,0]=4 16815 B16R0.97 CCCC(C)NCCCCCCC(=O)OCC 2230a_100000741246_100009814379 [0,2,0,0,0,0|1,0,0]=3 16816 B16R0.97 CCCC(C)OCCCCCCC(=O)OCC 34a_100000764384_100009814379 [0,2,0,0,0,0|1,0,0]=3 16817 B16R0.97 CCCC(C)OCCCCCCC(=O)OCC 7a_100000764384_100009814379 [0,2,0,0,0,0|1,0,0]=3 16818 B16R0.97 CCCC(C)SCCCCCCC(=O)OCC 62a_100000766640_100009814379 [0,2,0,0,0,0|1,0,0]=3 16819 B16R0.97 CCCN(C)CCCCCCCC(=O)OCC 2230a_100000747261_100009991516 [0,2,0,0,0,0|1,0,0]=3 16820 B16R0.97 CCCN(C)CCCCCCCC(=O)OCC 269982a_100000747261_100009991516 [0,2,0,0,0,0|1,0,0]=3 16821 B16R0.97 CCC[C@H](N)CCOCCCCC(=O)OCC 34a_100015193777_100000750268 [0,2,0,0,0,0|1,0,0]=3 16822 B16R0.97 CCC[C@H](N)CCOCCOCC(=O)OCC 34a_100015193777_100000088970 [0,2,0,0,0,0|2,0,0]=4 16823 B16R0.97 CCC[C@H](N)COCCCCCC(=O)OCC 34a_100000732646_100000755133 [0,2,0,0,0,0|1,0,0]=3 16824 B16R0.97 CCC[C@H](N)COCCCOCC(=O)OCC 34a_100000732646_100009893628 [0,2,0,0,0,0|2,0,0]=4 16825 B16R0.97 CCOC(=O)CCCCCCCC(=O)CCO 1458a_100011216618_100009991516 [0,2,0,0,0,0|1,0,1]=4 16826 B16R0.97 CCOC(=O)CCCCCCCC(=O)COC 1458a_100000210968_100009991516 [0,2,0,0,0,0|1,0,1]=4 16827 B16R0.97 CCOC(=O)CCCCCCCC(=O)CSC 1458a_100000184570_100009991516 [0,2,0,0,0,0|1,0,1]=4 16828 B16R0.97 CCOC(=O)CCCCCCCN(C)CCO 2230a_100000210263_100009991516 [0,2,0,0,0,0|2,0,0]=4 16829 B16R0.97 CCOC(=O)CCCCCCCN(C)CCO 269982a_100000210263_100009991516 [0,2,0,0,0,0|2,0,0]=4 16830 B16R0.97 CCOC(=O)CCCCCCN[C@H](C)CCO 2230a_100000706166_100009814379 [0,2,0,0,0,0|2,0,0]=4 16831 B16R0.97 CCOC(=O)CCCCCCN[C@H](C)CCO 34a_100000706166_100009814379 [0,2,0,0,0,0|2,0,0]=4 16832 B16R0.97 CCOC(=O)CCCCCCN[C@H](C)COC 2230a_100000764878_100009814379 [0,2,0,0,0,0|2,0,0]=4 16833 B16R0.97 CCOC(=O)CCCCCCOC(C)CCBr 34a_100012276601_100009814379 [0,2,0,0,0,0|2,0,0]=4 16834 B16R0.97 CCOC(=O)CCCCCCO[C@H](C)COC 34a_100011934205_100009814379 [0,2,0,0,0,0|2,0,0]=4 16835 B16R0.97 CCOC(=O)CCCCCCSC(C)CCO 62a_100009893172_100009814379 [0,2,0,0,0,0|2,0,0]=4 16836 B16R0.97 CCOC(=O)CCCCCCSC(C)COC 62a_100000765312_100009814379 [0,2,0,0,0,0|2,0,0]=4 16837 B16R0.97 CCOC(=O)CCCCCNCC(O)COC 2230a_100000756049_100000755133 [0,2,0,0,0,0|2,0,0]=4 16838 B16R0.97 CCOC(=O)CCCCCNCC(O)COC 34a_100000756049_100000755133 [0,2,0,0,0,0|2,0,0]=4 16839 B16R0.97 CCOC(=O)CCCCCOCC(C)CCN 34a_106354213184_100000755133 [0,2,0,0,0,0|2,0,0]=4 16840 B16R0.97 CCOC(=O)CCCCCOCC(N)COC 34a_100000724102_100000755133 [0,2,0,0,0,0|2,0,0]=4 16841 B16R0.97 CCOC(=O)CCCCCOCC(O)COC 7a_100011214988_100011215053 [0,2,0,0,0,0|2,0,0]=4 16842 B16R0.97 CCOC(=O)CCCCCSCC(O)COC 62a_100000755133_100011215053 [0,2,0,0,0,0|2,0,0]=4 16843 B16R0.97 CCOC(=O)CCCCCSCC(O)COC 62a_100011215053_100000755133 [0,2,0,0,0,0|2,0,0]=4 16844 B16R0.137 C=COC(=O)COC(C)CCCCCCCC 34a_100000210740_100000036128 [0,2,0,0,0,0|1,0,1]=4 16845 B16R0.137 CCCCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210759 [0,2,0,0,0,0|1,0,1]=4 16846 B16R0.137 CCCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210759 [0,2,0,0,0,0|0,0,1]=3 16847 B16R0.137 CCCCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210759 [0,2,0,0,0,0|1,0,1]=4 16848 B16R0.137 CCCCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100000210188 [0,2,0,0,0,0|1,0,1]=4 16849 B16R0.137 CCCCCCCCC(C)NCC(=O)NCC 270004a_100016988866_100011216694 [0,2,0,0,0,0|2,0,0]=4 16850 B16R0.137 CCCCCCCCC(C)OCC(=O)CCC 7a_100000210740_100000747444 [0,2,0,0,0,0|2,0,0]=4 16851 B16R0.137 CCCCCCCCC(C)OCC(=O)NCC 34a_100000210740_100000183381 [0,2,0,0,0,0|2,0,0]=4 16852 B16R0.137 CCCCCCCCC(C)OCC(=O)NCC 7a_100000210740_100000183381 [0,2,0,0,0,0|2,0,0]=4 16853 B16R0.137 CCCCCCCCC(C)OCC(=O)NCO 34a_100000210740_100000185155 [0,2,0,0,0,0|2,0,0]=4 16854 B16R0.137 CCCCCCCCC(C)OCC(=O)NCO 7a_100000210740_100000185155 [0,2,0,0,0,0|2,0,0]=4 16855 B16R0.137 CCCCCCCCC(C)OCC(=O)OCC 34a_100000210740_100000188475 [0,2,0,0,0,0|1,0,0]=3 16856 B16R0.137 CCCCCCCCC(C)OCC(=O)OCC 7a_100000210740_100000188475 [0,2,0,0,0,0|1,0,0]=3 16857 B16R0.137 CCCCCCCCN(C)CCC(=O)NCC 2230a_100000207567_100000737597 [0,2,0,0,0,0|2,0,0]=4 16858 B16R0.137 CCCCCCCCN(C)CCC(=O)NCC 269982a_100000207567_100000737597 [0,2,0,0,0,0|2,0,0]=4 16859 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 2230a_100000207567_100011206558 [0,2,0,0,0,0|1,0,0]=3 16860 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000210759 [0,2,0,0,0,0|1,0,0]=3 16861 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 269982a_100000207567_100011206558 [0,2,0,0,0,0|1,0,0]=3 16862 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210759 [0,2,0,0,0,0|1,0,0]=3 16863 B16R0.137 CCCCCCCNC(=O)CCC(=O)OCC 11a_100000229938_100000183558 [0,2,0,0,0,0|1,0,1]=4 16864 B16R0.137 CCCCCCCNC(=O)CCC(=O)OCC 1626a_100000229938_100000183558 [0,2,0,0,0,0|1,0,1]=4 16865 B16R0.137 CCCCCCCNC(=O)CCC(=O)OCC 240690a_100000229938_100000183558 [0,2,0,0,0,0|1,0,1]=4 16866 B16R0.137 CCCCCCCNC(C)CCC(=O)OCC 2230a_100000229938_100000748298 [0,2,0,0,0,0|1,0,0]=3 16867 B16R0.137 CCCCCCCOC(C)CCC(=O)OCC 34a_100000210272_100000748298 [0,2,0,0,0,0|1,0,0]=3 16868 B16R0.137 CCCCCCCOC(C)CCC(=O)OCC 7a_100000210272_100000748298 [0,2,0,0,0,0|1,0,0]=3 16869 B16R0.137 CCCCCCCSC(C)CCC(=O)OCC 62a_100000210614_100000748298 [0,2,0,0,0,0|1,0,0]=3 16870 B16R0.137 CCCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000210316 [0,2,0,0,0,0|1,0,0]=3 16871 B16R0.137 CCCCOCCOC(C)CCC(=O)OCC 34a_100000210238_100000748298 [0,2,0,0,0,0|2,0,0]=4 16872 B16R0.137 CCCCOCCOC(C)CCC(=O)OCC 7a_100000210238_100000748298 [0,2,0,0,0,0|2,0,0]=4 16873 B16R0.137 CCCCOCCSC(C)CCC(=O)OCC 62a_100000743108_100000748298 [0,2,0,0,0,0|2,0,0]=4 16874 B16R0.137 CCCCOCCSC(C)CCC(=O)OCC 62a_100000748298_100000743108 [0,2,0,0,0,0|2,0,0]=4 16875 B16R0.137 CCCCSCCNC(C)CCC(=O)OCC 2230a_100025743550_100000748298 [0,2,0,0,0,0|2,0,0]=4 16876 B16R0.137 CCCCSCCOC(C)CCC(=O)OCC 34a_200000230436_100000748298 [0,2,0,0,0,0|2,0,0]=4 16877 B16R0.137 CCCCSCCOC(C)CCC(=O)OCC 7a_200000230436_100000748298 [0,2,0,0,0,0|2,0,0]=4 16878 B16R0.137 CCCOCCCNC(C)CCC(=O)OCC 2230a_100011217757_100000748298 [0,2,0,0,0,0|2,0,0]=4 16879 B16R0.137 CCCOCCCNC(C)CCC(=O)OCC 34a_100011217757_100000748298 [0,2,0,0,0,0|2,0,0]=4 16880 B16R0.137 CCOC(=O)CCC(=O)CCCCCCCO 1458a_100000183558_100000760002 [0,2,0,0,0,0|1,0,1]=4 16881 B16R0.137 CCOC(=O)CCC(=O)CCCCCCOC 1458a_100000183558_100011998445 [0,2,0,0,0,0|1,0,1]=4 16882 B16R0.137 CCOC(=O)CCC(C)NCCCCCCO 2230a_100000686447_100000748298 [0,2,0,0,0,0|2,0,0]=4 16883 B16R0.137 CCOC(=O)CCC(C)NCCCCCCO 34a_100000686447_100000748298 [0,2,0,0,0,0|2,0,0]=4 16884 B16R0.137 CCOC(=O)CCC(C)NCCCCCOC 2230a_100000747528_100000748298 [0,2,0,0,0,0|2,0,0]=4 16885 B16R0.137 CCOC(=O)CCC(C)NCCCCCOC 34a_100000747528_100000748298 [0,2,0,0,0,0|2,0,0]=4 16886 B16R0.137 CCOC(=O)CCC(C)OCCCCCCBr 34a_100011215345_100000748298 [0,2,0,0,0,0|2,0,0]=4 16887 B16R0.137 CCOC(=O)CCC(C)OCCCCCCBr 7a_100011215345_100000748298 [0,2,0,0,0,0|2,0,0]=4 16888 B16R0.137 CCOC(=O)CCC(C)OCCCCCCCl 34a_100000766143_100000748298 [0,2,0,0,0,0|2,0,0]=4 16889 B16R0.137 CCOC(=O)CCC(C)OCCCCCCCl 7a_100000766143_100000748298 [0,2,0,0,0,0|2,0,0]=4 16890 B16R0.137 CCOC(=O)CCC(C)OCCCCCCF 34a_100000732779_100000748298 [0,2,0,0,0,0|2,0,0]=4 16891 B16R0.137 CCOC(=O)CCC(C)OCCCCCCF 7a_100000732779_100000748298 [0,2,0,0,0,0|2,0,0]=4 16892 B16R0.137 CCOC(=O)CCC(C)OCCCCCCN 34a_100000686447_100000748298 [0,2,0,0,0,0|2,0,0]=4 16893 B16R0.137 CCOC(=O)CCC(C)OCCCCCNC 34a_100000722520_100000748298 [0,2,0,0,0,0|2,0,0]=4 16894 B16R0.137 CCOC(=O)CCC(C)SCCCCCCF 62a_100000748298_100015922095 [0,2,0,0,0,0|2,0,0]=4 16895 B16R0.137 CCOC(=O)CCC(C)SCCCCCCF 62a_100015922095_100000748298 [0,2,0,0,0,0|2,0,0]=4 16896 B16R0.137 CCOC(=O)CCC(C)SCCCCCCO 62a_100000748298_100000766143 [0,2,0,0,0,0|2,0,0]=4 16897 B16R0.137 CCOC(=O)CCC(C)SCCCCCCO 62a_100000766143_100000748298 [0,2,0,0,0,0|2,0,0]=4 16898 B16R0.137 CCOC(=O)CCN(C)CCCCCCCO 2230a_100000745921_100000760002 [0,2,0,0,0,0|2,0,0]=4 16899 B16R0.137 CCOC(=O)CCN(C)CCCCCCCO 269982a_100000745921_100000760002 [0,2,0,0,0,0|2,0,0]=4 16900 B16R0.137 CCOC(=O)CCN(C)CCCCCCOC 2230a_100000745921_100011998445 [0,2,0,0,0,0|2,0,0]=4 16901 B16R0.137 CCOC(=O)CCN(C)CCCCCCOC 269982a_100000745921_100011998445 [0,2,0,0,0,0|2,0,0]=4 16902 B16R0.154 C=COC(=O)CC(=O)CCCCCCCCC 1458a_100000210558_100000036128 [0,2,0,0,0,0|0,0,2]=4 16903 B16R0.154 C=COC(=O)CN(C)CCCCCCCCC 2230a_100000232482_100000036128 [0,2,0,0,0,0|1,0,1]=4 16904 B16R0.154 C=COC(=O)CN(C)CCCCCCCCC 269982a_100000232482_100000036128 [0,2,0,0,0,0|1,0,1]=4 16905 B16R0.154 CCCCCCCCCC(=O)CC(=O)CCC 1458a_100000210558_100000747444 [0,2,0,0,0,0|1,0,1]=4 16906 B16R0.154 CCCCCCCCCC(=O)CC(=O)NCC 1458a_100000210558_100000183381 [0,2,0,0,0,0|1,0,1]=4 16907 B16R0.154 CCCCCCCCCC(=O)CC(=O)NCO 1458a_100000210558_100000185155 [0,2,0,0,0,0|1,0,1]=4 16908 B16R0.154 CCCCCCCCCC(=O)CC(=O)OCC 1458a_100000210558_100000188475 [0,2,0,0,0,0|0,0,1]=3 16909 B16R0.154 CCCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210670 [0,2,0,0,0,0|0,0,1]=3 16910 B16R0.154 CCCCCCCCCC(O)CC(=O)NCC 240690a_100015525214_200012339438 [0,2,0,0,0,0|1,0,0]=3 16911 B16R0.154 CCCCCCCCCC(O)CC(=O)NNC 22a_100016993582_200012339438 [0,2,0,0,0,0|1,0,0]=3 16912 B16R0.154 CCCCCCCCCN(C)CC(=O)CCC 2230a_100000232482_100000747444 [0,2,0,0,0,0|2,0,0]=4 16913 B16R0.154 CCCCCCCCCN(C)CC(=O)CCC 269982a_100000232482_100000747444 [0,2,0,0,0,0|2,0,0]=4 16914 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 2230a_100000232482_100000183381 [0,2,0,0,0,0|2,0,0]=4 16915 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100011214924 [0,2,0,0,0,0|2,0,0]=4 16916 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 269982a_100000232482_100000183381 [0,2,0,0,0,0|2,0,0]=4 16917 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100000210670 [0,2,0,0,0,0|2,0,0]=4 16918 B16R0.154 CCCCCCCCCN(C)CC(=O)NCO 2230a_100000232482_100000185155 [0,2,0,0,0,0|2,0,0]=4 16919 B16R0.154 CCCCCCCCCN(C)CC(=O)NCO 269982a_100000232482_100000185155 [0,2,0,0,0,0|2,0,0]=4 16920 B16R0.154 CCCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100011214924 [0,2,0,0,0,0|1,0,0]=3 16921 B16R0.154 CCCCCCCCCN(C)CC(=O)OCC 2230a_100000232482_100000188475 [0,2,0,0,0,0|1,0,0]=3 16922 B16R0.154 CCCCCCCCCN(C)CC(=O)OCC 269982a_100000232482_100000188475 [0,2,0,0,0,0|1,0,0]=3 16923 B16R0.154 CCCCCCCCNC(=O)CC(=O)OCC 240690a_100000229939_100000243816 [0,2,0,0,0,0|1,0,1]=4 16924 B16R0.154 CCCCCCCCNC(C)CC(=O)OCC 2230a_100000229939_100009817359 [0,2,0,0,0,0|1,0,0]=3 16925 B16R0.154 CCCCCCCCOC(C)CC(=O)OCC 7a_100000210232_100009817359 [0,2,0,0,0,0|1,0,0]=3 16926 B16R0.154 CCCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210759 [0,2,0,0,0,0|1,0,0]=3 16927 B16R0.154 CCCCCCCCSC(C)CC(=O)OCC 62a_100000210759_100009817359 [0,2,0,0,0,0|1,0,0]=3 16928 B16R0.154 CCCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000210317 [0,2,0,0,0,0|1,0,0]=3 16929 B16R0.154 CCCCCCCCSC(C)OC(=O)OCC 62a_100000036008_100000210317 [0,2,0,0,0,0|2,0,0]=4 16930 B16R0.154 CCCCCCCCSC(C)OC(=O)OCC 62a_100000210759_100000036008 [0,2,0,0,0,0|2,0,0]=4 16931 B16R0.154 CCCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210272_100000688340 [0,2,0,0,0,0|1,0,0]=3 16932 B16R0.154 CCCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210272_100000688340 [0,2,0,0,0,0|1,0,0]=3 16933 B16R0.154 CCCCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210316 [0,2,0,0,0,0|1,0,1]=4 16934 B16R0.154 CCCCCCCSCC(=O)CC(=O)OCC 62a_100000210614_100000210311 [0,2,0,0,0,0|1,0,1]=4 16935 B16R0.154 CCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000210614_100000688340 [0,2,0,0,0,0|1,0,0]=3 16936 B16R0.154 CCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210316 [0,2,0,0,0,0|1,0,0]=3 16937 B16R0.154 CCCCCOCCOC(C)CC(=O)OCC 7a_100011215259_100009817359 [0,2,0,0,0,0|2,0,0]=4 16938 B16R0.154 CCCCOCCCNC(C)CC(=O)OCC 2230a_200000211371_100009817359 [0,2,0,0,0,0|2,0,0]=4 16939 B16R0.154 CCCCOCCCOC(C)CC(=O)OCC 7a_200011215613_100009817359 [0,2,0,0,0,0|2,0,0]=4 16940 B16R0.154 CCCCOCCOC[C@@H](O)CC(=O)OCC 34a_100000210238_100000688340 [0,2,0,0,0,0|2,0,0]=4 16941 B16R0.154 CCCCOCCOC[C@@H](O)CC(=O)OCC 7a_100000210238_100000688340 [0,2,0,0,0,0|2,0,0]=4 16942 B16R0.154 CCCCOCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000743108 [0,2,0,0,0,0|2,0,0]=4 16943 B16R0.154 CCCCOCCSC[C@@H](O)CC(=O)OCC 62a_100000743108_100000688340 [0,2,0,0,0,0|2,0,0]=4 16944 B16R0.154 CCCCSCCOC[C@@H](O)CC(=O)OCC 34a_200000230436_100000688340 [0,2,0,0,0,0|2,0,0]=4 16945 B16R0.154 CCCCSCCOC[C@@H](O)CC(=O)OCC 7a_200000230436_100000688340 [0,2,0,0,0,0|2,0,0]=4 16946 B16R0.154 CCCOCCCNC[C@@H](O)CC(=O)OCC 34a_100011217757_100000688340 [0,2,0,0,0,0|2,0,0]=4 16947 B16R0.154 CCOC(=O)CC(=O)CCCCCCCCO 1458a_100000243816_100000033203 [0,2,0,0,0,0|1,0,1]=4 16948 B16R0.154 CCOC(=O)CC(C)NCCCCCCCO 2230a_100011996573_100009817359 [0,2,0,0,0,0|2,0,0]=4 16949 B16R0.154 CCOC(=O)CC(C)OCCCCCCCBr 7a_100000760002_100009817359 [0,2,0,0,0,0|2,0,0]=4 16950 B16R0.154 CCOC(=O)CC(C)OCCCCCCOC 7a_200012092642_100009817359 [0,2,0,0,0,0|2,0,0]=4 16951 B16R0.154 CCOC(=O)CC(C)SCCCCCCCO 62a_100000760002_100009817359 [0,2,0,0,0,0|2,0,0]=4 16952 B16R0.154 CCOC(=O)CC(C)SCCCCCCCO 62a_100009817359_100000760002 [0,2,0,0,0,0|2,0,0]=4 16953 B16R0.154 CCOC(=O)CC(C)SCCCCCCOC 62a_100009817359_100011998445 [0,2,0,0,0,0|2,0,0]=4 16954 B16R0.154 CCOC(=O)CC(C)SCCCCCCOC 62a_100011998445_100009817359 [0,2,0,0,0,0|2,0,0]=4 16955 B16R0.154 CCOC(=O)CN(C)CCCCCCCCO 2230a_100000220588_100000033203 [0,2,0,0,0,0|2,0,0]=4 16956 B16R0.154 CCOC(=O)C[C@@H](C)OCCCCCCCO 7a_100009816390_100000760002 [0,2,0,0,0,0|2,0,0]=4 16957 B16R0.154 CCOC(=O)C[C@@H](C)OCCCCCCOC 7a_100009816390_100011998445 [0,2,0,0,0,0|2,0,0]=4 16958 B16R0.154 CCOC(=O)C[C@H](O)CNCCCCCCO 34a_100000686447_100000688340 [0,2,0,0,0,0|2,0,0]=4 16959 B16R0.154 CCOC(=O)C[C@H](O)CNCCCCCOC 34a_100000747528_100000688340 [0,2,0,0,0,0|2,0,0]=4 16960 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCBr 34a_100011215345_100000688340 [0,2,0,0,0,0|2,0,0]=4 16961 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCBr 7a_100011215345_100000688340 [0,2,0,0,0,0|2,0,0]=4 16962 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCCl 34a_100000766143_100000688340 [0,2,0,0,0,0|2,0,0]=4 16963 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCCl 7a_100000766143_100000688340 [0,2,0,0,0,0|2,0,0]=4 16964 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCF 34a_100000732779_100000688340 [0,2,0,0,0,0|2,0,0]=4 16965 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCF 7a_100000732779_100000688340 [0,2,0,0,0,0|2,0,0]=4 16966 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCN 34a_100000686447_100000688340 [0,2,0,0,0,0|2,0,0]=4 16967 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCNC 34a_100000722520_100000688340 [0,2,0,0,0,0|2,0,0]=4 16968 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCF 62a_100000688340_100015922095 [0,2,0,0,0,0|2,0,0]=4 16969 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCF 62a_100015922095_100000688340 [0,2,0,0,0,0|2,0,0]=4 16970 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCO 62a_100000688340_100000766143 [0,2,0,0,0,0|2,0,0]=4 16971 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCO 62a_100000766143_100000688340 [0,2,0,0,0,0|2,0,0]=4 16972 B16R0.302 C=C(C)CC(=O)CCCCCCCCCCC 1458a_100000210736_100000748629 [0,2,0,0,0,0|1,0,0]=3 16973 B16R0.302 C=C(F)CC(=O)CCCCCCCCCCC 1458a_100000210736_100009893438 [0,2,0,0,0,0|1,0,1]=4 16974 B16R0.302 CC(=CC(=O)CCCCCCCCCCO)C 1458a_100000211388_100009813290 [0,2,0,0,0,0|2,0,0]=4 16975 B16R0.302 CC(=CC(=O)CCCCCCCCCCO)Cl 1458a_200042562850_100009813290 [0,2,0,0,0,0|2,0,0]=4 16976 B16R0.302 CC(=CC(=O)CCCCCCCCCCO)I 1458a_100025716642_100009813290 [0,2,0,0,0,0|2,0,0]=4 16977 B16R0.302 CC(C)CC(=O)CCCCCCCCCCO 1458a_100000210554_100009813290 [0,2,0,0,0,0|2,0,0]=4 16978 B16R0.302 CC(C)NC(=O)CCCCCCCCCCO 240690a_100138425928_200000016029 [0,2,0,0,0,0|2,0,0]=4 16979 B16R0.302 CC(C)OC(=O)CCCCCNCCCCO 2230a_100000750430_200010986244 [0,2,0,0,0,0|2,0,0]=4 16980 B16R0.302 CC(C)OC(=O)CCCCCNCCCCO 34a_100000750430_200010986244 [0,2,0,0,0,0|2,0,0]=4 16981 B16R0.302 CC(C)OC(=O)CCCCCOCCCCBr 34a_100011216708_200010986244 [0,2,0,0,0,0|2,0,0]=4 16982 B16R0.302 CC(C)OC(=O)CCCCCOCCCCCl 34a_100000210776_200010986244 [0,2,0,0,0,0|2,0,0]=4 16983 B16R0.302 CC(C)OC(=O)CCCCCOCCCCCl 7a_100000210776_200010986244 [0,2,0,0,0,0|2,0,0]=4 16984 B16R0.302 CC(C)OC(=O)CCCCCOCCCCF 34a_100011995726_200010986244 [0,2,0,0,0,0|2,0,0]=4 16985 B16R0.302 CC(C)OC(=O)CCCCCOCCCCF 7a_100011995726_200010986244 [0,2,0,0,0,0|2,0,0]=4 16986 B16R0.302 CC(C)OC(=O)CCCCCOCCCCI 34a_200012148704_200010986244 [0,2,0,0,0,0|2,0,0]=4 16987 B16R0.302 CC(C)OC(=O)CCCCCOCCCCN 34a_100000750430_200010986244 [0,2,0,0,0,0|2,0,0]=4 16988 B16R0.302 CC(C)OC(=O)CCCCCSCCCCF 62a_100000729493_200010986244 [0,2,0,0,0,0|2,0,0]=4 16989 B16R0.302 CC(C)OC(=O)CCCCCSCCCCF 62a_200010986244_100000729493 [0,2,0,0,0,0|2,0,0]=4 16990 B16R0.302 CC(C)OC(=O)CCCCCSCCCCO 62a_100000210776_200010986244 [0,2,0,0,0,0|2,0,0]=4 16991 B16R0.302 CC(C)OC(=O)CCCCCSCCCCO 62a_200010986244_100000210776 [0,2,0,0,0,0|2,0,0]=4 16992 B16R0.302 CC(C)OC(=O)CCNCCCCCCCO 2230a_100011996573_100000760027 [0,2,0,0,0,0|2,0,0]=4 16993 B16R0.302 CC(C)OC(=O)CCOCCCCCCCBr 7a_100000760002_100000760027 [0,2,0,0,0,0|2,0,0]=4 16994 B16R0.302 CC(C)OC(=O)CCSCCCCCCCO 62a_100000760002_100000760027 [0,2,0,0,0,0|2,0,0]=4 16995 B16R0.302 CC(C)OC(=O)CCSCCCCCCCO 62a_100000760027_100000760002 [0,2,0,0,0,0|2,0,0]=4 16996 B16R0.302 CC(C)OC(=O)CNCCCCCCCCO 2230a_102515433106_100011215430 [0,2,0,0,0,0|2,0,0]=4 16997 B16R0.302 CC(C)OC(=O)CNCCCCCCCCO 34a_102515433106_100011215430 [0,2,0,0,0,0|2,0,0]=4 16998 B16R0.302 CC(C)OC(=O)COCCCCCCCCBr 34a_100009813846_100011215430 [0,2,0,0,0,0|2,0,0]=4 16999 B16R0.302 CC(C)OC(=O)COCCCCCCCCBr 7a_100009813846_100011215430 [0,2,0,0,0,0|2,0,0]=4 17000 B16R0.302 CC(C)OC(=O)COCCCCCCCCCl 34a_100000033203_100011215430 [0,2,0,0,0,0|2,0,0]=4 17001 B16R0.302 CC(C)OC(=O)COCCCCCCCCCl 7a_100000033203_100011215430 [0,2,0,0,0,0|2,0,0]=4 17002 B16R0.302 CC(C)OC(=O)COCCCCCCCCN 34a_102515433106_100011215430 [0,2,0,0,0,0|2,0,0]=4 17003 B16R0.302 CC(C)OC(=O)CSCCCCCCCCO 62a_100000033203_100011215430 [0,2,0,0,0,0|2,0,0]=4 17004 B16R0.302 CC(C)OC(=O)CSCCCCCCCCO 62a_100011215430_100000033203 [0,2,0,0,0,0|2,0,0]=4 17005 B16R0.302 CCCCCCCCCCCC(=O)C=C(C)C 1458a_100000211388_100011215454 [0,2,0,0,0,0|1,0,0]=3 17006 B16R0.302 CCCCCCCCCCCC(=O)C=C(C)Cl 1458a_200042562850_100011215454 [0,2,0,0,0,0|1,0,0]=3 17007 B16R0.302 CCCCCCCCCCCC(=O)C=C(C)I 1458a_100025716642_100011215454 [0,2,0,0,0,0|1,0,0]=3 17008 B16R0.302 CCCCCCCCCCCC(=O)C=C(Cl)Cl 1458a_100000137448_100011215454 [0,2,0,0,0,0|1,0,1]=4 17009 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100000210736_100000187820 [0,2,0,0,0,0|1,0,1]=4 17010 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100011215454 [0,2,0,0,0,0|1,0,1]=4 17011 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000210736_100020667443 [0,2,0,0,0,0|1,0,1]=4 17012 B16R0.302 CCCCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100011215454 [0,2,0,0,0,0|1,0,0]=3 17013 B16R0.302 CCCCCCCCCCCC(=O)CC(C)C 1458a_100000210736_100000210624 [0,2,0,0,0,0|1,0,0]=3 17014 B16R0.302 CCCCCCCCCCCC(=O)CC(C)O 1458a_100000210736_100011218427 [0,2,0,0,0,0|1,0,0]=3 17015 B16R0.302 CCCCCCCCCCCC(=O)CC(F)F 1458a_100000210736_100011934356 [0,2,0,0,0,0|1,0,0]=3 17016 B16R0.302 CCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100011215454 [0,2,0,0,0,0|1,0,0]=3 17017 B16R0.302 CCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215454 [0,2,0,0,0,0|1,0,0]=3 17018 B16R0.302 CCCCCCCCCCCC(=O)C[N+](=O)[O-] 1458a_100000210736_100000761209 [0,2,0,0,0,0|2,0,0]=4 17019 B16R0.302 CCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100011215454 [0,2,0,0,0,0|0,1,0]=3 17020 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000210736 [0,2,0,0,0,0|1,0,0]=3 17021 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000210736 [0,2,0,0,0,0|1,0,0]=3 17022 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000210736 [0,2,0,0,0,0|1,0,0]=3 17023 B16R0.302 CCCCCCCCCCCC(C)OC(C)C 34a_100011217895_100000210206 [0,2,0,0,0,0|1,0,1]=4 17024 B16R0.302 CCCCCCCCCCCC(C)OC(C)C 7a_100011217895_100000210206 [0,2,0,0,0,0|1,0,1]=4 17025 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C 11a_100000684558_100000211388 [0,2,0,0,0,0|2,0,0]=4 17026 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C 1626a_100000684558_100000211388 [0,2,0,0,0,0|2,0,0]=4 17027 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C 240690a_100000684558_100000211388 [0,2,0,0,0,0|2,0,0]=4 17028 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)Cl 11a_100000684558_200042562850 [0,2,0,0,0,0|2,0,0]=4 17029 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)Cl 1626a_100000684558_200042562850 [0,2,0,0,0,0|2,0,0]=4 17030 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)Cl 240690a_100000684558_200042562850 [0,2,0,0,0,0|2,0,0]=4 17031 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)I 11a_100000684558_100025716642 [0,2,0,0,0,0|2,0,0]=4 17032 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)I 1626a_100000684558_100025716642 [0,2,0,0,0,0|2,0,0]=4 17033 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 11a_100000684558_100000210554 [0,2,0,0,0,0|2,0,0]=4 17034 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 1626a_100000684558_100000210554 [0,2,0,0,0,0|2,0,0]=4 17035 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 240690a_100000684558_100000210554 [0,2,0,0,0,0|2,0,0]=4 17036 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 527a_100000684558_100000210554 [0,2,0,0,0,0|2,0,0]=4 17037 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C 11a_100000684558_100000750896 [0,2,0,0,0,0|2,0,0]=4 17038 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C 240690a_100000684558_100000750896 [0,2,0,0,0,0|2,0,0]=4 17039 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C 527a_100000684558_100000750896 [0,2,0,0,0,0|2,0,0]=4 17040 B16R0.302 CCCCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000684558_100011933948 [0,2,0,0,0,0|2,0,0]=4 17041 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 11a_100000684558_200159257847 [0,2,0,0,0,0|1,1,0]=4 17042 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 1626a_100000684558_200159257847 [0,2,0,0,0,0|1,1,0]=4 17043 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 240690a_100000684558_200159257847 [0,2,0,0,0,0|1,1,0]=4 17044 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 527a_100000684558_200159257847 [0,2,0,0,0,0|1,1,0]=4 17045 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 2708a_100000684558_100138425928 [0,2,0,0,0,0|2,0,0]=4 17046 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000684558 [0,2,0,0,0,0|2,0,0]=4 17047 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000684558 [0,2,0,0,0,0|2,0,0]=4 17048 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 512a_100000684558_100138425928 [0,2,0,0,0,0|2,0,0]=4 17049 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000684558 [0,2,0,0,0,0|2,0,0]=4 17050 B16R0.302 CCCCCCCCCCOC(=O)CC(=O)C 1458a_100000070787_100000210668 [0,2,0,0,0,0|2,0,0]=4 17051 B16R0.302 CCCCCCCCCCOC(=O)CN(C)C 2230a_100102631434_100000210668 [0,2,0,0,0,0|2,0,0]=4 17052 B16R0.302 CCCCCCCCCCOC(=O)CN(C)C 269982a_100102631434_100000210668 [0,2,0,0,0,0|2,0,0]=4 17053 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100011214924 [0,2,0,0,0,0|2,0,0]=4 17054 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 2230a_100000212291_100000183996 [0,2,0,0,0,0|2,0,0]=4 17055 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 34a_100000212291_100000183996 [0,2,0,0,0,0|2,0,0]=4 17056 B16R0.302 CCCCCCCCCNCC(=O)OC(C)C 2230a_100000212291_100011215430 [0,2,0,0,0,0|1,0,0]=3 17057 B16R0.302 CCCCCCCCCNCC(=O)OC(C)C 34a_100000212291_100011215430 [0,2,0,0,0,0|1,0,0]=3 17058 B16R0.302 CCCCCCCCCOCC(=O)NC(=O)C 7a_100000210712_100000183797 [0,2,0,0,0,0|2,0,0]=4 17059 B16R0.302 CCCCCCCCCOCC(=O)NC(C)C 34a_100000210712_100000183996 [0,2,0,0,0,0|2,0,0]=4 17060 B16R0.302 CCCCCCCCCOCC(=O)NC(C)C 7a_100000210712_100000183996 [0,2,0,0,0,0|2,0,0]=4 17061 B16R0.302 CCCCCCCCCOCC(=O)OC(C)C 34a_100000210712_100011215430 [0,2,0,0,0,0|1,0,0]=3 17062 B16R0.302 CCCCCCCCCOCC(=O)OC(C)C 7a_100000210712_100011215430 [0,2,0,0,0,0|1,0,0]=3 17063 B16R0.302 CCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210670 [0,2,0,0,0,0|2,0,0]=4 17064 B16R0.302 CCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210670 [0,2,0,0,0,0|1,0,0]=3 17065 B16R0.302 CCCCCCCCNCCC(=O)NC(C)C 2230a_100000229939_100000737564 [0,2,0,0,0,0|2,0,0]=4 17066 B16R0.302 CCCCCCCCNCCC(=O)OC(C)C 2230a_100000229939_100000760027 [0,2,0,0,0,0|1,0,0]=3 17067 B16R0.302 CCCCCCCCOCCC(=O)NC(C)C 7a_100000210232_100000737564 [0,2,0,0,0,0|2,0,0]=4 17068 B16R0.302 CCCCCCCCOCCC(=O)OC(C)C 7a_100000210232_100000760027 [0,2,0,0,0,0|1,0,0]=3 17069 B16R0.302 CCCCCCCCSCCC(=O)NC(C)C 62a_100000210759_100000737564 [0,2,0,0,0,0|2,0,0]=4 17070 B16R0.302 CCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210317 [0,2,0,0,0,0|2,0,0]=4 17071 B16R0.302 CCCCCCCCSCCC(=O)OC(C)C 62a_100000210759_100000760027 [0,2,0,0,0,0|1,0,0]=3 17072 B16R0.302 CCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210317 [0,2,0,0,0,0|1,0,0]=3 17073 B16R0.302 CCCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210317 [0,2,0,0,0,0|2,0,0]=4 17074 B16R0.302 CCCCCCCCSCOC(=O)OC(C)C 62a_100000210759_100000003507 [0,2,0,0,0,0|2,0,0]=4 17075 B16R0.302 CCCCCCOCCOCC(=O)OC(C)C 34a_100000691444_100011215430 [0,2,0,0,0,0|2,0,0]=4 17076 B16R0.302 CCCCCCOCCOCC(=O)OC(C)C 7a_100000691444_100011215430 [0,2,0,0,0,0|2,0,0]=4 17077 B16R0.302 CCCCCNCCCCCC(=O)OC(C)C 2230a_100000209983_200010986244 [0,2,0,0,0,0|1,0,0]=3 17078 B16R0.302 CCCCCOCCCCCC(=O)OC(C)C 34a_100000210253_200010986244 [0,2,0,0,0,0|1,0,0]=3 17079 B16R0.302 CCCCCOCCCCCC(=O)OC(C)C 7a_100000210253_200010986244 [0,2,0,0,0,0|1,0,0]=3 17080 B16R0.302 CCCCCOCCOCCC(=O)OC(C)C 7a_100011215259_100000760027 [0,2,0,0,0,0|2,0,0]=4 17081 B16R0.302 CCCCCSCCCCCC(=O)OC(C)C 62a_100000210326_200010986244 [0,2,0,0,0,0|1,0,0]=3 17082 B16R0.302 CCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210326 [0,2,0,0,0,0|1,0,0]=3 17083 B16R0.302 CCCCNCCCCOCC(=O)OC(C)C 34a_200011216965_100011215430 [0,2,0,0,0,0|2,0,0]=4 17084 B16R0.302 CCCCOCCCCOCC(=O)OC(C)C 34a_200000760531_100011215430 [0,2,0,0,0,0|2,0,0]=4 17085 B16R0.302 CCCCOCCCCOCC(=O)OC(C)C 7a_200000760531_100011215430 [0,2,0,0,0,0|2,0,0]=4 17086 B16R0.302 CCCCOCCCNCCC(=O)OC(C)C 2230a_200000211371_100000760027 [0,2,0,0,0,0|2,0,0]=4 17087 B16R0.302 CCCCOCCCOCCC(=O)OC(C)C 7a_200011215613_100000760027 [0,2,0,0,0,0|2,0,0]=4 17088 B16R0.302 CCOCCNCCCCCC(=O)OC(C)C 2230a_102516460346_200010986244 [0,2,0,0,0,0|2,0,0]=4 17089 B16R0.302 CCOCCNCCCCCC(=O)OC(C)C 34a_102516460346_200010986244 [0,2,0,0,0,0|2,0,0]=4 17090 B16R0.302 CCOCCOCCCCCC(=O)OC(C)C 34a_100000210136_200010986244 [0,2,0,0,0,0|2,0,0]=4 17091 B16R0.302 CCOCCOCCCCCC(=O)OC(C)C 7a_100000210136_200010986244 [0,2,0,0,0,0|2,0,0]=4 17092 B16R0.302 CCOCCSCCCCCC(=O)OC(C)C 62a_100000210147_200010986244 [0,2,0,0,0,0|2,0,0]=4 17093 B16R0.302 CCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215890 [0,2,0,0,0,0|2,0,0]=4 17094 B16R0.302 CCSCCNCCCCCC(=O)OC(C)C 2230a_100000106463_200010986244 [0,2,0,0,0,0|2,0,0]=4 17095 B16R0.302 CCSCCOCCCCCC(=O)OC(C)C 34a_100000212035_200010986244 [0,2,0,0,0,0|2,0,0]=4 17096 B16R0.302 CCSCCOCCCCCC(=O)OC(C)C 7a_100000212035_200010986244 [0,2,0,0,0,0|2,0,0]=4 17097 B16R0.302 CCSCCSCCCCCC(=O)OC(C)C 62a_100000757381_200010986244 [0,2,0,0,0,0|2,0,0]=4 17098 B16R0.302 CCSCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000757381 [0,2,0,0,0,0|2,0,0]=4 17099 B16R0.302 CN(C)CC(=O)CCCCCCCCCCO 1458a_100000750896_100009813290 [0,2,0,0,0,0|2,0,0]=4 17100 B16R0.302 CNCCCOCCCCCC(=O)OC(C)C 34a_100000213112_200010986244 [0,2,0,0,0,0|2,0,0]=4 17101 B16R0.302 COCCCCCCOCCC(=O)OC(C)C 7a_200012092642_100000760027 [0,2,0,0,0,0|2,0,0]=4 17102 B16R0.302 COCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100011998445 [0,2,0,0,0,0|2,0,0]=4 17103 B16R0.302 COCCCCCCSCCC(=O)OC(C)C 62a_100011998445_100000760027 [0,2,0,0,0,0|2,0,0]=4 17104 B16R0.302 COCCCNCCCCCC(=O)OC(C)C 34a_100150723488_200010986244 [0,2,0,0,0,0|2,0,0]=4 17105 B16R0.302 COCCCOCCCCCC(=O)OC(C)C 34a_100000740835_200010986244 [0,2,0,0,0,0|2,0,0]=4 17106 B16R0.302 COCCCSCCCCCC(=O)OC(C)C 62a_100000709357_200010986244 [0,2,0,0,0,0|2,0,0]=4 17107 B16R0.302 COCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000709357 [0,2,0,0,0,0|2,0,0]=4 17108 B16R0.302 CSCCCNCCCCCC(=O)OC(C)C 2230a_100000749238_200010986244 [0,2,0,0,0,0|2,0,0]=4 17109 B16R0.302 CSCCCOCCCCCC(=O)OC(C)C 34a_100000690336_200010986244 [0,2,0,0,0,0|2,0,0]=4 17110 B16R0.302 CSCCCOCCCCCC(=O)OC(C)C 7a_100000690336_200010986244 [0,2,0,0,0,0|2,0,0]=4 17111 B16R0.302 C[C@@H](O)CC(=O)CCCCCCCCCCO 1458a_100011933948_100009813290 [0,2,0,0,0,0|2,0,0]=4 17112 B16R0.302 C[S+](C)CC(=O)CCCCCCCCCCO 1458a_200159257847_100009813290 [0,2,0,0,0,0|1,1,0]=4 17113 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000753159 [0,2,0,0,0,0|1,0,0]=3 17114 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000692101_100011215454 [0,2,0,0,0,0|1,0,0]=3 17115 B16R0.661 C#CCCC(=O)CCCCCCCCCCO 1458a_100000692101_100009813290 [0,2,0,0,0,0|2,0,0]=4 17116 B16R0.661 C#CCCC(=O)CCOCCCCCCCC 34a_100011064465_100000210759 [0,2,0,0,0,0|2,0,0]=4 17117 B16R0.661 C#CCCC(=O)CCOCCCCCCCC 7a_100011064465_100000210759 [0,2,0,0,0,0|2,0,0]=4 17118 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000692101 [0,2,0,0,0,0|2,0,0]=4 17119 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000692101 [0,2,0,0,0,0|2,0,0]=4 17120 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000692101 [0,2,0,0,0,0|2,0,0]=4 17121 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000692101 [0,2,0,0,0,0|2,0,0]=4 17122 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 11a_100000212058_100000210736 [0,2,0,0,0,0|1,0,0]=3 17123 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 1626a_100000212058_100000210736 [0,2,0,0,0,0|1,0,0]=3 17124 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 240690a_100000212058_100000210736 [0,2,0,0,0,0|1,0,0]=3 17125 B16R0.661 C#CCNC(=O)CCCCCCCCCCO 240690a_100000212058_200000016029 [0,2,0,0,0,0|2,0,0]=4 17126 B16R0.661 C#CCNC(=O)CNCCCCCCCCC 2230a_100000747989_100011214924 [0,2,0,0,0,0|2,0,0]=4 17127 B16R0.661 C#CCNC(=O)CNCCCCCCCCC 34a_100000747989_100011214924 [0,2,0,0,0,0|2,0,0]=4 17128 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 2708a_100000212058_100000684558 [0,2,0,0,0,0|2,0,0]=4 17129 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 2708a_100000684558_100000212058 [0,2,0,0,0,0|2,0,0]=4 17130 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 273464a_100000212058_100000684558 [0,2,0,0,0,0|2,0,0]=4 17131 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 273464a_100000684558_100000212058 [0,2,0,0,0,0|2,0,0]=4 17132 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 512a_100000212058_100000684558 [0,2,0,0,0,0|2,0,0]=4 17133 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 512a_100000684558_100000212058 [0,2,0,0,0,0|2,0,0]=4 17134 B16R0.661 C#CCOC(C)CCCCCCCCCCC 34a_100011217895_100000184674 [0,2,0,0,0,0|1,0,1]=4 17135 B16R0.661 C#CCOC(C)CCCCCCCCCCC 7a_100011217895_100000038162 [0,2,0,0,0,0|1,0,1]=4 17136 B16R0.661 C/C=C/CC(=O)CCCCCCCCCCC 1458a_100000210736_100102629194 [0,2,0,0,0,0|1,0,0]=3 17137 B16R0.661 C=C(CNCCCCCCCCC)OCOC 34a_100000212291_100000042856 [0,2,0,0,0,0|2,0,0]=4 17138 B16R0.661 C=C(COCCCCCCCCC)OCOC 34a_100000210712_100000042856 [0,2,0,0,0,0|2,0,0]=4 17139 B16R0.661 C=C(CSCCCCCCCCC)OCOC 62a_100000042856_100000210670 [0,2,0,0,0,0|2,0,0]=4 17140 B16R0.661 C=CC=CC(=O)CCCCCCCCCCC 1458a_100016291481_100011215454 [0,2,0,0,0,0|1,0,1]=4 17141 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000754431 [0,2,0,0,0,0|1,0,0]=3 17142 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000749702_100011215454 [0,2,0,0,0,0|1,0,0]=3 17143 B16R0.661 C=CCCC(=O)CCCCCCCCCCO 1458a_100000749702_100009813290 [0,2,0,0,0,0|2,0,0]=4 17144 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000749702 [0,2,0,0,0,0|2,0,0]=4 17145 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000749702 [0,2,0,0,0,0|2,0,0]=4 17146 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000749702 [0,2,0,0,0,0|2,0,0]=4 17147 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000749702 [0,2,0,0,0,0|2,0,0]=4 17148 B16R0.661 C=CCCCCCCCCCC(=O)C=COC 1458a_100016268678_100009814027 [0,2,0,0,0,0|0,0,2]=4 17149 B16R0.661 C=CCCCCCCCCCC(=O)CCOC 1458a_100000749529_100009814027 [0,2,0,0,0,0|0,0,2]=4 17150 B16R0.661 C=CCCCCCCCCCC(=O)COCC 1458a_100000211967_100009814027 [0,2,0,0,0,0|0,0,2]=4 17151 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 1626a_100020586998_100000210736 [0,2,0,0,0,0|1,0,0]=3 17152 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 240690a_100020586998_100000210736 [0,2,0,0,0,0|1,0,0]=3 17153 B16R0.661 C=CCNC(=O)CCCCCCCCCCO 240690a_100020586998_200000016029 [0,2,0,0,0,0|2,0,0]=4 17154 B16R0.661 C=CCNC(=O)CCNCCCCCCCC 2230a_100000229939_100011222895 [0,2,0,0,0,0|2,0,0]=4 17155 B16R0.661 C=CCNC(=O)CCOCCCCCCCC 7a_100000210232_100011222895 [0,2,0,0,0,0|2,0,0]=4 17156 B16R0.661 C=CCNC(=O)CCSCCCCCCCC 62a_100000210759_100011222895 [0,2,0,0,0,0|2,0,0]=4 17157 B16R0.661 C=CCNC(=O)CCSCCCCCCCC 62a_100011222895_100000210317 [0,2,0,0,0,0|2,0,0]=4 17158 B16R0.661 C=CCNC(=O)CNCCCCCCCCC 2230a_100000212291_100000183597 [0,2,0,0,0,0|2,0,0]=4 17159 B16R0.661 C=CCNC(=O)COCCCCCCCCC 7a_100000210712_100000183597 [0,2,0,0,0,0|2,0,0]=4 17160 B16R0.661 C=CCNC(=O)CSCCCCCCCCC 62a_100000183597_100000210670 [0,2,0,0,0,0|2,0,0]=4 17161 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 2708a_100000684558_100020586998 [0,2,0,0,0,0|2,0,0]=4 17162 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 273464a_100000684558_100020586998 [0,2,0,0,0,0|2,0,0]=4 17163 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 273464a_100020586998_100000684558 [0,2,0,0,0,0|2,0,0]=4 17164 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 512a_100000684558_100020586998 [0,2,0,0,0,0|2,0,0]=4 17165 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 512a_100020586998_100000684558 [0,2,0,0,0,0|2,0,0]=4 17166 B16R0.661 C=CCOC(=O)CNCCCCCCCCC 2230a_100000212291_100000033060 [0,2,0,0,0,0|1,0,0]=3 17167 B16R0.661 C=CCOC(=O)CNCCCCCCCCC 34a_100000212291_100000033060 [0,2,0,0,0,0|1,0,0]=3 17168 B16R0.661 C=CCOC(=O)CNCCCCCCCCO 2230a_102515433106_100000033060 [0,2,0,0,0,0|2,0,0]=4 17169 B16R0.661 C=CCOC(=O)CNCCCCCCCCO 34a_102515433106_100000033060 [0,2,0,0,0,0|2,0,0]=4 17170 B16R0.661 C=CCOC(=O)COCCCCCCCCBr 34a_100009813846_100000033060 [0,2,0,0,0,0|2,0,0]=4 17171 B16R0.661 C=CCOC(=O)COCCCCCCCCBr 7a_100009813846_100000033060 [0,2,0,0,0,0|2,0,0]=4 17172 B16R0.661 C=CCOC(=O)COCCCCCCCCC 34a_100000210712_100000033060 [0,2,0,0,0,0|1,0,0]=3 17173 B16R0.661 C=CCOC(=O)COCCCCCCCCC 7a_100000210712_100000033060 [0,2,0,0,0,0|1,0,0]=3 17174 B16R0.661 C=CCOC(=O)COCCCCCCCCCl 34a_100000033203_100000033060 [0,2,0,0,0,0|2,0,0]=4 17175 B16R0.661 C=CCOC(=O)COCCCCCCCCCl 7a_100000033203_100000033060 [0,2,0,0,0,0|2,0,0]=4 17176 B16R0.661 C=CCOC(=O)COCCCCCCCCN 34a_102515433106_100000033060 [0,2,0,0,0,0|2,0,0]=4 17177 B16R0.661 C=CCOC(=O)COCCCCNCCCC 34a_200011216965_100000033060 [0,2,0,0,0,0|2,0,0]=4 17178 B16R0.661 C=CCOC(=O)COCCCCOCCCC 34a_200000760531_100000033060 [0,2,0,0,0,0|2,0,0]=4 17179 B16R0.661 C=CCOC(=O)COCCCCOCCCC 7a_200000760531_100000033060 [0,2,0,0,0,0|2,0,0]=4 17180 B16R0.661 C=CCOC(=O)COCCOCCCCCC 34a_100000691444_100000033060 [0,2,0,0,0,0|2,0,0]=4 17181 B16R0.661 C=CCOC(=O)COCCOCCCCCC 7a_100000691444_100000033060 [0,2,0,0,0,0|2,0,0]=4 17182 B16R0.661 C=CCOC(=O)CSCCCCCCCCC 62a_100000033060_100000210670 [0,2,0,0,0,0|1,0,0]=3 17183 B16R0.661 C=CCOC(=O)CSCCCCCCCCO 62a_100000033060_100000033203 [0,2,0,0,0,0|2,0,0]=4 17184 B16R0.661 C=CCOC(=O)CSCCCCCCCCO 62a_100000033203_100000033060 [0,2,0,0,0,0|2,0,0]=4 17185 B16R0.661 C=CCOC(C)CCCCCCCCCCC 34a_100011217895_100015514636 [0,2,0,0,0,0|1,0,1]=4 17186 B16R0.661 C=CCOC(C)CCCCCCCCCCC 7a_100011217895_100015514636 [0,2,0,0,0,0|1,0,1]=4 17187 B16R0.661 CC#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000748600 [0,2,0,0,0,0|1,0,0]=3 17188 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000070051 [0,2,0,0,0,0|1,0,0]=3 17189 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100121576822_100011215454 [0,2,0,0,0,0|1,0,0]=3 17190 B16R0.661 CC=CCC(=O)CCCCCCCCCCO 1458a_100121576822_100009813290 [0,2,0,0,0,0|2,0,0]=4 17191 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 11a_100000684558_100121576822 [0,2,0,0,0,0|2,0,0]=4 17192 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100121576822 [0,2,0,0,0,0|2,0,0]=4 17193 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100121576822 [0,2,0,0,0,0|2,0,0]=4 17194 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 527a_100000684558_100121576822 [0,2,0,0,0,0|2,0,0]=4 17195 B16R0.661 CC=NNC(=O)CCCCCCCCCCC 4a_200011219152_200000210099 [0,2,0,0,0,0|1,0,0]=3 17196 B16R0.661 CCC#CC(=O)CCCCCCCCCCC 1458a_100011827653_100011215454 [0,2,0,0,0,0|1,0,0]=3 17197 B16R0.661 CCC#CC(=O)CCCCCCCCCCO 1458a_100011827653_100009813290 [0,2,0,0,0,0|2,0,0]=4 17198 B16R0.661 CCC=CC(=O)CCCCCCCCCCC 1458a_100000212282_100011215454 [0,2,0,0,0,0|1,0,0]=3 17199 B16R0.661 CCC=CC(=O)CCCCCCCCCCO 1458a_100000212282_100009813290 [0,2,0,0,0,0|2,0,0]=4 17200 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000212282 [0,2,0,0,0,0|2,0,0]=4 17201 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000212282 [0,2,0,0,0,0|2,0,0]=4 17202 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000212282 [0,2,0,0,0,0|2,0,0]=4 17203 B16R0.661 CCCCC(=O)CCCCCCCCCCO 1458a_100000210183_100009813290 [0,2,0,0,0,0|2,0,0]=4 17204 B16R0.661 CCCCCCCCCC=CC(=O)CCOC 1458a_200015352897_100000233755 [0,2,0,0,0,0|0,0,2]=4 17205 B16R0.661 CCCCCCCCCCCC(=NNCC)C 4a_100000756455_100011216755 [0,2,0,0,0,0|2,0,0]=4 17206 B16R0.661 CCCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100011215454 [0,2,0,0,0,0|1,0,0]=3 17207 B16R0.661 CCCCCCCCCCCC(=O)C=COC 1458a_100016268678_100011215454 [0,2,0,0,0,0|0,0,0]=2 17208 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100000210736_100011215226 [0,2,0,0,0,0|1,0,0]=3 17209 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100011215454 [0,2,0,0,0,0|1,0,0]=3 17210 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210183_100011215454 [0,2,0,0,0,0|1,0,0]=3 17211 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210736_100000210211 [0,2,0,0,0,0|1,0,0]=3 17212 B16R0.661 CCCCCCCCCCCC(=O)CCCF 1458a_100000210736_100011934791 [0,2,0,0,0,0|1,0,0]=3 17213 B16R0.661 CCCCCCCCCCCC(=O)CCCO 1458a_100000210736_100011215043 [0,2,0,0,0,0|1,0,0]=3 17214 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000210736_100000233755 [0,2,0,0,0,0|0,0,0]=2 17215 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100011215454 [0,2,0,0,0,0|0,0,0]=2 17216 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000174002_100011215454 [0,2,0,0,0,0|0,1,0]=3 17217 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000210736_100000751147 [0,2,0,0,0,0|0,1,0]=3 17218 B16R0.661 CCCCCCCCCCCC(=O)COCC 1458a_100000211967_100011215454 [0,2,0,0,0,0|0,0,0]=2 17219 B16R0.661 CCCCCCCCCCCC(=O)CSCC 1458a_100000230394_100011215454 [0,2,0,0,0,0|0,1,0]=3 17220 B16R0.661 CCCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000210736 [0,2,0,0,0,0|1,0,0]=3 17221 B16R0.661 CCCCCCCCCCCC(=O)NCCC 11a_100020643023_100000210736 [0,2,0,0,0,0|1,0,0]=3 17222 B16R0.661 CCCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210736 [0,2,0,0,0,0|1,0,0]=3 17223 B16R0.661 CCCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210736 [0,2,0,0,0,0|1,0,0]=3 17224 B16R0.661 CCCCCCCCCCCC(=O)NCCF 11a_100000724931_100000210736 [0,2,0,0,0,0|1,0,0]=3 17225 B16R0.661 CCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210736 [0,2,0,0,0,0|1,0,0]=3 17226 B16R0.661 CCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210736 [0,2,0,0,0,0|1,0,0]=3 17227 B16R0.661 CCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210736 [0,2,0,0,0,0|1,0,0]=3 17228 B16R0.661 CCCCCCCCCCCC(=O)NNCC 22a_100000756455_100000210736 [0,2,0,0,0,0|1,0,0]=3 17229 B16R0.661 CCCCCCCCCCCC(=O)OCNC 2230a_106832991635_100020644155 [0,2,0,0,0,0|0,0,0]=2 17230 B16R0.661 CCCCCCCCCCCC(=O)OCNC 34a_100102657272_100020644155 [0,2,0,0,0,0|0,0,0]=2 17231 B16R0.661 CCCCCCCCCCCC(=O)OCNC 7a_106832991635_100020644155 [0,2,0,0,0,0|0,0,0]=2 17232 B16R0.661 CCCCCCCCCCCC(=O)OCOC 34a_100138415774_100020644155 [0,2,0,0,0,0|0,0,0]=2 17233 B16R0.661 CCCCCCCCCCCC(=O)OCSC 62a_200000210301_100020644155 [0,2,0,0,0,0|0,0,0]=2 17234 B16R0.661 CCCCCCCCCCCC(=O)OCS[13CH3] 62a_200025704644_100020644155 [0,2,0,0,0,0|0,0,0]=2 17235 B16R0.661 CCCCCCCCCCCC(C)OCC#N 7a_100011217895_100011215382 [0,2,0,0,0,0|1,0,1]=4 17236 B16R0.661 CCCCCCCCCCCC(C)OCC=O 34a_100011217895_200009817547 [0,2,0,0,0,0|1,0,1]=4 17237 B16R0.661 CCCCCCCCCCCC(C)OCC=O 7a_100011217895_200015260668 [0,2,0,0,0,0|1,0,1]=4 17238 B16R0.661 CCCCCCCCCCCC(C)OCCC 34a_100011217895_100000210303 [0,2,0,0,0,0|1,0,1]=4 17239 B16R0.661 CCCCCCCCCCCC(C)OCCC 7a_100011217895_100000210303 [0,2,0,0,0,0|1,0,1]=4 17240 B16R0.661 CCCCCCCCCCCC(C)OCCF 34a_100011217895_100011217306 [0,2,0,0,0,0|1,0,1]=4 17241 B16R0.661 CCCCCCCCCCCC(C)OCCF 7a_100011217895_100011217306 [0,2,0,0,0,0|1,0,1]=4 17242 B16R0.661 CCCCCCCCCCCC(C)OCCO 34a_100011217895_100000211926 [0,2,0,0,0,0|1,0,1]=4 17243 B16R0.661 CCCCCCCCCCCC(C)OCCO 7a_100011217895_100000211926 [0,2,0,0,0,0|1,0,1]=4 17244 B16R0.661 CCCCCCCCCCCC(C)OCSC 34a_100011217895_100011218213 [0,2,0,0,0,0|1,0,1]=4 17245 B16R0.661 CCCCCCCCCCCN(C)CCOC 2230a_100000743101_100011215454 [0,2,0,0,0,0|2,0,0]=4 17246 B16R0.661 CCCCCCCCCCCN(C)CCOC 269982a_100000743101_100011215454 [0,2,0,0,0,0|2,0,0]=4 17247 B16R0.661 CCCCCCCCCCNC(=O)C=COC 1626a_100000684558_100016268678 [0,2,0,0,0,0|1,0,0]=3 17248 B16R0.661 CCCCCCCCCCNC(=O)C=COC 240690a_100000684558_100016268678 [0,2,0,0,0,0|1,0,0]=3 17249 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 11a_100000684558_100011934036 [0,2,0,0,0,0|2,0,0]=4 17250 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 1626a_100000684558_100011934036 [0,2,0,0,0,0|2,0,0]=4 17251 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 240690a_100000684558_100011934036 [0,2,0,0,0,0|2,0,0]=4 17252 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 527a_100000684558_100011934036 [0,2,0,0,0,0|2,0,0]=4 17253 B16R0.661 CCCCCCCCCCNC(=O)CCCC 11a_100000684558_100000210183 [0,2,0,0,0,0|2,0,0]=4 17254 B16R0.661 CCCCCCCCCCNC(=O)CCCC 1626a_100000684558_100000210183 [0,2,0,0,0,0|2,0,0]=4 17255 B16R0.661 CCCCCCCCCCNC(=O)CCCC 240690a_100000684558_100000210183 [0,2,0,0,0,0|2,0,0]=4 17256 B16R0.661 CCCCCCCCCCNC(=O)CCCC 527a_100000684558_100000210183 [0,2,0,0,0,0|2,0,0]=4 17257 B16R0.661 CCCCCCCCCCNC(=O)CCOC 11a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 17258 B16R0.661 CCCCCCCCCCNC(=O)CCOC 1626a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 17259 B16R0.661 CCCCCCCCCCNC(=O)CCOC 240690a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 17260 B16R0.661 CCCCCCCCCCNC(=O)CCOC 527a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 17261 B16R0.661 CCCCCCCCCCNC(=O)CCSC 11a_100000684558_100000174002 [0,2,0,0,0,0|1,1,0]=4 17262 B16R0.661 CCCCCCCCCCNC(=O)CCSC 1626a_100000684558_100000174002 [0,2,0,0,0,0|1,1,0]=4 17263 B16R0.661 CCCCCCCCCCNC(=O)CCSC 240690a_100000684558_100000174002 [0,2,0,0,0,0|1,1,0]=4 17264 B16R0.661 CCCCCCCCCCNC(=O)CCSC 527a_100000684558_100000174002 [0,2,0,0,0,0|1,1,0]=4 17265 B16R0.661 CCCCCCCCCCNC(=O)COCC 11a_100000684558_100000211967 [0,2,0,0,0,0|1,0,0]=3 17266 B16R0.661 CCCCCCCCCCNC(=O)COCC 1626a_100000684558_100000211967 [0,2,0,0,0,0|1,0,0]=3 17267 B16R0.661 CCCCCCCCCCNC(=O)COCC 240690a_100000684558_100000211967 [0,2,0,0,0,0|1,0,0]=3 17268 B16R0.661 CCCCCCCCCCNC(=O)COCC 527a_100000684558_100000211967 [0,2,0,0,0,0|1,0,0]=3 17269 B16R0.661 CCCCCCCCCCNC(=O)CSCC 11a_100000684558_100000230394 [0,2,0,0,0,0|1,1,0]=4 17270 B16R0.661 CCCCCCCCCCNC(=O)CSCC 1626a_100000684558_100000230394 [0,2,0,0,0,0|1,1,0]=4 17271 B16R0.661 CCCCCCCCCCNC(=O)CSCC 240690a_100000684558_100000230394 [0,2,0,0,0,0|1,1,0]=4 17272 B16R0.661 CCCCCCCCCCNC(=O)CSCC 527a_100000684558_100000230394 [0,2,0,0,0,0|1,1,0]=4 17273 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 2708a_100000734998_100000684558 [0,2,0,0,0,0|2,0,0]=4 17274 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 273464a_100000684558_100000734998 [0,2,0,0,0,0|2,0,0]=4 17275 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 273464a_100000734998_100000684558 [0,2,0,0,0,0|2,0,0]=4 17276 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 512a_100000684558_100000734998 [0,2,0,0,0,0|2,0,0]=4 17277 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 512a_100000734998_100000684558 [0,2,0,0,0,0|2,0,0]=4 17278 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100000684558_100020643023 [0,2,0,0,0,0|2,0,0]=4 17279 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000684558 [0,2,0,0,0,0|2,0,0]=4 17280 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100000684558_100020643023 [0,2,0,0,0,0|2,0,0]=4 17281 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000684558 [0,2,0,0,0,0|2,0,0]=4 17282 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100000684558_100020643023 [0,2,0,0,0,0|2,0,0]=4 17283 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100020643023_100000684558 [0,2,0,0,0,0|2,0,0]=4 17284 B16R0.661 CCCCCCCCCCNC(=O)NCCF 2708a_100000684558_100000724931 [0,2,0,0,0,0|2,0,0]=4 17285 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000684558_100000724931 [0,2,0,0,0,0|2,0,0]=4 17286 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000684558 [0,2,0,0,0,0|2,0,0]=4 17287 B16R0.661 CCCCCCCCCCNC(=O)NCCF 512a_100000684558_100000724931 [0,2,0,0,0,0|2,0,0]=4 17288 B16R0.661 CCCCCCCCCCNC(=O)NCCO 2708a_100000684558_100000210304 [0,2,0,0,0,0|2,0,0]=4 17289 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000684558 [0,2,0,0,0,0|2,0,0]=4 17290 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000684558_100000210304 [0,2,0,0,0,0|2,0,0]=4 17291 B16R0.661 CCCCCCCCCCNC(=O)NCCO 512a_100000684558_100000210304 [0,2,0,0,0,0|2,0,0]=4 17292 B16R0.661 CCCCCCCCCCNC(=O)NNCC 273464a_100000684558_100000756455 [0,2,0,0,0,0|2,0,0]=4 17293 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000684558_100000756455 [0,2,0,0,0,0|2,0,0]=4 17294 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000756455_100000684558 [0,2,0,0,0,0|2,0,0]=4 17295 B16R0.661 CCCCCCCCCCOC(=O)CNCC 2230a_100015525214_100000210668 [0,2,0,0,0,0|2,0,0]=4 17296 B16R0.661 CCCCCCCCCCOC(=O)COCC 34a_100121572206_100000210668 [0,2,0,0,0,0|1,0,0]=3 17297 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000210202_100000680656 [0,2,0,0,0,0|1,1,0]=4 17298 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000680656_100000210202 [0,2,0,0,0,0|1,1,0]=4 17299 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100000680656_100015361967 [0,2,0,0,0,0|1,1,0]=4 17300 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100015361967_100000680656 [0,2,0,0,0,0|1,1,0]=4 17301 B16R0.661 CCCCCCCCCNCC(=O)NCC#N 2230a_100000212291_100000736037 [0,2,0,0,0,0|2,0,0]=4 17302 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100011214924 [0,2,0,0,0,0|2,0,0]=4 17303 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000212291_100000183358 [0,2,0,0,0,0|2,0,0]=4 17304 B16R0.661 CCCCCCCCCNCC(=O)NCCC 34a_100000212291_100000183358 [0,2,0,0,0,0|2,0,0]=4 17305 B16R0.661 CCCCCCCCCNCC(=O)NCCF 2230a_100000725713_100011214924 [0,2,0,0,0,0|2,0,0]=4 17306 B16R0.661 CCCCCCCCCNCC(=O)OCCC 2230a_100000212291_200011215008 [0,2,0,0,0,0|1,0,0]=3 17307 B16R0.661 CCCCCCCCCNCC(=O)OCCC 34a_100000212291_200011215008 [0,2,0,0,0,0|1,0,0]=3 17308 B16R0.661 CCCCCCCCCOCC(=O)NCC#N 7a_100000210712_100000736037 [0,2,0,0,0,0|2,0,0]=4 17309 B16R0.661 CCCCCCCCCOCC(=O)NCCC 34a_100000210712_100000183358 [0,2,0,0,0,0|2,0,0]=4 17310 B16R0.661 CCCCCCCCCOCC(=O)NCCC 7a_100000210712_100000183358 [0,2,0,0,0,0|2,0,0]=4 17311 B16R0.661 CCCCCCCCCOCC(=O)OCCC 34a_100000210712_200011215008 [0,2,0,0,0,0|1,0,0]=3 17312 B16R0.661 CCCCCCCCCOCC(=O)OCCC 7a_100000210712_200011215008 [0,2,0,0,0,0|1,0,0]=3 17313 B16R0.661 CCCCCCCCCSCC(=O)NCC#N 62a_100000736037_100000210670 [0,2,0,0,0,0|2,0,0]=4 17314 B16R0.661 CCCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210670 [0,2,0,0,0,0|2,0,0]=4 17315 B16R0.661 CCCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210670 [0,2,0,0,0,0|1,0,0]=3 17316 B16R0.661 CCCCCCCCNCOC(=O)OCCC 34a_100000229939_200000139673 [0,2,0,0,0,0|2,0,0]=4 17317 B16R0.661 CCCCCCCCOCOC(=O)OCCC 34a_100000210232_200000139673 [0,2,0,0,0,0|2,0,0]=4 17318 B16R0.661 CCCCCCCCOCOC(=O)OCCC 7a_100000210232_200000139673 [0,2,0,0,0,0|2,0,0]=4 17319 B16R0.661 CCCCCCCCSCOC(=O)OCCC 62a_100000210759_200000139673 [0,2,0,0,0,0|2,0,0]=4 17320 B16R0.661 CCCCCCCNCCCC(=O)NCCC 2230a_100000229938_100011194427 [0,2,0,0,0,0|2,0,0]=4 17321 B16R0.661 CCCCCCCOCCCC(=O)NCCC 7a_100000210272_100011194427 [0,2,0,0,0,0|2,0,0]=4 17322 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100000210614_100011194427 [0,2,0,0,0,0|2,0,0]=4 17323 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210316 [0,2,0,0,0,0|2,0,0]=4 17324 B16R0.661 CCCCCCOCCOCC(=O)OCCC 34a_100000691444_200011215008 [0,2,0,0,0,0|2,0,0]=4 17325 B16R0.661 CCCCCCOCCOCC(=O)OCCC 7a_100000691444_200011215008 [0,2,0,0,0,0|2,0,0]=4 17326 B16R0.661 CCCCNCCCCOCC(=O)OCCC 34a_200011216965_200011215008 [0,2,0,0,0,0|2,0,0]=4 17327 B16R0.661 CCCCOCCCCOCC(=O)OCCC 34a_200000760531_200011215008 [0,2,0,0,0,0|2,0,0]=4 17328 B16R0.661 CCCCOCCCCOCC(=O)OCCC 7a_200000760531_200011215008 [0,2,0,0,0,0|2,0,0]=4 17329 B16R0.661 CCCNC(=O)CCCCCCCCCCO 240690a_100020643023_200000016029 [0,2,0,0,0,0|2,0,0]=4 17330 B16R0.661 CCCOC(=O)CNCCCCCCCCO 2230a_102515433106_200011215008 [0,2,0,0,0,0|2,0,0]=4 17331 B16R0.661 CCCOC(=O)CNCCCCCCCCO 34a_102515433106_200011215008 [0,2,0,0,0,0|2,0,0]=4 17332 B16R0.661 CCCOC(=O)COCCCCCCCCBr 34a_100009813846_200011215008 [0,2,0,0,0,0|2,0,0]=4 17333 B16R0.661 CCCOC(=O)COCCCCCCCCBr 7a_100009813846_200011215008 [0,2,0,0,0,0|2,0,0]=4 17334 B16R0.661 CCCOC(=O)COCCCCCCCCCl 34a_100000033203_200011215008 [0,2,0,0,0,0|2,0,0]=4 17335 B16R0.661 CCCOC(=O)COCCCCCCCCCl 7a_100000033203_200011215008 [0,2,0,0,0,0|2,0,0]=4 17336 B16R0.661 CCCOC(=O)COCCCCCCCCN 34a_102515433106_200011215008 [0,2,0,0,0,0|2,0,0]=4 17337 B16R0.661 CCCOC(=O)CSCCCCCCCCO 62a_100000033203_200011215008 [0,2,0,0,0,0|2,0,0]=4 17338 B16R0.661 CCCOC(=O)CSCCCCCCCCO 62a_200011215008_100000033203 [0,2,0,0,0,0|2,0,0]=4 17339 B16R0.661 CCNNC(=O)CCCCCCCCCCO 22a_100000756455_200000016029 [0,2,0,0,0,0|2,0,0]=4 17340 B16R0.661 CCOCC(=O)CCCCCCCCCCO 1458a_100000211967_100009813290 [0,2,0,0,0,0|1,0,0]=3 17341 B16R0.661 CCOCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211967 [0,2,0,0,0,0|2,0,0]=4 17342 B16R0.661 CCSCC(=O)CCCCCCCCCCO 1458a_100000230394_100009813290 [0,2,0,0,0,0|1,1,0]=4 17343 B16R0.661 COC=CC(=O)CCCCCCCCCCO 1458a_100016268678_100009813290 [0,2,0,0,0,0|1,0,0]=3 17344 B16R0.661 COC=CC(=O)NCCCCCCCCCO 240690a_100000078944_100016268678 [0,2,0,0,0,0|2,0,0]=4 17345 B16R0.661 COCCC(=O)CCCCCCCCCCO 1458a_100000749529_100009813290 [0,2,0,0,0,0|1,0,0]=3 17346 B16R0.661 COCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000749529 [0,2,0,0,0,0|2,0,0]=4 17347 B16R0.661 CSCCC(=O)CCCCCCCCCCO 1458a_100000174002_100009813290 [0,2,0,0,0,0|1,1,0]=4 17348 B16R0.661 N#CCCC(=O)CCCCCCCCCCO 1458a_100011934036_100009813290 [0,2,0,0,0,0|2,0,0]=4 17349 B16R0.661 O=C(C#CCO)CCCCCCCCCCO 1458a_100000049017_100009813290 [0,2,0,0,0,0|2,0,0]=4 17350 B16R0.661 O=C(CCCCCCCCCCO)NCCF 240690a_100000724931_200000016029 [0,2,0,0,0,0|2,0,0]=4 17351 B16R0.661 O=C(CCCCCCCCCCO)NCCO 240690a_100000210304_200000016029 [0,2,0,0,0,0|2,0,0]=4 17352 B16R0.1395 C#CC(CCC)OCCCCCCC(=O)OC 34a_200011217317_100009815986 [0,2,0,0,0,0|1,0,0]=3 17353 B16R0.1395 C#CC(CCC)OCCCCCCC(=O)OC 7a_200011217317_100009815986 [0,2,0,0,0,0|1,0,0]=3 17354 B16R0.1395 C=CC(CCC)OCCCCCCC(=O)OC 34a_100011216692_100009815986 [0,2,0,0,0,0|1,0,0]=3 17355 B16R0.1395 C=CC(CCC)OCCCCCCC(=O)OC 7a_100011216692_100009815986 [0,2,0,0,0,0|1,0,0]=3 17356 B16R0.1395 CCC(COC)NCCCCCCC(=O)OC 2230a_100000757820_100009815986 [0,2,0,0,0,0|2,0,0]=4 17357 B16R0.1395 CCC(COC)OCCCCCCC(=O)OC 7a_200011214946_100009815986 [0,2,0,0,0,0|2,0,0]=4 17358 B16R0.1395 CCCC(C#N)OCCCCCCC(=O)OC 34a_100000686963_100009815986 [0,2,0,0,0,0|1,0,0]=3 17359 B16R0.1395 CCCC(C#N)OCCCCCCC(=O)OC 7a_100000686963_100009815986 [0,2,0,0,0,0|1,0,0]=3 17360 B16R0.1395 CCCC(CC)NCCCCCCC(=O)OC 2230a_100000747048_100009815986 [0,2,0,0,0,0|1,0,0]=3 17361 B16R0.1395 CCCC(CC)OCCCCCCC(=O)OC 34a_100000687864_100009815986 [0,2,0,0,0,0|1,0,0]=3 17362 B16R0.1395 CCCC(CC)OCCCCCCC(=O)OC 7a_100000687864_100009815986 [0,2,0,0,0,0|1,0,0]=3 17363 B16R0.1395 CCCC(CC)OCCCCCCC(=O)OC 7a_100009863599_100011219200 [0,2,0,0,0,0|1,0,0]=3 17364 B16R0.1395 CCCC(CC)SCCCCCCC(=O)OC 62a_100009815986_100011219200 [0,2,0,0,0,0|1,0,0]=3 17365 B16R0.1395 CCCC(CC)SCCCCCCC(=O)OC 62a_100011219200_100009815986 [0,2,0,0,0,0|1,0,0]=3 17366 B16R0.1395 CCCC(CCOCCCCC(=O)OC)SC 34a_100000032865_100000204269 [0,2,0,0,0,0|1,0,0]=3 17367 B16R0.1395 CCCC(CCOCCCCC(=O)OC)SC 7a_100000032865_100000204269 [0,2,0,0,0,0|1,0,0]=3 17368 B16R0.1395 CCCC(CCOCCOCC(=O)OC)SC 34a_100000032865_100000090808 [0,2,0,0,0,0|2,0,0]=4 17369 B16R0.1395 CCCC(CCOCCOCC(=O)OC)SC 7a_100000032865_100000090808 [0,2,0,0,0,0|2,0,0]=4 17370 B16R0.1395 CCCN(CC)CCCCCCCC(=O)OC 2230a_100000226822_100010004213 [0,2,0,0,0,0|1,0,0]=3 17371 B16R0.1395 CCCN(CC)CCCCCCCC(=O)OC 269982a_100000226822_100010004213 [0,2,0,0,0,0|1,0,0]=3 17372 B16R0.1395 CCC[C@@H](CO)NCCCCCCC(=O)OC 2230a_100000732646_100009815986 [0,2,0,0,0,0|1,0,0]=3 17373 B16R0.1395 CCC[C@@H](CO)NCCCCCCC(=O)OC 34a_100000732646_100009815986 [0,2,0,0,0,0|1,0,0]=3 17374 B16R0.1395 CCN(CCO)CCCCCCCC(=O)OC 2230a_100000210973_100010004213 [0,2,0,0,0,0|2,0,0]=4 17375 B16R0.1395 CCN(CCO)CCCCCCCC(=O)OC 269982a_100000210973_100010004213 [0,2,0,0,0,0|2,0,0]=4 17376 B16R0.1395 CCOC(CC)CNCCCCCC(=O)OC 2230a_100015183923_100009816466 [0,2,0,0,0,0|2,0,0]=4 17377 B16R0.1395 CCOC(CC)CNCCCCCC(=O)OC 34a_100015183923_100009816466 [0,2,0,0,0,0|2,0,0]=4 17378 B16R0.1395 COCC(CCl)OCCCCCCC(=O)OC 34a_100011215053_100009815986 [0,2,0,0,0,0|2,0,0]=4 17379 B16R0.1395 COCC(CN)OCCCCCCC(=O)OC 34a_100000756049_100009815986 [0,2,0,0,0,0|2,0,0]=4 17380 B16R0.1395 COCC(CO)NCCCCCCC(=O)OC 2230a_100000724102_100009815986 [0,2,0,0,0,0|2,0,0]=4 17381 B16R0.1395 COCC(CO)NCCCCCCC(=O)OC 34a_100000724102_100009815986 [0,2,0,0,0,0|2,0,0]=4 17382 B16R0.2496 CCCC(C)(C)COCCCCCC(=O)OC 7a_100011995695_100009816466 [0,2,0,0,0,0|1,0,0]=3 17383 B16R0.2496 CCCC(C)(C)OCCCCCCC(=O)OC 7a_100000748436_100009815986 [0,2,0,0,0,0|1,0,0]=3 17384 B16R0.2496 CCNC(C)(C)COCCCCCC(=O)OC 7a_100000747347_100009816466 [0,2,0,0,0,0|2,0,0]=4 17385 B16R0.2496 COC(=O)CCCCCCNC(C)(C)CSC 2230a_100000759623_100009815986 [0,2,0,0,0,0|2,0,0]=4 17386 B16R0.2496 COC(=O)CCCCCCNC(C)(C)CSC 7a_100000759623_100009815986 [0,2,0,0,0,0|2,0,0]=4 17387 B16R0.2496 COC(=O)CCCCCCOC(C)(C)CCBr 7a_100000702414_100009815986 [0,2,0,0,0,0|2,0,0]=4 17388 B16R0.2496 COCC(C)(C)CNCCCCCC(=O)OC 2230a_100000734190_100009816466 [0,2,0,0,0,0|2,0,0]=4 17389 B16R0.2496 COCC(C)(C)NCCCCCCC(=O)OC 2230a_100000752728_100009815986 [0,2,0,0,0,0|2,0,0]=4 17390 B16R0.3227 CCCC(C)CCCOC[C@H](O)CC(=O)OC 34a_100011713154_100000754131 [0,2,0,0,0,0|1,0,0]=3 17391 B16R0.3227 CCCC(C)CCCOC[C@H](O)CC(=O)OC 7a_100011713154_100000754131 [0,2,0,0,0,0|1,0,0]=3 17392 B16R0.5780 CCCC(C)CCOCC(=O)CCC(=O)OC 34a_100011217855_100000691467 [0,2,0,0,0,0|1,0,1]=4 17393 B16R0.5780 CCCC(C)CCOCC(=O)CCC(=O)OC 7a_100011217855_100000691467 [0,2,0,0,0,0|1,0,1]=4 17394 B16R0.5780 CCC[C@H](N)CCOCC(=O)CCC(=O)OC 34a_100015193777_100000691467 [0,2,0,0,0,0|1,0,1]=4 17395 B16R0.1709 CCCCCCCNS(=O)(=O)CCC(=O)OC 270084a_100000229938_100000205946 [0,2,0,0,0,0|2,0,0]=4 17396 B16R0.1709 CCCCCCCNS(=O)(=O)CCC(=O)OC 274078a_100000229938_100000205946 [0,2,0,0,0,0|2,0,0]=4 17397 B16R0.3180 CCCCCCCCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000210759 [0,2,0,0,0,0|0,0,1]=3 17398 B16R0.3180 CCCCCCCCC(=O)N(C)CC(=O)OC 11a_100000198492_100000210188 [0,2,0,0,0,0|1,0,1]=4 17399 B16R0.3180 CCCCCCCCC(=O)N(C)CC(=O)OC 1626a_100000198492_100000210188 [0,2,0,0,0,0|1,0,1]=4 17400 B16R0.3180 CCCCCCCCC(=O)N(C)CC(=O)OC 240690a_100000198492_100000210188 [0,2,0,0,0,0|1,0,1]=4 17401 B16R0.3180 CCCCCCCCC(=O)N(C)CC(=O)OC 527a_100000198492_100000210188 [0,2,0,0,0,0|1,0,1]=4 17402 B16R0.3180 CCCCCCCCC(C)N(C)CC(=O)NC 270004a_100000189611_100011216694 [0,2,0,0,0,0|2,0,0]=4 17403 B16R0.3180 CCCCCCCCC(C)N(C)CC(=O)OC 270004a_100000198492_100011216694 [0,2,0,0,0,0|1,0,0]=3 17404 B16R0.3180 CCCCCCCCC(O)C(=O)CC(=O)CC 1458a_200011995895_100000747405 [0,2,0,0,0,0|1,0,1]=4 17405 B16R0.3180 CCCCCCCCC(O)C(=O)CC(=O)NC 1458a_200011995895_100000183359 [0,2,0,0,0,0|1,0,1]=4 17406 B16R0.3180 CCCCCCCCC(O)C(=O)CC(=O)OC 1458a_200011995895_100000747449 [0,2,0,0,0,0|0,0,1]=3 17407 B16R0.3180 CCCCCCCCN(C)C(=O)CC(=O)OC 240690a_100000207567_100000211351 [0,2,0,0,0,0|1,0,1]=4 17408 B16R0.3180 CCCCCCCCN(C)C(C)CC(=O)NC 2230a_100015186911_100000210759 [0,2,0,0,0,0|2,0,0]=4 17409 B16R0.3180 CCCCCCCCN(C)C(C)CC(=O)NC 269982a_100015186911_100000210759 [0,2,0,0,0,0|2,0,0]=4 17410 B16R0.3180 CCCCCCCCN(C)C(C)CC(=O)OC 2230a_100000207567_100009817358 [0,2,0,0,0,0|1,0,0]=3 17411 B16R0.3180 CCCCCCCCN(C)C(C)CC(=O)OC 269982a_100000207567_100009817358 [0,2,0,0,0,0|1,0,0]=3 17412 B16R0.3180 CCCCCCCNC(=O)C(C)CC(=O)OC 1626a_100000229938_100000037256 [0,2,0,0,0,0|1,0,1]=4 17413 B16R0.3180 CCCCCCCNC(=O)C(C)CC(=O)OC 240690a_100000229938_100000037256 [0,2,0,0,0,0|1,0,1]=4 17414 B16R0.3180 CCCCCCCNC(=O)C(C)CC(=O)OC 527a_100000229938_100000037256 [0,2,0,0,0,0|1,0,1]=4 17415 B16R0.3180 CCCCCCCSC(C)C(=O)CC(=O)OC 62a_100000210614_100009997173 [0,2,0,0,0,0|1,0,1]=4 17416 B16R0.3180 CCCCCCCSC(C)C(=O)CC(=O)OC 62a_100009997173_100000210316 [0,2,0,0,0,0|1,0,1]=4 17417 B16R0.3180 COC(=O)CC(C)C(=O)CCCCCCCO 1458a_100000037256_100000760002 [0,2,0,0,0,0|1,0,1]=4 17418 B16R0.3180 COCCCCCCC(=O)C(C)CC(=O)OC 1458a_100000037256_100011998445 [0,2,0,0,0,0|1,0,1]=4 17419 B16R0.6404 CCCCCCCCC(CC)NCC(=O)NC 270004a_100000693194_200011217995 [0,2,0,0,0,0|2,0,0]=4 17420 B16R0.6404 CCCCCCCCC(CC)OCC(=O)CC 7a_200011216270_100000747405 [0,2,0,0,0,0|2,0,0]=4 17421 B16R0.6404 CCCCCCCCC(CC)OCC(=O)NC 34a_200011216270_100000183359 [0,2,0,0,0,0|2,0,0]=4 17422 B16R0.6404 CCCCCCCCC(CC)OCC(=O)NC 7a_200011216270_100000183359 [0,2,0,0,0,0|2,0,0]=4 17423 B16R0.6404 CCCCCCCCC(CC)OCC(=O)OC 34a_200011216270_100000747449 [0,2,0,0,0,0|1,0,0]=3 17424 B16R0.6404 CCCCCCCCC(CC)OCC(=O)OC 7a_200011216270_100000747449 [0,2,0,0,0,0|1,0,0]=3 17425 B16R0.6404 CCCCCCCCN(CC)CCC(=O)OC 2230a_100000229097_100000210759 [0,2,0,0,0,0|1,0,0]=3 17426 B16R0.6404 CCCCCCCCN(CC)CCC(=O)OC 269982a_100000229097_100000210759 [0,2,0,0,0,0|1,0,0]=3 17427 B16R0.6404 CCN(CCCCCCCO)CCC(=O)OC 2230a_100000229097_100000760002 [0,2,0,0,0,0|2,0,0]=4 17428 B16R0.6404 CCN(CCCCCCCO)CCC(=O)OC 269982a_100000229097_100000760002 [0,2,0,0,0,0|2,0,0]=4 17429 B16R0.6404 CCN(CCCCCCOC)CCC(=O)OC 2230a_100000229097_100011998445 [0,2,0,0,0,0|2,0,0]=4 17430 B16R0.6404 CCN(CCCCCCOC)CCC(=O)OC 269982a_100000229097_100011998445 [0,2,0,0,0,0|2,0,0]=4 17431 B16R0.1194 CCCCCCCCO[C@@H](CC)CC(=O)OC 7a_200015357724_100000210759 [0,2,0,0,0,0|1,0,0]=3 17432 B16R0.1194 CCCCCCCCO[C@@H](CCl)CC(=O)OC 7a_100000754131_100000210759 [0,2,0,0,0,0|1,0,0]=3 17433 B16R0.1194 CC[C@@H](CC(=O)OC)OCCCCCCCO 7a_200015357724_100000760002 [0,2,0,0,0,0|2,0,0]=4 17434 B16R0.1194 CC[C@@H](CC(=O)OC)OCCCCCCOC 7a_200015357724_100011998445 [0,2,0,0,0,0|2,0,0]=4 17435 B16R0.1194 COC(=O)C[C@H](CCl)OCCCCCCCO 7a_100000754131_100000760002 [0,2,0,0,0,0|2,0,0]=4 17436 B16R0.1194 COCCCCCCO[C@@H](CCl)CC(=O)OC 7a_100000754131_100011998445 [0,2,0,0,0,0|2,0,0]=4 17437 B16R0.11498 CCCCCCCCNS(=O)(=O)CC(=O)OC 270084a_100000229939_100000736875 [0,2,0,0,0,0|2,0,0]=4 17438 B16R0.11498 CCCCCCCCNS(=O)(=O)CC(=O)OC 274078a_100000229939_100000736875 [0,2,0,0,0,0|2,0,0]=4 17439 B16R0.11498 CCCCCCCCOC(C)(C)CC(=O)OC 7a_100015205050_100000210759 [0,2,0,0,0,0|1,0,0]=3 17440 B16R0.11498 COC(=O)CC(C)(C)OCCCCCCCO 7a_100015205050_100000760002 [0,2,0,0,0,0|2,0,0]=4 17441 B16R0.11498 COCCCCCCOC(C)(C)CC(=O)OC 7a_100015205050_100011998445 [0,2,0,0,0,0|2,0,0]=4 17442 B14R1.26 CCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210681 [1,0,0,1,0,0|2,0,0]=4 17443 B14R1.26 CCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210681 [1,0,0,1,0,0|2,0,0]=4 17444 B14R1.26 CCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210314 [1,0,0,1,0,0|2,0,0]=4 17445 B14R1.26 CCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210314 [1,0,0,1,0,0|2,0,0]=4 17446 B14R1.26 CCCCCCOC1C=C(CCC1)C 34a_100011218613_100000210314 [1,0,0,1,0,0|2,0,0]=4 17447 B14R1.26 CCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210314 [1,0,0,1,0,0|1,0,0]=3 17448 B14R1.26 CCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210314 [1,0,0,1,0,0|2,0,0]=4 17449 B14R1.26 CCCCCOCC1CCCC(=O)N1 34a_200000102386_100000718602 [1,0,0,1,0,0|2,0,0]=4 17450 B14R1.26 CCCCCOCC1CCNC(=O)C1 34a_100009886756_100000718602 [1,0,0,1,0,0|2,0,0]=4 17451 B14R1.26 CCCCOCOC1CCCC(=O)C1 34a_100012613340_100011995733 [1,0,0,1,0,0|2,0,0]=4 17452 B14R1.26 CCCOCCOC1CCCC(=O)C1 34a_100012613340_100011215938 [1,0,0,1,0,0|2,0,0]=4 17453 B14R1.26 CCOCCCOC1CCCC(=O)C1 34a_100012613340_100012232248 [1,0,0,1,0,0|2,0,0]=4 17454 B14R1.26 COCCCCOC1CCCC(=O)C1 34a_100012613340_100000755781 [1,0,0,1,0,0|2,0,0]=4 17455 B14R1.26 O=C1CCCC(C1)OCCCCCF 34a_100012613340_100000729378 [1,0,0,1,0,0|2,0,0]=4 17456 B14R1.26 O=C1CCCC(C1)OCCCCCO 34a_100012613340_100000746330 [1,0,0,1,0,0|2,0,0]=4 17457 B14R1.96 C=C(C)CCOC1CCCCC1CC 34a_100000210738_100000730704 [1,0,0,1,0,0|2,0,0]=4 17458 B14R1.96 C=C(C)CCOC1CCCCC1CC 7a_100000210738_100000730704 [1,0,0,1,0,0|2,0,0]=4 17459 B14R1.96 CC(=O)CCCN1CCCCC1CO 269982a_100000210821_100011215641 [1,0,0,1,0,0|2,0,0]=4 17460 B14R1.96 CC(=O)CCCN1CCCCC1CO 34a_100000210821_100000685027 [1,0,0,1,0,0|2,0,0]=4 17461 B14R1.96 CCC1CCCCC1NCCC(=O)N 269862a_100000740010_100000757040 [1,0,0,1,0,0|2,0,0]=4 17462 B14R1.96 CCC1CCCCC1OCCC(=O)C 7a_100000210738_100000053229 [1,0,0,1,0,0|1,0,0]=3 17463 B14R1.96 CCC1CCCCC1OCCC(=O)N 34a_100000210738_100000731001 [1,0,0,1,0,0|2,0,0]=4 17464 B14R1.96 CCC1CCCCC1OCCC(=O)N 7a_100000210738_100000744528 [1,0,0,1,0,0|2,0,0]=4 17465 B14R1.96 CCC1CCCCC1OCOC(=O)C 34a_100000210738_100009813279 [1,0,0,1,0,0|2,0,0]=4 17466 B14R1.96 CCC1CCCCN1CCCC(=O)C 269982a_100000210034_100011215641 [1,0,0,1,0,0|1,0,0]=3 17467 B14R1.96 CCC1CCCCN1CCCC(=O)C 34a_100000210034_100000685027 [1,0,0,1,0,0|1,0,0]=3 17468 B14R1.96 CCC1CCCCN1CCCC(=O)N 269982a_100000210034_100102525003 [1,0,0,1,0,0|2,0,0]=4 17469 B14R1.96 CCC1CCCCN1CCCC(=O)N 34a_100000210034_100102525003 [1,0,0,1,0,0|2,0,0]=4 17470 B14R1.96 CCC1CCCCN1CCNC(=O)C 11a_100000755458_100015343762 [1,0,0,1,0,0|2,0,0]=4 17471 B14R1.96 CCC1CCCCN1CCNC(=O)C 1626a_100000755458_100015343762 [1,0,0,1,0,0|2,0,0]=4 17472 B14R1.96 CCC1CCCCN1CCNC(=O)C 2230a_100000210034_100000189650 [1,0,0,1,0,0|2,0,0]=4 17473 B14R1.96 CCC1CCCCN1CCNC(=O)C 240690a_100000755458_100015343762 [1,0,0,1,0,0|2,0,0]=4 17474 B14R1.96 CCC1CCCCN1CCNC(=O)C 269982a_100000210034_100000189650 [1,0,0,1,0,0|2,0,0]=4 17475 B14R1.96 CCC1CCCCN1CCNC(=O)C 527a_100000755458_100103153847 [1,0,0,1,0,0|2,0,0]=4 17476 B14R1.96 CCC1CCCCN1CCOC(=O)C 269982a_100000210034_100009814007 [1,0,0,1,0,0|2,0,0]=4 17477 B14R1.96 CCC1CCCCN1CCOC(=O)C 34a_100000210034_100009814007 [1,0,0,1,0,0|2,0,0]=4 17478 B14R1.96 CCN1CCCCC1CCNC(=O)C 2230a_200011221479_100000210202 [1,0,0,1,0,0|2,0,0]=4 17479 B14R1.96 CCN1CCCCC1CCNC(=O)C 269982a_200011221479_100000204670 [1,0,0,1,0,0|2,0,0]=4 17480 B14R1.96 CCN1CCCCC1CCNC(=O)C 34a_200011221479_100000210202 [1,0,0,1,0,0|2,0,0]=4 17481 B14R1.96 CC[C@H]1COCCN1CCCC(=O)C 269982a_100016988097_100011215641 [1,0,0,1,0,0|2,0,0]=4 17482 B14R1.96 CC[C@H]1COCCN1CCCC(=O)C 34a_100016988097_100000685027 [1,0,0,1,0,0|2,0,0]=4 17483 B14R1.96 CO[C@H]1CCCC[C@@H]1OCCC(=O)C 7a_200009815850_100000053229 [1,0,0,1,0,0|2,0,0]=4 17484 B14R1.108 CC(=O)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100000735457 [1,0,0,1,0,0|2,0,0]=4 17485 B14R1.108 CC(=O)CCCCN1CCC[C@@H]1CO 34a_100000745186_100009817362 [1,0,0,1,0,0|2,0,0]=4 17486 B14R1.108 CCC1CCCC1NCCCC(=O)N 269862a_100000739312_100000749056 [1,0,0,1,0,0|2,0,0]=4 17487 B14R1.108 CCC1CCCC1NCCCS(=O)C 270004a_200000753449_100000749056 [1,0,0,1,0,0|2,0,0]=4 17488 B14R1.108 CCC1CCCC1NCCNC(=O)C 269862a_100000209853_100000749056 [1,0,0,1,0,0|2,0,0]=4 17489 B14R1.108 CCC1CCCC1NCCSC(=O)C 269862a_100020647217_100000749056 [1,0,0,1,0,0|2,0,0]=4 17490 B14R1.108 CCC1CCCN1CCCCC(=O)C 269982a_100000754278_100000735457 [1,0,0,1,0,0|1,0,0]=3 17491 B14R1.108 CCC1CCCN1CCCCC(=O)C 34a_100000754278_100009817362 [1,0,0,1,0,0|1,0,0]=3 17492 B14R1.108 CCC1CCCN1CCCOC(=O)C 269982a_100000754278_100000042594 [1,0,0,1,0,0|2,0,0]=4 17493 B14R1.108 CCC1CCCN1CCCOC(=O)C 34a_100000754278_100000042594 [1,0,0,1,0,0|2,0,0]=4 17494 B14R1.108 CCC1CCCN1CCCSC(=O)C 2230a_100000754278_100000038929 [1,0,0,1,0,0|2,0,0]=4 17495 B14R1.108 CCC1CCCN1CCCSC(=O)C 269982a_100000754278_100000038929 [1,0,0,1,0,0|2,0,0]=4 17496 B14R1.108 CCC1CCCN1CCCSC(=O)C 34a_100000754278_100000038929 [1,0,0,1,0,0|2,0,0]=4 17497 B14R1.108 CCN1CCC[C@@H]1COCCC(=O)C 7a_100011739246_100000053229 [1,0,0,1,0,0|2,0,0]=4 17498 B14R1.122 CCCCCCCCN1CNC(=O)C1 2230a_200000708111_100000210759 [1,0,0,1,0,0|2,0,0]=4 17499 B14R1.122 CCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210681 [1,0,0,1,0,0|2,0,0]=4 17500 B14R1.122 CCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210614 [1,0,0,1,0,0|1,0,0]=3 17501 B14R1.122 CCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210614 [1,0,0,1,0,0|2,0,0]=4 17502 B14R1.122 CCCCCCCOC1COC(=O)O1 34a_100000210272_100000032252 [1,0,0,1,0,0|2,0,0]=4 17503 B14R1.122 CCCCCCCSC1COC(=O)O1 62a_100000210614_100000032252 [1,0,0,1,0,0|2,0,0]=4 17504 B14R1.122 CCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210314 [1,0,0,1,0,0|2,0,0]=4 17505 B14R1.122 CCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210314 [1,0,0,1,0,0|2,0,0]=4 17506 B14R1.122 CCCCCCNCC1CNC(=O)O1 2230a_100000210581_100000181169 [1,0,0,1,0,0|2,0,0]=4 17507 B14R1.122 CCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000210581_100015189358 [1,0,0,1,0,0|2,0,0]=4 17508 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210314 [1,0,0,1,0,0|2,0,0]=4 17509 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210314 [1,0,0,1,0,0|2,0,0]=4 17510 B14R1.122 CCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210314 [1,0,0,1,0,0|2,0,0]=4 17511 B14R1.122 CCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210314 [1,0,0,1,0,0|2,0,0]=4 17512 B14R1.122 CCCCCCOCC1CNC(=O)O1 34a_100000210259_100000181169 [1,0,0,1,0,0|2,0,0]=4 17513 B14R1.122 CCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210314 [1,0,0,1,0,0|2,0,0]=4 17514 B14R1.122 CCCCCCOCC1CNC(=O)O1 7a_100000210259_100000181169 [1,0,0,1,0,0|2,0,0]=4 17515 B14R1.122 CCCCCCOCC1COC(=O)O1 34a_100000210259_100000073702 [1,0,0,1,0,0|2,0,0]=4 17516 B14R1.122 CCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210259_100015189358 [1,0,0,1,0,0|2,0,0]=4 17517 B14R1.122 CCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210757 [1,0,0,1,0,0|2,0,0]=4 17518 B14R1.122 CCCCCCSCC1CNC(=O)O1 62a_100000210314_100000181169 [1,0,0,1,0,0|2,0,0]=4 17519 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000073702_100000210757 [1,0,0,1,0,0|2,0,0]=4 17520 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000210314_100000073702 [1,0,0,1,0,0|2,0,0]=4 17521 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210314_100015189358 [1,0,0,1,0,0|2,0,0]=4 17522 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210757 [1,0,0,1,0,0|2,0,0]=4 17523 B14R1.122 CCCCOCCOC1CCC(=O)C1 34a_100012614533_100000743108 [1,0,0,1,0,0|2,0,0]=4 17524 B14R1.122 O=C1CCC(C1)OCCCCCCF 34a_100012614533_100015922095 [1,0,0,1,0,0|2,0,0]=4 17525 B14R1.122 O=C1CCC(C1)OCCCCCCO 34a_100012614533_100000766143 [1,0,0,1,0,0|2,0,0]=4 17526 B14R1.159 CC(=O)CCCCN1CCCCC1C 269982a_100000211376_100000735457 [1,0,0,1,0,0|1,0,0]=3 17527 B14R1.159 CC(=O)CCCCN1CCCCC1C 34a_100000211376_100009817362 [1,0,0,1,0,0|1,0,0]=3 17528 B14R1.159 CC(=O)CCCCN1CCOC[C@@H]1C 269982a_100009815349_100000735457 [1,0,0,1,0,0|2,0,0]=4 17529 B14R1.159 CC(=O)CCCCN1CCOC[C@@H]1C 34a_100009815349_100009817362 [1,0,0,1,0,0|2,0,0]=4 17530 B14R1.159 CC(=O)CCCNC1CCCCC1C 34a_100000211402_100000685027 [1,0,0,1,0,0|1,0,0]=3 17531 B14R1.159 CC(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000685027 [1,0,0,1,0,0|2,0,0]=4 17532 B14R1.159 CC(=O)CCCOC1CCCCC1C 34a_100000211207_100000685027 [1,0,0,1,0,0|1,0,0]=3 17533 B14R1.159 CC(=O)CCCOC1CCCCC1C 7a_100000211207_100011215641 [1,0,0,1,0,0|1,0,0]=3 17534 B14R1.159 CC(=O)CCCOC1CCCCC1Cl 34a_100000038908_100000685027 [1,0,0,1,0,0|2,0,0]=4 17535 B14R1.159 CC(=O)CCCOC1CCCCC1Cl 7a_100000038908_100011215641 [1,0,0,1,0,0|2,0,0]=4 17536 B14R1.159 CC(=O)CCCOC1CCCCC1F 34a_100000759063_100015423560 [1,0,0,1,0,0|2,0,0]=4 17537 B14R1.159 CC(=O)CCCOC1CCCCC1O 34a_100000759063_100000038908 [1,0,0,1,0,0|2,0,0]=4 17538 B14R1.159 CC(=O)CCCOC1CCNCC1C 34a_100011998114_100000685027 [1,0,0,1,0,0|2,0,0]=4 17539 B14R1.159 CC(=O)CCCOC1CNCCC1C 34a_100000696640_100000685027 [1,0,0,1,0,0|2,0,0]=4 17540 B14R1.159 CC(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000685027 [1,0,0,1,0,0|2,0,0]=4 17541 B14R1.159 CC(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215641 [1,0,0,1,0,0|2,0,0]=4 17542 B14R1.159 CC(=O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000685027 [1,0,0,1,0,0|2,0,0]=4 17543 B14R1.159 CC(=O)CCCSC1CCCCC1F 62a_100011215641_100015423560 [1,0,0,1,0,0|2,0,0]=4 17544 B14R1.159 CC(=O)CCCSC1CCCCC1F 62a_100015423560_100011215641 [1,0,0,1,0,0|2,0,0]=4 17545 B14R1.159 CC(=O)CCCSC1CCCCC1O 62a_100000038908_100011215641 [1,0,0,1,0,0|2,0,0]=4 17546 B14R1.159 CC(=O)CCCSC1CCCCC1O 62a_100011215641_100000038908 [1,0,0,1,0,0|2,0,0]=4 17547 B14R1.159 CC(=O)CCOCC1CCCCN1C 34a_100000759926_100015186950 [1,0,0,1,0,0|2,0,0]=4 17548 B14R1.159 CC(=O)CCOCC1CCCCN1C 7a_100000759926_100015185383 [1,0,0,1,0,0|2,0,0]=4 17549 B14R1.159 CC(=O)CCSCC1CCCCN1C 62a_100000053229_100015185383 [1,0,0,1,0,0|2,0,0]=4 17550 B14R1.159 CC(=O)CCSCC1CCCCN1C 62a_100015185383_100000053229 [1,0,0,1,0,0|2,0,0]=4 17551 B14R1.159 CC(=O)COCCC1CCCCN1C 34a_100000211253_100000211948 [1,0,0,1,0,0|2,0,0]=4 17552 B14R1.159 CC(=O)NCCCN1CCCCC1C 240690a_100000212276_100015343762 [1,0,0,1,0,0|2,0,0]=4 17553 B14R1.159 CC(=O)NCCCN1CCCCC1C 527a_100000212276_100103153847 [1,0,0,1,0,0|2,0,0]=4 17554 B14R1.159 CC(=O)NCCNC1CCCCC1C 2230a_100000211402_100000189650 [1,0,0,1,0,0|2,0,0]=4 17555 B14R1.159 CC(=O)NCCNC1CCCCC1C 269862a_100000209853_100000210921 [1,0,0,1,0,0|2,0,0]=4 17556 B14R1.159 CC(=O)NCCOC1CCCCC1C 7a_100000211207_100000189650 [1,0,0,1,0,0|2,0,0]=4 17557 B14R1.159 CC(=O)OCCCN1CCCCC1C 269982a_100000211376_100000042594 [1,0,0,1,0,0|2,0,0]=4 17558 B14R1.159 CC(=O)OCCCN1CCCCC1C 34a_100000211376_100000042594 [1,0,0,1,0,0|2,0,0]=4 17559 B14R1.159 CC(=O)OCCNC1CCCCC1C 34a_100000211402_100009814007 [1,0,0,1,0,0|2,0,0]=4 17560 B14R1.159 CC(=O)OCCOC1CCCCC1C 34a_100000211207_100009814007 [1,0,0,1,0,0|2,0,0]=4 17561 B14R1.159 CC(=O)OCCOC1CCCCC1C 7a_100000211207_100009814007 [1,0,0,1,0,0|2,0,0]=4 17562 B14R1.159 CC(=O)SCCCN1CCCCC1C 2230a_100000211376_100000038929 [1,0,0,1,0,0|2,0,0]=4 17563 B14R1.159 CC(=O)SCCCN1CCCCC1C 269982a_100000211376_100000038929 [1,0,0,1,0,0|2,0,0]=4 17564 B14R1.159 CC(=O)SCCCN1CCCCC1C 34a_100000211376_100000038929 [1,0,0,1,0,0|2,0,0]=4 17565 B14R1.159 CC(=O)SCCNC1CCCCC1C 269862a_100020647217_100000210921 [1,0,0,1,0,0|2,0,0]=4 17566 B14R1.159 CC1CCCCC1NCCCC(=O)N 269862a_100000739312_100000210921 [1,0,0,1,0,0|2,0,0]=4 17567 B14R1.159 CC1CCCCC1NCCCC(=O)N 34a_100000211402_100102525003 [1,0,0,1,0,0|2,0,0]=4 17568 B14R1.159 CC1CCCCC1NCCCS(=O)C 270004a_200000753449_100000210921 [1,0,0,1,0,0|2,0,0]=4 17569 B14R1.159 CC1CCCCC1OCCCC(=O)N 34a_100000211207_100102525003 [1,0,0,1,0,0|2,0,0]=4 17570 B14R1.159 CC1CCCCC1OCCCC(=O)N 7a_100000211207_100102525003 [1,0,0,1,0,0|2,0,0]=4 17571 B14R1.159 CN1CCCCC1CCNCC(=O)O 269956a_100016091260_100000211948 [1,0,0,1,0,0|2,0,0]=4 17572 B14R1.168 CC(=O)CCCCOC1CCCC1C 34a_100011216460_100009817362 [1,0,0,1,0,0|1,0,0]=3 17573 B14R1.168 CC(=O)CCCCOC1CCCC1C 7a_100011216460_100000735457 [1,0,0,1,0,0|1,0,0]=3 17574 B14R1.168 CC(=O)CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009817362 [1,0,0,1,0,0|2,0,0]=4 17575 B14R1.168 CC(=O)CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009817362 [1,0,0,1,0,0|2,0,0]=4 17576 B14R1.168 CC(=O)CCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009817362 [1,0,0,1,0,0|2,0,0]=4 17577 B14R1.168 CC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_100000735457_200016002552 [1,0,0,1,0,0|2,0,0]=4 17578 B14R1.168 CC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000735457 [1,0,0,1,0,0|2,0,0]=4 17579 B14R1.168 CC(=O)CCCOCC1CCCN1C 34a_100000743107_100000685027 [1,0,0,1,0,0|2,0,0]=4 17580 B14R1.168 CC(=O)CCOCCC1CCCN1C 34a_100000759926_100000005710 [1,0,0,1,0,0|2,0,0]=4 17581 B14R1.168 CC(=O)CCOCCC1CCCN1C 7a_100000759926_100000005710 [1,0,0,1,0,0|2,0,0]=4 17582 B14R1.168 CC(=O)CCOCCC1CCCN1C 7a_100011215177_100000053229 [1,0,0,1,0,0|2,0,0]=4 17583 B14R1.168 CC(=O)CCSCCC1CCCN1C 62a_100000005710_100000053229 [1,0,0,1,0,0|2,0,0]=4 17584 B14R1.168 CC(=O)CCSCCC1CCCN1C 62a_100000053229_100000005710 [1,0,0,1,0,0|2,0,0]=4 17585 B14R1.168 CC(=O)NCCCNC1CCCC1C 269862a_100000736810_100000752053 [1,0,0,1,0,0|2,0,0]=4 17586 B14R1.168 CC(=O)OCCCCN1CCC[C@@H]1C 269982a_100020605311_100000033659 [1,0,0,1,0,0|2,0,0]=4 17587 B14R1.168 CC(=O)OCCCCN1CCC[C@H]1C 269982a_100015189458_100000033659 [1,0,0,1,0,0|2,0,0]=4 17588 B14R1.168 CC(=O)OCCCCN1CCC[C@H]1C 34a_100015189458_100000033659 [1,0,0,1,0,0|2,0,0]=4 17589 B14R1.168 CC(=O)OCCCOC1CCCC1C 34a_100011216460_100000042594 [1,0,0,1,0,0|2,0,0]=4 17590 B14R1.168 CC(=O)OCCCOC1CCCC1C 7a_100011216460_100000042594 [1,0,0,1,0,0|2,0,0]=4 17591 B14R1.168 CC(=O)SCCCCN1CCC[C@@H]1C 2230a_100020605311_200010402107 [1,0,0,1,0,0|2,0,0]=4 17592 B14R1.168 CC(=O)SCCCCN1CCC[C@@H]1C 269982a_100020605311_200010402107 [1,0,0,1,0,0|2,0,0]=4 17593 B14R1.168 CC(=O)SCCCCN1CCC[C@H]1C 2230a_100015189458_200010402107 [1,0,0,1,0,0|2,0,0]=4 17594 B14R1.168 CC(=O)SCCCCN1CCC[C@H]1C 269982a_100015189458_200010402107 [1,0,0,1,0,0|2,0,0]=4 17595 B14R1.168 CC(=O)SCCCCN1CCC[C@H]1C 34a_100015189458_200010402107 [1,0,0,1,0,0|2,0,0]=4 17596 B14R1.168 CC(=O)SCCCOC1CCCC1C 34a_100011216460_100000038929 [1,0,0,1,0,0|2,0,0]=4 17597 B14R1.168 CC(=O)SCCCOC1CCCC1C 7a_100011216460_100000038929 [1,0,0,1,0,0|2,0,0]=4 17598 B14R1.168 CC1CCCC1NCCCCC(=O)N 269862a_100000696515_100000752053 [1,0,0,1,0,0|2,0,0]=4 17599 B14R1.168 C[C@@H]1CCCN1CCCCCC(=O)N 2230a_100015189458_100009817443 [1,0,0,1,0,0|2,0,0]=4 17600 B14R1.168 C[C@@H]1CCCN1CCCCCC(=O)N 269982a_100015189458_100009817443 [1,0,0,1,0,0|2,0,0]=4 17601 B14R1.168 C[C@@H]1CCCN1CCCCCC(=O)N 34a_100015189458_100009817443 [1,0,0,1,0,0|2,0,0]=4 17602 B14R1.168 C[C@H]1CCCN1CCCCCC(=O)N 2230a_100020605311_100009817443 [1,0,0,1,0,0|2,0,0]=4 17603 B14R1.168 C[C@H]1CCCN1CCCCCC(=O)N 269982a_100020605311_100009817443 [1,0,0,1,0,0|2,0,0]=4 17604 B14R1.233 CCCCCCC1CCCC1N(C)C 270004a_100102631434_100000189428 [1,0,0,1,0,0|2,0,0]=4 17605 B14R1.233 CCCCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210314 [1,0,0,1,0,0|2,0,0]=4 17606 B14R1.233 CCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210757 [1,0,0,1,0,0|1,0,0]=3 17607 B14R1.233 CCCCCCN1CCSC1C(=O)O 269956a_100000035718_100000210757 [1,0,0,1,0,0|2,0,0]=4 17608 B14R1.233 CCCCCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210757 [1,0,0,1,0,0|2,0,0]=4 17609 B14R1.233 CCCCOCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011995733 [1,0,0,1,0,0|2,0,0]=4 17610 B14R1.233 CCCCOC[C@H]1CCCN1C(=O)C 34a_100012242843_100000210210 [1,0,0,1,0,0|2,0,0]=4 17611 B14R1.233 CCCCOC[C@H]1CCCN1C(=O)C 7a_100012242843_100000210211 [1,0,0,1,0,0|2,0,0]=4 17612 B14R1.233 CCCOCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011215938 [1,0,0,1,0,0|2,0,0]=4 17613 B14R1.233 CCOCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100012232248 [1,0,0,1,0,0|2,0,0]=4 17614 B14R1.233 COCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000730899 [1,0,0,1,0,0|2,0,0]=4 17615 B14R1.233 O=C(O)[C@@H]1CCCN1CCCCCF 269956a_100000743916_100000729378 [1,0,0,1,0,0|2,0,0]=4 17616 B14R1.233 O=C(O)[C@@H]1CCCN1CCCCCO 269956a_100000743916_100000746330 [1,0,0,1,0,0|2,0,0]=4 17617 B14R1.241 CC(=O)OCCCCOCC1CC1C 34a_100000744939_100000033659 [1,0,0,1,0,0|2,0,0]=4 17618 B14R1.241 CC(=O)OCCCCOCC1CC1C 7a_100000744939_100000033659 [1,0,0,1,0,0|2,0,0]=4 17619 B14R1.241 CC(=O)SCCCCOCC1CC1C 34a_100000744939_200010402107 [1,0,0,1,0,0|2,0,0]=4 17620 B14R1.241 CC(=O)SCCCCOCC1CC1C 7a_100000744939_200010402107 [1,0,0,1,0,0|2,0,0]=4 17621 B14R1.241 CC1CC1COCCCCCC(=O)N 34a_100000744939_100009817443 [1,0,0,1,0,0|2,0,0]=4 17622 B14R1.241 CC1CC1COCCCCCC(=O)N 7a_100000744939_100009817443 [1,0,0,1,0,0|2,0,0]=4 17623 B14R1.258 COCC1CCN1CCCCC(=O)C 269982a_100015195929_100000735457 [1,0,0,1,0,0|2,0,0]=4 17624 B14R1.258 COCC1CCN1CCCCC(=O)C 34a_100015195929_100009817362 [1,0,0,1,0,0|2,0,0]=4 17625 B14R1.325 CC(=O)OCCCCCN1CCC1C 269982a_100000755817_100000033007 [1,0,0,1,0,0|2,0,0]=4 17626 B14R1.325 CC(=O)OCCCCCN1CCC1C 34a_100000755817_100000033007 [1,0,0,1,0,0|2,0,0]=4 17627 B14R1.422 C=C(C)CCNCCC1CCCCC1 2230a_100000738074_100000730704 [1,0,0,1,0,0|2,0,0]=4 17628 B14R1.422 C=C(C)CCNCCC1CCCCC1 34a_100000738074_100000730704 [1,0,0,1,0,0|2,0,0]=4 17629 B14R1.422 C=C(C)CCOCCC1CCCCC1 34a_100000764851_100011209188 [1,0,0,1,0,0|2,0,0]=4 17630 B14R1.422 C=C(C)CCOCCC1CCCCC1 34a_100011217863_100000730704 [1,0,0,1,0,0|2,0,0]=4 17631 B14R1.422 C=C(C)CCOCCC1CCCCC1 7a_100011217863_100000730704 [1,0,0,1,0,0|2,0,0]=4 17632 B14R1.422 C=C(C)CCSCCC1CCCCC1 62a_100000730704_100012355289 [1,0,0,1,0,0|2,0,0]=4 17633 B14R1.422 C=C(C)CCSCCC1CCCCC1 62a_100012355289_100000730704 [1,0,0,1,0,0|2,0,0]=4 17634 B14R1.422 C=C(C)CNCCCC1CCCCC1 2230a_100011211642_100000748629 [1,0,0,1,0,0|2,0,0]=4 17635 B14R1.422 C=C(C)CNCCCC1CCCCC1 34a_100011211642_100000748629 [1,0,0,1,0,0|2,0,0]=4 17636 B14R1.422 C=C(C)COCCCC1CCCCC1 34a_100000198086_100000748629 [1,0,0,1,0,0|2,0,0]=4 17637 B14R1.422 C=C(C)COCCCC1CCCCC1 34a_100000210245_100011713725 [1,0,0,1,0,0|2,0,0]=4 17638 B14R1.422 C=C(C)COCCCC1CCCCC1 7a_100000198086_100000748629 [1,0,0,1,0,0|2,0,0]=4 17639 B14R1.422 C=C(C)CSCCCC1CCCCC1 62a_100000748629_100011713725 [1,0,0,1,0,0|2,0,0]=4 17640 B14R1.422 C=C(C)CSCCCC1CCCCC1 62a_100011713725_100000211660 [1,0,0,1,0,0|2,0,0]=4 17641 B14R1.422 CC(=O)CCCCCN1CCCCC1 1458a_100012051570_200000210301 [1,0,0,1,0,0|1,0,0]=3 17642 B14R1.422 CC(=O)CCCCCN1CCOCC1 1458a_100012051560_200000210301 [1,0,0,1,0,0|2,0,0]=4 17643 B14R1.422 CC(=O)CCCCNC1CCCCC1 34a_100000182618_100009817362 [1,0,0,1,0,0|1,0,0]=3 17644 B14R1.422 CC(=O)CCCCNC1CCCOC1 34a_100000719290_100009817362 [1,0,0,1,0,0|2,0,0]=4 17645 B14R1.422 CC(=O)CCCCNC1CCOCC1 34a_100000741149_100009817362 [1,0,0,1,0,0|2,0,0]=4 17646 B14R1.422 CC(=O)CCCCNC1CCSCC1 34a_100000748639_100009817362 [1,0,0,1,0,0|2,0,0]=4 17647 B14R1.422 CC(=O)CCCCOC1CCCCC1 34a_100000210231_100009817362 [1,0,0,1,0,0|1,0,0]=3 17648 B14R1.422 CC(=O)CCCCOC1CCCCC1 7a_100000210231_100000735457 [1,0,0,1,0,0|1,0,0]=3 17649 B14R1.422 CC(=O)CCCCOC1CCCCO1 1458a_100000070787_100000031530 [1,0,0,1,0,0|2,0,0]=4 17650 B14R1.422 CC(=O)CCCCOC1CCCCO1 34a_100000033831_100009817362 [1,0,0,1,0,0|2,0,0]=4 17651 B14R1.422 CC(=O)CCCCOC1CCCOC1 34a_100000754041_100009817362 [1,0,0,1,0,0|2,0,0]=4 17652 B14R1.422 CC(=O)CCCCOC1CCCSC1 7a_100015962668_100000735457 [1,0,0,1,0,0|2,0,0]=4 17653 B14R1.422 CC(=O)CCCCOC1CCOCC1 34a_100000744328_100009817362 [1,0,0,1,0,0|2,0,0]=4 17654 B14R1.422 CC(=O)CCCCOC1CCSCC1 34a_100000731022_100009817362 [1,0,0,1,0,0|2,0,0]=4 17655 B14R1.422 CC(=O)CCCCOC1CCSCC1 7a_100000731022_100000735457 [1,0,0,1,0,0|2,0,0]=4 17656 B14R1.422 CC(=O)CCCCSC1CCCCC1 62a_100000210327_100000735457 [1,0,0,1,0,0|1,0,0]=3 17657 B14R1.422 CC(=O)CCCCSC1CCCCC1 62a_100000735457_100000210327 [1,0,0,1,0,0|1,0,0]=3 17658 B14R1.422 CC(=O)CCCCSC1CCCOC1 62a_100000735457_100000693364 [1,0,0,1,0,0|2,0,0]=4 17659 B14R1.422 CC(=O)CCCCSC1CCOCC1 62a_100000735457_100011324220 [1,0,0,1,0,0|2,0,0]=4 17660 B14R1.422 CC(=O)CCCCSC1CCSCC1 62a_100000735457_100000069128 [1,0,0,1,0,0|2,0,0]=4 17661 B14R1.422 CC(=O)CCCNCC1CCCCC1 34a_100000210473_100000685027 [1,0,0,1,0,0|1,0,0]=3 17662 B14R1.422 CC(=O)CCCNCC1CCCCO1 34a_100000174945_100000685027 [1,0,0,1,0,0|2,0,0]=4 17663 B14R1.422 CC(=O)CCCNCC1CCCOC1 34a_100000720124_100000685027 [1,0,0,1,0,0|2,0,0]=4 17664 B14R1.422 CC(=O)CCCNCC1CCOCC1 34a_100000746373_100000685027 [1,0,0,1,0,0|2,0,0]=4 17665 B14R1.422 CC(=O)CCCNCC1CCSCC1 34a_100015188806_100000685027 [1,0,0,1,0,0|2,0,0]=4 17666 B14R1.422 CC(=O)CCCOCC1CCCCC1 34a_100000212181_100000685027 [1,0,0,1,0,0|1,0,0]=3 17667 B14R1.422 CC(=O)CCCOCC1CCCCC1 34a_100000759063_100000211423 [1,0,0,1,0,0|1,0,0]=3 17668 B14R1.422 CC(=O)CCCOCC1CCCCC1 7a_100000212181_100011215641 [1,0,0,1,0,0|1,0,0]=3 17669 B14R1.422 CC(=O)CCCOCC1CCCCC1 7a_100000759063_100000211423 [1,0,0,1,0,0|1,0,0]=3 17670 B14R1.422 CC(=O)CCCOCC1CCCCN1 34a_100000210821_100000685027 [1,0,0,1,0,0|2,0,0]=4 17671 B14R1.422 CC(=O)CCCOCC1CCCCO1 34a_100000211370_100000685027 [1,0,0,1,0,0|2,0,0]=4 17672 B14R1.422 CC(=O)CCCOCC1CCCCO1 34a_100000759063_100000211543 [1,0,0,1,0,0|2,0,0]=4 17673 B14R1.422 CC(=O)CCCOCC1CCCCO1 7a_100000211370_100011215641 [1,0,0,1,0,0|2,0,0]=4 17674 B14R1.422 CC(=O)CCCOCC1CCCCO1 7a_100000759063_100000211543 [1,0,0,1,0,0|2,0,0]=4 17675 B14R1.422 CC(=O)CCCOCC1CCCNC1 34a_100000211344_100000685027 [1,0,0,1,0,0|2,0,0]=4 17676 B14R1.422 CC(=O)CCCOCC1CCCOC1 34a_100000741520_100000685027 [1,0,0,1,0,0|2,0,0]=4 17677 B14R1.422 CC(=O)CCCOCC1CCCOC1 34a_100000759063_100000741521 [1,0,0,1,0,0|2,0,0]=4 17678 B14R1.422 CC(=O)CCCOCC1CCCOC1 7a_100000759063_100000741521 [1,0,0,1,0,0|2,0,0]=4 17679 B14R1.422 CC(=O)CCCOCC1CCNCC1 34a_100000738675_100000685027 [1,0,0,1,0,0|2,0,0]=4 17680 B14R1.422 CC(=O)CCCOCC1CCOCC1 34a_100000749013_100000685027 [1,0,0,1,0,0|2,0,0]=4 17681 B14R1.422 CC(=O)CCCOCC1CCOCC1 34a_100000759063_100000754603 [1,0,0,1,0,0|2,0,0]=4 17682 B14R1.422 CC(=O)CCCOCC1CCOCC1 7a_100000759063_100000754603 [1,0,0,1,0,0|2,0,0]=4 17683 B14R1.422 CC(=O)CCCOCC1CCSCC1 34a_100000070558_100000685027 [1,0,0,1,0,0|2,0,0]=4 17684 B14R1.422 CC(=O)CCCOCC1CCSCC1 7a_100000070558_100011215641 [1,0,0,1,0,0|2,0,0]=4 17685 B14R1.422 CC(=O)CCCSCC1CCCCC1 62a_100000211423_100011215641 [1,0,0,1,0,0|1,0,0]=3 17686 B14R1.422 CC(=O)CCCSCC1CCCCC1 62a_100011215641_100000211423 [1,0,0,1,0,0|1,0,0]=3 17687 B14R1.422 CC(=O)CCCSCC1CCCCO1 62a_100000211543_100011215641 [1,0,0,1,0,0|2,0,0]=4 17688 B14R1.422 CC(=O)CCCSCC1CCCCO1 62a_100011215641_100000211543 [1,0,0,1,0,0|2,0,0]=4 17689 B14R1.422 CC(=O)CCCSCC1CCCOC1 62a_100000741521_100011215641 [1,0,0,1,0,0|2,0,0]=4 17690 B14R1.422 CC(=O)CCCSCC1CCCOC1 62a_100011215641_100000741521 [1,0,0,1,0,0|2,0,0]=4 17691 B14R1.422 CC(=O)CCCSCC1CCOCC1 62a_100000754603_100011215641 [1,0,0,1,0,0|2,0,0]=4 17692 B14R1.422 CC(=O)CCCSCC1CCOCC1 62a_100011215641_100000749018 [1,0,0,1,0,0|2,0,0]=4 17693 B14R1.422 CC(=O)CCOCCC1CCCCC1 34a_100000759926_100011209188 [1,0,0,1,0,0|1,0,0]=3 17694 B14R1.422 CC(=O)CCOCCC1CCCCC1 7a_100000759926_100011273959 [1,0,0,1,0,0|1,0,0]=3 17695 B14R1.422 CC(=O)CCOCCC1CCCCC1 7a_100011217863_100000053229 [1,0,0,1,0,0|1,0,0]=3 17696 B14R1.422 CC(=O)CCOCCC1CCOCC1 34a_100000759926_100011934994 [1,0,0,1,0,0|2,0,0]=4 17697 B14R1.422 CC(=O)CCOCCC1CCOCC1 7a_100000759926_100011934994 [1,0,0,1,0,0|2,0,0]=4 17698 B14R1.422 CC(=O)CCOCCC1CCOCC1 7a_100011933979_100000053229 [1,0,0,1,0,0|2,0,0]=4 17699 B14R1.422 CC(=O)CCOCCN1CCCCC1 34a_100000759926_100000739454 [1,0,0,1,0,0|2,0,0]=4 17700 B14R1.422 CC(=O)CCOCCN1CCCCC1 7a_100000759926_100000739454 [1,0,0,1,0,0|2,0,0]=4 17701 B14R1.422 CC(=O)CCOCOC1CCCCC1 34a_100000759926_100011935260 [1,0,0,1,0,0|2,0,0]=4 17702 B14R1.422 CC(=O)CCOCOC1CCCCC1 7a_100000759926_100011935260 [1,0,0,1,0,0|2,0,0]=4 17703 B14R1.422 CC(=O)CCSCCC1CCCCC1 62a_100000053229_100012355289 [1,0,0,1,0,0|1,0,0]=3 17704 B14R1.422 CC(=O)CCSCCC1CCCCC1 62a_100012355289_100000053229 [1,0,0,1,0,0|1,0,0]=3 17705 B14R1.422 CC(=O)CCSCCC1CCOCC1 62a_100000053229_100011934994 [1,0,0,1,0,0|2,0,0]=4 17706 B14R1.422 CC(=O)CCSCCC1CCOCC1 62a_100011934994_100000053229 [1,0,0,1,0,0|2,0,0]=4 17707 B14R1.422 CC(=O)CCSCCN1CCCCC1 62a_100000053229_100000739454 [1,0,0,1,0,0|2,0,0]=4 17708 B14R1.422 CC(=O)CCSCCN1CCCCC1 62a_100000739454_100000053229 [1,0,0,1,0,0|2,0,0]=4 17709 B14R1.422 CC(=O)CCSCOC1CCCCC1 62a_100000053229_100011935260 [1,0,0,1,0,0|2,0,0]=4 17710 B14R1.422 CC(=O)CCSCOC1CCCCC1 62a_100011935260_100000053229 [1,0,0,1,0,0|2,0,0]=4 17711 B14R1.422 CC(=O)COCCCC1CCCCC1 34a_100000211253_100011713725 [1,0,0,1,0,0|1,0,0]=3 17712 B14R1.422 CC(=O)COCCCN1CCCCC1 34a_100000211253_100000690320 [1,0,0,1,0,0|2,0,0]=4 17713 B14R1.422 CC(=O)COCCOC1CCCCC1 34a_100000211253_100011211530 [1,0,0,1,0,0|2,0,0]=4 17714 B14R1.422 CC(=O)NCCCCN1CCCCC1 240690a_200011207366_100015343762 [1,0,0,1,0,0|2,0,0]=4 17715 B14R1.422 CC(=O)NCCCNC1CCCCC1 270004a_100000736810_100000210434 [1,0,0,1,0,0|2,0,0]=4 17716 B14R1.422 CC(=O)NCCCNC1CCCCC1 34a_100000736810_100000210327 [1,0,0,1,0,0|2,0,0]=4 17717 B14R1.422 CC(=O)NCCCOC1CCCCC1 11a_100000205933_100015343762 [1,0,0,1,0,0|2,0,0]=4 17718 B14R1.422 CC(=O)NCCCOC1CCCCC1 1626a_100000205933_100015343762 [1,0,0,1,0,0|2,0,0]=4 17719 B14R1.422 CC(=O)NCCCOC1CCCCC1 240690a_100000205933_100015343762 [1,0,0,1,0,0|2,0,0]=4 17720 B14R1.422 CC(=O)NCCCOC1CCCCC1 34a_100000752032_100000210327 [1,0,0,1,0,0|2,0,0]=4 17721 B14R1.422 CC(=O)NCCCOC1CCCCC1 527a_100000205933_100103153847 [1,0,0,1,0,0|2,0,0]=4 17722 B14R1.422 CC(=O)NCCNCC1CCCCC1 2230a_100000209853_100000211423 [1,0,0,1,0,0|2,0,0]=4 17723 B14R1.422 CC(=O)NCCNCC1CCCCC1 2230a_100000210473_100000189650 [1,0,0,1,0,0|2,0,0]=4 17724 B14R1.422 CC(=O)NCCNCC1CCCCC1 269862a_100000209853_100000211278 [1,0,0,1,0,0|2,0,0]=4 17725 B14R1.422 CC(=O)NCCOCC1CCCCC1 34a_100000158858_100000211423 [1,0,0,1,0,0|2,0,0]=4 17726 B14R1.422 CC(=O)NCCOCC1CCCCC1 7a_100000212181_100000189650 [1,0,0,1,0,0|2,0,0]=4 17727 B14R1.422 CC(=O)NCCSCC1CCCCC1 62a_100000189650_100000211423 [1,0,0,1,0,0|2,0,0]=4 17728 B14R1.422 CC(=O)NCCSCC1CCCCC1 62a_100000211423_100000189650 [1,0,0,1,0,0|2,0,0]=4 17729 B14R1.422 CC(=O)OCCCNC1CCCCC1 34a_100000182618_100000042594 [1,0,0,1,0,0|2,0,0]=4 17730 B14R1.422 CC(=O)OCCCOC1CCCCC1 34a_100000210231_100000042594 [1,0,0,1,0,0|2,0,0]=4 17731 B14R1.422 CC(=O)OCCCOC1CCCCC1 7a_100000210231_100000042594 [1,0,0,1,0,0|2,0,0]=4 17732 B14R1.422 CC(=O)OCCCSC1CCCCC1 62a_100000042594_100000210327 [1,0,0,1,0,0|2,0,0]=4 17733 B14R1.422 CC(=O)OCCCSC1CCCCC1 62a_100000210327_100000042594 [1,0,0,1,0,0|2,0,0]=4 17734 B14R1.422 CC(=O)OCCNCC1CCCCC1 34a_100000210473_100009814007 [1,0,0,1,0,0|2,0,0]=4 17735 B14R1.422 CC(=O)OCCOCC1CCCCC1 34a_100000212181_100009814007 [1,0,0,1,0,0|2,0,0]=4 17736 B14R1.422 CC(=O)OCCOCC1CCCCC1 7a_100000212181_100009814007 [1,0,0,1,0,0|2,0,0]=4 17737 B14R1.422 CC(=O)OCCSCC1CCCCC1 62a_100000211423_100009814007 [1,0,0,1,0,0|2,0,0]=4 17738 B14R1.422 CC(=O)OCCSCC1CCCCC1 62a_100009814007_100000211423 [1,0,0,1,0,0|2,0,0]=4 17739 B14R1.422 CC(=O)OCNCCC1CCCCC1 34a_100000738074_100009813279 [1,0,0,1,0,0|2,0,0]=4 17740 B14R1.422 CC(=O)OCOCCC1CCCCC1 34a_100011217863_100009813279 [1,0,0,1,0,0|2,0,0]=4 17741 B14R1.422 CC(=O)OCSCCC1CCCCC1 62a_100000076356_100012355289 [1,0,0,1,0,0|2,0,0]=4 17742 B14R1.422 CC(=O)OCSCCC1CCCCC1 62a_100012355289_100000076356 [1,0,0,1,0,0|2,0,0]=4 17743 B14R1.422 CC(=O)SCCCNC1CCCCC1 2230a_100000182618_100000038929 [1,0,0,1,0,0|2,0,0]=4 17744 B14R1.422 CC(=O)SCCCNC1CCCCC1 34a_100000182618_100000038929 [1,0,0,1,0,0|2,0,0]=4 17745 B14R1.422 CC(=O)SCCCOC1CCCCC1 34a_100000210231_100000038929 [1,0,0,1,0,0|2,0,0]=4 17746 B14R1.422 CC(=O)SCCCOC1CCCCC1 7a_100000210231_100000038929 [1,0,0,1,0,0|2,0,0]=4 17747 B14R1.422 CC(=O)SCCCSC1CCCCC1 62a_100000038929_100000210327 [1,0,0,1,0,0|2,0,0]=4 17748 B14R1.422 CC(=O)SCCCSC1CCCCC1 62a_100000210327_100000038929 [1,0,0,1,0,0|2,0,0]=4 17749 B14R1.422 CC(=O)SCCNCC1CCCCC1 269862a_100020647217_100000211278 [1,0,0,1,0,0|2,0,0]=4 17750 B14R1.422 CS(=O)CCCNCC1CCCCC1 2230a_200000753449_100000211423 [1,0,0,1,0,0|2,0,0]=4 17751 B14R1.422 NC(=O)CCCCNC1CCCCC1 270004a_100000696515_100000210434 [1,0,0,1,0,0|2,0,0]=4 17752 B14R1.422 NC(=O)CCCCNC1CCCCC1 34a_100000696515_100000210327 [1,0,0,1,0,0|2,0,0]=4 17753 B14R1.422 NC(=O)CCCCOC1CCCCC1 34a_100012022536_100000210327 [1,0,0,1,0,0|2,0,0]=4 17754 B14R1.422 NC(=O)CCCCOC1CCCCC1 7a_100012022536_100000210327 [1,0,0,1,0,0|2,0,0]=4 17755 B14R1.422 NC(=O)CCCNCC1CCCCC1 269862a_100000739312_100000211278 [1,0,0,1,0,0|2,0,0]=4 17756 B14R1.422 NC(=O)CCCNCC1CCCCC1 34a_100000210473_100102525003 [1,0,0,1,0,0|2,0,0]=4 17757 B14R1.422 NC(=O)CCCNCC1CCCCC1 34a_100000739312_100000211423 [1,0,0,1,0,0|2,0,0]=4 17758 B14R1.422 NC(=O)CCCOCC1CCCCC1 34a_100000212181_100102525003 [1,0,0,1,0,0|2,0,0]=4 17759 B14R1.422 NC(=O)CCCOCC1CCCCC1 7a_100000212181_100102525003 [1,0,0,1,0,0|2,0,0]=4 17760 B14R1.422 NC(=O)CCCSCC1CCCCC1 62a_100000211423_100102525003 [1,0,0,1,0,0|2,0,0]=4 17761 B14R1.422 NC(=O)CCCSCC1CCCCC1 62a_100102525003_100000211423 [1,0,0,1,0,0|2,0,0]=4 17762 B14R1.422 NC(=O)CCNCCC1CCCCC1 2230a_100000738074_100000744528 [1,0,0,1,0,0|2,0,0]=4 17763 B14R1.422 NC(=O)CCNCCC1CCCCC1 34a_100000738074_100000731001 [1,0,0,1,0,0|2,0,0]=4 17764 B14R1.422 NC(=O)CCOCCC1CCCCC1 34a_100000757172_100011209188 [1,0,0,1,0,0|2,0,0]=4 17765 B14R1.422 NC(=O)CCOCCC1CCCCC1 34a_100011217863_100000731001 [1,0,0,1,0,0|2,0,0]=4 17766 B14R1.422 NC(=O)CCOCCC1CCCCC1 7a_100000757172_100011273959 [1,0,0,1,0,0|2,0,0]=4 17767 B14R1.422 NC(=O)CCOCCC1CCCCC1 7a_100011217863_100000744528 [1,0,0,1,0,0|2,0,0]=4 17768 B14R1.422 NC(=O)CCSCCC1CCCCC1 62a_100000744528_100012355289 [1,0,0,1,0,0|2,0,0]=4 17769 B14R1.422 NC(=O)CCSCCC1CCCCC1 62a_100012355289_100000744528 [1,0,0,1,0,0|2,0,0]=4 17770 B14R1.422 NC(=O)CNCCCC1CCCCC1 2230a_100000711301_100011713725 [1,0,0,1,0,0|2,0,0]=4 17771 B14R1.422 NC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000747473 [1,0,0,1,0,0|2,0,0]=4 17772 B14R1.422 NC(=O)CNCCCC1CCCCC1 34a_100011211642_100000187820 [1,0,0,1,0,0|2,0,0]=4 17773 B14R1.422 NC(=O)COCCCC1CCCCC1 34a_100000198086_100000187820 [1,0,0,1,0,0|2,0,0]=4 17774 B14R1.422 NC(=O)COCCCC1CCCCC1 7a_100000198086_100000187820 [1,0,0,1,0,0|2,0,0]=4 17775 B14R1.422 NC(=O)CSCCCC1CCCCC1 62a_100000747473_100011713725 [1,0,0,1,0,0|2,0,0]=4 17776 B14R1.422 NC(=O)CSCCCC1CCCCC1 62a_100011713725_100000747473 [1,0,0,1,0,0|2,0,0]=4 17777 B14R1.422 O=C(O)CNCCCC1CCCCC1 269956a_100016091260_100011713725 [1,0,0,1,0,0|1,0,0]=3 17778 B14R1.422 O=C(O)CNCCCN1CCCCC1 269956a_100016091260_100000007876 [1,0,0,1,0,0|2,0,0]=4 17779 B14R1.422 O=C(O)CNCCOC1CCCCC1 269956a_100016091260_100011211530 [1,0,0,1,0,0|2,0,0]=4 17780 B14R1.422 O=C(O)COCCNC1CCCCC1 269956a_100000700818_100000210327 [1,0,0,1,0,0|2,0,0]=4 17781 B14R1.422 O=C(O)CONCCC1CCCCC1 269956a_100000106656_100011273959 [1,0,0,1,0,0|2,0,0]=4 17782 B14R1.422 O=C([O-])CNCCCC1CCCCC1 34a_100011211642_100020667443 [1,0,0,1,0,0|1,0,1]=4 17783 B14R1.422 O=C([O-])COCCCC1CCCCC1 34a_100000198086_100020667443 [1,0,0,1,0,0|1,0,1]=4 17784 B14R1.422 O=C([O-])CSCCCC1CCCCC1 62a_100011713725_100020667443 [1,0,0,1,0,0|1,0,1]=4 17785 B14R1.422 O=C([O-])CSCCCC1CCCCC1 62a_100020667443_100011713725 [1,0,0,1,0,0|1,0,1]=4 17786 B14R1.422 [13CH3]C(=O)CCCCCN1CCCCC1 1458a_100012051570_200025704644 [1,0,0,1,0,0|1,0,0]=3 17787 B14R1.422 [13CH3]C(=O)CCCCCN1CCOCC1 1458a_100012051560_200025704644 [1,0,0,1,0,0|2,0,0]=4 17788 B14R1.427 C=C(C)CCNCCCC1CCCC1 2230a_100000736752_100000730704 [1,0,0,1,0,0|2,0,0]=4 17789 B14R1.427 C=C(C)CCNCCCC1CCCC1 34a_100000736752_100000730704 [1,0,0,1,0,0|2,0,0]=4 17790 B14R1.427 C=C(C)CCOCCCC1CCCC1 34a_100000764851_100011713738 [1,0,0,1,0,0|2,0,0]=4 17791 B14R1.427 C=C(C)CCOCCCC1CCCC1 34a_100011215328_100000730704 [1,0,0,1,0,0|2,0,0]=4 17792 B14R1.427 C=C(C)CCOCCCC1CCCC1 7a_100011215328_100000730704 [1,0,0,1,0,0|2,0,0]=4 17793 B14R1.427 C=C(C)CCSCCCC1CCCC1 62a_100000730704_100011713738 [1,0,0,1,0,0|2,0,0]=4 17794 B14R1.427 C=C(C)CCSCCCC1CCCC1 62a_100011713738_100000730704 [1,0,0,1,0,0|2,0,0]=4 17795 B14R1.427 CC(=O)CCCCNCC1CCCC1 34a_100000737975_100009817362 [1,0,0,1,0,0|1,0,0]=3 17796 B14R1.427 CC(=O)CCCCNCC1CCOC1 34a_100000737293_100009817362 [1,0,0,1,0,0|2,0,0]=4 17797 B14R1.427 CC(=O)CCCCNC[C@@H]1CCCO1 34a_100020590478_100009817362 [1,0,0,1,0,0|2,0,0]=4 17798 B14R1.427 CC(=O)CCCCOCC1CCCC1 34a_100000742336_100009817362 [1,0,0,1,0,0|1,0,0]=3 17799 B14R1.427 CC(=O)CCCCOCC1CCCC1 7a_100000742336_100000735457 [1,0,0,1,0,0|1,0,0]=3 17800 B14R1.427 CC(=O)CCCCOCC1CCCO1 34a_100000210270_100009817362 [1,0,0,1,0,0|2,0,0]=4 17801 B14R1.427 CC(=O)CCCCOCC1CCCO1 7a_100000210270_100000735457 [1,0,0,1,0,0|2,0,0]=4 17802 B14R1.427 CC(=O)CCCCOCC1CCNC1 34a_100000748654_100009817362 [1,0,0,1,0,0|2,0,0]=4 17803 B14R1.427 CC(=O)CCCCOCC1CCOC1 34a_100000740260_100009817362 [1,0,0,1,0,0|2,0,0]=4 17804 B14R1.427 CC(=O)CCCCOC[C@H]1CCCN1 34a_100000745186_100009817362 [1,0,0,1,0,0|2,0,0]=4 17805 B14R1.427 CC(=O)CCCCSCC1CCCC1 62a_100000735457_100000740388 [1,0,0,1,0,0|1,0,0]=3 17806 B14R1.427 CC(=O)CCCCSCC1CCCC1 62a_100000740388_100000735457 [1,0,0,1,0,0|1,0,0]=3 17807 B14R1.427 CC(=O)CCCCSCC1CCCO1 62a_100000203698_100000735457 [1,0,0,1,0,0|2,0,0]=4 17808 B14R1.427 CC(=O)CCCCSCC1CCCO1 62a_100000735457_100000203698 [1,0,0,1,0,0|2,0,0]=4 17809 B14R1.427 CC(=O)CCCCSCC1CCOC1 62a_100000702531_100000735457 [1,0,0,1,0,0|2,0,0]=4 17810 B14R1.427 CC(=O)CCCCSCC1CCOC1 62a_100000735457_100000702531 [1,0,0,1,0,0|2,0,0]=4 17811 B14R1.427 CC(=O)CCCNCCC1CCCC1 34a_100000739158_100000685027 [1,0,0,1,0,0|1,0,0]=3 17812 B14R1.427 CC(=O)CCCOCCC1CCCC1 34a_100000749090_100000685027 [1,0,0,1,0,0|1,0,0]=3 17813 B14R1.427 CC(=O)CCCOCCC1CCCC1 34a_100000759063_100000760354 [1,0,0,1,0,0|1,0,0]=3 17814 B14R1.427 CC(=O)CCCOCCC1CCCC1 7a_100000749090_100011215641 [1,0,0,1,0,0|1,0,0]=3 17815 B14R1.427 CC(=O)CCCOCCC1CCCC1 7a_100000759063_100000760354 [1,0,0,1,0,0|1,0,0]=3 17816 B14R1.427 CC(=O)CCCOCCC1CCNC1 34a_100016987287_100000685027 [1,0,0,1,0,0|2,0,0]=4 17817 B14R1.427 CC(=O)CCCOCCC1CCOC1 34a_100011879284_100000685027 [1,0,0,1,0,0|2,0,0]=4 17818 B14R1.427 CC(=O)CCCOCCN1CCCC1 7a_100000759063_100000004467 [1,0,0,1,0,0|2,0,0]=4 17819 B14R1.427 CC(=O)CCCSCCC1CCCC1 62a_100000760354_100011215641 [1,0,0,1,0,0|1,0,0]=3 17820 B14R1.427 CC(=O)CCCSCCC1CCCC1 62a_100011215641_100000760354 [1,0,0,1,0,0|1,0,0]=3 17821 B14R1.427 CC(=O)CCCSCCN1CCCC1 62a_100000700749_100011215641 [1,0,0,1,0,0|2,0,0]=4 17822 B14R1.427 CC(=O)CCCSCCN1CCCC1 62a_100011215641_100000004467 [1,0,0,1,0,0|2,0,0]=4 17823 B14R1.427 CC(=O)CCOCCCC1CCCC1 34a_100000759926_100011713738 [1,0,0,1,0,0|1,0,0]=3 17824 B14R1.427 CC(=O)CCOCCCC1CCCC1 7a_100000759926_100011713738 [1,0,0,1,0,0|1,0,0]=3 17825 B14R1.427 CC(=O)CCOCCCC1CCCC1 7a_100011215328_100000053229 [1,0,0,1,0,0|1,0,0]=3 17826 B14R1.427 CC(=O)CCOCCCN1CCCC1 34a_100000759926_100016991639 [1,0,0,1,0,0|2,0,0]=4 17827 B14R1.427 CC(=O)CCOCCCN1CCCC1 7a_100000759926_100011445909 [1,0,0,1,0,0|2,0,0]=4 17828 B14R1.427 CC(=O)CCOCCOC1CCCC1 7a_100000738311_100000053229 [1,0,0,1,0,0|2,0,0]=4 17829 B14R1.427 CC(=O)CCSCCCC1CCCC1 62a_100000053229_100011713738 [1,0,0,1,0,0|1,0,0]=3 17830 B14R1.427 CC(=O)CCSCCCC1CCCC1 62a_100011713738_100000053229 [1,0,0,1,0,0|1,0,0]=3 17831 B14R1.427 CC(=O)CCSCCCN1CCCC1 62a_100000053229_100011445909 [1,0,0,1,0,0|2,0,0]=4 17832 B14R1.427 CC(=O)CCSCCCN1CCCC1 62a_100016991639_100000053229 [1,0,0,1,0,0|2,0,0]=4 17833 B14R1.427 CC(=O)NCCCCCN1CCCC1 1626a_100011491779_100015343762 [1,0,0,1,0,0|2,0,0]=4 17834 B14R1.427 CC(=O)NCCCCCN1CCCC1 240690a_100011491779_100015343762 [1,0,0,1,0,0|2,0,0]=4 17835 B14R1.427 CC(=O)NCCCCNC1CCCC1 2230a_200011368371_100000179811 [1,0,0,1,0,0|2,0,0]=4 17836 B14R1.427 CC(=O)NCCCCNC1CCCC1 270004a_200011368371_100000210133 [1,0,0,1,0,0|2,0,0]=4 17837 B14R1.427 CC(=O)NCCCCNC1CCCC1 34a_200011368371_100000179811 [1,0,0,1,0,0|2,0,0]=4 17838 B14R1.427 CC(=O)NCCCNCC1CCCC1 269862a_100000736810_100000746403 [1,0,0,1,0,0|2,0,0]=4 17839 B14R1.427 CC(=O)NCCCNCC1CCCC1 34a_100000736810_100000740388 [1,0,0,1,0,0|2,0,0]=4 17840 B14R1.427 CC(=O)NCCCOCC1CCCC1 34a_100000752032_100000740388 [1,0,0,1,0,0|2,0,0]=4 17841 B14R1.427 CC(=O)NCCNCCC1CCCC1 2230a_100000209853_100000760354 [1,0,0,1,0,0|2,0,0]=4 17842 B14R1.427 CC(=O)NCCNCCC1CCCC1 2230a_100000739158_100000189650 [1,0,0,1,0,0|2,0,0]=4 17843 B14R1.427 CC(=O)NCCOCCC1CCCC1 34a_100000158858_100000760354 [1,0,0,1,0,0|2,0,0]=4 17844 B14R1.427 CC(=O)NCCOCCC1CCCC1 7a_100000749090_100000189650 [1,0,0,1,0,0|2,0,0]=4 17845 B14R1.427 CC(=O)NCCSCCC1CCCC1 62a_100000189650_100000760354 [1,0,0,1,0,0|2,0,0]=4 17846 B14R1.427 CC(=O)NCCSCCC1CCCC1 62a_100000760354_100000189650 [1,0,0,1,0,0|2,0,0]=4 17847 B14R1.427 CC(=O)OCCCCCN1CCCC1 2230a_100000188435_100009813381 [1,0,0,1,0,0|2,0,0]=4 17848 B14R1.427 CC(=O)OCCCCCN1CCCC1 269982a_100000188435_100000033007 [1,0,0,1,0,0|2,0,0]=4 17849 B14R1.427 CC(=O)OCCCCNC1CCCC1 34a_100000211070_100000033659 [1,0,0,1,0,0|2,0,0]=4 17850 B14R1.427 CC(=O)OCCCCOC1CCCC1 34a_100000073216_100000179811 [1,0,0,1,0,0|2,0,0]=4 17851 B14R1.427 CC(=O)OCCCCOC1CCCC1 34a_100000210269_100000033659 [1,0,0,1,0,0|2,0,0]=4 17852 B14R1.427 CC(=O)OCCCCOC1CCCC1 7a_100000073216_100000179811 [1,0,0,1,0,0|2,0,0]=4 17853 B14R1.427 CC(=O)OCCCCOC1CCCC1 7a_100000210269_100000033659 [1,0,0,1,0,0|2,0,0]=4 17854 B14R1.427 CC(=O)OCCCCSC1CCCC1 62a_100000033659_100000179811 [1,0,0,1,0,0|2,0,0]=4 17855 B14R1.427 CC(=O)OCCCCSC1CCCC1 62a_100011217020_100000033659 [1,0,0,1,0,0|2,0,0]=4 17856 B14R1.427 CC(=O)OCCCNCC1CCCC1 34a_100000737975_100000042594 [1,0,0,1,0,0|2,0,0]=4 17857 B14R1.427 CC(=O)OCCCOCC1CCCC1 34a_100000742336_100000042594 [1,0,0,1,0,0|2,0,0]=4 17858 B14R1.427 CC(=O)OCCCOCC1CCCC1 7a_100000742336_100000042594 [1,0,0,1,0,0|2,0,0]=4 17859 B14R1.427 CC(=O)OCCCSCC1CCCC1 62a_100000042594_100000740388 [1,0,0,1,0,0|2,0,0]=4 17860 B14R1.427 CC(=O)OCCCSCC1CCCC1 62a_100000740388_100000042594 [1,0,0,1,0,0|2,0,0]=4 17861 B14R1.427 CC(=O)OCCNCCC1CCCC1 34a_100000739158_100009814007 [1,0,0,1,0,0|2,0,0]=4 17862 B14R1.427 CC(=O)OCCOCCC1CCCC1 34a_100000749090_100009814007 [1,0,0,1,0,0|2,0,0]=4 17863 B14R1.427 CC(=O)OCCOCCC1CCCC1 7a_100000749090_100009814007 [1,0,0,1,0,0|2,0,0]=4 17864 B14R1.427 CC(=O)OCCSCCC1CCCC1 62a_100000760354_100009814007 [1,0,0,1,0,0|2,0,0]=4 17865 B14R1.427 CC(=O)OCCSCCC1CCCC1 62a_100009814007_100000760354 [1,0,0,1,0,0|2,0,0]=4 17866 B14R1.427 CC(=O)OCNCCCC1CCCC1 34a_100000736752_100009813279 [1,0,0,1,0,0|2,0,0]=4 17867 B14R1.427 CC(=O)OCOCCCC1CCCC1 34a_100011215328_100009813279 [1,0,0,1,0,0|2,0,0]=4 17868 B14R1.427 CC(=O)OCSCCCC1CCCC1 62a_100000076356_100011713738 [1,0,0,1,0,0|2,0,0]=4 17869 B14R1.427 CC(=O)OCSCCCC1CCCC1 62a_100011713738_100000076356 [1,0,0,1,0,0|2,0,0]=4 17870 B14R1.427 CC(=O)SCCCCNC1CCCC1 2230a_100000211070_200010402107 [1,0,0,1,0,0|2,0,0]=4 17871 B14R1.427 CC(=O)SCCCCNC1CCCC1 34a_100000211070_200010402107 [1,0,0,1,0,0|2,0,0]=4 17872 B14R1.427 CC(=O)SCCCCOC1CCCC1 34a_100000210269_200010402107 [1,0,0,1,0,0|2,0,0]=4 17873 B14R1.427 CC(=O)SCCCCOC1CCCC1 7a_100000210269_200010402107 [1,0,0,1,0,0|2,0,0]=4 17874 B14R1.427 CC(=O)SCCCCSC1CCCC1 62a_100011217020_200010402107 [1,0,0,1,0,0|2,0,0]=4 17875 B14R1.427 CC(=O)SCCCCSC1CCCC1 62a_200010402107_100000179811 [1,0,0,1,0,0|2,0,0]=4 17876 B14R1.427 CC(=O)SCCCNCC1CCCC1 2230a_100000737975_100000038929 [1,0,0,1,0,0|2,0,0]=4 17877 B14R1.427 CC(=O)SCCCNCC1CCCC1 34a_100000737975_100000038929 [1,0,0,1,0,0|2,0,0]=4 17878 B14R1.427 CC(=O)SCCCOCC1CCCC1 34a_100000742336_100000038929 [1,0,0,1,0,0|2,0,0]=4 17879 B14R1.427 CC(=O)SCCCOCC1CCCC1 7a_100000742336_100000038929 [1,0,0,1,0,0|2,0,0]=4 17880 B14R1.427 CC(=O)SCCCSCC1CCCC1 62a_100000038929_100000740388 [1,0,0,1,0,0|2,0,0]=4 17881 B14R1.427 CC(=O)SCCCSCC1CCCC1 62a_100000740388_100000038929 [1,0,0,1,0,0|2,0,0]=4 17882 B14R1.427 CS(=O)CCCNCCC1CCCC1 2230a_200000753449_100000760354 [1,0,0,1,0,0|2,0,0]=4 17883 B14R1.427 NC(=O)CCCCCNC1CCCC1 2230a_100000211070_100009817443 [1,0,0,1,0,0|2,0,0]=4 17884 B14R1.427 NC(=O)CCCCCNC1CCCC1 34a_100000211070_100009817443 [1,0,0,1,0,0|2,0,0]=4 17885 B14R1.427 NC(=O)CCCCCOC1CCCC1 34a_100000123541_100000179811 [1,0,0,1,0,0|2,0,0]=4 17886 B14R1.427 NC(=O)CCCCCOC1CCCC1 34a_100000210269_100009817443 [1,0,0,1,0,0|2,0,0]=4 17887 B14R1.427 NC(=O)CCCCCOC1CCCC1 7a_100000123541_100000179811 [1,0,0,1,0,0|2,0,0]=4 17888 B14R1.427 NC(=O)CCCCCOC1CCCC1 7a_100000210269_100009817443 [1,0,0,1,0,0|2,0,0]=4 17889 B14R1.427 NC(=O)CCCCCSC1CCCC1 62a_100009817443_100000179811 [1,0,0,1,0,0|2,0,0]=4 17890 B14R1.427 NC(=O)CCCCCSC1CCCC1 62a_100011217020_100009817443 [1,0,0,1,0,0|2,0,0]=4 17891 B14R1.427 NC(=O)CCCCNCC1CCCC1 269862a_100000696515_100000746403 [1,0,0,1,0,0|2,0,0]=4 17892 B14R1.427 NC(=O)CCCCNCC1CCCC1 34a_100000696515_100000740388 [1,0,0,1,0,0|2,0,0]=4 17893 B14R1.427 NC(=O)CCCCOCC1CCCC1 34a_100012022536_100000740388 [1,0,0,1,0,0|2,0,0]=4 17894 B14R1.427 NC(=O)CCCCOCC1CCCC1 7a_100012022536_100000740388 [1,0,0,1,0,0|2,0,0]=4 17895 B14R1.427 NC(=O)CCCNCCC1CCCC1 34a_100000739158_100102525003 [1,0,0,1,0,0|2,0,0]=4 17896 B14R1.427 NC(=O)CCCNCCC1CCCC1 34a_100000739312_100000760354 [1,0,0,1,0,0|2,0,0]=4 17897 B14R1.427 NC(=O)CCCOCCC1CCCC1 34a_100000749090_100102525003 [1,0,0,1,0,0|2,0,0]=4 17898 B14R1.427 NC(=O)CCCOCCC1CCCC1 7a_100000749090_100102525003 [1,0,0,1,0,0|2,0,0]=4 17899 B14R1.427 NC(=O)CCCSCCC1CCCC1 62a_100000760354_100102525003 [1,0,0,1,0,0|2,0,0]=4 17900 B14R1.427 NC(=O)CCCSCCC1CCCC1 62a_100102525003_100000760354 [1,0,0,1,0,0|2,0,0]=4 17901 B14R1.427 NC(=O)CCNCCCC1CCCC1 2230a_100000736752_100000744528 [1,0,0,1,0,0|2,0,0]=4 17902 B14R1.427 NC(=O)CCNCCCC1CCCC1 34a_100000736752_100000731001 [1,0,0,1,0,0|2,0,0]=4 17903 B14R1.427 NC(=O)CCOCCCC1CCCC1 34a_100000757172_100011713738 [1,0,0,1,0,0|2,0,0]=4 17904 B14R1.427 NC(=O)CCOCCCC1CCCC1 34a_100011215328_100000731001 [1,0,0,1,0,0|2,0,0]=4 17905 B14R1.427 NC(=O)CCOCCCC1CCCC1 7a_100000757172_100011713738 [1,0,0,1,0,0|2,0,0]=4 17906 B14R1.427 NC(=O)CCOCCCC1CCCC1 7a_100011215328_100000744528 [1,0,0,1,0,0|2,0,0]=4 17907 B14R1.427 NC(=O)CCSCCCC1CCCC1 62a_100000744528_100011713738 [1,0,0,1,0,0|2,0,0]=4 17908 B14R1.427 NC(=O)CCSCCCC1CCCC1 62a_100011713738_100000744528 [1,0,0,1,0,0|2,0,0]=4 17909 B14R1.427 O=C(O)COCCNCC1CCCC1 269956a_100000700818_100000740388 [1,0,0,1,0,0|2,0,0]=4 17910 B14R1.427 O=C(O)CONCCCC1CCCC1 269956a_100000106656_100011713738 [1,0,0,1,0,0|2,0,0]=4 17911 B14R1.427 O=C([O-])CCCCCOC1CCCC1 7a_100102619762_100000179811 [1,0,0,1,0,0|1,0,1]=4 17912 B14R1.482 C=C(C)CCN1CCCCC1CCC 2230a_100000701414_100000730704 [1,0,0,1,0,0|2,0,0]=4 17913 B14R1.482 C=C(C)CCN1CCCCC1CCC 269982a_100000701414_100000730704 [1,0,0,1,0,0|2,0,0]=4 17914 B14R1.482 C=C(C)CCN1CCCCC1CCC 34a_100000701414_100000730704 [1,0,0,1,0,0|2,0,0]=4 17915 B14R1.482 C=C(C)COC1CCCCC1CCC 34a_100011217265_100000748629 [1,0,0,1,0,0|2,0,0]=4 17916 B14R1.482 C=C(C)COC1CCCCC1CCC 7a_100011217265_100000748629 [1,0,0,1,0,0|2,0,0]=4 17917 B14R1.482 CC(=O)CCN1CCCCC1CCO 269982a_100000211664_100000053229 [1,0,0,1,0,0|2,0,0]=4 17918 B14R1.482 CCCC1CCCCC1OCC(=O)N 34a_100011217265_100000187820 [1,0,0,1,0,0|2,0,0]=4 17919 B14R1.482 CCCC1CCCCC1OCC(=O)N 7a_100011217265_100000187820 [1,0,0,1,0,0|2,0,0]=4 17920 B14R1.482 CCCC1CCCCC1OCC(=O)[O-] 34a_100011217265_100020667443 [1,0,0,1,0,0|1,0,1]=4 17921 B14R1.482 CCCC1CCCCN1CCC(=O)C 269982a_100000701414_100000053229 [1,0,0,1,0,0|1,0,0]=3 17922 B14R1.482 CCCC1CCCCN1CCC(=O)N 2230a_100000701414_100000744528 [1,0,0,1,0,0|2,0,0]=4 17923 B14R1.482 CCCC1CCCCN1CCC(=O)N 269982a_100000701414_100000744528 [1,0,0,1,0,0|2,0,0]=4 17924 B14R1.482 CCCC1CCCCN1CCC(=O)N 34a_100000701414_100000731001 [1,0,0,1,0,0|2,0,0]=4 17925 B14R1.482 CCCC1CCCCN1COC(=O)C 269982a_100000701414_100000076356 [1,0,0,1,0,0|2,0,0]=4 17926 B14R1.482 CCCC1CCCCN1COC(=O)C 34a_100000701414_100009813279 [1,0,0,1,0,0|2,0,0]=4 17927 B14R1.482 CCCC1COCCN1CCC(=O)C 269982a_102495339903_100000053229 [1,0,0,1,0,0|2,0,0]=4 17928 B14R1.482 CCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210207 [1,0,0,1,0,0|1,0,0]=3 17929 B14R1.482 COCC1CCCCN1CCC(=O)C 269982a_100015184032_100000053229 [1,0,0,1,0,0|2,0,0]=4 17930 B14R1.482 COCN1CCCCC1CCC(=O)O 269956a_100000694054_100000766300 [1,0,0,1,0,0|2,0,0]=4 17931 B14R1.482 CSCN1CCCCC1CCC(=O)O 269956a_100000694054_100011218213 [1,0,0,1,0,0|2,0,0]=4 17932 B14R1.482 O=C(O)CCC1CCCCN1CCF 269956a_100000694054_100011217306 [1,0,0,1,0,0|2,0,0]=4 17933 B14R1.482 O=C(O)CCC1CCCCN1CCO 269956a_100000694054_100000211926 [1,0,0,1,0,0|2,0,0]=4 17934 B14R1.498 CCCC1CCCC1NCCC(=O)N 269862a_100000740010_100000723119 [1,0,0,1,0,0|2,0,0]=4 17935 B14R1.498 COC[C@@H]1CCCN1CCCC(=O)C 269982a_100020646714_100011215641 [1,0,0,1,0,0|2,0,0]=4 17936 B14R1.498 COC[C@@H]1CCCN1CCCC(=O)C 34a_100020646714_100000685027 [1,0,0,1,0,0|2,0,0]=4 17937 B14R1.651 CCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210211 [1,0,0,1,0,0|1,0,0]=3 17938 B14R1.651 CCOCN1CCCCCC1C(=O)O 269956a_100000758484_100000739092 [1,0,0,1,0,0|2,0,0]=4 17939 B14R1.651 COCCN1CCCCCC1C(=O)O 269956a_100000758484_100000233755 [1,0,0,1,0,0|2,0,0]=4 17940 B14R1.651 CSCCN1CCCCCC1C(=O)O 269956a_100000758484_100000212216 [1,0,0,1,0,0|2,0,0]=4 17941 B14R1.651 O=C(O)C1CCCCCN1CCCF 269956a_100000758484_100011934791 [1,0,0,1,0,0|2,0,0]=4 17942 B14R1.651 O=C(O)C1CCCCCN1CCCO 269956a_100000758484_100011215043 [1,0,0,1,0,0|2,0,0]=4 17943 B14R1.767 C=C1CC(C1)CNCCCCCCC 2230a_100102567296_100000210681 [1,0,0,1,0,0|2,0,0]=4 17944 B14R1.767 C=C1CC(C1)CNCCCCCCC 34a_100102567296_100000210614 [1,0,0,1,0,0|2,0,0]=4 17945 B14R1.767 C=C1CC(C1)COCCCCCCC 34a_100011011225_100000210614 [1,0,0,1,0,0|2,0,0]=4 17946 B14R1.767 C=C1CC(C1)NCCCCCCCC 2230a_100132301982_100000210759 [1,0,0,1,0,0|2,0,0]=4 17947 B14R1.767 CCCCCCCCSC1CC(=O)C1 62a_100009894365_100000210317 [1,0,0,1,0,0|1,0,0]=3 17948 B14R1.767 CCCCCCCNCC1CC(=O)C1 2230a_100000229938_100009874392 [1,0,0,1,0,0|1,0,0]=3 17949 B14R1.767 CCCCCCCOCC1CC(=O)C1 34a_100000101936_100000210614 [1,0,0,1,0,0|1,0,0]=3 17950 B14R1.767 CCCCCCCOCC1CC(=O)C1 7a_100000210272_100009874392 [1,0,0,1,0,0|1,0,0]=3 17951 B14R1.767 CCCCCCCSCC1CC(=O)C1 62a_100000210614_100009874392 [1,0,0,1,0,0|1,0,0]=3 17952 B14R1.767 CCCCCCCSCC1CC(=O)C1 62a_100009874392_100000210316 [1,0,0,1,0,0|1,0,0]=3 17953 B14R1.767 CCCCOCCOCC1CC(=O)C1 34a_100000101936_100000743108 [1,0,0,1,0,0|2,0,0]=4 17954 B14R1.767 CCCCOCCOCC1CC(=O)C1 7a_100000210238_100009874392 [1,0,0,1,0,0|2,0,0]=4 17955 B14R1.767 CCCCOCCSCC1CC(=O)C1 62a_100000743108_100009874392 [1,0,0,1,0,0|2,0,0]=4 17956 B14R1.767 CCCCOCCSCC1CC(=O)C1 62a_100009874392_100000743108 [1,0,0,1,0,0|2,0,0]=4 17957 B14R1.767 CCCCSCCNCC1CC(=O)C1 2230a_100025743550_100009874392 [1,0,0,1,0,0|2,0,0]=4 17958 B14R1.767 CCCCSCCOCC1CC(=O)C1 7a_200000230436_100009874392 [1,0,0,1,0,0|2,0,0]=4 17959 B14R1.767 CCCOCCCNCC1CC(=O)C1 2230a_100011217757_100009874392 [1,0,0,1,0,0|2,0,0]=4 17960 B14R1.767 COCCCCCCSC1CC(=O)C1 62a_100009894365_100011998445 [1,0,0,1,0,0|2,0,0]=4 17961 B14R1.767 COCCCCCNCC1CC(=O)C1 2230a_100000747528_100009874392 [1,0,0,1,0,0|2,0,0]=4 17962 B14R1.767 O=C1CC(C1)CNCCCCCCO 2230a_100000686447_100009874392 [1,0,0,1,0,0|2,0,0]=4 17963 B14R1.767 O=C1CC(C1)COCCCCCCBr 7a_100011215345_100009874392 [1,0,0,1,0,0|2,0,0]=4 17964 B14R1.767 O=C1CC(C1)COCCCCCCCl 7a_100000766143_100009874392 [1,0,0,1,0,0|2,0,0]=4 17965 B14R1.767 O=C1CC(C1)COCCCCCCF 34a_100000101936_100015922095 [1,0,0,1,0,0|2,0,0]=4 17966 B14R1.767 O=C1CC(C1)COCCCCCCF 7a_100000732779_100009874392 [1,0,0,1,0,0|2,0,0]=4 17967 B14R1.767 O=C1CC(C1)COCCCCCCO 34a_100000101936_100000766143 [1,0,0,1,0,0|2,0,0]=4 17968 B14R1.767 O=C1CC(C1)CSCCCCCCF 62a_100009874392_100015922095 [1,0,0,1,0,0|2,0,0]=4 17969 B14R1.767 O=C1CC(C1)CSCCCCCCF 62a_100015922095_100009874392 [1,0,0,1,0,0|2,0,0]=4 17970 B14R1.767 O=C1CC(C1)CSCCCCCCO 62a_100000766143_100009874392 [1,0,0,1,0,0|2,0,0]=4 17971 B14R1.767 O=C1CC(C1)CSCCCCCCO 62a_100009874392_100000766143 [1,0,0,1,0,0|2,0,0]=4 17972 B14R1.767 O=C1CC(C1)SCCCCCCCO 62a_100009894365_100000760002 [1,0,0,1,0,0|2,0,0]=4 17973 B14R1.786 CCCCN1CCCCC1CC(=O)N 2230a_100015184752_100000210211 [1,0,0,1,0,0|2,0,0]=4 17974 B14R1.786 CCCCN1CCCCC1CC(=O)N 269982a_100015184752_100000210211 [1,0,0,1,0,0|2,0,0]=4 17975 B14R1.786 CCCCN1CCCCC1CC(=O)N 34a_100015184752_100000210210 [1,0,0,1,0,0|2,0,0]=4 17976 B14R1.903 CCCCCN1CCCCC1C(=O)N 2230a_100000181395_100000210326 [1,0,0,1,0,0|2,0,0]=4 17977 B14R1.903 CCCCCN1CCCCC1C(=O)N 269982a_100000181395_100000210215 [1,0,0,1,0,0|2,0,0]=4 17978 B14R1.903 CCCCCN1CCCCC1C(=O)N 34a_100000181395_100000718602 [1,0,0,1,0,0|2,0,0]=4 17979 B14R1.903 CCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210326 [1,0,0,1,0,0|1,0,0]=3 17980 B14R1.903 CCCCCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210326 [1,0,0,1,0,0|2,0,0]=4 17981 B14R1.903 CCCCCN1CCSCC1C(=O)O 269956a_100011346106_100000210326 [1,0,0,1,0,0|2,0,0]=4 17982 B14R1.903 CCCCCN1CSCCC1C(=O)O 269956a_100015185162_100000210326 [1,0,0,1,0,0|2,0,0]=4 17983 B14R1.903 CCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210211 [1,0,0,1,0,0|1,0,0]=3 17984 B14R1.903 CCOCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210147 [1,0,0,1,0,0|2,0,0]=4 17985 B14R1.903 CCOCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000739092 [1,0,0,1,0,0|2,0,0]=4 17986 B14R1.903 CCSCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000757381 [1,0,0,1,0,0|2,0,0]=4 17987 B14R1.903 COCCCC1CCCCN1C(=O)C 11a_100011804088_100015343762 [1,0,0,1,0,0|2,0,0]=4 17988 B14R1.903 COCCCC1CCCCN1C(=O)C 1626a_100011804088_100015343762 [1,0,0,1,0,0|2,0,0]=4 17989 B14R1.903 COCCCC1CCCCN1C(=O)C 240690a_100011804088_100015343762 [1,0,0,1,0,0|2,0,0]=4 17990 B14R1.903 COCCCC1CCCCN1C(=O)C 527a_100011804088_100103153847 [1,0,0,1,0,0|2,0,0]=4 17991 B14R1.903 COCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000740836 [1,0,0,1,0,0|2,0,0]=4 17992 B14R1.903 COCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000233755 [1,0,0,1,0,0|2,0,0]=4 17993 B14R1.903 CSCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000212216 [1,0,0,1,0,0|2,0,0]=4 17994 B14R1.903 O=C(O)[C@@H]1CCCC[C@H]1NCCCF 269956a_100009816435_100011934791 [1,0,0,1,0,0|2,0,0]=4 17995 B14R1.903 O=C(O)[C@@H]1CCCC[C@H]1NCCCO 269956a_100009816435_100011215043 [1,0,0,1,0,0|2,0,0]=4 17996 B14R1.903 O=C(O)[C@H]1CCCCN1CCCCF 269956a_100000763471_100000729493 [1,0,0,1,0,0|2,0,0]=4 17997 B14R1.903 O=C(O)[C@H]1CCCCN1CCCCO 269956a_100000763471_100000210776 [1,0,0,1,0,0|2,0,0]=4 17998 B14R1.1252 CCCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210314 [1,0,0,1,0,0|2,0,0]=4 17999 B14R1.1454 C=C(C)CCNC1CCCCCCC1 2230a_100000211152_100000730704 [1,0,0,1,0,0|2,0,0]=4 18000 B14R1.1454 C=C(C)CCNC1CCCCCCC1 34a_100000211152_100000730704 [1,0,0,1,0,0|2,0,0]=4 18001 B14R1.1454 C=C(C)CCOC1CCCCCCC1 34a_100000210054_100000730704 [1,0,0,1,0,0|2,0,0]=4 18002 B14R1.1454 C=C(C)CCOC1CCCCCCC1 7a_100000210054_100000730704 [1,0,0,1,0,0|2,0,0]=4 18003 B14R1.1454 C=C(C)COCC1CCCCCCC1 34a_100011216312_100000748629 [1,0,0,1,0,0|2,0,0]=4 18004 B14R1.1454 C=C(C)COCC1CCCCCCC1 7a_100011216312_100000748629 [1,0,0,1,0,0|2,0,0]=4 18005 B14R1.1454 CC(=O)CCCN1CCCCCCC1 269982a_100000211400_100011215641 [1,0,0,1,0,0|1,0,0]=3 18006 B14R1.1454 CC(=O)CCCN1CCCCCCC1 34a_100000211400_100000685027 [1,0,0,1,0,0|1,0,0]=3 18007 B14R1.1454 CC(=O)CCOC1CCCCCCC1 7a_100000210054_100000053229 [1,0,0,1,0,0|1,0,0]=3 18008 B14R1.1454 CC(=O)NCCC1CCCCCCC1 11a_100011532352_100015343762 [1,0,0,1,0,0|1,0,0]=3 18009 B14R1.1454 CC(=O)NCCC1CCCCCCC1 1626a_100011532352_100015343762 [1,0,0,1,0,0|1,0,0]=3 18010 B14R1.1454 CC(=O)NCCC1CCCCCCC1 240690a_100011532352_100015343762 [1,0,0,1,0,0|1,0,0]=3 18011 B14R1.1454 CC(=O)NCCC1CCCCCCC1 527a_100011532352_100103153847 [1,0,0,1,0,0|1,0,0]=3 18012 B14R1.1454 CC(=O)NCCN1CCCCCCC1 2230a_100000211400_100000189650 [1,0,0,1,0,0|2,0,0]=4 18013 B14R1.1454 CC(=O)NCCN1CCCCCCC1 269982a_100000211400_100000189650 [1,0,0,1,0,0|2,0,0]=4 18014 B14R1.1454 CC(=O)OCCN1CCCCCCC1 269982a_100000211400_100009814007 [1,0,0,1,0,0|2,0,0]=4 18015 B14R1.1454 CC(=O)OCCN1CCCCCCC1 34a_100000211400_100009814007 [1,0,0,1,0,0|2,0,0]=4 18016 B14R1.1454 CC(=O)OCNC1CCCCCCC1 34a_100000211152_100009813279 [1,0,0,1,0,0|2,0,0]=4 18017 B14R1.1454 CC(=O)OCOC1CCCCCCC1 34a_100000210054_100009813279 [1,0,0,1,0,0|2,0,0]=4 18018 B14R1.1454 NC(=O)CCCN1CCCCCCC1 269982a_100000211400_100102525003 [1,0,0,1,0,0|2,0,0]=4 18019 B14R1.1454 NC(=O)CCCN1CCCCCCC1 34a_100000211400_100102525003 [1,0,0,1,0,0|2,0,0]=4 18020 B14R1.1454 NC(=O)CCNC1CCCCCCC1 2230a_100000211152_100000744528 [1,0,0,1,0,0|2,0,0]=4 18021 B14R1.1454 NC(=O)CCNC1CCCCCCC1 34a_100000211152_100000731001 [1,0,0,1,0,0|2,0,0]=4 18022 B14R1.1454 NC(=O)CCOC1CCCCCCC1 34a_100000210054_100000731001 [1,0,0,1,0,0|2,0,0]=4 18023 B14R1.1454 NC(=O)CCOC1CCCCCCC1 7a_100000210054_100000744528 [1,0,0,1,0,0|2,0,0]=4 18024 B14R1.1454 NC(=O)COCC1CCCCCCC1 34a_100011216312_100000187820 [1,0,0,1,0,0|2,0,0]=4 18025 B14R1.1454 NC(=O)COCC1CCCCCCC1 7a_100011216312_100000187820 [1,0,0,1,0,0|2,0,0]=4 18026 B14R1.1454 O=C([O-])COCC1CCCCCCC1 34a_100011216312_100020667443 [1,0,0,1,0,0|1,0,1]=4 18027 B14R1.3447 CCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210614 [1,0,0,1,0,0|1,0,0]=3 18028 B14R1.3447 CCCCOCCN1CCC1C(=O)O 269956a_100000021838_100000743108 [1,0,0,1,0,0|2,0,0]=4 18029 B14R1.3447 O=C(O)C1CCN1CCCCCCF 269956a_100000021838_100015922095 [1,0,0,1,0,0|2,0,0]=4 18030 B14R1.3447 O=C(O)C1CCN1CCCCCCO 269956a_100000021838_100000766143 [1,0,0,1,0,0|2,0,0]=4 18031 B14R1.4521 CC(=O)CCCCOCCC1COC1 34a_100009855314_100009817362 [1,0,0,1,0,0|2,0,0]=4 18032 B14R1.4521 CC(=O)NCCCCCNC1CCC1 270004a_200012022750_100000241760 [1,0,0,1,0,0|2,0,0]=4 18033 B14R1.4521 CC(=O)NCCCCCNC1CCC1 34a_200012022750_100000749161 [1,0,0,1,0,0|2,0,0]=4 18034 B14R1.4521 CC(=O)NCCCCNCC1CCC1 2230a_200011368371_100000763275 [1,0,0,1,0,0|2,0,0]=4 18035 B14R1.4521 CC(=O)NCCCCNCC1CCC1 269862a_200011368371_100000753134 [1,0,0,1,0,0|2,0,0]=4 18036 B14R1.4521 CC(=O)NCCCCNCC1CCC1 34a_200011368371_100000763275 [1,0,0,1,0,0|2,0,0]=4 18037 B14R1.4521 CC(=O)OCCCCCNC1CCC1 2230a_100000749019_100009813381 [1,0,0,1,0,0|2,0,0]=4 18038 B14R1.4521 CC(=O)OCCCCCNC1CCC1 34a_100000749019_100000033007 [1,0,0,1,0,0|2,0,0]=4 18039 B14R1.4521 CC(=O)OCCCCCOC1CCC1 34a_100000748187_100000033007 [1,0,0,1,0,0|2,0,0]=4 18040 B14R1.4521 CC(=O)OCCCCCSC1CCC1 62a_100000033007_100000749161 [1,0,0,1,0,0|2,0,0]=4 18041 B14R1.4521 CC(=O)OCCCCNCC1CCC1 34a_100000738700_100000033659 [1,0,0,1,0,0|2,0,0]=4 18042 B14R1.4521 CC(=O)OCCCCOCC1CCC1 34a_100000073216_100000763275 [1,0,0,1,0,0|2,0,0]=4 18043 B14R1.4521 CC(=O)OCCCCOCC1CCC1 34a_100000760304_100000033659 [1,0,0,1,0,0|2,0,0]=4 18044 B14R1.4521 CC(=O)OCCCCOCC1CCC1 7a_100000073216_100000763275 [1,0,0,1,0,0|2,0,0]=4 18045 B14R1.4521 CC(=O)OCCCCSCC1CCC1 62a_100000033659_100000763275 [1,0,0,1,0,0|2,0,0]=4 18046 B14R1.4521 CC(=O)OCCCCSCC1CCC1 62a_100000763275_100000033659 [1,0,0,1,0,0|2,0,0]=4 18047 B14R1.4521 CC(=O)SCCCCNCC1CCC1 2230a_100000738700_200010402107 [1,0,0,1,0,0|2,0,0]=4 18048 B14R1.4521 CC(=O)SCCCCNCC1CCC1 34a_100000738700_200010402107 [1,0,0,1,0,0|2,0,0]=4 18049 B14R1.4521 CC(=O)SCCCCOCC1CCC1 34a_100000760304_200010402107 [1,0,0,1,0,0|2,0,0]=4 18050 B14R1.4521 CC(=O)SCCCCSCC1CCC1 62a_100000763275_200010402107 [1,0,0,1,0,0|2,0,0]=4 18051 B14R1.4521 CC(=O)SCCCCSCC1CCC1 62a_200010402107_100000763275 [1,0,0,1,0,0|2,0,0]=4 18052 B14R1.4521 NC(=O)CCCCCNCC1CCC1 2230a_100000738700_100009817443 [1,0,0,1,0,0|2,0,0]=4 18053 B14R1.4521 NC(=O)CCCCCNCC1CCC1 34a_100000738700_100009817443 [1,0,0,1,0,0|2,0,0]=4 18054 B14R1.4521 NC(=O)CCCCCOCC1CCC1 34a_100000123541_100000763275 [1,0,0,1,0,0|2,0,0]=4 18055 B14R1.4521 NC(=O)CCCCCOCC1CCC1 34a_100000760304_100009817443 [1,0,0,1,0,0|2,0,0]=4 18056 B14R1.4521 NC(=O)CCCCCOCC1CCC1 7a_100000123541_100000763275 [1,0,0,1,0,0|2,0,0]=4 18057 B14R1.4521 NC(=O)CCCCCSCC1CCC1 62a_100000763275_100009817443 [1,0,0,1,0,0|2,0,0]=4 18058 B14R1.4521 NC(=O)CCCCCSCC1CCC1 62a_100009817443_100000763275 [1,0,0,1,0,0|2,0,0]=4 18059 B14R1.4521 O=C([O-])CCCCCOCC1CCC1 7a_100102619762_100000763275 [1,0,0,1,0,0|1,0,1]=4 18060 B14R1.5254 CCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210202 [1,0,0,1,0,0|1,0,0]=3 18061 B14R1.5254 O=C(O)[C@H]1CCCCCC[C@H]1NCF 269956a_200049070474_100015361967 [1,0,0,1,0,0|2,0,0]=4 18062 B14R1.6335 C=C(C)CCN1CCCCCCCC1 2230a_100000039187_100000730704 [1,0,0,1,0,0|2,0,0]=4 18063 B14R1.6335 C=C(C)CCN1CCCCCCCC1 269982a_100000039187_100000730704 [1,0,0,1,0,0|2,0,0]=4 18064 B14R1.6335 C=C(C)CCN1CCCCCCCC1 34a_100000039187_100000730704 [1,0,0,1,0,0|2,0,0]=4 18065 B14R1.6335 CC(=O)CCN1CCCCCCCC1 269982a_100000039187_100000053229 [1,0,0,1,0,0|1,0,0]=3 18066 B14R1.6335 CC(=O)OCN1CCCCCCCC1 269982a_100000039187_100000076356 [1,0,0,1,0,0|2,0,0]=4 18067 B14R1.6335 CC(=O)OCN1CCCCCCCC1 34a_100000039187_100009813279 [1,0,0,1,0,0|2,0,0]=4 18068 B14R1.6335 NC(=O)CCN1CCCCCCCC1 2230a_100000039187_100000744528 [1,0,0,1,0,0|2,0,0]=4 18069 B14R1.6335 NC(=O)CCN1CCCCCCCC1 269982a_100000039187_100000744528 [1,0,0,1,0,0|2,0,0]=4 18070 B14R1.6335 NC(=O)CCN1CCCCCCCC1 34a_100000039187_100000731001 [1,0,0,1,0,0|2,0,0]=4 18071 B14R1.6343 C=C(C)CCNCC1CCCCCC1 2230a_100015204231_100000730704 [1,0,0,1,0,0|2,0,0]=4 18072 B14R1.6343 C=C(C)CCNCC1CCCCCC1 34a_100015204231_100000730704 [1,0,0,1,0,0|2,0,0]=4 18073 B14R1.6343 C=C(C)CCOCC1CCCCCC1 34a_100000699130_100000730704 [1,0,0,1,0,0|2,0,0]=4 18074 B14R1.6343 C=C(C)CCOCC1CCCCCC1 34a_100000764851_200000696569 [1,0,0,1,0,0|2,0,0]=4 18075 B14R1.6343 C=C(C)CCOCC1CCCCCC1 7a_100000699130_100000730704 [1,0,0,1,0,0|2,0,0]=4 18076 B14R1.6343 C=C(C)CCSCC1CCCCCC1 62a_100000730704_200000696569 [1,0,0,1,0,0|2,0,0]=4 18077 B14R1.6343 C=C(C)CCSCC1CCCCCC1 62a_200000696569_100000730704 [1,0,0,1,0,0|2,0,0]=4 18078 B14R1.6343 C=C(C)CNCCC1CCCCCC1 2230a_100011532351_100000748629 [1,0,0,1,0,0|2,0,0]=4 18079 B14R1.6343 C=C(C)CNCCC1CCCCCC1 34a_100011532351_100000748629 [1,0,0,1,0,0|2,0,0]=4 18080 B14R1.6343 CC(=O)CCCCN1CCCCCC1 269982a_100000185865_100000735457 [1,0,0,1,0,0|1,0,0]=3 18081 B14R1.6343 CC(=O)CCCCN1CCCCCC1 34a_100000185865_100009817362 [1,0,0,1,0,0|1,0,0]=3 18082 B14R1.6343 CC(=O)CCCCN1CCCOCC1 269982a_100000685342_100000735457 [1,0,0,1,0,0|2,0,0]=4 18083 B14R1.6343 CC(=O)CCCCN1CCCOCC1 34a_100000685342_100009817362 [1,0,0,1,0,0|2,0,0]=4 18084 B14R1.6343 CC(=O)CCCNC1CCCCCC1 34a_100000210984_100000685027 [1,0,0,1,0,0|1,0,0]=3 18085 B14R1.6343 CC(=O)CCCOC1CCCCCC1 34a_100000210887_100000685027 [1,0,0,1,0,0|1,0,0]=3 18086 B14R1.6343 CC(=O)CCCOC1CCCCCC1 34a_100000759063_100011217769 [1,0,0,1,0,0|1,0,0]=3 18087 B14R1.6343 CC(=O)CCCOC1CCCCCC1 7a_100000210887_100011215641 [1,0,0,1,0,0|1,0,0]=3 18088 B14R1.6343 CC(=O)CCCSC1CCCCCC1 62a_100011215641_100011217769 [1,0,0,1,0,0|1,0,0]=3 18089 B14R1.6343 CC(=O)CCCSC1CCCCCC1 62a_100011217769_100011215641 [1,0,0,1,0,0|1,0,0]=3 18090 B14R1.6343 CC(=O)CCOCC1CCCCCC1 34a_100000759926_200000696569 [1,0,0,1,0,0|1,0,0]=3 18091 B14R1.6343 CC(=O)CCOCC1CCCCCC1 7a_100000699130_100000053229 [1,0,0,1,0,0|1,0,0]=3 18092 B14R1.6343 CC(=O)CCOCC1CCCCCC1 7a_100000759926_200000696569 [1,0,0,1,0,0|1,0,0]=3 18093 B14R1.6343 CC(=O)CCSCC1CCCCCC1 62a_100000053229_200000696569 [1,0,0,1,0,0|1,0,0]=3 18094 B14R1.6343 CC(=O)CCSCC1CCCCCC1 62a_200000696569_100000053229 [1,0,0,1,0,0|1,0,0]=3 18095 B14R1.6343 CC(=O)NCCCN1CCCCCC1 11a_100000181460_100015343762 [1,0,0,1,0,0|2,0,0]=4 18096 B14R1.6343 CC(=O)NCCCN1CCCCCC1 240690a_100000181460_100015343762 [1,0,0,1,0,0|2,0,0]=4 18097 B14R1.6343 CC(=O)NCCCN1CCCCCC1 527a_100000181460_100103153847 [1,0,0,1,0,0|2,0,0]=4 18098 B14R1.6343 CC(=O)NCCNC1CCCCCC1 2230a_100000210984_100000189650 [1,0,0,1,0,0|2,0,0]=4 18099 B14R1.6343 CC(=O)NCCOC1CCCCCC1 34a_100000158858_100011217769 [1,0,0,1,0,0|2,0,0]=4 18100 B14R1.6343 CC(=O)NCCOC1CCCCCC1 7a_100000210887_100000189650 [1,0,0,1,0,0|2,0,0]=4 18101 B14R1.6343 CC(=O)NCCSC1CCCCCC1 62a_100000189650_100011217769 [1,0,0,1,0,0|2,0,0]=4 18102 B14R1.6343 CC(=O)NCCSC1CCCCCC1 62a_100011217769_100000189650 [1,0,0,1,0,0|2,0,0]=4 18103 B14R1.6343 CC(=O)OCCCN1CCCCCC1 269982a_100000185865_100000042594 [1,0,0,1,0,0|2,0,0]=4 18104 B14R1.6343 CC(=O)OCCCN1CCCCCC1 34a_100000185865_100000042594 [1,0,0,1,0,0|2,0,0]=4 18105 B14R1.6343 CC(=O)OCCNC1CCCCCC1 34a_100000210984_100009814007 [1,0,0,1,0,0|2,0,0]=4 18106 B14R1.6343 CC(=O)OCCOC1CCCCCC1 34a_100000210887_100009814007 [1,0,0,1,0,0|2,0,0]=4 18107 B14R1.6343 CC(=O)OCCOC1CCCCCC1 7a_100000210887_100009814007 [1,0,0,1,0,0|2,0,0]=4 18108 B14R1.6343 CC(=O)OCCSC1CCCCCC1 62a_100009814007_100011217769 [1,0,0,1,0,0|2,0,0]=4 18109 B14R1.6343 CC(=O)OCCSC1CCCCCC1 62a_100011217769_100009814007 [1,0,0,1,0,0|2,0,0]=4 18110 B14R1.6343 CC(=O)OCNCC1CCCCCC1 34a_100015204231_100009813279 [1,0,0,1,0,0|2,0,0]=4 18111 B14R1.6343 CC(=O)OCOCC1CCCCCC1 34a_100000699130_100009813279 [1,0,0,1,0,0|2,0,0]=4 18112 B14R1.6343 CC(=O)OCSCC1CCCCCC1 62a_100000076356_200000696569 [1,0,0,1,0,0|2,0,0]=4 18113 B14R1.6343 CC(=O)OCSCC1CCCCCC1 62a_200000696569_100000076356 [1,0,0,1,0,0|2,0,0]=4 18114 B14R1.6343 CC(=O)SCCCN1CCCCCC1 2230a_100000185865_100000038929 [1,0,0,1,0,0|2,0,0]=4 18115 B14R1.6343 CC(=O)SCCCN1CCCCCC1 269982a_100000185865_100000038929 [1,0,0,1,0,0|2,0,0]=4 18116 B14R1.6343 CC(=O)SCCCN1CCCCCC1 34a_100000185865_100000038929 [1,0,0,1,0,0|2,0,0]=4 18117 B14R1.6343 CS(=O)CCCNC1CCCCCC1 270004a_200000753449_100000210131 [1,0,0,1,0,0|2,0,0]=4 18118 B14R1.6343 NC(=O)CCCNC1CCCCCC1 34a_100000210984_100102525003 [1,0,0,1,0,0|2,0,0]=4 18119 B14R1.6343 NC(=O)CCCNC1CCCCCC1 34a_100000739312_100011217769 [1,0,0,1,0,0|2,0,0]=4 18120 B14R1.6343 NC(=O)CCCOC1CCCCCC1 34a_100000210887_100102525003 [1,0,0,1,0,0|2,0,0]=4 18121 B14R1.6343 NC(=O)CCCOC1CCCCCC1 7a_100000210887_100102525003 [1,0,0,1,0,0|2,0,0]=4 18122 B14R1.6343 NC(=O)CCCSC1CCCCCC1 62a_100011217769_100102525003 [1,0,0,1,0,0|2,0,0]=4 18123 B14R1.6343 NC(=O)CCCSC1CCCCCC1 62a_100102525003_100011217769 [1,0,0,1,0,0|2,0,0]=4 18124 B14R1.6343 NC(=O)CCNCC1CCCCCC1 2230a_100015204231_100000744528 [1,0,0,1,0,0|2,0,0]=4 18125 B14R1.6343 NC(=O)CCNCC1CCCCCC1 269862a_100000740010_200000763224 [1,0,0,1,0,0|2,0,0]=4 18126 B14R1.6343 NC(=O)CCNCC1CCCCCC1 34a_100015204231_100000731001 [1,0,0,1,0,0|2,0,0]=4 18127 B14R1.6343 NC(=O)CCOCC1CCCCCC1 34a_100000699130_100000731001 [1,0,0,1,0,0|2,0,0]=4 18128 B14R1.6343 NC(=O)CCOCC1CCCCCC1 34a_100000757172_200000696569 [1,0,0,1,0,0|2,0,0]=4 18129 B14R1.6343 NC(=O)CCOCC1CCCCCC1 7a_100000699130_100000744528 [1,0,0,1,0,0|2,0,0]=4 18130 B14R1.6343 NC(=O)CCOCC1CCCCCC1 7a_100000757172_200000696569 [1,0,0,1,0,0|2,0,0]=4 18131 B14R1.6343 NC(=O)CCSCC1CCCCCC1 62a_100000744528_200000696569 [1,0,0,1,0,0|2,0,0]=4 18132 B14R1.6343 NC(=O)CCSCC1CCCCCC1 62a_200000696569_100000744528 [1,0,0,1,0,0|2,0,0]=4 18133 B14R1.6343 NC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000747473 [1,0,0,1,0,0|2,0,0]=4 18134 B14R1.6343 NC(=O)CNCCC1CCCCCC1 34a_100011532351_100000187820 [1,0,0,1,0,0|2,0,0]=4 18135 B14R1.6343 O=C(O)CNCCN1CCCCCC1 269956a_100016091260_100000722644 [1,0,0,1,0,0|2,0,0]=4 18136 B14R1.6343 O=C(O)CONCC1CCCCCC1 269956a_100000106656_200000696569 [1,0,0,1,0,0|2,0,0]=4 18137 B14R1.6343 O=C([O-])CNCCC1CCCCCC1 34a_100011532351_100020667443 [1,0,0,1,0,0|1,0,1]=4 18138 B14R1.6388 CC(=O)CCCCOCCNC1CC1 34a_100000738766_100009817362 [1,0,0,1,0,0|2,0,0]=4 18139 B14R1.6388 CC(=O)CCCCSCCCC1CO1 62a_100000733510_100000735457 [1,0,0,1,0,0|2,0,0]=4 18140 B14R1.6388 CC(=O)CCCCSCCCC1CO1 62a_100000735457_100000733510 [1,0,0,1,0,0|2,0,0]=4 18141 B14R1.6388 CC(=O)NCCCCCCNC1CC1 34a_200011996284_100000211595 [1,0,0,1,0,0|2,0,0]=4 18142 B14R1.6388 CC(=O)NCCCCCNCC1CC1 2230a_200012022750_100000742324 [1,0,0,1,0,0|2,0,0]=4 18143 B14R1.6388 CC(=O)NCCCCCNCC1CC1 269862a_200012022750_100000741477 [1,0,0,1,0,0|2,0,0]=4 18144 B14R1.6388 CC(=O)NCCCCCNCC1CC1 34a_200012022750_100000742324 [1,0,0,1,0,0|2,0,0]=4 18145 B14R1.6388 CC(=O)NCCCCNCCC1CC1 2230a_200011368371_100000694398 [1,0,0,1,0,0|2,0,0]=4 18146 B14R1.6388 CC(=O)NCCCCNCCC1CC1 34a_200011368371_100000694398 [1,0,0,1,0,0|2,0,0]=4 18147 B14R1.6388 CC(=O)OCCCCCNCC1CC1 2230a_100000735609_100009813381 [1,0,0,1,0,0|2,0,0]=4 18148 B14R1.6388 CC(=O)OCCCCCNCC1CC1 34a_100000735609_100000033007 [1,0,0,1,0,0|2,0,0]=4 18149 B14R1.6388 CC(=O)OCCCCCOCC1CC1 34a_100000211283_100000033007 [1,0,0,1,0,0|2,0,0]=4 18150 B14R1.6388 CC(=O)OCCCCCSCC1CC1 62a_100000033007_100000742324 [1,0,0,1,0,0|2,0,0]=4 18151 B14R1.6388 CC(=O)OCCCCCSCC1CC1 62a_100000756562_100000033007 [1,0,0,1,0,0|2,0,0]=4 18152 B14R1.6388 CC(=O)OCCCCNCCC1CC1 34a_100000764129_100000033659 [1,0,0,1,0,0|2,0,0]=4 18153 B14R1.6388 CC(=O)OCCCCOCCC1CC1 34a_100000073216_100000694398 [1,0,0,1,0,0|2,0,0]=4 18154 B14R1.6388 CC(=O)OCCCCOCCC1CC1 34a_100000754188_100000033659 [1,0,0,1,0,0|2,0,0]=4 18155 B14R1.6388 CC(=O)OCCCCOCCC1CC1 7a_100000073216_100000764125 [1,0,0,1,0,0|2,0,0]=4 18156 B14R1.6388 CC(=O)OCCCCOCCC1CC1 7a_100000754188_100000033659 [1,0,0,1,0,0|2,0,0]=4 18157 B14R1.6388 CC(=O)OCCCCSCCC1CC1 62a_100000033659_100000764125 [1,0,0,1,0,0|2,0,0]=4 18158 B14R1.6388 CC(=O)OCCCCSCCC1CC1 62a_100000764125_100000033659 [1,0,0,1,0,0|2,0,0]=4 18159 B14R1.6388 CC(=O)SCCCCNCCC1CC1 34a_100000764129_200010402107 [1,0,0,1,0,0|2,0,0]=4 18160 B14R1.6388 CC(=O)SCCCCOCCC1CC1 34a_100000754188_200010402107 [1,0,0,1,0,0|2,0,0]=4 18161 B14R1.6388 CC(=O)SCCCCOCCC1CC1 7a_100000754188_200010402107 [1,0,0,1,0,0|2,0,0]=4 18162 B14R1.6388 CC(=O)SCCCCSCCC1CC1 62a_100000764125_200010402107 [1,0,0,1,0,0|2,0,0]=4 18163 B14R1.6388 CC(=O)SCCCCSCCC1CC1 62a_200010402107_100000764125 [1,0,0,1,0,0|2,0,0]=4 18164 B14R1.6388 NC(=O)CCCCCNCCC1CC1 34a_100000764129_100009817443 [1,0,0,1,0,0|2,0,0]=4 18165 B14R1.6388 NC(=O)CCCCCOCCC1CC1 34a_100000123541_100000694398 [1,0,0,1,0,0|2,0,0]=4 18166 B14R1.6388 NC(=O)CCCCCOCCC1CC1 34a_100000754188_100009817443 [1,0,0,1,0,0|2,0,0]=4 18167 B14R1.6388 NC(=O)CCCCCOCCC1CC1 7a_100000123541_100000764125 [1,0,0,1,0,0|2,0,0]=4 18168 B14R1.6388 NC(=O)CCCCCOCCC1CC1 7a_100000754188_100009817443 [1,0,0,1,0,0|2,0,0]=4 18169 B14R1.6388 NC(=O)CCCCCSCCC1CC1 62a_100000764125_100009817443 [1,0,0,1,0,0|2,0,0]=4 18170 B14R1.6388 NC(=O)CCCCCSCCC1CC1 62a_100009817443_100000764125 [1,0,0,1,0,0|2,0,0]=4 18171 B14R1.6388 O=C([O-])CCCCCOCCC1CC1 7a_100102619762_100000764125 [1,0,0,1,0,0|1,0,1]=4 18172 B14R1.9 CCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210211 [1,0,0,1,0,0|2,0,0]=4 18173 B14R1.9 CCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210210 [1,0,0,1,0,0|2,0,0]=4 18174 B14R1.14 CCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210314 [1,0,0,1,0,0|2,0,0]=4 18175 B14R1.14 CCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210314 [1,0,0,1,0,0|2,0,0]=4 18176 B14R1.14 CCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210314 [1,0,0,1,0,0|2,0,0]=4 18177 B14R1.14 CCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210314 [1,0,0,1,0,0|2,0,0]=4 18178 B14R1.14 CCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210314 [1,0,0,1,0,0|2,0,0]=4 18179 B14R1.14 CCCCCOCC1CCC(=O)CC1 34a_100000062911_100000718602 [1,0,0,1,0,0|2,0,0]=4 18180 B14R1.109 CCC1CCCC1NCCC(=O)NC 269862a_100000738227_100000749056 [1,0,0,1,0,0|2,0,0]=4 18181 B14R1.109 CCC1CCCC1NCCC(=O)NC 270004a_100000738227_100000749056 [1,0,0,1,0,0|2,0,0]=4 18182 B14R1.109 CCC1CCCN1CCCC(=O)NC 2230a_100000754278_100000741757 [1,0,0,1,0,0|2,0,0]=4 18183 B14R1.109 CCC1CCCN1CCCC(=O)NC 269982a_100000754278_100000741757 [1,0,0,1,0,0|2,0,0]=4 18184 B14R1.109 CCC1CCCN1CCCC(=O)NC 34a_100000754278_100000741757 [1,0,0,1,0,0|2,0,0]=4 18185 B14R1.109 CCC1CCCN1CCCC(=O)OC 2230a_100000754278_100011218270 [1,0,0,1,0,0|1,0,0]=3 18186 B14R1.109 CCC1CCCN1CCCC(=O)OC 269982a_100000754278_100011218270 [1,0,0,1,0,0|1,0,0]=3 18187 B14R1.109 CCC1CCCN1CCCC(=O)OC 34a_100000754278_100000742333 [1,0,0,1,0,0|1,0,0]=3 18188 B14R1.109 CCN1CCCC1CNCC(=O)OC 2230a_100000211693_100000747449 [1,0,0,1,0,0|2,0,0]=4 18189 B14R1.109 CCN1CCC[C@@H]1COCC(=O)OC 34a_100011739246_100000747449 [1,0,0,1,0,0|2,0,0]=4 18190 B14R1.109 CCN1CCC[C@@H]1COCC(=O)OC 7a_100011739246_100000747449 [1,0,0,1,0,0|2,0,0]=4 18191 B14R1.109 COC(=O)CCCN1CCC[C@@H]1CO 2230a_100000745186_100011218270 [1,0,0,1,0,0|2,0,0]=4 18192 B14R1.109 COC(=O)CCCN1CCC[C@@H]1CO 269982a_100000745186_100011218270 [1,0,0,1,0,0|2,0,0]=4 18193 B14R1.109 COC(=O)CCCN1CCC[C@@H]1CO 34a_100000745186_100000742333 [1,0,0,1,0,0|2,0,0]=4 18194 B14R1.229 CCCCCCCCNC1CCC1=O 34a_100000229939_100009892977 [1,0,0,1,0,0|2,0,0]=4 18195 B14R1.229 CCCCCCCCOC1CCC1=O 34a_100000210232_100009892977 [1,0,0,1,0,0|2,0,0]=4 18196 B14R1.229 CCCCCCCCOC1CCC1=O 7a_100000210232_100009892977 [1,0,0,1,0,0|2,0,0]=4 18197 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100000210759_100009892977 [1,0,0,1,0,0|2,0,0]=4 18198 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100009892977_100000210317 [1,0,0,1,0,0|2,0,0]=4 18199 B14R1.229 CCCCCCNCCC1CCC1=O 2230a_100000210581_200016118888 [1,0,0,1,0,0|2,0,0]=4 18200 B14R1.229 CCCCCCOCCC1CCC1=O 7a_100000210259_200016118888 [1,0,0,1,0,0|2,0,0]=4 18201 B14R1.229 CCCCCCSCCC1CCC1=O 62a_100000210314_200016118888 [1,0,0,1,0,0|2,0,0]=4 18202 B14R1.229 CCCCCCSCCC1CCC1=O 62a_200016118888_100000210757 [1,0,0,1,0,0|2,0,0]=4 18203 B14R1.259 COCC1CCN1CCCC(=O)OC 2230a_100015195929_100011218270 [1,0,0,1,0,0|2,0,0]=4 18204 B14R1.259 COCC1CCN1CCCC(=O)OC 269982a_100015195929_100011218270 [1,0,0,1,0,0|2,0,0]=4 18205 B14R1.259 COCC1CCN1CCCC(=O)OC 34a_100015195929_100000742333 [1,0,0,1,0,0|2,0,0]=4 18206 B14R1.272 CCCC1CCCC1NCC(=O)NC 269862a_100000693194_100000723119 [1,0,0,1,0,0|2,0,0]=4 18207 B14R1.272 CCCC1CCCC1NCC(=O)NC 270004a_100000693194_100000723119 [1,0,0,1,0,0|2,0,0]=4 18208 B14R1.272 COC[C@@H]1CCCN1CCC(=O)OC 2230a_100020646714_100000204255 [1,0,0,1,0,0|2,0,0]=4 18209 B14R1.272 COC[C@@H]1CCCN1CCC(=O)OC 269982a_100020646714_100000204255 [1,0,0,1,0,0|2,0,0]=4 18210 B14R1.272 COC[C@@H]1CCCN1CCC(=O)OC 34a_100020646714_100000742370 [1,0,0,1,0,0|2,0,0]=4 18211 B14R1.483 CCCC1CCCCN1CC(=O)CC 269982a_100000701414_100000747405 [1,0,0,1,0,0|2,0,0]=4 18212 B14R1.483 CCCC1CCCCN1CC(=O)NC 2230a_100000701414_100000183359 [1,0,0,1,0,0|2,0,0]=4 18213 B14R1.483 CCCC1CCCCN1CC(=O)NC 269982a_100000701414_100000183359 [1,0,0,1,0,0|2,0,0]=4 18214 B14R1.483 CCCC1CCCCN1CC(=O)NC 34a_100000701414_100000183359 [1,0,0,1,0,0|2,0,0]=4 18215 B14R1.483 CCCC1CCCCN1CC(=O)OC 2230a_100000701414_100000747449 [1,0,0,1,0,0|1,0,0]=3 18216 B14R1.483 CCCC1CCCCN1CC(=O)OC 269982a_100000701414_100000747449 [1,0,0,1,0,0|1,0,0]=3 18217 B14R1.483 CCCC1CCCCN1CC(=O)OC 34a_100000701414_100000747449 [1,0,0,1,0,0|1,0,0]=3 18218 B14R1.483 CCCC1COCCN1CC(=O)OC 2230a_102495339903_100000747449 [1,0,0,1,0,0|2,0,0]=4 18219 B14R1.483 CCCC1COCCN1CC(=O)OC 269982a_102495339903_100000747449 [1,0,0,1,0,0|2,0,0]=4 18220 B14R1.483 CCCC1COCCN1CC(=O)OC 34a_102495339903_100000747449 [1,0,0,1,0,0|2,0,0]=4 18221 B14R1.483 CCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210303 [1,0,0,1,0,0|2,0,0]=4 18222 B14R1.483 CCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210303 [1,0,0,1,0,0|2,0,0]=4 18223 B14R1.483 COC(=O)CN1CCCCC1CCO 2230a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 18224 B14R1.483 COC(=O)CN1CCCCC1CCO 269982a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 18225 B14R1.483 COC(=O)CN1CCCCC1CCO 34a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 18226 B14R1.483 COCC1CCCCN1CC(=O)OC 2230a_100015184032_100000747449 [1,0,0,1,0,0|2,0,0]=4 18227 B14R1.483 COCC1CCCCN1CC(=O)OC 269982a_100015184032_100000747449 [1,0,0,1,0,0|2,0,0]=4 18228 B14R1.483 COCC1CCCCN1CC(=O)OC 34a_100015184032_100000747449 [1,0,0,1,0,0|2,0,0]=4 18229 B14R1.716 CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210202 [1,0,0,1,0,0|1,0,0]=3 18230 B14R1.716 CCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000210202 [1,0,0,1,0,0|2,0,0]=4 18231 B14R1.716 CCC(=O)COCCC1CCCCC1 34a_100000725409_100011209188 [1,0,0,1,0,0|2,0,0]=4 18232 B14R1.716 CCC(=O)COCCC1CCCCC1 7a_100011217863_100000747405 [1,0,0,1,0,0|2,0,0]=4 18233 B14R1.716 CCC(=O)CSCCC1CCCCC1 62a_100000747405_100012355289 [1,0,0,1,0,0|2,0,0]=4 18234 B14R1.716 CCC(=O)CSCCC1CCCCC1 62a_100012355289_100000747405 [1,0,0,1,0,0|2,0,0]=4 18235 B14R1.716 CCC(=O)NCCCC1CCCCC1 11a_100011211642_100000210414 [1,0,0,1,0,0|2,0,0]=4 18236 B14R1.716 CCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000210414 [1,0,0,1,0,0|2,0,0]=4 18237 B14R1.716 CCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000210414 [1,0,0,1,0,0|2,0,0]=4 18238 B14R1.716 CCC(=O)NCCCC1CCCCC1 527a_100011211642_100000210414 [1,0,0,1,0,0|2,0,0]=4 18239 B14R1.716 CNC(=O)CCCCC1CCCCC1 11a_106832991635_200011215547 [1,0,0,1,0,0|1,0,0]=3 18240 B14R1.716 CNC(=O)CCCCC1CCCCC1 1626a_100102657272_200011215547 [1,0,0,1,0,0|1,0,0]=3 18241 B14R1.716 CNC(=O)CCCCC1CCCCC1 240690a_100102657272_200011215547 [1,0,0,1,0,0|1,0,0]=3 18242 B14R1.716 CNC(=O)CCCCC1CCCCC1 527a_100102657272_200011215547 [1,0,0,1,0,0|1,0,0]=3 18243 B14R1.716 CNC(=O)CCCCN1CCCCC1 11a_106832991635_100000754417 [1,0,0,1,0,0|2,0,0]=4 18244 B14R1.716 CNC(=O)CCCCN1CCCCC1 240690a_100102657272_100000754417 [1,0,0,1,0,0|2,0,0]=4 18245 B14R1.716 CNC(=O)CCCNC1CCCCC1 2230a_100000182618_100000741757 [1,0,0,1,0,0|2,0,0]=4 18246 B14R1.716 CNC(=O)CCCNC1CCCCC1 270004a_100000740002_100000210434 [1,0,0,1,0,0|2,0,0]=4 18247 B14R1.716 CNC(=O)CCCNC1CCCCC1 34a_100000182618_100000741757 [1,0,0,1,0,0|2,0,0]=4 18248 B14R1.716 CNC(=O)CCCNC1CCCCC1 34a_100000740002_100000210327 [1,0,0,1,0,0|2,0,0]=4 18249 B14R1.716 CNC(=O)CCCOC1CCCCC1 34a_100000210231_100000741757 [1,0,0,1,0,0|2,0,0]=4 18250 B14R1.716 CNC(=O)CCCOC1CCCCC1 7a_100000210231_100000741757 [1,0,0,1,0,0|2,0,0]=4 18251 B14R1.716 CNC(=O)CCCSC1CCCCC1 62a_100000210327_100000741757 [1,0,0,1,0,0|2,0,0]=4 18252 B14R1.716 CNC(=O)CCCSC1CCCCC1 62a_100000741757_100000210327 [1,0,0,1,0,0|2,0,0]=4 18253 B14R1.716 CNC(=O)CCNCC1CCCCC1 2230a_100000210473_100000737683 [1,0,0,1,0,0|2,0,0]=4 18254 B14R1.716 CNC(=O)CCNCC1CCCCC1 2230a_100000738227_100000211423 [1,0,0,1,0,0|2,0,0]=4 18255 B14R1.716 CNC(=O)CCNCC1CCCCC1 269862a_100000738227_100000211278 [1,0,0,1,0,0|2,0,0]=4 18256 B14R1.716 CNC(=O)CCNCC1CCCCC1 34a_100000210473_100012179268 [1,0,0,1,0,0|2,0,0]=4 18257 B14R1.716 CNC(=O)CCNCC1CCCCC1 34a_100000738227_100000211423 [1,0,0,1,0,0|2,0,0]=4 18258 B14R1.716 CNC(=O)CCOCC1CCCCC1 34a_100000212181_100012179268 [1,0,0,1,0,0|2,0,0]=4 18259 B14R1.716 CNC(=O)CCOCC1CCCCC1 34a_100000754576_100000211423 [1,0,0,1,0,0|2,0,0]=4 18260 B14R1.716 CNC(=O)CCOCC1CCCCC1 7a_100000212181_100000737683 [1,0,0,1,0,0|2,0,0]=4 18261 B14R1.716 CNC(=O)CCSCC1CCCCC1 62a_100000211423_100000737683 [1,0,0,1,0,0|2,0,0]=4 18262 B14R1.716 CNC(=O)CCSCC1CCCCC1 62a_100000737683_100000211423 [1,0,0,1,0,0|2,0,0]=4 18263 B14R1.716 CNC(=O)CNCCC1CCCCC1 2230a_100000693194_100012355289 [1,0,0,1,0,0|2,0,0]=4 18264 B14R1.716 CNC(=O)CNCCC1CCCCC1 2230a_100000738074_100000183359 [1,0,0,1,0,0|2,0,0]=4 18265 B14R1.716 CNC(=O)CNCCC1CCCCC1 270004a_100000693194_100011713444 [1,0,0,1,0,0|2,0,0]=4 18266 B14R1.716 CNC(=O)CNCCC1CCCCC1 34a_100000738074_100000183359 [1,0,0,1,0,0|2,0,0]=4 18267 B14R1.716 CNC(=O)COCCC1CCCCC1 34a_100000750040_100011209188 [1,0,0,1,0,0|2,0,0]=4 18268 B14R1.716 CNC(=O)COCCC1CCCCC1 34a_100011217863_100000183359 [1,0,0,1,0,0|2,0,0]=4 18269 B14R1.716 CNC(=O)COCCC1CCCCC1 7a_100011217863_100000183359 [1,0,0,1,0,0|2,0,0]=4 18270 B14R1.716 CNC(=O)CSCCC1CCCCC1 62a_100000183359_100012355289 [1,0,0,1,0,0|2,0,0]=4 18271 B14R1.716 CNC(=O)CSCCC1CCCCC1 62a_100012355289_100000183359 [1,0,0,1,0,0|2,0,0]=4 18272 B14R1.716 CNC(=O)NCCCC1CCCCC1 2708a_100011211642_106832991635 [1,0,0,1,0,0|2,0,0]=4 18273 B14R1.716 CNC(=O)NCCCC1CCCCC1 2708a_100102657272_100011211642 [1,0,0,1,0,0|2,0,0]=4 18274 B14R1.716 CNC(=O)NCCCC1CCCCC1 273464a_100011211642_100102657272 [1,0,0,1,0,0|2,0,0]=4 18275 B14R1.716 CNC(=O)NCCCC1CCCCC1 273464a_100102657272_100011211642 [1,0,0,1,0,0|2,0,0]=4 18276 B14R1.716 CNC(=O)NCCCC1CCCCC1 512a_100011211642_100102657272 [1,0,0,1,0,0|2,0,0]=4 18277 B14R1.716 CNC(=O)NCCCC1CCCCC1 512a_106832991638_100011211642 [1,0,0,1,0,0|2,0,0]=4 18278 B14R1.716 COC(=O)CCCCN1CCCOC1 2230a_100000131196_100000204269 [1,0,0,1,0,0|2,0,0]=4 18279 B14R1.716 COC(=O)CCCCN1CCCOC1 269982a_100000131196_100000204269 [1,0,0,1,0,0|2,0,0]=4 18280 B14R1.716 COC(=O)CCCCN1CCCOC1 34a_100000131196_100000204269 [1,0,0,1,0,0|2,0,0]=4 18281 B14R1.716 COC(=O)CCCCN1CCOCC1 2230a_100015191051_100000204269 [1,0,0,1,0,0|2,0,0]=4 18282 B14R1.716 COC(=O)CCCCN1CCOCC1 269982a_100015191051_100000204269 [1,0,0,1,0,0|2,0,0]=4 18283 B14R1.716 COC(=O)CCCCN1CCOCC1 34a_100015191051_100000204269 [1,0,0,1,0,0|2,0,0]=4 18284 B14R1.716 COC(=O)CCCCN1CCSCC1 2230a_100000737611_100000204269 [1,0,0,1,0,0|2,0,0]=4 18285 B14R1.716 COC(=O)CCCCN1CCSCC1 269982a_100000737611_100000204269 [1,0,0,1,0,0|2,0,0]=4 18286 B14R1.716 COC(=O)CCCNC1CCCCC1 2230a_100000182618_100011218270 [1,0,0,1,0,0|1,0,0]=3 18287 B14R1.716 COC(=O)CCCNC1CCCCC1 34a_100000182618_100000742333 [1,0,0,1,0,0|1,0,0]=3 18288 B14R1.716 COC(=O)CCCNC1CCCOC1 2230a_100000719290_100011218270 [1,0,0,1,0,0|2,0,0]=4 18289 B14R1.716 COC(=O)CCCNC1CCCOC1 34a_100000719290_100000742333 [1,0,0,1,0,0|2,0,0]=4 18290 B14R1.716 COC(=O)CCCNC1CCOCC1 2230a_100000741149_100011218270 [1,0,0,1,0,0|2,0,0]=4 18291 B14R1.716 COC(=O)CCCNC1CCOCC1 34a_100000741149_100000742333 [1,0,0,1,0,0|2,0,0]=4 18292 B14R1.716 COC(=O)CCCNC1CCSCC1 2230a_100000748639_100011218270 [1,0,0,1,0,0|2,0,0]=4 18293 B14R1.716 COC(=O)CCCNC1CCSCC1 34a_100000748639_100000742333 [1,0,0,1,0,0|2,0,0]=4 18294 B14R1.716 COC(=O)CCCOC1CCCCC1 34a_100000210231_100000742333 [1,0,0,1,0,0|1,0,0]=3 18295 B14R1.716 COC(=O)CCCOC1CCCCC1 7a_100000210231_100011218270 [1,0,0,1,0,0|1,0,0]=3 18296 B14R1.716 COC(=O)CCCOC1CCCCO1 34a_100000033831_100000742333 [1,0,0,1,0,0|2,0,0]=4 18297 B14R1.716 COC(=O)CCCOC1CCCOC1 34a_100000754041_100000742333 [1,0,0,1,0,0|2,0,0]=4 18298 B14R1.716 COC(=O)CCCOC1CCCSC1 7a_100015962668_100011218270 [1,0,0,1,0,0|2,0,0]=4 18299 B14R1.716 COC(=O)CCCOC1CCOCC1 34a_100000744328_100000742333 [1,0,0,1,0,0|2,0,0]=4 18300 B14R1.716 COC(=O)CCCOC1CCSCC1 34a_100000731022_100000742333 [1,0,0,1,0,0|2,0,0]=4 18301 B14R1.716 COC(=O)CCCOC1CCSCC1 7a_100000731022_100011218270 [1,0,0,1,0,0|2,0,0]=4 18302 B14R1.716 COC(=O)CCCSC1CCCCC1 62a_100000210327_100011218270 [1,0,0,1,0,0|1,0,0]=3 18303 B14R1.716 COC(=O)CCCSC1CCCCC1 62a_100011218270_100000210327 [1,0,0,1,0,0|1,0,0]=3 18304 B14R1.716 COC(=O)CCCSC1CCCOC1 62a_100011218270_100000693364 [1,0,0,1,0,0|2,0,0]=4 18305 B14R1.716 COC(=O)CCCSC1CCOCC1 62a_100011218270_100011324220 [1,0,0,1,0,0|2,0,0]=4 18306 B14R1.716 COC(=O)CCCSC1CCSCC1 62a_100011218270_100000069128 [1,0,0,1,0,0|2,0,0]=4 18307 B14R1.716 COC(=O)CCNCC1CCCCC1 2230a_100000210473_100000204255 [1,0,0,1,0,0|1,0,0]=3 18308 B14R1.716 COC(=O)CCNCC1CCCCC1 34a_100000210473_100000742370 [1,0,0,1,0,0|1,0,0]=3 18309 B14R1.716 COC(=O)CCNCC1CCCCO1 2230a_100000174945_100000204255 [1,0,0,1,0,0|2,0,0]=4 18310 B14R1.716 COC(=O)CCNCC1CCCCO1 34a_100000174945_100000742370 [1,0,0,1,0,0|2,0,0]=4 18311 B14R1.716 COC(=O)CCNCC1CCCOC1 2230a_100000720124_100000204255 [1,0,0,1,0,0|2,0,0]=4 18312 B14R1.716 COC(=O)CCNCC1CCCOC1 34a_100000720124_100000742370 [1,0,0,1,0,0|2,0,0]=4 18313 B14R1.716 COC(=O)CCNCC1CCOCC1 2230a_100000746373_100000204255 [1,0,0,1,0,0|2,0,0]=4 18314 B14R1.716 COC(=O)CCNCC1CCOCC1 34a_100000746373_100000742370 [1,0,0,1,0,0|2,0,0]=4 18315 B14R1.716 COC(=O)CCNCC1CCSCC1 2230a_100015188806_100000204255 [1,0,0,1,0,0|2,0,0]=4 18316 B14R1.716 COC(=O)CCNCC1CCSCC1 34a_100015188806_100000742370 [1,0,0,1,0,0|2,0,0]=4 18317 B14R1.716 COC(=O)CCOCC1CCCCC1 34a_100000212181_100000742370 [1,0,0,1,0,0|1,0,0]=3 18318 B14R1.716 COC(=O)CCOCC1CCCCC1 7a_100000212181_100000204255 [1,0,0,1,0,0|1,0,0]=3 18319 B14R1.716 COC(=O)CCOCC1CCCCN1 34a_100000210821_100000742370 [1,0,0,1,0,0|2,0,0]=4 18320 B14R1.716 COC(=O)CCOCC1CCCCO1 34a_100000211370_100000742370 [1,0,0,1,0,0|2,0,0]=4 18321 B14R1.716 COC(=O)CCOCC1CCCCO1 7a_100000211370_100000204255 [1,0,0,1,0,0|2,0,0]=4 18322 B14R1.716 COC(=O)CCOCC1CCCNC1 34a_100000211344_100000742370 [1,0,0,1,0,0|2,0,0]=4 18323 B14R1.716 COC(=O)CCOCC1CCCOC1 34a_100000741520_100000742370 [1,0,0,1,0,0|2,0,0]=4 18324 B14R1.716 COC(=O)CCOCC1CCNCC1 34a_100000738675_100000742370 [1,0,0,1,0,0|2,0,0]=4 18325 B14R1.716 COC(=O)CCOCC1CCOCC1 34a_100000749013_100000742370 [1,0,0,1,0,0|2,0,0]=4 18326 B14R1.716 COC(=O)CCOCC1CCSCC1 34a_100000070558_100000742370 [1,0,0,1,0,0|2,0,0]=4 18327 B14R1.716 COC(=O)CCOCC1CCSCC1 7a_100000070558_100000204255 [1,0,0,1,0,0|2,0,0]=4 18328 B14R1.716 COC(=O)CCSCC1CCCCC1 62a_100000204255_100000211423 [1,0,0,1,0,0|1,0,0]=3 18329 B14R1.716 COC(=O)CCSCC1CCCCC1 62a_100000211423_100000204255 [1,0,0,1,0,0|1,0,0]=3 18330 B14R1.716 COC(=O)CCSCC1CCCCO1 62a_100000204255_100000211543 [1,0,0,1,0,0|2,0,0]=4 18331 B14R1.716 COC(=O)CCSCC1CCCCO1 62a_100000211543_100000204255 [1,0,0,1,0,0|2,0,0]=4 18332 B14R1.716 COC(=O)CCSCC1CCCOC1 62a_100000204255_100000741521 [1,0,0,1,0,0|2,0,0]=4 18333 B14R1.716 COC(=O)CCSCC1CCCOC1 62a_100000741521_100000204255 [1,0,0,1,0,0|2,0,0]=4 18334 B14R1.716 COC(=O)CCSCC1CCOCC1 62a_100000204255_100000749018 [1,0,0,1,0,0|2,0,0]=4 18335 B14R1.716 COC(=O)CCSCC1CCOCC1 62a_100000754603_100000204255 [1,0,0,1,0,0|2,0,0]=4 18336 B14R1.716 COC(=O)CNCCC1CCCCC1 2230a_100000738074_100000747449 [1,0,0,1,0,0|1,0,0]=3 18337 B14R1.716 COC(=O)CNCCC1CCCCC1 34a_100000738074_100000747449 [1,0,0,1,0,0|1,0,0]=3 18338 B14R1.716 COC(=O)CNCCC1CCCCO1 2230a_100015183643_100000747449 [1,0,0,1,0,0|2,0,0]=4 18339 B14R1.716 COC(=O)CNCCC1CCCCO1 34a_100015183643_100000747449 [1,0,0,1,0,0|2,0,0]=4 18340 B14R1.716 COC(=O)CNCCC1CCOCC1 2230a_100000755988_100000747449 [1,0,0,1,0,0|2,0,0]=4 18341 B14R1.716 COC(=O)CNCCC1CCOCC1 34a_100000755988_100000747449 [1,0,0,1,0,0|2,0,0]=4 18342 B14R1.716 COC(=O)COCCC1CCCCC1 34a_100011217863_100000747449 [1,0,0,1,0,0|1,0,0]=3 18343 B14R1.716 COC(=O)COCCC1CCCCC1 7a_100011217863_100000747449 [1,0,0,1,0,0|1,0,0]=3 18344 B14R1.716 COC(=O)COCCC1CCCCN1 34a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 18345 B14R1.716 COC(=O)COCCC1CCCNC1 34a_100000752241_100000747449 [1,0,0,1,0,0|2,0,0]=4 18346 B14R1.716 COC(=O)COCCC1CCNCC1 34a_100015190746_100000747449 [1,0,0,1,0,0|2,0,0]=4 18347 B14R1.716 COC(=O)COCCC1CCOCC1 34a_100011933979_100000747449 [1,0,0,1,0,0|2,0,0]=4 18348 B14R1.716 COC(=O)COCCC1CCOCC1 7a_100011933979_100000747449 [1,0,0,1,0,0|2,0,0]=4 18349 B14R1.716 COC(=O)CSCCC1CCCCC1 62a_100000747449_100012355289 [1,0,0,1,0,0|1,0,0]=3 18350 B14R1.716 COC(=O)CSCCC1CCCCC1 62a_100012355289_100000747449 [1,0,0,1,0,0|1,0,0]=3 18351 B14R1.716 COC(=O)CSCCC1CCOCC1 62a_100000747449_100011934994 [1,0,0,1,0,0|2,0,0]=4 18352 B14R1.716 COC(=O)CSCCC1CCOCC1 62a_100011934994_100000747449 [1,0,0,1,0,0|2,0,0]=4 18353 B14R1.716 COC(=O)CSCCN1CCCCC1 62a_100000739454_100000747449 [1,0,0,1,0,0|2,0,0]=4 18354 B14R1.716 COC(=O)CSCCN1CCCCC1 62a_100000747449_100000739454 [1,0,0,1,0,0|2,0,0]=4 18355 B14R1.716 COC(=O)CSCOC1CCCCC1 62a_100000747449_100011935260 [1,0,0,1,0,0|2,0,0]=4 18356 B14R1.716 COC(=O)CSCOC1CCCCC1 62a_100011935260_100000747449 [1,0,0,1,0,0|2,0,0]=4 18357 B14R1.716 COC(=O)NCCOC1CCCCC1 34a_100000757965_100000210327 [1,0,0,1,0,0|2,0,0]=4 18358 B14R1.716 COC(=O)OCCOC1CCCCC1 34a_100010262106_100000210327 [1,0,0,1,0,0|2,0,0]=4 18359 B14R1.716 COC(=O)OCSCC1CCCCC1 62a_100000211423_100000139417 [1,0,0,1,0,0|2,0,0]=4 18360 B14R1.716 O=C(CF)CCCCC1CCCCC1 1458a_200011215547_100015361967 [1,0,0,1,0,0|2,0,0]=4 18361 B14R1.730 CCC(=O)COCCCC1CCCC1 34a_100000725409_100011713738 [1,0,0,1,0,0|2,0,0]=4 18362 B14R1.730 CCC(=O)COCCCC1CCCC1 7a_100011215328_100000747405 [1,0,0,1,0,0|2,0,0]=4 18363 B14R1.730 CCC(=O)CSCCCC1CCCC1 62a_100000747405_100011713738 [1,0,0,1,0,0|2,0,0]=4 18364 B14R1.730 CCC(=O)CSCCCC1CCCC1 62a_100011713738_100000747405 [1,0,0,1,0,0|2,0,0]=4 18365 B14R1.730 CNC(=O)CCCNCC1CCCC1 2230a_100000737975_100000741757 [1,0,0,1,0,0|2,0,0]=4 18366 B14R1.730 CNC(=O)CCCNCC1CCCC1 2230a_100000740002_100000740388 [1,0,0,1,0,0|2,0,0]=4 18367 B14R1.730 CNC(=O)CCCNCC1CCCC1 269862a_100000740002_100000746403 [1,0,0,1,0,0|2,0,0]=4 18368 B14R1.730 CNC(=O)CCCNCC1CCCC1 34a_100000737975_100000741757 [1,0,0,1,0,0|2,0,0]=4 18369 B14R1.730 CNC(=O)CCCNCC1CCCC1 34a_100000740002_100000740388 [1,0,0,1,0,0|2,0,0]=4 18370 B14R1.730 CNC(=O)CCCOCC1CCCC1 34a_100000742336_100000741757 [1,0,0,1,0,0|2,0,0]=4 18371 B14R1.730 CNC(=O)CCCOCC1CCCC1 7a_100000742336_100000741757 [1,0,0,1,0,0|2,0,0]=4 18372 B14R1.730 CNC(=O)CCCSCC1CCCC1 62a_100000740388_100000741757 [1,0,0,1,0,0|2,0,0]=4 18373 B14R1.730 CNC(=O)CCCSCC1CCCC1 62a_100000741757_100000740388 [1,0,0,1,0,0|2,0,0]=4 18374 B14R1.730 CNC(=O)CCNCCC1CCCC1 2230a_100000738227_100000760354 [1,0,0,1,0,0|2,0,0]=4 18375 B14R1.730 CNC(=O)CCNCCC1CCCC1 2230a_100000739158_100000737683 [1,0,0,1,0,0|2,0,0]=4 18376 B14R1.730 CNC(=O)CCNCCC1CCCC1 34a_100000738227_100000760354 [1,0,0,1,0,0|2,0,0]=4 18377 B14R1.730 CNC(=O)CCNCCC1CCCC1 34a_100000739158_100012179268 [1,0,0,1,0,0|2,0,0]=4 18378 B14R1.730 CNC(=O)CCOCCC1CCCC1 34a_100000749090_100012179268 [1,0,0,1,0,0|2,0,0]=4 18379 B14R1.730 CNC(=O)CCOCCC1CCCC1 34a_100000754576_100000760354 [1,0,0,1,0,0|2,0,0]=4 18380 B14R1.730 CNC(=O)CCOCCC1CCCC1 7a_100000749090_100000737683 [1,0,0,1,0,0|2,0,0]=4 18381 B14R1.730 CNC(=O)CCSCCC1CCCC1 62a_100000737683_100000760354 [1,0,0,1,0,0|2,0,0]=4 18382 B14R1.730 CNC(=O)CCSCCC1CCCC1 62a_100000760354_100000737683 [1,0,0,1,0,0|2,0,0]=4 18383 B14R1.730 CNC(=O)CNCCCC1CCCC1 2230a_100000693194_100011713738 [1,0,0,1,0,0|2,0,0]=4 18384 B14R1.730 CNC(=O)CNCCCC1CCCC1 2230a_100000736752_100000183359 [1,0,0,1,0,0|2,0,0]=4 18385 B14R1.730 CNC(=O)CNCCCC1CCCC1 34a_100000736752_100000183359 [1,0,0,1,0,0|2,0,0]=4 18386 B14R1.730 CNC(=O)COCCCC1CCCC1 34a_100000750040_100011713738 [1,0,0,1,0,0|2,0,0]=4 18387 B14R1.730 CNC(=O)COCCCC1CCCC1 34a_100011215328_100000183359 [1,0,0,1,0,0|2,0,0]=4 18388 B14R1.730 CNC(=O)COCCCC1CCCC1 7a_100011215328_100000183359 [1,0,0,1,0,0|2,0,0]=4 18389 B14R1.730 CNC(=O)CSCCCC1CCCC1 62a_100000183359_100011713738 [1,0,0,1,0,0|2,0,0]=4 18390 B14R1.730 CNC(=O)CSCCCC1CCCC1 62a_100011713738_100000183359 [1,0,0,1,0,0|2,0,0]=4 18391 B14R1.730 COC(=O)CCCCCN1CCCC1 2230a_100000188435_100009816466 [1,0,0,1,0,0|1,0,0]=3 18392 B14R1.730 COC(=O)CCCCCN1CCCC1 269982a_100000188435_100009816466 [1,0,0,1,0,0|1,0,0]=3 18393 B14R1.730 COC(=O)CCCCCN1CCSC1 2230a_100011215254_100009816466 [1,0,0,1,0,0|2,0,0]=4 18394 B14R1.730 COC(=O)CCCCCN1CCSC1 269982a_100011215254_100009816466 [1,0,0,1,0,0|2,0,0]=4 18395 B14R1.730 COC(=O)CCCCNC1CCCC1 2230a_100000211070_100000204269 [1,0,0,1,0,0|1,0,0]=3 18396 B14R1.730 COC(=O)CCCCNC1CCCC1 34a_100000211070_100000204269 [1,0,0,1,0,0|1,0,0]=3 18397 B14R1.730 COC(=O)CCCCN[C@@H]1CCOC1 2230a_200015188469_100000204269 [1,0,0,1,0,0|2,0,0]=4 18398 B14R1.730 COC(=O)CCCCN[C@H]1CCOC1 2230a_100015188467_100000204269 [1,0,0,1,0,0|2,0,0]=4 18399 B14R1.730 COC(=O)CCCCN[C@H]1CCOC1 34a_100015188467_100000204269 [1,0,0,1,0,0|2,0,0]=4 18400 B14R1.730 COC(=O)CCCCOC1CCCC1 34a_100000059025_100000179811 [1,0,0,1,0,0|1,0,0]=3 18401 B14R1.730 COC(=O)CCCCOC1CCCC1 34a_100000210269_100000204269 [1,0,0,1,0,0|1,0,0]=3 18402 B14R1.730 COC(=O)CCCCOC1CCCC1 7a_100000059025_100000179811 [1,0,0,1,0,0|1,0,0]=3 18403 B14R1.730 COC(=O)CCCCOC1CCCC1 7a_100000210269_100000204269 [1,0,0,1,0,0|1,0,0]=3 18404 B14R1.730 COC(=O)CCCCOC1CCCO1 34a_100000085407_100000204269 [1,0,0,1,0,0|2,0,0]=4 18405 B14R1.730 COC(=O)CCCCOC1CCOC1 34a_100000059025_100000690089 [1,0,0,1,0,0|2,0,0]=4 18406 B14R1.730 COC(=O)CCCCOC1CCOC1 7a_100000059025_100000731011 [1,0,0,1,0,0|2,0,0]=4 18407 B14R1.730 COC(=O)CCCCOC1CCSC1 7a_100011232664_100000204269 [1,0,0,1,0,0|2,0,0]=4 18408 B14R1.730 COC(=O)CCCCO[C@H]1CCOC1 34a_100000717292_100000204269 [1,0,0,1,0,0|2,0,0]=4 18409 B14R1.730 COC(=O)CCCCSC1CCCC1 62a_100000204269_100000179811 [1,0,0,1,0,0|1,0,0]=3 18410 B14R1.730 COC(=O)CCCCSC1CCCC1 62a_100011217020_100000204269 [1,0,0,1,0,0|1,0,0]=3 18411 B14R1.730 COC(=O)CCCCSC1CCOC1 62a_100000204269_100000690089 [1,0,0,1,0,0|2,0,0]=4 18412 B14R1.730 COC(=O)CCCNCC1CCCC1 2230a_100000737975_100011218270 [1,0,0,1,0,0|1,0,0]=3 18413 B14R1.730 COC(=O)CCCNCC1CCCC1 34a_100000737975_100000742333 [1,0,0,1,0,0|1,0,0]=3 18414 B14R1.730 COC(=O)CCCNCC1CCOC1 2230a_100000737293_100011218270 [1,0,0,1,0,0|2,0,0]=4 18415 B14R1.730 COC(=O)CCCNCC1CCOC1 34a_100000737293_100000742333 [1,0,0,1,0,0|2,0,0]=4 18416 B14R1.730 COC(=O)CCCNC[C@@H]1CCCO1 2230a_100020590478_100011218270 [1,0,0,1,0,0|2,0,0]=4 18417 B14R1.730 COC(=O)CCCNC[C@@H]1CCCO1 34a_100020590478_100000742333 [1,0,0,1,0,0|2,0,0]=4 18418 B14R1.730 COC(=O)CCCOCC1CCCC1 34a_100000742336_100000742333 [1,0,0,1,0,0|1,0,0]=3 18419 B14R1.730 COC(=O)CCCOCC1CCCC1 7a_100000742336_100011218270 [1,0,0,1,0,0|1,0,0]=3 18420 B14R1.730 COC(=O)CCCOCC1CCCO1 34a_100000210270_100000742333 [1,0,0,1,0,0|2,0,0]=4 18421 B14R1.730 COC(=O)CCCOCC1CCCO1 7a_100000210270_100011218270 [1,0,0,1,0,0|2,0,0]=4 18422 B14R1.730 COC(=O)CCCOCC1CCNC1 34a_100000748654_100000742333 [1,0,0,1,0,0|2,0,0]=4 18423 B14R1.730 COC(=O)CCCOCC1CCOC1 34a_100000740260_100000742333 [1,0,0,1,0,0|2,0,0]=4 18424 B14R1.730 COC(=O)CCCOC[C@H]1CCCN1 34a_100000745186_100000742333 [1,0,0,1,0,0|2,0,0]=4 18425 B14R1.730 COC(=O)CCCSCC1CCCC1 62a_100000740388_100011218270 [1,0,0,1,0,0|1,0,0]=3 18426 B14R1.730 COC(=O)CCCSCC1CCCC1 62a_100011218270_100000740388 [1,0,0,1,0,0|1,0,0]=3 18427 B14R1.730 COC(=O)CCCSCC1CCCO1 62a_100000203698_100011218270 [1,0,0,1,0,0|2,0,0]=4 18428 B14R1.730 COC(=O)CCCSCC1CCCO1 62a_100011218270_100000203698 [1,0,0,1,0,0|2,0,0]=4 18429 B14R1.730 COC(=O)CCCSCC1CCOC1 62a_100000702531_100011218270 [1,0,0,1,0,0|2,0,0]=4 18430 B14R1.730 COC(=O)CCCSCC1CCOC1 62a_100011218270_100000702531 [1,0,0,1,0,0|2,0,0]=4 18431 B14R1.730 COC(=O)CCNCCC1CCCC1 2230a_100000739158_100000204255 [1,0,0,1,0,0|1,0,0]=3 18432 B14R1.730 COC(=O)CCNCCC1CCCC1 34a_100000739158_100000742370 [1,0,0,1,0,0|1,0,0]=3 18433 B14R1.730 COC(=O)CCOCCC1CCCC1 34a_100000749090_100000742370 [1,0,0,1,0,0|1,0,0]=3 18434 B14R1.730 COC(=O)CCOCCC1CCCC1 7a_100000749090_100000204255 [1,0,0,1,0,0|1,0,0]=3 18435 B14R1.730 COC(=O)CCOCCC1CCNC1 34a_100016987287_100000742370 [1,0,0,1,0,0|2,0,0]=4 18436 B14R1.730 COC(=O)CCOCCC1CCOC1 34a_100011879284_100000742370 [1,0,0,1,0,0|2,0,0]=4 18437 B14R1.730 COC(=O)CCSCCC1CCCC1 62a_100000204255_100000760354 [1,0,0,1,0,0|1,0,0]=3 18438 B14R1.730 COC(=O)CCSCCC1CCCC1 62a_100000760354_100000204255 [1,0,0,1,0,0|1,0,0]=3 18439 B14R1.730 COC(=O)CCSCCN1CCCC1 62a_100000204255_100000004467 [1,0,0,1,0,0|2,0,0]=4 18440 B14R1.730 COC(=O)CCSCCN1CCCC1 62a_100000700749_100000204255 [1,0,0,1,0,0|2,0,0]=4 18441 B14R1.730 COC(=O)CNCCCC1CCCC1 2230a_100000736752_100000747449 [1,0,0,1,0,0|1,0,0]=3 18442 B14R1.730 COC(=O)CNCCCC1CCCC1 34a_100000736752_100000747449 [1,0,0,1,0,0|1,0,0]=3 18443 B14R1.730 COC(=O)CNCCOC1CCCC1 34a_100000741755_100000747449 [1,0,0,1,0,0|2,0,0]=4 18444 B14R1.730 COC(=O)COCCCC1CCCC1 34a_100011215328_100000747449 [1,0,0,1,0,0|1,0,0]=3 18445 B14R1.730 COC(=O)COCCCC1CCCC1 7a_100011215328_100000747449 [1,0,0,1,0,0|1,0,0]=3 18446 B14R1.730 COC(=O)COCCNC1CCCC1 2230a_100000211070_100000090808 [1,0,0,1,0,0|2,0,0]=4 18447 B14R1.730 COC(=O)COCCNC1CCCC1 34a_100000211070_100000090808 [1,0,0,1,0,0|2,0,0]=4 18448 B14R1.730 COC(=O)COCCNC1CCCC1 34a_200000200444_100000747449 [1,0,0,1,0,0|2,0,0]=4 18449 B14R1.730 COC(=O)COCCOC1CCCC1 34a_100000210269_100000090808 [1,0,0,1,0,0|2,0,0]=4 18450 B14R1.730 COC(=O)COCCOC1CCCC1 34a_100000738311_100000747449 [1,0,0,1,0,0|2,0,0]=4 18451 B14R1.730 COC(=O)COCCOC1CCCC1 7a_100000210269_100000090808 [1,0,0,1,0,0|2,0,0]=4 18452 B14R1.730 COC(=O)COCCOC1CCCC1 7a_100000738311_100000747449 [1,0,0,1,0,0|2,0,0]=4 18453 B14R1.730 COC(=O)COCCSC1CCCC1 62a_100000090808_100000179811 [1,0,0,1,0,0|2,0,0]=4 18454 B14R1.730 COC(=O)COCCSC1CCCC1 62a_100011217020_100000090808 [1,0,0,1,0,0|2,0,0]=4 18455 B14R1.730 COC(=O)CSCCCC1CCCC1 62a_100000747449_100011713738 [1,0,0,1,0,0|1,0,0]=3 18456 B14R1.730 COC(=O)CSCCCC1CCCC1 62a_100011713738_100000747449 [1,0,0,1,0,0|1,0,0]=3 18457 B14R1.730 COC(=O)CSCCCN1CCCC1 62a_100000747449_100011445909 [1,0,0,1,0,0|2,0,0]=4 18458 B14R1.730 COC(=O)CSCCCN1CCCC1 62a_100016991639_100000747449 [1,0,0,1,0,0|2,0,0]=4 18459 B14R1.730 COC(=O)NCCOCC1CCCC1 34a_100000757965_100000740388 [1,0,0,1,0,0|2,0,0]=4 18460 B14R1.730 COC(=O)OCCOCC1CCCC1 34a_100010262106_100000740388 [1,0,0,1,0,0|2,0,0]=4 18461 B14R1.730 COC(=O)OCSCCC1CCCC1 62a_100000760354_100000139417 [1,0,0,1,0,0|2,0,0]=4 18462 B14R1.789 CCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210211 [1,0,0,1,0,0|2,0,0]=4 18463 B14R1.789 CCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210211 [1,0,0,1,0,0|2,0,0]=4 18464 B14R1.789 CCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210210 [1,0,0,1,0,0|2,0,0]=4 18465 B14R1.789 CCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210211 [1,0,0,1,0,0|1,0,0]=3 18466 B14R1.789 CCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210211 [1,0,0,1,0,0|1,0,0]=3 18467 B14R1.789 CCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210210 [1,0,0,1,0,0|1,0,0]=3 18468 B14R1.789 CCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210211 [1,0,0,1,0,0|2,0,0]=4 18469 B14R1.789 CCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210210 [1,0,0,1,0,0|2,0,0]=4 18470 B14R1.789 CCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210303 [1,0,0,1,0,0|2,0,0]=4 18471 B14R1.789 CCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210303 [1,0,0,1,0,0|1,0,0]=3 18472 B14R1.789 CCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210303 [1,0,0,1,0,0|1,0,0]=3 18473 B14R1.789 CCOCN1CCCCC1C(=O)OC 269982a_100000734855_100000739092 [1,0,0,1,0,0|2,0,0]=4 18474 B14R1.789 COC(=O)C1CCCCN1CCCF 2230a_100000734855_100011934791 [1,0,0,1,0,0|2,0,0]=4 18475 B14R1.789 COC(=O)C1CCCCN1CCCF 269982a_100000734855_100011934791 [1,0,0,1,0,0|2,0,0]=4 18476 B14R1.789 COC(=O)C1CCCCN1CCCF 34a_100000734855_100011934791 [1,0,0,1,0,0|2,0,0]=4 18477 B14R1.789 COC(=O)C1CCCCN1CCCO 2230a_100000734855_100000230001 [1,0,0,1,0,0|2,0,0]=4 18478 B14R1.789 COC(=O)C1CCCCN1CCCO 269982a_100000734855_100011215043 [1,0,0,1,0,0|2,0,0]=4 18479 B14R1.789 COC(=O)C1CCCCN1CCCO 34a_100000734855_100000230001 [1,0,0,1,0,0|2,0,0]=4 18480 B14R1.789 COC(=O)C1CCCCN1CCSC 2230a_100000734855_100000751147 [1,0,0,1,0,0|2,0,0]=4 18481 B14R1.789 COC(=O)C1CCCCN1CCSC 269982a_100000734855_100000212216 [1,0,0,1,0,0|2,0,0]=4 18482 B14R1.789 COC(=O)C1CCCCN1CCSC 34a_100000734855_100000212216 [1,0,0,1,0,0|2,0,0]=4 18483 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCF 34a_100015709673_100011217306 [1,0,0,1,0,0|2,0,0]=4 18484 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCF 7a_100015709673_100011217306 [1,0,0,1,0,0|2,0,0]=4 18485 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCO 34a_100015709673_100000211926 [1,0,0,1,0,0|2,0,0]=4 18486 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCO 7a_100015709673_100000211926 [1,0,0,1,0,0|2,0,0]=4 18487 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCSC 34a_100015709673_100011218213 [1,0,0,1,0,0|2,0,0]=4 18488 B14R1.789 COCCN1CCCCC1C(=O)OC 2230a_100000734855_100011201679 [1,0,0,1,0,0|2,0,0]=4 18489 B14R1.789 COCCN1CCCCC1C(=O)OC 269982a_100000734855_100000233755 [1,0,0,1,0,0|2,0,0]=4 18490 B14R1.789 COCCN1CCCCC1C(=O)OC 34a_100000734855_100011201679 [1,0,0,1,0,0|2,0,0]=4 18491 B14R1.800 CCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210211 [1,0,0,1,0,0|1,0,0]=3 18492 B14R1.800 CCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210211 [1,0,0,1,0,0|1,0,0]=3 18493 B14R1.800 CCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210210 [1,0,0,1,0,0|1,0,0]=3 18494 B14R1.800 CCOCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000739092 [1,0,0,1,0,0|2,0,0]=4 18495 B14R1.800 COC(=O)C[C@H]1CCCN1CCCF 2230a_100025726698_100011934791 [1,0,0,1,0,0|2,0,0]=4 18496 B14R1.800 COC(=O)C[C@H]1CCCN1CCCF 269982a_100025726698_100011934791 [1,0,0,1,0,0|2,0,0]=4 18497 B14R1.800 COC(=O)C[C@H]1CCCN1CCCF 34a_100025726698_100011934791 [1,0,0,1,0,0|2,0,0]=4 18498 B14R1.800 COC(=O)C[C@H]1CCCN1CCCO 2230a_100025726698_100000230001 [1,0,0,1,0,0|2,0,0]=4 18499 B14R1.800 COC(=O)C[C@H]1CCCN1CCCO 269982a_100025726698_100011215043 [1,0,0,1,0,0|2,0,0]=4 18500 B14R1.800 COC(=O)C[C@H]1CCCN1CCCO 34a_100025726698_100000230001 [1,0,0,1,0,0|2,0,0]=4 18501 B14R1.800 COC(=O)C[C@H]1CCCN1CCSC 2230a_100025726698_100000751147 [1,0,0,1,0,0|2,0,0]=4 18502 B14R1.800 COC(=O)C[C@H]1CCCN1CCSC 269982a_100025726698_100000212216 [1,0,0,1,0,0|2,0,0]=4 18503 B14R1.800 COC(=O)C[C@H]1CCCN1CCSC 34a_100025726698_100000212216 [1,0,0,1,0,0|2,0,0]=4 18504 B14R1.800 COCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011201679 [1,0,0,1,0,0|2,0,0]=4 18505 B14R1.800 COCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000233755 [1,0,0,1,0,0|2,0,0]=4 18506 B14R1.800 COCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011201679 [1,0,0,1,0,0|2,0,0]=4 18507 B14R1.819 CNC(=O)CCCNC1CCCC1C 269862a_100000740002_100000752053 [1,0,0,1,0,0|2,0,0]=4 18508 B14R1.819 CNC(=O)CCCOC1CCCC1C 34a_100011216460_100000741757 [1,0,0,1,0,0|2,0,0]=4 18509 B14R1.819 CNC(=O)CCCOC1CCCC1C 7a_100011216460_100000741757 [1,0,0,1,0,0|2,0,0]=4 18510 B14R1.819 COC(=O)CCCCN1CCC[C@@H]1C 2230a_100020605311_100000204269 [1,0,0,1,0,0|1,0,0]=3 18511 B14R1.819 COC(=O)CCCCN1CCC[C@@H]1C 269982a_100020605311_100000204269 [1,0,0,1,0,0|1,0,0]=3 18512 B14R1.819 COC(=O)CCCCN1CCC[C@H]1C 2230a_100015189458_100000204269 [1,0,0,1,0,0|1,0,0]=3 18513 B14R1.819 COC(=O)CCCCN1CCC[C@H]1C 269982a_100015189458_100000204269 [1,0,0,1,0,0|1,0,0]=3 18514 B14R1.819 COC(=O)CCCCN1CCC[C@H]1C 34a_100015189458_100000204269 [1,0,0,1,0,0|1,0,0]=3 18515 B14R1.819 COC(=O)CCCCN1CCSC1C 2230a_200011216479_100000204269 [1,0,0,1,0,0|2,0,0]=4 18516 B14R1.819 COC(=O)CCCCN1CCSC1C 269982a_200011216479_100000204269 [1,0,0,1,0,0|2,0,0]=4 18517 B14R1.819 COC(=O)CCCCN1CCSC1C 34a_200011216479_100000204269 [1,0,0,1,0,0|2,0,0]=4 18518 B14R1.819 COC(=O)CCCOC1CCCC1C 34a_100011216460_100000742333 [1,0,0,1,0,0|1,0,0]=3 18519 B14R1.819 COC(=O)CCCOC1CCCC1C 7a_100011216460_100011218270 [1,0,0,1,0,0|1,0,0]=3 18520 B14R1.819 COC(=O)CCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000742333 [1,0,0,1,0,0|2,0,0]=4 18521 B14R1.819 COC(=O)CCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000742333 [1,0,0,1,0,0|2,0,0]=4 18522 B14R1.819 COC(=O)CCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000742333 [1,0,0,1,0,0|2,0,0]=4 18523 B14R1.819 COC(=O)CCCS[C@@H]1CCC[C@H]1O 62a_100011218270_200016002552 [1,0,0,1,0,0|2,0,0]=4 18524 B14R1.819 COC(=O)CCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011218270 [1,0,0,1,0,0|2,0,0]=4 18525 B14R1.819 COC(=O)CCOCC1CCCN1C 34a_100000743107_100000742370 [1,0,0,1,0,0|2,0,0]=4 18526 B14R1.819 COC(=O)COCCC1CCCN1C 34a_100011215177_100000747449 [1,0,0,1,0,0|2,0,0]=4 18527 B14R1.819 COC(=O)COCCC1CCCN1C 7a_100011215177_100000747449 [1,0,0,1,0,0|2,0,0]=4 18528 B14R1.819 COC(=O)COCCN1CCC[C@@H]1C 2230a_100020605311_100000090808 [1,0,0,1,0,0|2,0,0]=4 18529 B14R1.819 COC(=O)COCCN1CCC[C@H]1C 2230a_100015189458_100000090808 [1,0,0,1,0,0|2,0,0]=4 18530 B14R1.819 COC(=O)COCCN1CCC[C@H]1C 34a_100015189458_100000090808 [1,0,0,1,0,0|2,0,0]=4 18531 B14R1.819 COC(=O)CSCCC1CCCN1C 62a_100000005710_100000747449 [1,0,0,1,0,0|2,0,0]=4 18532 B14R1.819 COC(=O)CSCCC1CCCN1C 62a_100000747449_100000005710 [1,0,0,1,0,0|2,0,0]=4 18533 B14R1.822 COC(=O)CCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009816466 [1,0,0,1,0,0|2,0,0]=4 18534 B14R1.822 COC(=O)CCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009816466 [1,0,0,1,0,0|2,0,0]=4 18535 B14R1.822 COC(=O)CCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009816466 [1,0,0,1,0,0|2,0,0]=4 18536 B14R1.822 COC(=O)CCCCOCC1CC1C 34a_100000744939_100000204269 [1,0,0,1,0,0|1,0,0]=3 18537 B14R1.822 COC(=O)CCCCOCC1CC1C 7a_100000744939_100000204269 [1,0,0,1,0,0|1,0,0]=3 18538 B14R1.822 COC(=O)COCCOCC1CC1C 34a_100000744939_100000090808 [1,0,0,1,0,0|2,0,0]=4 18539 B14R1.822 COC(=O)COCCOCC1CC1C 7a_100000744939_100000090808 [1,0,0,1,0,0|2,0,0]=4 18540 B14R1.823 COC(=O)CCCCCCN1CCC1 269982a_100000754969_100009815986 [1,0,0,1,0,0|1,0,0]=3 18541 B14R1.823 COC(=O)CCCCCNC1CCC1 2230a_100000749019_100009816466 [1,0,0,1,0,0|1,0,0]=3 18542 B14R1.823 COC(=O)CCCCCNC1CCC1 34a_100000749019_100009816466 [1,0,0,1,0,0|1,0,0]=3 18543 B14R1.823 COC(=O)CCCCCNC1COC1 2230a_100016991112_100009816466 [1,0,0,1,0,0|2,0,0]=4 18544 B14R1.823 COC(=O)CCCCCOC1CCC1 34a_100000074720_100000749161 [1,0,0,1,0,0|1,0,0]=3 18545 B14R1.823 COC(=O)CCCCCOC1CCC1 34a_100000748187_100009816466 [1,0,0,1,0,0|1,0,0]=3 18546 B14R1.823 COC(=O)CCCCCOC1COC1 34a_100000074720_100009818527 [1,0,0,1,0,0|2,0,0]=4 18547 B14R1.823 COC(=O)CCCCCOC1COC1 7a_100000074720_100009818527 [1,0,0,1,0,0|2,0,0]=4 18548 B14R1.823 COC(=O)CCCCCOC1CSC1 7a_100000072292_100009816466 [1,0,0,1,0,0|2,0,0]=4 18549 B14R1.823 COC(=O)CCCCCSC1CCC1 62a_100009816466_100000749161 [1,0,0,1,0,0|1,0,0]=3 18550 B14R1.823 COC(=O)CCCCCSC1COC1 62a_100009816466_100009818527 [1,0,0,1,0,0|2,0,0]=4 18551 B14R1.823 COC(=O)CCCCNCC1CCC1 2230a_100000738700_100000204269 [1,0,0,1,0,0|1,0,0]=3 18552 B14R1.823 COC(=O)CCCCNCC1CCC1 34a_100000738700_100000204269 [1,0,0,1,0,0|1,0,0]=3 18553 B14R1.823 COC(=O)CCCCNCC1COC1 2230a_100015281925_100000204269 [1,0,0,1,0,0|2,0,0]=4 18554 B14R1.823 COC(=O)CCCCNCC1COC1 34a_100015281925_100000204269 [1,0,0,1,0,0|2,0,0]=4 18555 B14R1.823 COC(=O)CCCCNC[C@@H]1CCO1 2230a_100020831831_100000204269 [1,0,0,1,0,0|2,0,0]=4 18556 B14R1.823 COC(=O)CCCCNC[C@@H]1CCO1 34a_100020831831_100000204269 [1,0,0,1,0,0|2,0,0]=4 18557 B14R1.823 COC(=O)CCCCOCC1CCC1 34a_100000059025_100000763275 [1,0,0,1,0,0|1,0,0]=3 18558 B14R1.823 COC(=O)CCCCOCC1CCC1 34a_100000760304_100000204269 [1,0,0,1,0,0|1,0,0]=3 18559 B14R1.823 COC(=O)CCCCOCC1CCC1 7a_100000059025_100000763275 [1,0,0,1,0,0|1,0,0]=3 18560 B14R1.823 COC(=O)CCCCOCC1CCO1 34a_100000039022_100000204269 [1,0,0,1,0,0|2,0,0]=4 18561 B14R1.823 COC(=O)CCCCOCC1CCO1 34a_100000059025_100000103362 [1,0,0,1,0,0|2,0,0]=4 18562 B14R1.823 COC(=O)CCCCOCC1CCO1 7a_100000059025_100000103362 [1,0,0,1,0,0|2,0,0]=4 18563 B14R1.823 COC(=O)CCCCOCC1CNC1 34a_100016987283_100000204269 [1,0,0,1,0,0|2,0,0]=4 18564 B14R1.823 COC(=O)CCCCOCC1COC1 34a_100000059025_100010264016 [1,0,0,1,0,0|2,0,0]=4 18565 B14R1.823 COC(=O)CCCCOCC1COC1 34a_100000060846_100000204269 [1,0,0,1,0,0|2,0,0]=4 18566 B14R1.823 COC(=O)CCCCOCC1COC1 7a_100000059025_100010264016 [1,0,0,1,0,0|2,0,0]=4 18567 B14R1.823 COC(=O)CCCCSCC1CCC1 62a_100000204269_100000763275 [1,0,0,1,0,0|1,0,0]=3 18568 B14R1.823 COC(=O)CCCCSCC1CCC1 62a_100000763275_100000204269 [1,0,0,1,0,0|1,0,0]=3 18569 B14R1.823 COC(=O)CCCCSCC1CCO1 62a_100000103362_100000204269 [1,0,0,1,0,0|2,0,0]=4 18570 B14R1.823 COC(=O)CCCCSCC1CCO1 62a_100000204269_100000103362 [1,0,0,1,0,0|2,0,0]=4 18571 B14R1.823 COC(=O)CCCCSCC1COC1 62a_100000204269_100010264016 [1,0,0,1,0,0|2,0,0]=4 18572 B14R1.823 COC(=O)CCCCSCC1COC1 62a_100010264016_100000204269 [1,0,0,1,0,0|2,0,0]=4 18573 B14R1.823 COC(=O)CCCOCCC1COC1 34a_100009855314_100000742333 [1,0,0,1,0,0|2,0,0]=4 18574 B14R1.823 COC(=O)COCCNCC1CCC1 2230a_100000738700_100000090808 [1,0,0,1,0,0|2,0,0]=4 18575 B14R1.823 COC(=O)COCCNCC1CCC1 34a_100000738700_100000090808 [1,0,0,1,0,0|2,0,0]=4 18576 B14R1.823 COC(=O)COCCOCC1CCC1 34a_100000760304_100000090808 [1,0,0,1,0,0|2,0,0]=4 18577 B14R1.823 COC(=O)COCCSCC1CCC1 62a_100000090808_100000763275 [1,0,0,1,0,0|2,0,0]=4 18578 B14R1.823 COC(=O)COCCSCC1CCC1 62a_100000763275_100000090808 [1,0,0,1,0,0|2,0,0]=4 18579 B14R1.827 COC(=O)CCCCCCNC1CC1 34a_100000212008_100009815986 [1,0,0,1,0,0|1,0,0]=3 18580 B14R1.827 COC(=O)CCCCCCOC1CC1 34a_100009863599_100000211595 [1,0,0,1,0,0|1,0,0]=3 18581 B14R1.827 COC(=O)CCCCCCSC1CC1 62a_100009815986_100000211595 [1,0,0,1,0,0|1,0,0]=3 18582 B14R1.827 COC(=O)CCCCCNCC1CC1 2230a_100000735609_100009816466 [1,0,0,1,0,0|1,0,0]=3 18583 B14R1.827 COC(=O)CCCCCNCC1CC1 34a_100000735609_100009816466 [1,0,0,1,0,0|1,0,0]=3 18584 B14R1.827 COC(=O)CCCCCOCC1CC1 34a_100000074720_100000742324 [1,0,0,1,0,0|1,0,0]=3 18585 B14R1.827 COC(=O)CCCCCOCC1CC1 34a_100000211283_100009816466 [1,0,0,1,0,0|1,0,0]=3 18586 B14R1.827 COC(=O)CCCCCOCC1CC1 7a_100000074720_100000742324 [1,0,0,1,0,0|1,0,0]=3 18587 B14R1.827 COC(=O)CCCCCOCC1CO1 34a_100000074720_102125554688 [1,0,0,1,0,0|2,0,0]=4 18588 B14R1.827 COC(=O)CCCCCOCC1CO1 7a_100000074720_102125554688 [1,0,0,1,0,0|2,0,0]=4 18589 B14R1.827 COC(=O)CCCCCOCC1CS1 7a_100000074720_100000031435 [1,0,0,1,0,0|2,0,0]=4 18590 B14R1.827 COC(=O)CCCCCOC[C@@H]1CO1 34a_100000757423_100009816466 [1,0,0,1,0,0|2,0,0]=4 18591 B14R1.827 COC(=O)CCCCCOC[C@@H]1CO1 7a_100000074720_100000745022 [1,0,0,1,0,0|2,0,0]=4 18592 B14R1.827 COC(=O)CCCCCSCC1CC1 62a_100000756562_100009816466 [1,0,0,1,0,0|1,0,0]=3 18593 B14R1.827 COC(=O)CCCCCSCC1CC1 62a_100009816466_100000742324 [1,0,0,1,0,0|1,0,0]=3 18594 B14R1.827 COC(=O)CCCCCSCC1CO1 62a_100009816466_102125554688 [1,0,0,1,0,0|2,0,0]=4 18595 B14R1.827 COC(=O)CCCCCSCC1CO1 62a_102125554688_100009816466 [1,0,0,1,0,0|2,0,0]=4 18596 B14R1.827 COC(=O)CCCCCSCC1CS1 62a_100000031435_100009816466 [1,0,0,1,0,0|2,0,0]=4 18597 B14R1.827 COC(=O)CCCCCSCC1CS1 62a_100009816466_100000031435 [1,0,0,1,0,0|2,0,0]=4 18598 B14R1.827 COC(=O)CCCCCSC[C@@H]1CO1 62a_100000745022_100009816466 [1,0,0,1,0,0|2,0,0]=4 18599 B14R1.827 COC(=O)CCCCCSC[C@@H]1CO1 62a_100009816466_100000745022 [1,0,0,1,0,0|2,0,0]=4 18600 B14R1.827 COC(=O)CCCCNCCC1CC1 34a_100000764129_100000204269 [1,0,0,1,0,0|1,0,0]=3 18601 B14R1.827 COC(=O)CCCCOCCC1CC1 34a_100000059025_100000694398 [1,0,0,1,0,0|1,0,0]=3 18602 B14R1.827 COC(=O)CCCCOCCC1CC1 34a_100000754188_100000204269 [1,0,0,1,0,0|1,0,0]=3 18603 B14R1.827 COC(=O)CCCCOCCC1CC1 7a_100000059025_100000764125 [1,0,0,1,0,0|1,0,0]=3 18604 B14R1.827 COC(=O)CCCCOCCC1CC1 7a_100000754188_100000204269 [1,0,0,1,0,0|1,0,0]=3 18605 B14R1.827 COC(=O)CCCCOCCC1CO1 34a_100000059025_100000732470 [1,0,0,1,0,0|2,0,0]=4 18606 B14R1.827 COC(=O)CCCCOCCC1CO1 7a_100000059025_100000732470 [1,0,0,1,0,0|2,0,0]=4 18607 B14R1.827 COC(=O)CCCCOCC[C@@H]1CO1 34a_100009820653_100000204269 [1,0,0,1,0,0|2,0,0]=4 18608 B14R1.827 COC(=O)CCCCSCCC1CC1 62a_100000204269_100000764125 [1,0,0,1,0,0|1,0,0]=3 18609 B14R1.827 COC(=O)CCCCSCCC1CC1 62a_100000764125_100000204269 [1,0,0,1,0,0|1,0,0]=3 18610 B14R1.827 COC(=O)CCCCSCCC1CO1 62a_100000204269_100000732470 [1,0,0,1,0,0|2,0,0]=4 18611 B14R1.827 COC(=O)CCCCSCCC1CO1 62a_100000732470_100000204269 [1,0,0,1,0,0|2,0,0]=4 18612 B14R1.827 COC(=O)CCCOCCNC1CC1 34a_100000738766_100000742333 [1,0,0,1,0,0|2,0,0]=4 18613 B14R1.827 COC(=O)CCCSCCCC1CO1 62a_100000733510_100011218270 [1,0,0,1,0,0|2,0,0]=4 18614 B14R1.827 COC(=O)CCCSCCCC1CO1 62a_100011218270_100000733510 [1,0,0,1,0,0|2,0,0]=4 18615 B14R1.827 COC(=O)COCCNCCC1CC1 34a_100000764129_100000090808 [1,0,0,1,0,0|2,0,0]=4 18616 B14R1.827 COC(=O)COCCOCCC1CC1 34a_100000754188_100000090808 [1,0,0,1,0,0|2,0,0]=4 18617 B14R1.827 COC(=O)COCCOCCC1CC1 7a_100000754188_100000090808 [1,0,0,1,0,0|2,0,0]=4 18618 B14R1.827 COC(=O)COCCSCCC1CC1 62a_100000090808_100000764125 [1,0,0,1,0,0|2,0,0]=4 18619 B14R1.827 COC(=O)COCCSCCC1CC1 62a_100000764125_100000090808 [1,0,0,1,0,0|2,0,0]=4 18620 B14R1.831 COC(=O)CCCCCN1CCC1C 269982a_100000755817_100009816466 [1,0,0,1,0,0|1,0,0]=3 18621 B14R1.831 COC(=O)CCCCCN1CCC1C 34a_100000755817_100009816466 [1,0,0,1,0,0|1,0,0]=3 18622 B14R1.837 CNC(=O)CCCN1CCCCC1C 2230a_100000211376_100000741757 [1,0,0,1,0,0|2,0,0]=4 18623 B14R1.837 CNC(=O)CCCN1CCCCC1C 269982a_100000211376_100000741757 [1,0,0,1,0,0|2,0,0]=4 18624 B14R1.837 CNC(=O)CCCN1CCCCC1C 34a_100000211376_100000741757 [1,0,0,1,0,0|2,0,0]=4 18625 B14R1.837 CNC(=O)CCNC1CCCCC1C 2230a_100000211402_100000737683 [1,0,0,1,0,0|2,0,0]=4 18626 B14R1.837 CNC(=O)CCNC1CCCCC1C 269862a_100000738227_100000210921 [1,0,0,1,0,0|2,0,0]=4 18627 B14R1.837 CNC(=O)CCNC1CCCCC1C 270004a_100000738227_100000210921 [1,0,0,1,0,0|2,0,0]=4 18628 B14R1.837 CNC(=O)CCNC1CCCCC1C 34a_100000211402_100012179268 [1,0,0,1,0,0|2,0,0]=4 18629 B14R1.837 CNC(=O)CCOC1CCCCC1C 34a_100000211207_100012179268 [1,0,0,1,0,0|2,0,0]=4 18630 B14R1.837 CNC(=O)CCOC1CCCCC1C 7a_100000211207_100000737683 [1,0,0,1,0,0|2,0,0]=4 18631 B14R1.837 COC(=O)CCCN1CCCCC1C 2230a_100000211376_100011218270 [1,0,0,1,0,0|1,0,0]=3 18632 B14R1.837 COC(=O)CCCN1CCCCC1C 269982a_100000211376_100011218270 [1,0,0,1,0,0|1,0,0]=3 18633 B14R1.837 COC(=O)CCCN1CCCCC1C 34a_100000211376_100000742333 [1,0,0,1,0,0|1,0,0]=3 18634 B14R1.837 COC(=O)CCCN1CCOC[C@@H]1C 2230a_100009815349_100011218270 [1,0,0,1,0,0|2,0,0]=4 18635 B14R1.837 COC(=O)CCCN1CCOC[C@@H]1C 269982a_100009815349_100011218270 [1,0,0,1,0,0|2,0,0]=4 18636 B14R1.837 COC(=O)CCCN1CCOC[C@@H]1C 34a_100009815349_100000742333 [1,0,0,1,0,0|2,0,0]=4 18637 B14R1.837 COC(=O)CCNC1CCCCC1C 2230a_100000211402_100000204255 [1,0,0,1,0,0|1,0,0]=3 18638 B14R1.837 COC(=O)CCNC1CCCCC1C 34a_100000211402_100000742370 [1,0,0,1,0,0|1,0,0]=3 18639 B14R1.837 COC(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000204255 [1,0,0,1,0,0|2,0,0]=4 18640 B14R1.837 COC(=O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000742370 [1,0,0,1,0,0|2,0,0]=4 18641 B14R1.837 COC(=O)CCOC1CCCCC1C 34a_100000211207_100000742370 [1,0,0,1,0,0|1,0,0]=3 18642 B14R1.837 COC(=O)CCOC1CCCCC1C 7a_100000211207_100000204255 [1,0,0,1,0,0|1,0,0]=3 18643 B14R1.837 COC(=O)CCOC1CCCCC1Cl 34a_100000038908_100000742370 [1,0,0,1,0,0|2,0,0]=4 18644 B14R1.837 COC(=O)CCOC1CCCCC1Cl 7a_100000038908_100000204255 [1,0,0,1,0,0|2,0,0]=4 18645 B14R1.837 COC(=O)CCOC1CCNCC1C 34a_100011998114_100000742370 [1,0,0,1,0,0|2,0,0]=4 18646 B14R1.837 COC(=O)CCOC1CNCCC1C 34a_100000696640_100000742370 [1,0,0,1,0,0|2,0,0]=4 18647 B14R1.837 COC(=O)CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000742370 [1,0,0,1,0,0|2,0,0]=4 18648 B14R1.837 COC(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000204255 [1,0,0,1,0,0|2,0,0]=4 18649 B14R1.837 COC(=O)CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000742370 [1,0,0,1,0,0|2,0,0]=4 18650 B14R1.837 COC(=O)CCSC1CCCCC1F 62a_100000204255_100015423560 [1,0,0,1,0,0|2,0,0]=4 18651 B14R1.837 COC(=O)CCSC1CCCCC1F 62a_100015423560_100000204255 [1,0,0,1,0,0|2,0,0]=4 18652 B14R1.837 COC(=O)CCSC1CCCCC1O 62a_100000038908_100000204255 [1,0,0,1,0,0|2,0,0]=4 18653 B14R1.837 COC(=O)CCSC1CCCCC1O 62a_100000204255_100000038908 [1,0,0,1,0,0|2,0,0]=4 18654 B14R1.837 COC(=O)CNCC1CCCCC1O 34a_100011216029_100000747449 [1,0,0,1,0,0|2,0,0]=4 18655 B14R1.837 COC(=O)CNCC1CCCCN1C 34a_100011228421_100000747449 [1,0,0,1,0,0|2,0,0]=4 18656 B14R1.837 COC(=O)COCC1CCCCN1C 34a_100000225079_100000747449 [1,0,0,1,0,0|2,0,0]=4 18657 B14R1.837 COC(=O)CSCC1CCCCN1C 62a_100000747449_100015185383 [1,0,0,1,0,0|2,0,0]=4 18658 B14R1.837 COC(=O)CSCC1CCCCN1C 62a_100015185383_100000747449 [1,0,0,1,0,0|2,0,0]=4 18659 B14R1.845 COC1CCCCCCCCCCC1 34a_100000211378_200000210301 [1,0,0,1,0,0|1,0,1]=4 18660 B14R1.845 COC1CCCCCCCCCCC1 7a_100000211378_200000210301 [1,0,0,1,0,0|1,0,1]=4 18661 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 34a_100000211378_200025704644 [1,0,0,1,0,0|1,0,1]=4 18662 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 7a_100000211378_200025704644 [1,0,0,1,0,0|1,0,1]=4 18663 B14R1.863 CCC(=O)COC1CCCCC1CC 7a_100000210738_100000747405 [1,0,0,1,0,0|2,0,0]=4 18664 B14R1.863 CCC1CCCCC1NCC(=O)NC 269862a_100000693194_100000757040 [1,0,0,1,0,0|2,0,0]=4 18665 B14R1.863 CCC1CCCCC1NCC(=O)NC 270004a_100000693194_100000757040 [1,0,0,1,0,0|2,0,0]=4 18666 B14R1.863 CCC1CCCCC1OCC(=O)NC 34a_100000210738_100000183359 [1,0,0,1,0,0|2,0,0]=4 18667 B14R1.863 CCC1CCCCC1OCC(=O)NC 7a_100000210738_100000183359 [1,0,0,1,0,0|2,0,0]=4 18668 B14R1.863 CCC1CCCCC1OCC(=O)OC 34a_100000210738_100000747449 [1,0,0,1,0,0|1,0,0]=3 18669 B14R1.863 CCC1CCCCC1OCC(=O)OC 7a_100000210738_100000747449 [1,0,0,1,0,0|1,0,0]=3 18670 B14R1.863 CCC1CCCCN1CCC(=O)NC 2230a_100000210034_100000737683 [1,0,0,1,0,0|2,0,0]=4 18671 B14R1.863 CCC1CCCCN1CCC(=O)NC 269982a_100000210034_100000737683 [1,0,0,1,0,0|2,0,0]=4 18672 B14R1.863 CCC1CCCCN1CCC(=O)NC 34a_100000210034_100012179268 [1,0,0,1,0,0|2,0,0]=4 18673 B14R1.863 CCC1CCCCN1CCC(=O)OC 2230a_100000210034_100000204255 [1,0,0,1,0,0|1,0,0]=3 18674 B14R1.863 CCC1CCCCN1CCC(=O)OC 269982a_100000210034_100000204255 [1,0,0,1,0,0|1,0,0]=3 18675 B14R1.863 CCC1CCCCN1CCC(=O)OC 34a_100000210034_100000742370 [1,0,0,1,0,0|1,0,0]=3 18676 B14R1.863 CC[C@H]1COCCN1CCC(=O)OC 2230a_100016988097_100000204255 [1,0,0,1,0,0|2,0,0]=4 18677 B14R1.863 CC[C@H]1COCCN1CCC(=O)OC 269982a_100016988097_100000204255 [1,0,0,1,0,0|2,0,0]=4 18678 B14R1.863 CC[C@H]1COCCN1CCC(=O)OC 34a_100016988097_100000742370 [1,0,0,1,0,0|2,0,0]=4 18679 B14R1.863 CN[C@@H]1CCCC[C@H]1OCC(=O)OC 34a_100000708425_100000747449 [1,0,0,1,0,0|2,0,0]=4 18680 B14R1.863 COC(=O)CCN1CCCCC1CO 2230a_100000210821_100000204255 [1,0,0,1,0,0|2,0,0]=4 18681 B14R1.863 COC(=O)CCN1CCCCC1CO 269982a_100000210821_100000204255 [1,0,0,1,0,0|2,0,0]=4 18682 B14R1.863 COC(=O)CCN1CCCCC1CO 34a_100000210821_100000742370 [1,0,0,1,0,0|2,0,0]=4 18683 B14R1.863 COC(=O)CNC1CCCCC1OC 34a_100011208099_100000747449 [1,0,0,1,0,0|2,0,0]=4 18684 B14R1.863 COC(=O)COC1CCCCC1CN 34a_100011216029_100000747449 [1,0,0,1,0,0|2,0,0]=4 18685 B14R1.863 COC(=O)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000747449 [1,0,0,1,0,0|2,0,0]=4 18686 B14R1.863 COC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000747449 [1,0,0,1,0,0|2,0,0]=4 18687 B14R1.913 CCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210326 [1,0,0,1,0,0|2,0,0]=4 18688 B14R1.913 CCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210215 [1,0,0,1,0,0|2,0,0]=4 18689 B14R1.913 CCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000718602 [1,0,0,1,0,0|2,0,0]=4 18690 B14R1.913 CCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210326 [1,0,0,1,0,0|1,0,0]=3 18691 B14R1.913 CCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210215 [1,0,0,1,0,0|1,0,0]=3 18692 B14R1.913 CCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210326 [1,0,0,1,0,0|2,0,0]=4 18693 B14R1.913 CCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210215 [1,0,0,1,0,0|2,0,0]=4 18694 B14R1.913 CCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210215 [1,0,0,1,0,0|2,0,0]=4 18695 B14R1.913 CCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210210 [1,0,0,1,0,0|1,0,0]=3 18696 B14R1.913 CCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210211 [1,0,0,1,0,0|1,0,0]=3 18697 B14R1.913 CCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011215890 [1,0,0,1,0,0|2,0,0]=4 18698 B14R1.913 CCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011215890 [1,0,0,1,0,0|2,0,0]=4 18699 B14R1.913 CCSCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000757381 [1,0,0,1,0,0|2,0,0]=4 18700 B14R1.913 CCSCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000757381 [1,0,0,1,0,0|2,0,0]=4 18701 B14R1.913 COC(=O)C1CCCC1OCCCF 34a_200000081814_100011934791 [1,0,0,1,0,0|2,0,0]=4 18702 B14R1.913 COC(=O)C1CCCC1OCCCF 7a_200000081814_100011934791 [1,0,0,1,0,0|2,0,0]=4 18703 B14R1.913 COC(=O)C1CCCC1OCCCO 34a_200000081814_100000230001 [1,0,0,1,0,0|2,0,0]=4 18704 B14R1.913 COC(=O)C1CCCC1OCCCO 7a_200000081814_100011215043 [1,0,0,1,0,0|2,0,0]=4 18705 B14R1.913 COC(=O)C1CCCC1OCCSC 34a_200000081814_100000212216 [1,0,0,1,0,0|2,0,0]=4 18706 B14R1.913 COC(=O)C1CCCC1OCCSC 7a_200000081814_100000212216 [1,0,0,1,0,0|2,0,0]=4 18707 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCF 2230a_100000752040_100000729493 [1,0,0,1,0,0|2,0,0]=4 18708 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCF 269982a_100000752040_100000729493 [1,0,0,1,0,0|2,0,0]=4 18709 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCO 2230a_100000752040_100000210776 [1,0,0,1,0,0|2,0,0]=4 18710 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCO 269982a_100000752040_100000210776 [1,0,0,1,0,0|2,0,0]=4 18711 B14R1.913 COCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000740836 [1,0,0,1,0,0|2,0,0]=4 18712 B14R1.913 COCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000740836 [1,0,0,1,0,0|2,0,0]=4 18713 B14R1.913 COCCOC1CCCC1C(=O)OC 34a_200000081814_100011201679 [1,0,0,1,0,0|2,0,0]=4 18714 B14R1.913 COCCOC1CCCC1C(=O)OC 7a_200000081814_100000233755 [1,0,0,1,0,0|2,0,0]=4 18715 B14R1.1224 CCC(=O)CN1CCCCCCCC1 269982a_100000039187_100000747405 [1,0,0,1,0,0|2,0,0]=4 18716 B14R1.1224 CNC(=O)CN1CCCCCCCC1 2230a_100000039187_100000183359 [1,0,0,1,0,0|2,0,0]=4 18717 B14R1.1224 CNC(=O)CN1CCCCCCCC1 269982a_100000039187_100000183359 [1,0,0,1,0,0|2,0,0]=4 18718 B14R1.1224 CNC(=O)CN1CCCCCCCC1 34a_100000039187_100000183359 [1,0,0,1,0,0|2,0,0]=4 18719 B14R1.1224 COC(=O)CN1CCCCCCCC1 2230a_100000039187_100000747449 [1,0,0,1,0,0|1,0,0]=3 18720 B14R1.1224 COC(=O)CN1CCCCCCCC1 269982a_100000039187_100000747449 [1,0,0,1,0,0|1,0,0]=3 18721 B14R1.1224 COC(=O)CN1CCCCCCCC1 34a_100000039187_100000747449 [1,0,0,1,0,0|1,0,0]=3 18722 B14R1.1586 CCC(=O)COCC1CCCCCC1 34a_100000725409_200000696569 [1,0,0,1,0,0|2,0,0]=4 18723 B14R1.1586 CCC(=O)COCC1CCCCCC1 7a_100000699130_100000747405 [1,0,0,1,0,0|2,0,0]=4 18724 B14R1.1586 CCC(=O)CSCC1CCCCCC1 62a_100000747405_200000696569 [1,0,0,1,0,0|2,0,0]=4 18725 B14R1.1586 CCC(=O)CSCC1CCCCCC1 62a_200000696569_100000747405 [1,0,0,1,0,0|2,0,0]=4 18726 B14R1.1586 CCC(=O)NCCC1CCCCCC1 11a_100011532351_100000210414 [1,0,0,1,0,0|2,0,0]=4 18727 B14R1.1586 CCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000210414 [1,0,0,1,0,0|2,0,0]=4 18728 B14R1.1586 CCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000210414 [1,0,0,1,0,0|2,0,0]=4 18729 B14R1.1586 CCC(=O)NCCC1CCCCCC1 527a_100011532351_100000210414 [1,0,0,1,0,0|2,0,0]=4 18730 B14R1.1586 CNC(=O)CCCN1CCCCCC1 2230a_100000185865_100000741757 [1,0,0,1,0,0|2,0,0]=4 18731 B14R1.1586 CNC(=O)CCCN1CCCCCC1 269982a_100000185865_100000741757 [1,0,0,1,0,0|2,0,0]=4 18732 B14R1.1586 CNC(=O)CCCN1CCCCCC1 34a_100000185865_100000741757 [1,0,0,1,0,0|2,0,0]=4 18733 B14R1.1586 CNC(=O)CCNC1CCCCCC1 2230a_100000210984_100000737683 [1,0,0,1,0,0|2,0,0]=4 18734 B14R1.1586 CNC(=O)CCNC1CCCCCC1 270004a_100000738227_100000210131 [1,0,0,1,0,0|2,0,0]=4 18735 B14R1.1586 CNC(=O)CCNC1CCCCCC1 34a_100000210984_100012179268 [1,0,0,1,0,0|2,0,0]=4 18736 B14R1.1586 CNC(=O)CCNC1CCCCCC1 34a_100000738227_100011217769 [1,0,0,1,0,0|2,0,0]=4 18737 B14R1.1586 CNC(=O)CCOC1CCCCCC1 34a_100000210887_100012179268 [1,0,0,1,0,0|2,0,0]=4 18738 B14R1.1586 CNC(=O)CCOC1CCCCCC1 34a_100000754576_100011217769 [1,0,0,1,0,0|2,0,0]=4 18739 B14R1.1586 CNC(=O)CCOC1CCCCCC1 7a_100000210887_100000737683 [1,0,0,1,0,0|2,0,0]=4 18740 B14R1.1586 CNC(=O)CCSC1CCCCCC1 62a_100000737683_100011217769 [1,0,0,1,0,0|2,0,0]=4 18741 B14R1.1586 CNC(=O)CCSC1CCCCCC1 62a_100011217769_100000737683 [1,0,0,1,0,0|2,0,0]=4 18742 B14R1.1586 CNC(=O)CNCC1CCCCCC1 2230a_100000693194_200000696569 [1,0,0,1,0,0|2,0,0]=4 18743 B14R1.1586 CNC(=O)CNCC1CCCCCC1 2230a_100015204231_100000183359 [1,0,0,1,0,0|2,0,0]=4 18744 B14R1.1586 CNC(=O)CNCC1CCCCCC1 269862a_100000693194_200000763224 [1,0,0,1,0,0|2,0,0]=4 18745 B14R1.1586 CNC(=O)CNCC1CCCCCC1 34a_100015204231_100000183359 [1,0,0,1,0,0|2,0,0]=4 18746 B14R1.1586 CNC(=O)COCC1CCCCCC1 34a_100000699130_100000183359 [1,0,0,1,0,0|2,0,0]=4 18747 B14R1.1586 CNC(=O)COCC1CCCCCC1 34a_100000750040_200000696569 [1,0,0,1,0,0|2,0,0]=4 18748 B14R1.1586 CNC(=O)COCC1CCCCCC1 7a_100000699130_100000183359 [1,0,0,1,0,0|2,0,0]=4 18749 B14R1.1586 CNC(=O)CSCC1CCCCCC1 62a_100000183359_200000696569 [1,0,0,1,0,0|2,0,0]=4 18750 B14R1.1586 CNC(=O)CSCC1CCCCCC1 62a_200000696569_100000183359 [1,0,0,1,0,0|2,0,0]=4 18751 B14R1.1586 CNC(=O)NCCC1CCCCCC1 2708a_100011532351_106832991635 [1,0,0,1,0,0|2,0,0]=4 18752 B14R1.1586 CNC(=O)NCCC1CCCCCC1 2708a_100102657272_100011532351 [1,0,0,1,0,0|2,0,0]=4 18753 B14R1.1586 CNC(=O)NCCC1CCCCCC1 273464a_100011532351_100102657272 [1,0,0,1,0,0|2,0,0]=4 18754 B14R1.1586 CNC(=O)NCCC1CCCCCC1 273464a_100102657272_100011532351 [1,0,0,1,0,0|2,0,0]=4 18755 B14R1.1586 CNC(=O)NCCC1CCCCCC1 512a_106832991638_100011532351 [1,0,0,1,0,0|2,0,0]=4 18756 B14R1.1586 COC(=O)CCCN1CCCCCC1 2230a_100000185865_100011218270 [1,0,0,1,0,0|1,0,0]=3 18757 B14R1.1586 COC(=O)CCCN1CCCCCC1 269982a_100000185865_100011218270 [1,0,0,1,0,0|1,0,0]=3 18758 B14R1.1586 COC(=O)CCCN1CCCCCC1 34a_100000185865_100000742333 [1,0,0,1,0,0|1,0,0]=3 18759 B14R1.1586 COC(=O)CCCN1CCCOCC1 2230a_100000685342_100011218270 [1,0,0,1,0,0|2,0,0]=4 18760 B14R1.1586 COC(=O)CCCN1CCCOCC1 269982a_100000685342_100011218270 [1,0,0,1,0,0|2,0,0]=4 18761 B14R1.1586 COC(=O)CCCN1CCCOCC1 34a_100000685342_100000742333 [1,0,0,1,0,0|2,0,0]=4 18762 B14R1.1586 COC(=O)CCNC1CCCCCC1 2230a_100000210984_100000204255 [1,0,0,1,0,0|1,0,0]=3 18763 B14R1.1586 COC(=O)CCNC1CCCCCC1 34a_100000210984_100000742370 [1,0,0,1,0,0|1,0,0]=3 18764 B14R1.1586 COC(=O)CCOC1CCCCCC1 34a_100000210887_100000742370 [1,0,0,1,0,0|1,0,0]=3 18765 B14R1.1586 COC(=O)CCOC1CCCCCC1 7a_100000210887_100000204255 [1,0,0,1,0,0|1,0,0]=3 18766 B14R1.1586 COC(=O)CCSC1CCCCCC1 62a_100000204255_100011217769 [1,0,0,1,0,0|1,0,0]=3 18767 B14R1.1586 COC(=O)CCSC1CCCCCC1 62a_100011217769_100000204255 [1,0,0,1,0,0|1,0,0]=3 18768 B14R1.1586 COC(=O)CNCC1CCCCCC1 2230a_100015204231_100000747449 [1,0,0,1,0,0|1,0,0]=3 18769 B14R1.1586 COC(=O)CNCC1CCCCCC1 34a_100015204231_100000747449 [1,0,0,1,0,0|1,0,0]=3 18770 B14R1.1586 COC(=O)COCC1CCCCCC1 34a_100000699130_100000747449 [1,0,0,1,0,0|1,0,0]=3 18771 B14R1.1586 COC(=O)COCC1CCCCCC1 7a_100000699130_100000747449 [1,0,0,1,0,0|1,0,0]=3 18772 B14R1.1586 COC(=O)CSCC1CCCCCC1 62a_100000747449_200000696569 [1,0,0,1,0,0|1,0,0]=3 18773 B14R1.1586 COC(=O)CSCC1CCCCCC1 62a_200000696569_100000747449 [1,0,0,1,0,0|1,0,0]=3 18774 B14R1.1586 COC(=O)OCSC1CCCCCC1 62a_100011217769_100000139417 [1,0,0,1,0,0|2,0,0]=4 18775 B14R1.2350 CCCCCCCN1CC1C(=O)OC 2230a_200009830135_100000210681 [1,0,0,1,0,0|1,0,0]=3 18776 B14R1.2350 CCCCOCCN1CC1C(=O)OC 2230a_200009830135_100000743108 [1,0,0,1,0,0|2,0,0]=4 18777 B14R1.2350 COC(=O)C1CN1CCCCCCF 2230a_200009830135_100015922095 [1,0,0,1,0,0|2,0,0]=4 18778 B14R1.2350 COC(=O)C1CN1CCCCCCO 2230a_200009830135_100000766143 [1,0,0,1,0,0|2,0,0]=4 18779 B14R1.4297 CCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210314 [1,0,0,1,0,0|1,0,0]=3 18780 B14R1.4297 CCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210757 [1,0,0,1,0,0|1,0,0]=3 18781 B14R1.4297 CCCCOCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011995733 [1,0,0,1,0,0|2,0,0]=4 18782 B14R1.4297 CCCCOCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011995733 [1,0,0,1,0,0|2,0,0]=4 18783 B14R1.4297 CCCOCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011215938 [1,0,0,1,0,0|2,0,0]=4 18784 B14R1.4297 CCCOCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011215938 [1,0,0,1,0,0|2,0,0]=4 18785 B14R1.4297 CCOCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100012232248 [1,0,0,1,0,0|2,0,0]=4 18786 B14R1.4297 CCOCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100012232248 [1,0,0,1,0,0|2,0,0]=4 18787 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCF 2230a_102516456887_100000729378 [1,0,0,1,0,0|2,0,0]=4 18788 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCF 269982a_102516456887_100000729378 [1,0,0,1,0,0|2,0,0]=4 18789 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCO 2230a_102516456887_100000746330 [1,0,0,1,0,0|2,0,0]=4 18790 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCO 269982a_102516456887_100000746330 [1,0,0,1,0,0|2,0,0]=4 18791 B14R1.4297 COCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000730899 [1,0,0,1,0,0|2,0,0]=4 18792 B14R1.4297 COCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000730899 [1,0,0,1,0,0|2,0,0]=4 18793 B14R1.7684 CCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000210202 [1,0,0,1,0,0|2,0,0]=4 18794 B14R1.7684 CCC(=O)COC1CCCCCCC1 7a_100000210054_100000747405 [1,0,0,1,0,0|2,0,0]=4 18795 B14R1.7684 CNC(=O)CCN1CCCCCCC1 2230a_100000211400_100000737683 [1,0,0,1,0,0|2,0,0]=4 18796 B14R1.7684 CNC(=O)CCN1CCCCCCC1 240690a_100102657272_200015187237 [1,0,0,1,0,0|2,0,0]=4 18797 B14R1.7684 CNC(=O)CCN1CCCCCCC1 269982a_100000211400_100000737683 [1,0,0,1,0,0|2,0,0]=4 18798 B14R1.7684 CNC(=O)CCN1CCCCCCC1 34a_100000211400_100012179268 [1,0,0,1,0,0|2,0,0]=4 18799 B14R1.7684 CNC(=O)CNC1CCCCCCC1 2230a_100000211152_100000183359 [1,0,0,1,0,0|2,0,0]=4 18800 B14R1.7684 CNC(=O)CNC1CCCCCCC1 270004a_100000693194_100000210524 [1,0,0,1,0,0|2,0,0]=4 18801 B14R1.7684 CNC(=O)CNC1CCCCCCC1 34a_100000211152_100000183359 [1,0,0,1,0,0|2,0,0]=4 18802 B14R1.7684 CNC(=O)COC1CCCCCCC1 34a_100000210054_100000183359 [1,0,0,1,0,0|2,0,0]=4 18803 B14R1.7684 CNC(=O)COC1CCCCCCC1 7a_100000210054_100000183359 [1,0,0,1,0,0|2,0,0]=4 18804 B14R1.7684 COC(=O)CCN1CCCCCCC1 2230a_100000211400_100000204255 [1,0,0,1,0,0|1,0,0]=3 18805 B14R1.7684 COC(=O)CCN1CCCCCCC1 269982a_100000211400_100000204255 [1,0,0,1,0,0|1,0,0]=3 18806 B14R1.7684 COC(=O)CCN1CCCCCCC1 34a_100000211400_100000742370 [1,0,0,1,0,0|1,0,0]=3 18807 B14R1.7684 COC(=O)CNC1CCCCCCC1 2230a_100000211152_100000747449 [1,0,0,1,0,0|1,0,0]=3 18808 B14R1.7684 COC(=O)CNC1CCCCCCC1 34a_100000211152_100000747449 [1,0,0,1,0,0|1,0,0]=3 18809 B14R1.7684 COC(=O)COC1CCCCCCC1 34a_100000210054_100000747449 [1,0,0,1,0,0|1,0,0]=3 18810 B14R1.7684 COC(=O)COC1CCCCCCC1 7a_100000210054_100000747449 [1,0,0,1,0,0|1,0,0]=3 18811 B14R1.40 C/C=C/CCOCCCC1CCCC1 34a_100016278192_100011713738 [1,0,0,1,0,0|2,0,0]=4 18812 B14R1.40 CC=CCCCOCCC1CCCC1 34a_100020645299_100000760354 [1,0,0,1,0,0|2,0,0]=4 18813 B14R1.40 CCCCCCCCCN1CC=CC1 269982a_100015195280_100000210670 [1,0,0,1,0,0|2,0,0]=4 18814 B14R1.40 CCCCCCCCNC1CC=CC1 2230a_100015188752_100000210759 [1,0,0,1,0,0|2,0,0]=4 18815 B14R1.40 CCCCCCCCNC1CCOC1 2230a_100000229939_100000731011 [1,0,0,1,0,0|1,0,1]=4 18816 B14R1.40 CCCCCCCCNC1CCOC1 270004a_100000229939_100000752484 [1,0,0,1,0,0|1,0,1]=4 18817 B14R1.40 CCCCCCCCNC1CCOC1 34a_100000229939_100000690089 [1,0,0,1,0,0|1,0,1]=4 18818 B14R1.40 CCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210759 [1,0,0,1,0,0|1,0,1]=4 18819 B14R1.40 CCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210759 [1,0,0,1,0,0|1,0,1]=4 18820 B14R1.40 CCCCCCCCN[C@H]1CCOC1 34a_100015188467_100000210759 [1,0,0,1,0,0|1,0,1]=4 18821 B14R1.40 CCCCCCCCOC1CCOC1 34a_100000210232_100000690089 [1,0,0,1,0,0|1,0,1]=4 18822 B14R1.40 CCCCCCCCOC1CCOC1 7a_100000210232_100000731011 [1,0,0,1,0,0|1,0,1]=4 18823 B14R1.40 CCCCCCCCO[C@H]1CCOC1 34a_100000717292_100000210759 [1,0,0,1,0,0|1,0,1]=4 18824 B14R1.40 CCCCCCCCSC1CCOC1 62a_100000210759_100000690089 [1,0,0,1,0,0|1,0,1]=4 18825 B14R1.40 CCCCCCCNCC1CCOC1 2230a_100000229938_100000702531 [1,0,0,1,0,0|1,0,1]=4 18826 B14R1.40 CCCCCCCNCC1CCOC1 2230a_100000737293_100000210681 [1,0,0,1,0,0|1,0,1]=4 18827 B14R1.40 CCCCCCCNCC1CCOC1 34a_100000737293_100000210614 [1,0,0,1,0,0|1,0,1]=4 18828 B14R1.40 CCCCCCCOCC1CC=CC1 34a_100000688395_100000210614 [1,0,0,1,0,0|2,0,0]=4 18829 B14R1.40 CCCCCCCOCC1CCOC1 34a_100000210272_100011261433 [1,0,0,1,0,0|1,0,1]=4 18830 B14R1.40 CCCCCCCOCC1CCOC1 34a_100000740260_100000210614 [1,0,0,1,0,0|1,0,1]=4 18831 B14R1.40 CCCCCCCOCC1CCOC1 7a_100000210272_100000702531 [1,0,0,1,0,0|1,0,1]=4 18832 B14R1.40 CCCCCCCSCC1CCOC1 62a_100000210614_100000702531 [1,0,0,1,0,0|1,0,1]=4 18833 B14R1.40 CCCCCCCSCC1CCOC1 62a_100000702531_100000210316 [1,0,0,1,0,0|1,0,1]=4 18834 B14R1.40 CCCCCCOCCC1CCOC1 34a_100011879284_100000210314 [1,0,0,1,0,0|1,0,1]=4 18835 B14R1.40 COCCCCCCNC1CCCC1 2230a_100000211070_100011998445 [1,0,0,1,0,0|1,0,1]=4 18836 B14R1.40 COCCCCCCNC1CCCC1 34a_100000211070_100011998445 [1,0,0,1,0,0|1,0,1]=4 18837 B14R1.40 COCCCCCCOC1CCCC1 34a_100000210269_100011998445 [1,0,0,1,0,0|1,0,1]=4 18838 B14R1.40 COCCCCCCOC1CCCC1 34a_200012092642_100000179811 [1,0,0,1,0,0|1,0,1]=4 18839 B14R1.40 COCCCCCCOC1CCCC1 7a_100000210269_100011998445 [1,0,0,1,0,0|1,0,1]=4 18840 B14R1.40 COCCCCCCOC1CCCC1 7a_200012092642_100000179811 [1,0,0,1,0,0|1,0,1]=4 18841 B14R1.40 COCCCCCCSC1CCCC1 62a_100011217020_100011998445 [1,0,0,1,0,0|1,0,1]=4 18842 B14R1.40 COCCCCCCSC1CCCC1 62a_100011998445_100000179811 [1,0,0,1,0,0|1,0,1]=4 18843 B14R1.40 COCCCCCNCC1CCCC1 2230a_100000747528_100000740388 [1,0,0,1,0,0|1,0,1]=4 18844 B14R1.40 COCCCCCNCC1CCCC1 269862a_100000747528_100000746403 [1,0,0,1,0,0|1,0,1]=4 18845 B14R1.40 COCCCCCNCC1CCCC1 34a_100000747528_100000740388 [1,0,0,1,0,0|1,0,1]=4 18846 B14R1.40 COCCCCNCCC1CCCC1 2230a_100000739158_100000730899 [1,0,0,1,0,0|1,0,1]=4 18847 B14R1.40 COCCCCNCCC1CCCC1 34a_100000739158_100000755781 [1,0,0,1,0,0|1,0,1]=4 18848 B14R1.40 COCCCCOCCC1CCCC1 34a_100000740925_100000760354 [1,0,0,1,0,0|1,0,1]=4 18849 B14R1.40 COCCCCOCCC1CCCC1 34a_100000749090_100000755781 [1,0,0,1,0,0|1,0,1]=4 18850 B14R1.40 COCCCCOCCC1CCCC1 7a_100000749090_100000730899 [1,0,0,1,0,0|1,0,1]=4 18851 B14R1.40 COCCCCSCCC1CCCC1 62a_100000730899_100000760354 [1,0,0,1,0,0|1,0,1]=4 18852 B14R1.40 COCCCCSCCC1CCCC1 62a_100000760354_100000730899 [1,0,0,1,0,0|1,0,1]=4 18853 B14R1.40 COCCCNCCCC1CCCC1 2230a_100000736752_100000740836 [1,0,0,1,0,0|1,0,1]=4 18854 B14R1.40 COCCCNCCCC1CCCC1 34a_100000736752_100000740836 [1,0,0,1,0,0|1,0,1]=4 18855 B14R1.40 COCCCNCCCC1CCCC1 34a_100150723488_100011713738 [1,0,0,1,0,0|1,0,1]=4 18856 B14R1.40 COCCCOCCCC1CCCC1 34a_100000740835_100011713738 [1,0,0,1,0,0|1,0,1]=4 18857 B14R1.40 COCCCOCCCC1CCCC1 34a_100011215328_100000740836 [1,0,0,1,0,0|1,0,1]=4 18858 B14R1.40 COCCCOCCCC1CCCC1 7a_100011215328_100000740836 [1,0,0,1,0,0|1,0,1]=4 18859 B14R1.40 COCCCSCCCC1CCCC1 62a_100000709357_100011713738 [1,0,0,1,0,0|1,0,1]=4 18860 B14R1.40 COCCCSCCCC1CCCC1 62a_100011713738_100000709357 [1,0,0,1,0,0|1,0,1]=4 18861 B14R1.62 CCCCCCCC1CCCC1NC 269862a_106832991636_200011216720 [1,0,0,1,0,0|1,0,1]=4 18862 B14R1.62 CCCCCCCC1CCCC1NC 270004a_106832991635_200011216720 [1,0,0,1,0,0|1,0,1]=4 18863 B14R1.123 C/C=C/CCOCCC1CCCCC1 34a_100016278192_100011209188 [1,0,0,1,0,0|2,0,0]=4 18864 B14R1.123 C/C=C/CNCCCC1CCCCC1 34a_100011211642_100102629194 [1,0,0,1,0,0|2,0,0]=4 18865 B14R1.123 C/C=C/COCCCC1CCCCC1 34a_100000198086_100102629194 [1,0,0,1,0,0|2,0,0]=4 18866 B14R1.123 C/C=C/COCCCC1CCCCC1 34a_100016270725_100011713725 [1,0,0,1,0,0|2,0,0]=4 18867 B14R1.123 C/C=C/COCCCC1CCCCC1 7a_100000198086_100102629194 [1,0,0,1,0,0|2,0,0]=4 18868 B14R1.123 C/C=C/CSCCCC1CCCCC1 62a_100011713725_100102629194 [1,0,0,1,0,0|2,0,0]=4 18869 B14R1.123 C/C=C/CSCCCC1CCCCC1 62a_100102629194_100011713725 [1,0,0,1,0,0|2,0,0]=4 18870 B14R1.123 CC=CCCCOCC1CCCCC1 34a_100020645299_100000211423 [1,0,0,1,0,0|2,0,0]=4 18871 B14R1.123 CC=CCNCCCC1CCCCC1 2230a_100011211642_100000070051 [1,0,0,1,0,0|2,0,0]=4 18872 B14R1.123 CC=CCNCCCC1CCCCC1 34a_100011211642_100000070051 [1,0,0,1,0,0|2,0,0]=4 18873 B14R1.123 CC=CCOCCCC1CCCCC1 34a_100000198086_100000070051 [1,0,0,1,0,0|2,0,0]=4 18874 B14R1.123 CC=CCOCCCC1CCCCC1 7a_100000198086_100000070051 [1,0,0,1,0,0|2,0,0]=4 18875 B14R1.123 CC=CCSCCCC1CCCCC1 62a_100000070051_100011713725 [1,0,0,1,0,0|2,0,0]=4 18876 B14R1.123 CC=CCSCCCC1CCCCC1 62a_100011713725_100000070051 [1,0,0,1,0,0|2,0,0]=4 18877 B14R1.123 CCCCCCCCN1CC=CCC1 2230a_100000698166_100000210759 [1,0,0,1,0,0|2,0,0]=4 18878 B14R1.123 CCCCCCCCN1CC=CCC1 269982a_100000698166_100000210759 [1,0,0,1,0,0|2,0,0]=4 18879 B14R1.123 CCCCCCCCN1CC=CCC1 34a_100000698166_100000210759 [1,0,0,1,0,0|2,0,0]=4 18880 B14R1.123 CCCCCCCCN1CCCOC1 2230a_100000131196_100000210759 [1,0,0,1,0,0|1,0,1]=4 18881 B14R1.123 CCCCCCCCN1CCCOC1 269982a_100000131196_100000210759 [1,0,0,1,0,0|1,0,1]=4 18882 B14R1.123 CCCCCCCCN1CCCOC1 34a_100000131196_100000210759 [1,0,0,1,0,0|1,0,1]=4 18883 B14R1.123 CCCCCCCNC1CCCOC1 2230a_100000719290_100000210681 [1,0,0,1,0,0|1,0,1]=4 18884 B14R1.123 CCCCCCCNC1CCCOC1 270004a_100000229938_100000753404 [1,0,0,1,0,0|1,0,1]=4 18885 B14R1.123 CCCCCCCNC1CCCOC1 34a_100000719290_100000210614 [1,0,0,1,0,0|1,0,1]=4 18886 B14R1.123 CCCCCCCOC1CC=CCC1 34a_100000073881_100000210614 [1,0,0,1,0,0|2,0,0]=4 18887 B14R1.123 CCCCCCCOC1CCCOC1 34a_100000210272_100000693364 [1,0,0,1,0,0|1,0,1]=4 18888 B14R1.123 CCCCCCCOC1CCCOC1 34a_100000754041_100000210614 [1,0,0,1,0,0|1,0,1]=4 18889 B14R1.123 CCCCCCCOC1CCCOC1 7a_100000210272_100000693364 [1,0,0,1,0,0|1,0,1]=4 18890 B14R1.123 CCCCCCCSC1CCCOC1 62a_100000210614_100000693364 [1,0,0,1,0,0|1,0,1]=4 18891 B14R1.123 CCCCCCNCC1CC=CCC1 270004a_100000210581_100000189434 [1,0,0,1,0,0|2,0,0]=4 18892 B14R1.123 CCCCCCNCC1CCCOC1 2230a_100000210581_100000741521 [1,0,0,1,0,0|1,0,1]=4 18893 B14R1.123 CCCCCCNCC1CCCOC1 2230a_100000720124_100000210314 [1,0,0,1,0,0|1,0,1]=4 18894 B14R1.123 CCCCCCNCC1CCCOC1 34a_100000720124_100000210314 [1,0,0,1,0,0|1,0,1]=4 18895 B14R1.123 CCCCCCOCC1CC=CCC1 34a_100000210713_100000210314 [1,0,0,1,0,0|2,0,0]=4 18896 B14R1.123 CCCCCCOCC1CCCOC1 34a_100000210259_100000741521 [1,0,0,1,0,0|1,0,1]=4 18897 B14R1.123 CCCCCCOCC1CCCOC1 34a_100000741520_100000210314 [1,0,0,1,0,0|1,0,1]=4 18898 B14R1.123 CCCCCCOCC1CCCOC1 7a_100000210259_100000741521 [1,0,0,1,0,0|1,0,1]=4 18899 B14R1.123 CCCCCCSCC1CCCOC1 62a_100000210314_100000741521 [1,0,0,1,0,0|1,0,1]=4 18900 B14R1.123 CCCCCCSCC1CCCOC1 62a_100000741521_100000210757 [1,0,0,1,0,0|1,0,1]=4 18901 B14R1.123 COCCCCCNC1CCCCC1 270004a_100000747528_100000210434 [1,0,0,1,0,0|1,0,1]=4 18902 B14R1.123 COCCCCCNC1CCCCC1 34a_100000747528_100000210327 [1,0,0,1,0,0|1,0,1]=4 18903 B14R1.123 COCCCCNCC1CCCCC1 2230a_100000210473_100000730899 [1,0,0,1,0,0|1,0,1]=4 18904 B14R1.123 COCCCCNCC1CCCCC1 34a_100000210473_100000755781 [1,0,0,1,0,0|1,0,1]=4 18905 B14R1.123 COCCCCOCC1CCCCC1 34a_100000212181_100000755781 [1,0,0,1,0,0|1,0,1]=4 18906 B14R1.123 COCCCCOCC1CCCCC1 34a_100000740925_100000211423 [1,0,0,1,0,0|1,0,1]=4 18907 B14R1.123 COCCCCOCC1CCCCC1 7a_100000212181_100000730899 [1,0,0,1,0,0|1,0,1]=4 18908 B14R1.123 COCCCCSCC1CCCCC1 62a_100000211423_100000730899 [1,0,0,1,0,0|1,0,1]=4 18909 B14R1.123 COCCCCSCC1CCCCC1 62a_100000730899_100000211423 [1,0,0,1,0,0|1,0,1]=4 18910 B14R1.123 COCCCNCCC1CCCCC1 2230a_100000738074_100000740836 [1,0,0,1,0,0|1,0,1]=4 18911 B14R1.123 COCCCNCCC1CCCCC1 270004a_100150723488_100011713444 [1,0,0,1,0,0|1,0,1]=4 18912 B14R1.123 COCCCNCCC1CCCCC1 34a_100000738074_100000740836 [1,0,0,1,0,0|1,0,1]=4 18913 B14R1.123 COCCCNCCC1CCCCC1 34a_100150723488_100011209188 [1,0,0,1,0,0|1,0,1]=4 18914 B14R1.123 COCCCOCCC1CCCCC1 34a_100000740835_100011209188 [1,0,0,1,0,0|1,0,1]=4 18915 B14R1.123 COCCCOCCC1CCCCC1 34a_100011217863_100000740836 [1,0,0,1,0,0|1,0,1]=4 18916 B14R1.123 COCCCOCCC1CCCCC1 7a_100011217863_100000740836 [1,0,0,1,0,0|1,0,1]=4 18917 B14R1.123 COCCCSCCC1CCCCC1 62a_100000709357_100012355289 [1,0,0,1,0,0|1,0,1]=4 18918 B14R1.123 COCCCSCCC1CCCCC1 62a_100012355289_100000709357 [1,0,0,1,0,0|1,0,1]=4 18919 B14R1.123 COCCNCCCC1CCCCC1 2230a_100000209980_100011713725 [1,0,0,1,0,0|1,0,1]=4 18920 B14R1.123 COCCNCCCC1CCCCC1 2230a_100011211642_100011201679 [1,0,0,1,0,0|1,0,1]=4 18921 B14R1.123 COCCNCCCC1CCCCC1 34a_100011211642_100011201679 [1,0,0,1,0,0|1,0,1]=4 18922 B14R1.123 COCCOCCCC1CCCCC1 34a_100000198086_100011201679 [1,0,0,1,0,0|1,0,1]=4 18923 B14R1.123 COCCOCCCC1CCCCC1 34a_100000210237_100011713725 [1,0,0,1,0,0|1,0,1]=4 18924 B14R1.123 COCCOCCCC1CCCCC1 7a_100000198086_100000233755 [1,0,0,1,0,0|1,0,1]=4 18925 B14R1.123 COCCSCCCC1CCCCC1 62a_100000233755_100011713725 [1,0,0,1,0,0|1,0,1]=4 18926 B14R1.123 COCCSCCCC1CCCCC1 62a_100011713725_100000233755 [1,0,0,1,0,0|1,0,1]=4 18927 B14R1.216 COCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011998445 [1,0,0,1,0,0|1,0,1]=4 18928 B14R1.216 COCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100011998445 [1,0,0,1,0,0|1,0,1]=4 18929 B14R1.216 COCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011998445 [1,0,0,1,0,0|1,0,1]=4 18930 B14R1.216 COCCCCCCN1CCC[C@H]1C 269982a_100015189458_100011998445 [1,0,0,1,0,0|1,0,1]=4 18931 B14R1.216 COCCCCCCN1CCC[C@H]1C 34a_100015189458_100011998445 [1,0,0,1,0,0|1,0,1]=4 18932 B14R1.216 COCCCCCNC1CCCC1C 269862a_100000747528_100000752053 [1,0,0,1,0,0|1,0,1]=4 18933 B14R1.234 CCCC1CCCC1NCCCOC 269862a_100150723488_100000723119 [1,0,0,1,0,0|1,0,1]=4 18934 B14R1.234 CCCC1CCCC1NCCCOC 270004a_100150723488_100000723119 [1,0,0,1,0,0|1,0,1]=4 18935 B14R1.234 CCCCCCC1CCCC1NCC 269862a_100015525214_100000189428 [1,0,0,1,0,0|2,0,0]=4 18936 B14R1.234 CCCCCCC1CCCC1NCC 270004a_100015525214_100000189428 [1,0,0,1,0,0|2,0,0]=4 18937 B14R1.234 CCCCCCN1CCC[C@H]1COC 2230a_100020646714_100000210314 [1,0,0,1,0,0|1,0,1]=4 18938 B14R1.234 CCCCCCN1CCC[C@H]1COC 269982a_100020646714_100000210757 [1,0,0,1,0,0|1,0,1]=4 18939 B14R1.234 CCCCCCN1CCC[C@H]1COC 34a_100020646714_100000210314 [1,0,0,1,0,0|1,0,1]=4 18940 B14R1.476 CCC1CCCCC1NCCCOC 269862a_100150723488_100000757040 [1,0,0,1,0,0|1,0,1]=4 18941 B14R1.476 CCC1CCCCC1NCCCOC 270004a_100150723488_100000757040 [1,0,0,1,0,0|1,0,1]=4 18942 B14R1.476 CCC1CCCCC1OCCCOC 34a_100000210738_100000740836 [1,0,0,1,0,0|1,0,1]=4 18943 B14R1.476 CCC1CCCCC1OCCCOC 7a_100000210738_100000740836 [1,0,0,1,0,0|1,0,1]=4 18944 B14R1.476 CCC1CCCCN1CCCCOC 2230a_100000210034_100000730899 [1,0,0,1,0,0|1,0,1]=4 18945 B14R1.476 CCC1CCCCN1CCCCOC 269982a_100000210034_100000730899 [1,0,0,1,0,0|1,0,1]=4 18946 B14R1.476 CCC1CCCCN1CCCCOC 34a_100000210034_100000755781 [1,0,0,1,0,0|1,0,1]=4 18947 B14R1.476 CCCCCNC1CCCCC1OC 270004a_100000209983_100000740605 [1,0,0,1,0,0|1,0,1]=4 18948 B14R1.476 CCCCCNC1CCCCC1OC 34a_100011208099_100000718602 [1,0,0,1,0,0|1,0,1]=4 18949 B14R1.476 CCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000718602 [1,0,0,1,0,0|1,0,1]=4 18950 B14R1.476 CCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210326 [1,0,0,1,0,0|1,0,1]=4 18951 B14R1.787 CCCCN1CCCCC1CCOC 2230a_100015186528_100000210211 [1,0,0,1,0,0|1,0,1]=4 18952 B14R1.787 CCCCN1CCCCC1CCOC 269982a_100015186528_100000210211 [1,0,0,1,0,0|1,0,1]=4 18953 B14R1.787 CCCCN1CCCCC1CCOC 34a_100015186528_100000210210 [1,0,0,1,0,0|1,0,1]=4 18954 B14R1.882 COCCCCNC1CCCCC1C 2230a_100000211402_100000730899 [1,0,0,1,0,0|1,0,1]=4 18955 B14R1.882 COCCCCNC1CCCCC1C 34a_100000211402_100000755781 [1,0,0,1,0,0|1,0,1]=4 18956 B14R1.882 COCCCCOC1CCCCC1C 34a_100000211207_100000755781 [1,0,0,1,0,0|1,0,1]=4 18957 B14R1.882 COCCCCOC1CCCCC1C 7a_100000211207_100000730899 [1,0,0,1,0,0|1,0,1]=4 18958 B14R1.904 C/C=C/COC1CCCCC1CCC 34a_100011217265_100102629194 [1,0,0,1,0,0|2,0,0]=4 18959 B14R1.904 C/C=C/COC1CCCCC1CCC 7a_100011217265_100102629194 [1,0,0,1,0,0|2,0,0]=4 18960 B14R1.904 CC=CCOC1CCCCC1CCC 34a_100011217265_100000070051 [1,0,0,1,0,0|2,0,0]=4 18961 B14R1.904 CC=CCOC1CCCCC1CCC 7a_100011217265_100000070051 [1,0,0,1,0,0|2,0,0]=4 18962 B14R1.904 CCCC1CCCCC1NCCOC 269862a_100000209980_100011218038 [1,0,0,1,0,0|1,0,1]=4 18963 B14R1.904 CCCC1CCCCC1NCCOC 270004a_100000209980_100011218038 [1,0,0,1,0,0|1,0,1]=4 18964 B14R1.904 CCCC1CCCCC1OCCOC 34a_100011217265_100011201679 [1,0,0,1,0,0|1,0,1]=4 18965 B14R1.904 CCCC1CCCCC1OCCOC 7a_100011217265_100000233755 [1,0,0,1,0,0|1,0,1]=4 18966 B14R1.904 CCCC1CCCCN1CCCOC 2230a_100000701414_100000740836 [1,0,0,1,0,0|1,0,1]=4 18967 B14R1.904 CCCC1CCCCN1CCCOC 269982a_100000701414_100000740836 [1,0,0,1,0,0|1,0,1]=4 18968 B14R1.904 CCCC1CCCCN1CCCOC 34a_100000701414_100000740836 [1,0,0,1,0,0|1,0,1]=4 18969 B14R1.904 CCCCCN1CCCCC1COC 2230a_100015184032_100000210326 [1,0,0,1,0,0|1,0,1]=4 18970 B14R1.904 CCCCCN1CCCCC1COC 269982a_100015184032_100000210215 [1,0,0,1,0,0|1,0,1]=4 18971 B14R1.904 CCCCCN1CCCCC1COC 34a_100015184032_100000718602 [1,0,0,1,0,0|1,0,1]=4 18972 B14R1.904 CCCN1CCCCC1CCCOC 2230a_100011804088_100000210303 [1,0,0,1,0,0|1,0,1]=4 18973 B14R1.904 CCCN1CCCCC1CCCOC 269982a_100011804088_100000210303 [1,0,0,1,0,0|1,0,1]=4 18974 B14R1.904 CCCN1CCCCC1CCCOC 34a_100011804088_100000210303 [1,0,0,1,0,0|1,0,1]=4 18975 B14R1.911 CCCCC1CCCC1NCCOC 269862a_100000209980_100000750825 [1,0,0,1,0,0|1,0,1]=4 18976 B14R1.911 CCCCC1CCCC1NCCOC 270004a_100000209980_100000750825 [1,0,0,1,0,0|1,0,1]=4 18977 B14R1.1254 C/C=C/COCC1CCCCCCC1 34a_100011216312_100102629194 [1,0,0,1,0,0|2,0,0]=4 18978 B14R1.1254 C/C=C/COCC1CCCCCCC1 7a_100011216312_100102629194 [1,0,0,1,0,0|2,0,0]=4 18979 B14R1.1254 CC=CCOCC1CCCCCCC1 34a_100011216312_100000070051 [1,0,0,1,0,0|2,0,0]=4 18980 B14R1.1254 CC=CCOCC1CCCCCCC1 7a_100011216312_100000070051 [1,0,0,1,0,0|2,0,0]=4 18981 B14R1.1254 COCCCCN1CCCCCCC1 2230a_100000211400_100000730899 [1,0,0,1,0,0|1,0,1]=4 18982 B14R1.1254 COCCCCN1CCCCCCC1 269982a_100000211400_100000730899 [1,0,0,1,0,0|1,0,1]=4 18983 B14R1.1254 COCCCCN1CCCCCCC1 34a_100000211400_100000755781 [1,0,0,1,0,0|1,0,1]=4 18984 B14R1.1254 COCCCNC1CCCCCCC1 2230a_100000211152_100000740836 [1,0,0,1,0,0|1,0,1]=4 18985 B14R1.1254 COCCCNC1CCCCCCC1 270004a_100150723488_100000210524 [1,0,0,1,0,0|1,0,1]=4 18986 B14R1.1254 COCCCNC1CCCCCCC1 34a_100000211152_100000740836 [1,0,0,1,0,0|1,0,1]=4 18987 B14R1.1254 COCCCOC1CCCCCCC1 34a_100000210054_100000740836 [1,0,0,1,0,0|1,0,1]=4 18988 B14R1.1254 COCCCOC1CCCCCCC1 7a_100000210054_100000740836 [1,0,0,1,0,0|1,0,1]=4 18989 B14R1.1254 COCCOCC1CCCCCCC1 34a_100011216312_100011201679 [1,0,0,1,0,0|1,0,1]=4 18990 B14R1.1254 COCCOCC1CCCCCCC1 7a_100011216312_100000233755 [1,0,0,1,0,0|1,0,1]=4 18991 B14R1.1254 COCNCCC1CCCCCCC1 2230a_100011532352_100000766300 [1,0,0,1,0,0|1,0,1]=4 18992 B14R1.2352 C/C=C/CCOCC1CCCCCC1 34a_100016278192_200000696569 [1,0,0,1,0,0|2,0,0]=4 18993 B14R1.2352 C/C=C/CNCCC1CCCCCC1 34a_100011532351_100102629194 [1,0,0,1,0,0|2,0,0]=4 18994 B14R1.2352 CC=CCCCOC1CCCCCC1 34a_100020645299_100011217769 [1,0,0,1,0,0|2,0,0]=4 18995 B14R1.2352 CC=CCNCCC1CCCCCC1 2230a_100011532351_100000070051 [1,0,0,1,0,0|2,0,0]=4 18996 B14R1.2352 CC=CCNCCC1CCCCCC1 34a_100011532351_100000070051 [1,0,0,1,0,0|2,0,0]=4 18997 B14R1.2352 COCCCCNC1CCCCCC1 2230a_100000210984_100000730899 [1,0,0,1,0,0|1,0,1]=4 18998 B14R1.2352 COCCCCNC1CCCCCC1 34a_100000210984_100000755781 [1,0,0,1,0,0|1,0,1]=4 18999 B14R1.2352 COCCCCOC1CCCCCC1 34a_100000210887_100000755781 [1,0,0,1,0,0|1,0,1]=4 19000 B14R1.2352 COCCCCOC1CCCCCC1 34a_100000740925_100011217769 [1,0,0,1,0,0|1,0,1]=4 19001 B14R1.2352 COCCCCOC1CCCCCC1 7a_100000210887_100000730899 [1,0,0,1,0,0|1,0,1]=4 19002 B14R1.2352 COCCCCSC1CCCCCC1 62a_100000730899_100011217769 [1,0,0,1,0,0|1,0,1]=4 19003 B14R1.2352 COCCCCSC1CCCCCC1 62a_100011217769_100000730899 [1,0,0,1,0,0|1,0,1]=4 19004 B14R1.2352 COCCCNCC1CCCCCC1 2230a_100015204231_100000740836 [1,0,0,1,0,0|1,0,1]=4 19005 B14R1.2352 COCCCNCC1CCCCCC1 269862a_100150723488_200000763224 [1,0,0,1,0,0|1,0,1]=4 19006 B14R1.2352 COCCCNCC1CCCCCC1 34a_100015204231_100000740836 [1,0,0,1,0,0|1,0,1]=4 19007 B14R1.2352 COCCCNCC1CCCCCC1 34a_100150723488_200000696569 [1,0,0,1,0,0|1,0,1]=4 19008 B14R1.2352 COCCCOCC1CCCCCC1 34a_100000699130_100000740836 [1,0,0,1,0,0|1,0,1]=4 19009 B14R1.2352 COCCCOCC1CCCCCC1 34a_100000740835_200000696569 [1,0,0,1,0,0|1,0,1]=4 19010 B14R1.2352 COCCCOCC1CCCCCC1 7a_100000699130_100000740836 [1,0,0,1,0,0|1,0,1]=4 19011 B14R1.2352 COCCCSCC1CCCCCC1 62a_100000709357_200000696569 [1,0,0,1,0,0|1,0,1]=4 19012 B14R1.2352 COCCCSCC1CCCCCC1 62a_200000696569_100000709357 [1,0,0,1,0,0|1,0,1]=4 19013 B14R1.2352 COCCNCCC1CCCCCC1 2230a_100011532351_100011201679 [1,0,0,1,0,0|1,0,1]=4 19014 B14R1.2352 COCCNCCC1CCCCCC1 34a_100011532351_100011201679 [1,0,0,1,0,0|1,0,1]=4 19015 B14R1.3128 CCCCCCCN1CCC1COC 2230a_100015195929_100000210681 [1,0,0,1,0,0|1,0,1]=4 19016 B14R1.3128 CCCCCCCN1CCC1COC 269982a_100015195929_100000210681 [1,0,0,1,0,0|1,0,1]=4 19017 B14R1.3128 CCCCCCCN1CCC1COC 34a_100015195929_100000210614 [1,0,0,1,0,0|1,0,1]=4 19018 B14R1.6533 COCCCN1CCCCCCCC1 2230a_100000039187_100000740836 [1,0,0,1,0,0|1,0,1]=4 19019 B14R1.6533 COCCCN1CCCCCCCC1 269982a_100000039187_100000740836 [1,0,0,1,0,0|1,0,1]=4 19020 B14R1.6533 COCCCN1CCCCCCCC1 34a_100000039187_100000740836 [1,0,0,1,0,0|1,0,1]=4 19021 B14R1.6533 COCCNC1CCCCCCCC1 270004a_100000209980_100000038600 [1,0,0,1,0,0|1,0,1]=4 19022 B16R1.6 C=C1CCC(CC1)COCCCCCCC 34a_100000074039_100000210614 [0,1,0,1,0,0|2,0,0]=4 19023 B16R1.6 C=C1CCC(CC1)NCCCCCCCC 270004a_100000229939_100010272673 [0,1,0,1,0,0|2,0,0]=4 19024 B16R1.6 C=C1CCN(CC1)CCCCCCCCC 2230a_100000752442_100011214924 [0,1,0,1,0,0|2,0,0]=4 19025 B16R1.6 C=C1CCN(CC1)CCCCCCCCC 269982a_100000752442_100000210670 [0,1,0,1,0,0|2,0,0]=4 19026 B16R1.6 C=C1CCN(CC1)CCCCCCCCC 34a_100000752442_100011214924 [0,1,0,1,0,0|2,0,0]=4 19027 B16R1.6 CCCCCCCCCN1CC=C(CC1)C 2230a_100000693516_100011214924 [0,1,0,1,0,0|2,0,0]=4 19028 B16R1.6 CCCCCCCCCN1CC=C(CC1)C 269982a_100000693516_100000210670 [0,1,0,1,0,0|2,0,0]=4 19029 B16R1.6 CCCCCCCCCN1CC=C(CC1)C 34a_100000693516_100011214924 [0,1,0,1,0,0|2,0,0]=4 19030 B16R1.6 CCCCCCCCCN1CCS(=O)CC1 2230a_100000752083_100011214924 [0,1,0,1,0,0|2,0,0]=4 19031 B16R1.6 CCCCCCCCCN1CCS(=O)CC1 269982a_100000752083_100000210670 [0,1,0,1,0,0|2,0,0]=4 19032 B16R1.6 CCCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210759 [0,1,0,1,0,0|1,0,0]=3 19033 B16R1.6 CCCCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210759 [0,1,0,1,0,0|1,0,0]=3 19034 B16R1.6 CCCCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210759 [0,1,0,1,0,0|1,0,0]=3 19035 B16R1.6 CCCCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210759 [0,1,0,1,0,0|1,0,0]=3 19036 B16R1.6 CCCCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210759 [0,1,0,1,0,0|1,0,0]=3 19037 B16R1.6 CCCCCCCCOC1CNC(=O)NC1 34a_100000080929_100000210759 [0,1,0,1,0,0|2,0,0]=4 19038 B16R1.6 CCCCCCCOCC1CCC(=O)CC1 34a_100000062911_100000210614 [0,1,0,1,0,0|1,0,0]=3 19039 B16R1.6 CCCCOCCOCC1CCC(=O)CC1 34a_100000062911_100000743108 [0,1,0,1,0,0|2,0,0]=4 19040 B16R1.6 COCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100011998445 [0,1,0,1,0,0|2,0,0]=4 19041 B16R1.6 COCCCCCCNC1CCC(=O)NC1 34a_100000748762_100011998445 [0,1,0,1,0,0|2,0,0]=4 19042 B16R1.6 COCCCCCCOC1CCC(=O)CC1 34a_100000764474_100011998445 [0,1,0,1,0,0|2,0,0]=4 19043 B16R1.6 COCCCCCCOC1CCC(=O)CC1 7a_100000764474_100011998445 [0,1,0,1,0,0|2,0,0]=4 19044 B16R1.6 COCCCCCCOC1CCC(=O)NC1 34a_100000079199_100011998445 [0,1,0,1,0,0|2,0,0]=4 19045 B16R1.6 O=C1CCC(CC1)COCCCCCCF 34a_100000062911_100015922095 [0,1,0,1,0,0|2,0,0]=4 19046 B16R1.6 O=C1CCC(CC1)COCCCCCCO 34a_100000062911_100000766143 [0,1,0,1,0,0|2,0,0]=4 19047 B16R1.6 O=C1CCC(CC1)OCCCCCCCO 34a_100000764474_100000760002 [0,1,0,1,0,0|2,0,0]=4 19048 B16R1.6 O=C1CCC(CC1)OCCCCCCCO 7a_100000764474_100000760002 [0,1,0,1,0,0|2,0,0]=4 19049 B16R1.6 O=C1CCC(CN1)NCCCCCCCO 2230a_100000748762_100000760002 [0,1,0,1,0,0|2,0,0]=4 19050 B16R1.6 O=C1CCC(CN1)NCCCCCCCO 34a_100000748762_100000760002 [0,1,0,1,0,0|2,0,0]=4 19051 B16R1.6 O=C1CCC(CN1)OCCCCCCCO 34a_100000079199_100000760002 [0,1,0,1,0,0|2,0,0]=4 19052 B16R1.75 CCCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100000210759 [0,1,0,1,0,0|2,0,0]=4 19053 B16R1.75 CCCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210759 [0,1,0,1,0,0|2,0,0]=4 19054 B16R1.75 CCCCCCCCN1CCNC(=O)C1C 34a_100000750721_100000210759 [0,1,0,1,0,0|2,0,0]=4 19055 B16R1.75 CCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210314 [0,1,0,1,0,0|1,0,0]=3 19056 B16R1.75 CCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210314 [0,1,0,1,0,0|1,0,0]=3 19057 B16R1.75 CCCCOCNCC1CCCC(=O)N1C 2230a_200010383782_100011995733 [0,1,0,1,0,0|2,0,0]=4 19058 B16R1.75 CCCCOCNCC1CCCC(=O)N1C 34a_200010383782_100011995733 [0,1,0,1,0,0|2,0,0]=4 19059 B16R1.75 CCCOCCNCC1CCCC(=O)N1C 2230a_200010383782_100011215938 [0,1,0,1,0,0|2,0,0]=4 19060 B16R1.75 CCCOCCNCC1CCCC(=O)N1C 34a_200010383782_100011215938 [0,1,0,1,0,0|2,0,0]=4 19061 B16R1.75 CCOCCCNCC1CCCC(=O)N1C 2230a_200010383782_100012232248 [0,1,0,1,0,0|2,0,0]=4 19062 B16R1.75 CCOCCCNCC1CCCC(=O)N1C 34a_200010383782_100012232248 [0,1,0,1,0,0|2,0,0]=4 19063 B16R1.75 CN1C(=O)CCCC1CNCCCCCF 2230a_200010383782_100000729378 [0,1,0,1,0,0|2,0,0]=4 19064 B16R1.75 CN1C(=O)CCCC1CNCCCCCF 34a_200010383782_100000729378 [0,1,0,1,0,0|2,0,0]=4 19065 B16R1.75 CN1C(=O)CCCC1CNCCCCCO 2230a_200010383782_100000746330 [0,1,0,1,0,0|2,0,0]=4 19066 B16R1.75 CN1C(=O)CCCC1CNCCCCCO 34a_200010383782_100000746330 [0,1,0,1,0,0|2,0,0]=4 19067 B16R1.75 COCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000730899 [0,1,0,1,0,0|2,0,0]=4 19068 B16R1.75 COCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000755781 [0,1,0,1,0,0|2,0,0]=4 19069 B16R1.273 C#CCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100010269958 [0,1,0,1,0,0|0,0,2]=4 19070 B16R1.273 C#CCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100010269958 [0,1,0,1,0,0|0,0,2]=4 19071 B16R1.273 C#CCCCCN1CCCCC1C(=O)OC 34a_100000734855_100010269958 [0,1,0,1,0,0|0,0,2]=4 19072 B16R1.273 C#CCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000695029 [0,1,0,1,0,0|0,0,2]=4 19073 B16R1.273 C#CCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011215417 [0,1,0,1,0,0|0,0,2]=4 19074 B16R1.273 C=CCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100011215482 [0,1,0,1,0,0|0,0,2]=4 19075 B16R1.273 C=CCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100011215482 [0,1,0,1,0,0|0,0,2]=4 19076 B16R1.273 C=CCCCCN1CCCCC1C(=O)OC 34a_100000734855_100011215482 [0,1,0,1,0,0|0,0,2]=4 19077 B16R1.273 C=CCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000757094 [0,1,0,1,0,0|0,0,2]=4 19078 B16R1.273 C=CCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000757094 [0,1,0,1,0,0|0,0,2]=4 19079 B16R1.273 CC/C=C\CCN1CCCCC1C(=O)OC 2230a_100000734855_100015370543 [0,1,0,1,0,0|0,0,2]=4 19080 B16R1.273 CC/C=C\CCN1CCCCC1C(=O)OC 269982a_100000734855_100015370543 [0,1,0,1,0,0|0,0,2]=4 19081 B16R1.273 CC/C=C\CCN1CCCCC1C(=O)OC 34a_100000734855_100015370543 [0,1,0,1,0,0|0,0,2]=4 19082 B16R1.273 CC/C=C\CO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100103147603 [0,1,0,1,0,0|0,0,2]=4 19083 B16R1.273 CC/C=C\CO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100103147603 [0,1,0,1,0,0|0,0,2]=4 19084 B16R1.273 CCC#CCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100009813939 [0,1,0,1,0,0|0,0,2]=4 19085 B16R1.273 CCC#CCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100009813939 [0,1,0,1,0,0|0,0,2]=4 19086 B16R1.273 CCCCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210314 [0,1,0,1,0,0|1,0,0]=3 19087 B16R1.273 CCCCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210757 [0,1,0,1,0,0|1,0,0]=3 19088 B16R1.273 CCCCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210314 [0,1,0,1,0,0|1,0,0]=3 19089 B16R1.273 CCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210314 [0,1,0,1,0,0|0,0,0]=2 19090 B16R1.273 CCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210757 [0,1,0,1,0,0|0,0,0]=2 19091 B16R1.273 CCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210314 [0,1,0,1,0,0|0,0,0]=2 19092 B16R1.273 CCCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210314 [0,1,0,1,0,0|1,0,0]=3 19093 B16R1.273 CCCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210314 [0,1,0,1,0,0|1,0,0]=3 19094 B16R1.273 CCCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000718602 [0,1,0,1,0,0|1,0,0]=3 19095 B16R1.273 CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000718602 [0,1,0,1,0,0|0,0,0]=2 19096 B16R1.273 CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210326 [0,1,0,1,0,0|0,0,0]=2 19097 B16R1.273 CCCCNN=C1CCCCC1C(=O)OC 4a_100025702795_100011215843 [0,1,0,1,0,0|1,0,1]=4 19098 B16R1.273 CCCCOCN1CCCCC1C(=O)NC 2230a_100011209383_100011995733 [0,1,0,1,0,0|2,0,0]=4 19099 B16R1.273 CCCCOCN1CCCCC1C(=O)NC 269982a_100011209383_100011995733 [0,1,0,1,0,0|2,0,0]=4 19100 B16R1.273 CCCCOCN1CCCCC1C(=O)NC 34a_100011209383_100011995733 [0,1,0,1,0,0|2,0,0]=4 19101 B16R1.273 CCCCOCN1CCCCC1C(=O)OC 2230a_100000734855_100011995733 [0,1,0,1,0,0|1,0,0]=3 19102 B16R1.273 CCCCOCN1CCCCC1C(=O)OC 269982a_100000734855_100011995733 [0,1,0,1,0,0|1,0,0]=3 19103 B16R1.273 CCCCOCN1CCCCC1C(=O)OC 34a_100000734855_100011995733 [0,1,0,1,0,0|1,0,0]=3 19104 B16R1.273 CCCCOCN1CCOCC1C(=O)OC 2230a_100000765174_100011995733 [0,1,0,1,0,0|2,0,0]=4 19105 B16R1.273 CCCCOCN1CCOCC1C(=O)OC 34a_100000765174_100011995733 [0,1,0,1,0,0|2,0,0]=4 19106 B16R1.273 CCCOCCN1CCCCC1C(=O)NC 2230a_100011209383_100011215938 [0,1,0,1,0,0|2,0,0]=4 19107 B16R1.273 CCCOCCN1CCCCC1C(=O)NC 269982a_100011209383_100011215938 [0,1,0,1,0,0|2,0,0]=4 19108 B16R1.273 CCCOCCN1CCCCC1C(=O)NC 34a_100011209383_100011215938 [0,1,0,1,0,0|2,0,0]=4 19109 B16R1.273 CCCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100011215938 [0,1,0,1,0,0|1,0,0]=3 19110 B16R1.273 CCCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100011215938 [0,1,0,1,0,0|1,0,0]=3 19111 B16R1.273 CCCOCCN1CCCCC1C(=O)OC 34a_100000734855_100011215938 [0,1,0,1,0,0|1,0,0]=3 19112 B16R1.273 CCCOCCN1CCOCC1C(=O)OC 2230a_100000765174_100011215938 [0,1,0,1,0,0|2,0,0]=4 19113 B16R1.273 CCCOCCN1CCOCC1C(=O)OC 34a_100000765174_100011215938 [0,1,0,1,0,0|2,0,0]=4 19114 B16R1.273 CCOCCCN1CCCCC1C(=O)NC 2230a_100011209383_100012232248 [0,1,0,1,0,0|2,0,0]=4 19115 B16R1.273 CCOCCCN1CCCCC1C(=O)NC 269982a_100011209383_100012232248 [0,1,0,1,0,0|2,0,0]=4 19116 B16R1.273 CCOCCCN1CCCCC1C(=O)NC 34a_100011209383_100012232248 [0,1,0,1,0,0|2,0,0]=4 19117 B16R1.273 CCOCCCN1CCCCC1C(=O)OC 2230a_100000734855_100012232248 [0,1,0,1,0,0|1,0,0]=3 19118 B16R1.273 CCOCCCN1CCCCC1C(=O)OC 269982a_100000734855_100012232248 [0,1,0,1,0,0|1,0,0]=3 19119 B16R1.273 CCOCCCN1CCCCC1C(=O)OC 34a_100000734855_100012232248 [0,1,0,1,0,0|1,0,0]=3 19120 B16R1.273 CCOCCCN1CCOCC1C(=O)OC 2230a_100000765174_100012232248 [0,1,0,1,0,0|2,0,0]=4 19121 B16R1.273 CCOCCCN1CCOCC1C(=O)OC 34a_100000765174_100012232248 [0,1,0,1,0,0|2,0,0]=4 19122 B16R1.273 CCOCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210147 [0,1,0,1,0,0|2,0,0]=4 19123 B16R1.273 CCOCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210147 [0,1,0,1,0,0|1,0,0]=3 19124 B16R1.273 CCOCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011215890 [0,1,0,1,0,0|1,0,0]=3 19125 B16R1.273 CCSCCOC1CCNCC1C(=O)OC 34a_200103168510_100000757381 [0,1,0,1,0,0|2,0,0]=4 19126 B16R1.273 CCSCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000757381 [0,1,0,1,0,0|1,0,0]=3 19127 B16R1.273 CCSCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000757381 [0,1,0,1,0,0|1,0,0]=3 19128 B16R1.273 CNC(=O)C1CCCCN1CCCCCF 2230a_100011209383_100000729378 [0,1,0,1,0,0|2,0,0]=4 19129 B16R1.273 CNC(=O)C1CCCCN1CCCCCF 269982a_100011209383_100000729378 [0,1,0,1,0,0|2,0,0]=4 19130 B16R1.273 CNC(=O)C1CCCCN1CCCCCF 34a_100011209383_100000729378 [0,1,0,1,0,0|2,0,0]=4 19131 B16R1.273 CNC(=O)C1CCCCN1CCCCCO 2230a_100011209383_100000746330 [0,1,0,1,0,0|2,0,0]=4 19132 B16R1.273 CNC(=O)C1CCCCN1CCCCCO 269982a_100011209383_100000746330 [0,1,0,1,0,0|2,0,0]=4 19133 B16R1.273 CNC(=O)C1CCCCN1CCCCCO 34a_100011209383_100000746330 [0,1,0,1,0,0|2,0,0]=4 19134 B16R1.273 CNC(=O)C1CCCCN1CCCCOC 2230a_100011209383_100000730899 [0,1,0,1,0,0|2,0,0]=4 19135 B16R1.273 CNC(=O)C1CCCCN1CCCCOC 269982a_100011209383_100000730899 [0,1,0,1,0,0|2,0,0]=4 19136 B16R1.273 CNC(=O)C1CCCCN1CCCCOC 34a_100011209383_100000755781 [0,1,0,1,0,0|2,0,0]=4 19137 B16R1.273 COC(=O)C1CCCCN1CCCCC#N 2230a_100000734855_100000211819 [0,1,0,1,0,0|1,0,1]=4 19138 B16R1.273 COC(=O)C1CCCCN1CCCCC#N 269982a_100000734855_100011219923 [0,1,0,1,0,0|1,0,1]=4 19139 B16R1.273 COC(=O)C1CCCCN1CCCCC=O 2230a_100000734855_100000139335 [0,1,0,1,0,0|1,0,1]=4 19140 B16R1.273 COC(=O)C1CCCCN1CCCCC=O 269982a_100000734855_100000139335 [0,1,0,1,0,0|1,0,1]=4 19141 B16R1.273 COC(=O)C1CCCCN1CCCCCF 2230a_100000734855_100000729378 [0,1,0,1,0,0|1,0,0]=3 19142 B16R1.273 COC(=O)C1CCCCN1CCCCCF 269982a_100000734855_100000729378 [0,1,0,1,0,0|1,0,0]=3 19143 B16R1.273 COC(=O)C1CCCCN1CCCCCF 34a_100000734855_100000729378 [0,1,0,1,0,0|1,0,0]=3 19144 B16R1.273 COC(=O)C1CCCCN1CCCCCO 2230a_100000734855_100000746330 [0,1,0,1,0,0|1,0,0]=3 19145 B16R1.273 COC(=O)C1CCCCN1CCCCCO 269982a_100000734855_100000746330 [0,1,0,1,0,0|1,0,0]=3 19146 B16R1.273 COC(=O)C1CCCCN1CCCCCO 34a_100000734855_100000746330 [0,1,0,1,0,0|1,0,0]=3 19147 B16R1.273 COC(=O)C1CCCCN1CCOCCO 2230a_100000734855_100011215305 [0,1,0,1,0,0|2,0,0]=4 19148 B16R1.273 COC(=O)C1CCCCN1CCOCCO 269982a_100000734855_100011215305 [0,1,0,1,0,0|2,0,0]=4 19149 B16R1.273 COC(=O)C1CCCCN1CCOCCO 34a_100000734855_100000692535 [0,1,0,1,0,0|2,0,0]=4 19150 B16R1.273 COC(=O)C1CNCCC1OCCCCF 34a_200103168510_100000729493 [0,1,0,1,0,0|2,0,0]=4 19151 B16R1.273 COC(=O)C1CNCCC1OCCCCO 34a_200103168510_100011216708 [0,1,0,1,0,0|2,0,0]=4 19152 B16R1.273 COC(=O)C1COCCN1CCCCCF 2230a_100000765174_100000729378 [0,1,0,1,0,0|2,0,0]=4 19153 B16R1.273 COC(=O)C1COCCN1CCCCCF 34a_100000765174_100000729378 [0,1,0,1,0,0|2,0,0]=4 19154 B16R1.273 COC(=O)C1COCCN1CCCCCO 2230a_100000765174_100000746330 [0,1,0,1,0,0|2,0,0]=4 19155 B16R1.273 COC(=O)C1COCCN1CCCCCO 34a_100000765174_100000746330 [0,1,0,1,0,0|2,0,0]=4 19156 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCC#N 7a_100015709673_100000687738 [0,1,0,1,0,0|1,0,1]=4 19157 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCC=O 7a_100015709673_200011292268 [0,1,0,1,0,0|1,0,1]=4 19158 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCF 34a_100015709673_100000729493 [0,1,0,1,0,0|1,0,0]=3 19159 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCF 7a_100015709673_100000729493 [0,1,0,1,0,0|1,0,0]=3 19160 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCO 34a_100015709673_100011216708 [0,1,0,1,0,0|1,0,0]=3 19161 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCO 7a_100015709673_100000210776 [0,1,0,1,0,0|1,0,0]=3 19162 B16R1.273 COCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000730899 [0,1,0,1,0,0|1,0,0]=3 19163 B16R1.273 COCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000730899 [0,1,0,1,0,0|1,0,0]=3 19164 B16R1.273 COCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000755781 [0,1,0,1,0,0|1,0,0]=3 19165 B16R1.273 COCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000730899 [0,1,0,1,0,0|2,0,0]=4 19166 B16R1.273 COCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000755781 [0,1,0,1,0,0|2,0,0]=4 19167 B16R1.273 COCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000740836 [0,1,0,1,0,0|2,0,0]=4 19168 B16R1.273 COCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000740836 [0,1,0,1,0,0|1,0,0]=3 19169 B16R1.273 COCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000740836 [0,1,0,1,0,0|1,0,0]=3 19170 B16R1.273 COCCOCN1CCCCC1C(=O)OC 2230a_100000734855_100000231047 [0,1,0,1,0,0|2,0,0]=4 19171 B16R1.273 COCCOCN1CCCCC1C(=O)OC 269982a_100000734855_100000231047 [0,1,0,1,0,0|2,0,0]=4 19172 B16R1.285 C#CCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100010269958 [0,1,0,1,0,0|0,0,2]=4 19173 B16R1.285 C#CCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100010269958 [0,1,0,1,0,0|0,0,2]=4 19174 B16R1.285 C#CCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100010269958 [0,1,0,1,0,0|0,0,2]=4 19175 B16R1.285 C=CCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011215482 [0,1,0,1,0,0|0,0,2]=4 19176 B16R1.285 C=CCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215482 [0,1,0,1,0,0|0,0,2]=4 19177 B16R1.285 C=CCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011215482 [0,1,0,1,0,0|0,0,2]=4 19178 B16R1.285 CC/C=C\CCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100015370543 [0,1,0,1,0,0|0,0,2]=4 19179 B16R1.285 CC/C=C\CCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100015370543 [0,1,0,1,0,0|0,0,2]=4 19180 B16R1.285 CC/C=C\CCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100015370543 [0,1,0,1,0,0|0,0,2]=4 19181 B16R1.285 CCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210314 [0,1,0,1,0,0|0,0,0]=2 19182 B16R1.285 CCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210757 [0,1,0,1,0,0|0,0,0]=2 19183 B16R1.285 CCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210314 [0,1,0,1,0,0|0,0,0]=2 19184 B16R1.285 CCCCOCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011995733 [0,1,0,1,0,0|1,0,0]=3 19185 B16R1.285 CCCCOCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011995733 [0,1,0,1,0,0|1,0,0]=3 19186 B16R1.285 CCCCOCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011995733 [0,1,0,1,0,0|1,0,0]=3 19187 B16R1.285 CCCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011215938 [0,1,0,1,0,0|1,0,0]=3 19188 B16R1.285 CCCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215938 [0,1,0,1,0,0|1,0,0]=3 19189 B16R1.285 CCCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011215938 [0,1,0,1,0,0|1,0,0]=3 19190 B16R1.285 CCOCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100012232248 [0,1,0,1,0,0|1,0,0]=3 19191 B16R1.285 CCOCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100012232248 [0,1,0,1,0,0|1,0,0]=3 19192 B16R1.285 CCOCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100012232248 [0,1,0,1,0,0|1,0,0]=3 19193 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCC#N 2230a_100025726698_100000211819 [0,1,0,1,0,0|1,0,1]=4 19194 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCC#N 269982a_100025726698_100011219923 [0,1,0,1,0,0|1,0,1]=4 19195 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCC=O 2230a_100025726698_100000139335 [0,1,0,1,0,0|1,0,1]=4 19196 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCC=O 269982a_100025726698_100000139335 [0,1,0,1,0,0|1,0,1]=4 19197 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCF 2230a_100025726698_100000729378 [0,1,0,1,0,0|1,0,0]=3 19198 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCF 269982a_100025726698_100000729378 [0,1,0,1,0,0|1,0,0]=3 19199 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCF 34a_100025726698_100000729378 [0,1,0,1,0,0|1,0,0]=3 19200 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCO 2230a_100025726698_100000746330 [0,1,0,1,0,0|1,0,0]=3 19201 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCO 269982a_100025726698_100000746330 [0,1,0,1,0,0|1,0,0]=3 19202 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCO 34a_100025726698_100000746330 [0,1,0,1,0,0|1,0,0]=3 19203 B16R1.285 COC(=O)C[C@H]1CCCN1CCOCCO 2230a_100025726698_100011215305 [0,1,0,1,0,0|2,0,0]=4 19204 B16R1.285 COC(=O)C[C@H]1CCCN1CCOCCO 269982a_100025726698_100011215305 [0,1,0,1,0,0|2,0,0]=4 19205 B16R1.285 COC(=O)C[C@H]1CCCN1CCOCCO 34a_100025726698_100000692535 [0,1,0,1,0,0|2,0,0]=4 19206 B16R1.285 COCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000730899 [0,1,0,1,0,0|1,0,0]=3 19207 B16R1.285 COCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000730899 [0,1,0,1,0,0|1,0,0]=3 19208 B16R1.285 COCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000755781 [0,1,0,1,0,0|1,0,0]=3 19209 B16R1.285 COCCOCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000231047 [0,1,0,1,0,0|2,0,0]=4 19210 B16R1.285 COCCOCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000231047 [0,1,0,1,0,0|2,0,0]=4 19211 B16R1.300 COCC1CCN1CCCCCC(=O)OC 2230a_100015195929_100009816466 [0,1,0,1,0,0|1,0,0]=3 19212 B16R1.300 COCC1CCN1CCCCCC(=O)OC 269982a_100015195929_100009816466 [0,1,0,1,0,0|1,0,0]=3 19213 B16R1.300 COCC1CCN1CCCCCC(=O)OC 34a_100015195929_100009816466 [0,1,0,1,0,0|1,0,0]=3 19214 B16R1.642 CCCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100000210320 [0,1,0,1,0,0|1,0,0]=3 19215 B16R1.642 CCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100011214924 [0,1,0,1,0,0|1,0,0]=3 19216 B16R1.642 CCCCCCCCCNC1COC(=O)O1 34a_100000212291_100000032252 [0,1,0,1,0,0|1,0,0]=3 19217 B16R1.642 CCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100011214924 [0,1,0,1,0,0|1,0,0]=3 19218 B16R1.642 CCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100011214924 [0,1,0,1,0,0|1,0,0]=3 19219 B16R1.642 CCCCCCCCCOC1COC(=O)O1 34a_100000210712_100000032252 [0,1,0,1,0,0|1,0,0]=3 19220 B16R1.642 CCCCCCCCNCC1=CC(=O)OC1 34a_100000229939_100000716558 [0,1,0,1,0,0|0,0,2]=4 19221 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210759 [0,1,0,1,0,0|1,0,0]=3 19222 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210759 [0,1,0,1,0,0|1,0,0]=3 19223 B16R1.642 CCCCCCCCNCC1CNC(=O)O1 2230a_100000229939_100000181169 [0,1,0,1,0,0|2,0,0]=4 19224 B16R1.642 CCCCCCCCNCC1CNC(=O)O1 34a_100000229939_100000181169 [0,1,0,1,0,0|2,0,0]=4 19225 B16R1.642 CCCCCCCCNCC1COC(=O)O1 34a_100000229939_100000073702 [0,1,0,1,0,0|1,0,0]=3 19226 B16R1.642 CCCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000229939_100015189358 [0,1,0,1,0,0|2,0,0]=4 19227 B16R1.642 CCCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210759 [0,1,0,1,0,0|2,0,0]=4 19228 B16R1.642 CCCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210759 [0,1,0,1,0,0|2,0,0]=4 19229 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000229939_100015307671 [0,1,0,1,0,0|1,0,0]=3 19230 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 34a_100000229939_100015307671 [0,1,0,1,0,0|1,0,0]=3 19231 B16R1.642 CCCCCCCCOCC1=CC(=O)OC1 34a_100000210232_100000716558 [0,1,0,1,0,0|0,0,2]=4 19232 B16R1.642 CCCCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210759 [0,1,0,1,0,0|2,0,0]=4 19233 B16R1.642 CCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210759 [0,1,0,1,0,0|1,0,0]=3 19234 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 34a_100000210232_100000181169 [0,1,0,1,0,0|2,0,0]=4 19235 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210759 [0,1,0,1,0,0|2,0,0]=4 19236 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 7a_100000210232_100000181169 [0,1,0,1,0,0|2,0,0]=4 19237 B16R1.642 CCCCCCCCOCC1COC(=O)O1 34a_100000210232_100000073702 [0,1,0,1,0,0|1,0,0]=3 19238 B16R1.642 CCCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210232_100015189358 [0,1,0,1,0,0|2,0,0]=4 19239 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210232_100015307671 [0,1,0,1,0,0|1,0,0]=3 19240 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210232_100015307671 [0,1,0,1,0,0|1,0,0]=3 19241 B16R1.642 CCCCCCCCSCC1=CC(=O)OC1 62a_100000210759_100000716558 [0,1,0,1,0,0|0,0,2]=4 19242 B16R1.642 CCCCCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210317 [0,1,0,1,0,0|0,0,2]=4 19243 B16R1.642 CCCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210317 [0,1,0,1,0,0|2,0,0]=4 19244 B16R1.642 CCCCCCCCSCC1CNC(=O)O1 62a_100000210759_100000181169 [0,1,0,1,0,0|2,0,0]=4 19245 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210317 [0,1,0,1,0,0|1,0,0]=3 19246 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000210759_100000073702 [0,1,0,1,0,0|1,0,0]=3 19247 B16R1.642 CCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210759_100015189358 [0,1,0,1,0,0|2,0,0]=4 19248 B16R1.642 CCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210317 [0,1,0,1,0,0|2,0,0]=4 19249 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100000210759_100015307671 [0,1,0,1,0,0|1,0,0]=3 19250 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210317 [0,1,0,1,0,0|1,0,0]=3 19251 B16R1.642 CCCCCCCOCCC1COS(=O)O1 7a_100000210272_100009840081 [0,1,0,1,0,0|2,0,0]=4 19252 B16R1.642 CCCCCCCSCCC1COS(=O)O1 62a_100000210614_100009840081 [0,1,0,1,0,0|2,0,0]=4 19253 B16R1.642 CCCCCCOCCOC1COC(=O)O1 34a_100000691444_100000032252 [0,1,0,1,0,0|2,0,0]=4 19254 B16R1.642 CCCCCNCCOCC1COC(=O)O1 34a_100000224656_100000073702 [0,1,0,1,0,0|2,0,0]=4 19255 B16R1.642 CCCCCNCCOC[C@H]1COC(=O)N1 34a_100000224656_100015307671 [0,1,0,1,0,0|2,0,0]=4 19256 B16R1.642 CCCCCOCCOCC1COC(=O)O1 34a_100011215259_100000073702 [0,1,0,1,0,0|2,0,0]=4 19257 B16R1.642 CCCCCOCCOC[C@H]1COC(=O)N1 34a_100011215259_100015307671 [0,1,0,1,0,0|2,0,0]=4 19258 B16R1.642 CCCCCOCCOC[C@H]1COC(=O)N1 7a_100011215259_100015307671 [0,1,0,1,0,0|2,0,0]=4 19259 B16R1.642 CCCCNCCCCOC1COC(=O)O1 34a_200011216965_100000032252 [0,1,0,1,0,0|2,0,0]=4 19260 B16R1.642 CCCCOCCCCOC1COC(=O)O1 34a_200000760531_100000032252 [0,1,0,1,0,0|2,0,0]=4 19261 B16R1.642 CCCCOCCCNCC1COC(=O)O1 34a_200000211371_100000073702 [0,1,0,1,0,0|2,0,0]=4 19262 B16R1.642 CCCCOCCCNC[C@H]1COC(=O)N1 2230a_200000211371_100015307671 [0,1,0,1,0,0|2,0,0]=4 19263 B16R1.642 CCCCOCCCNC[C@H]1COC(=O)N1 34a_200000211371_100015307671 [0,1,0,1,0,0|2,0,0]=4 19264 B16R1.642 CCCCOCCCOCC1COC(=O)O1 34a_200011215613_100000073702 [0,1,0,1,0,0|2,0,0]=4 19265 B16R1.642 CCCCOCCCOC[C@H]1COC(=O)N1 34a_200011215613_100015307671 [0,1,0,1,0,0|2,0,0]=4 19266 B16R1.642 CCCCOCCCOC[C@H]1COC(=O)N1 7a_200011215613_100015307671 [0,1,0,1,0,0|2,0,0]=4 19267 B16R1.642 COCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100011998445 [0,1,0,1,0,0|2,0,0]=4 19268 B16R1.642 COCCCCCCNCC1CNC(=O)C1 34a_100016993742_100011998445 [0,1,0,1,0,0|2,0,0]=4 19269 B16R1.642 COCCCCCCOCC1CNC(=O)C1 34a_100016041077_100011998445 [0,1,0,1,0,0|2,0,0]=4 19270 B16R1.642 COCCCCCCOCC1COC(=O)O1 34a_200012092642_100000073702 [0,1,0,1,0,0|2,0,0]=4 19271 B16R1.642 COCCCCCCOC[C@H]1COC(=O)N1 34a_200012092642_100015307671 [0,1,0,1,0,0|2,0,0]=4 19272 B16R1.642 COCCCCCCOC[C@H]1COC(=O)N1 7a_200012092642_100015307671 [0,1,0,1,0,0|2,0,0]=4 19273 B16R1.642 COCCCCCCSCC1COC(=O)O1 62a_100000073702_100011998445 [0,1,0,1,0,0|2,0,0]=4 19274 B16R1.642 COCCCCCCSCC1COC(=O)O1 62a_100011998445_100000073702 [0,1,0,1,0,0|2,0,0]=4 19275 B16R1.642 COCCCCCCSC[C@H]1COC(=O)N1 62a_100011998445_100015307671 [0,1,0,1,0,0|2,0,0]=4 19276 B16R1.642 COCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100011998445 [0,1,0,1,0,0|2,0,0]=4 19277 B16R1.642 NCCCCCCCCOC1COC(=O)O1 34a_102515433106_100000032252 [0,1,0,1,0,0|2,0,0]=4 19278 B16R1.642 NCCCCCCCOCC1COC(=O)O1 34a_100011996573_100000073702 [0,1,0,1,0,0|2,0,0]=4 19279 B16R1.642 NCCCCCCCOC[C@H]1COC(=O)N1 34a_100011996573_100015307671 [0,1,0,1,0,0|2,0,0]=4 19280 B16R1.642 O=C1CC(CN1)CNCCCCCCCO 2230a_100016993742_100000760002 [0,1,0,1,0,0|2,0,0]=4 19281 B16R1.642 O=C1CC(CN1)CNCCCCCCCO 34a_100016993742_100000760002 [0,1,0,1,0,0|2,0,0]=4 19282 B16R1.642 O=C1CC(CN1)COCCCCCCCO 34a_100016041077_100000760002 [0,1,0,1,0,0|2,0,0]=4 19283 B16R1.642 O=C1CC(CN1)NCCCCCCCCO 2230a_100000697751_100000033203 [0,1,0,1,0,0|2,0,0]=4 19284 B16R1.642 O=C1CC(CN1)OCCCCCCCCO 34a_100000690082_100000033203 [0,1,0,1,0,0|2,0,0]=4 19285 B16R1.642 O=C1CCC(C1)OCCCCCCCCO 34a_100012614533_100000033203 [0,1,0,1,0,0|2,0,0]=4 19286 B16R1.642 O=C1CN(CN1)CCCCCCCCCO 2230a_200000708111_100009813782 [0,1,0,1,0,0|2,0,0]=4 19287 B16R1.642 O=C1N[C@H](CO1)CNCCCCCCCO 2230a_100011996573_100015307671 [0,1,0,1,0,0|2,0,0]=4 19288 B16R1.642 O=C1N[C@H](CO1)CNCCCCCCCO 34a_100011996573_100015307671 [0,1,0,1,0,0|2,0,0]=4 19289 B16R1.642 O=C1N[C@H](CO1)COCCCCCCCBr 34a_100000760002_100015307671 [0,1,0,1,0,0|2,0,0]=4 19290 B16R1.642 O=C1N[C@H](CO1)COCCCCCCCBr 7a_100000760002_100015307671 [0,1,0,1,0,0|2,0,0]=4 19291 B16R1.642 O=C1N[C@H](CO1)CSCCCCCCCO 62a_100000760002_100015307671 [0,1,0,1,0,0|2,0,0]=4 19292 B16R1.642 O=C1N[C@H](CO1)CSCCCCCCCO 62a_100015307671_100000760002 [0,1,0,1,0,0|2,0,0]=4 19293 B16R1.642 O=C1OCC(O1)CNCCCCCCCO 34a_100011996573_100000073702 [0,1,0,1,0,0|2,0,0]=4 19294 B16R1.642 O=C1OCC(O1)COCCCCCCCBr 34a_100000760002_100000073702 [0,1,0,1,0,0|2,0,0]=4 19295 B16R1.642 O=C1OCC(O1)CSCCCCCCCO 62a_100000073702_100000760002 [0,1,0,1,0,0|2,0,0]=4 19296 B16R1.642 O=C1OCC(O1)CSCCCCCCCO 62a_100000760002_100000073702 [0,1,0,1,0,0|2,0,0]=4 19297 B16R1.642 O=C1OCC(O1)NCCCCCCCCO 34a_102515433106_100000032252 [0,1,0,1,0,0|2,0,0]=4 19298 B16R1.642 O=C1OCC(O1)OCCCCCCCCBr 34a_100009813846_100000032252 [0,1,0,1,0,0|2,0,0]=4 19299 B16R1.642 O=C1OCC(O1)OCCCCCCCCCl 34a_100000033203_100000032252 [0,1,0,1,0,0|2,0,0]=4 19300 B16R1.642 O=C1OCC(O1)SCCCCCCCCO 62a_100000033203_100000032252 [0,1,0,1,0,0|2,0,0]=4 19301 B16R1.696 CCCC1CCCCC1NCCC(=O)NC 269862a_100000738227_100011218038 [0,1,0,1,0,0|1,0,0]=3 19302 B16R1.696 CCCC1CCCCC1NCCC(=O)NC 270004a_100000738227_100011218038 [0,1,0,1,0,0|1,0,0]=3 19303 B16R1.696 CCCC1CCCCC1OCCC(=O)NC 34a_100011217265_100012179268 [0,1,0,1,0,0|1,0,0]=3 19304 B16R1.696 CCCC1CCCCC1OCCC(=O)NC 7a_100011217265_100000737683 [0,1,0,1,0,0|1,0,0]=3 19305 B16R1.696 CCCC1CCCCC1OCCC(=O)OC 34a_100011217265_100000742370 [0,1,0,1,0,0|0,0,0]=2 19306 B16R1.696 CCCC1CCCCC1OCCC(=O)OC 7a_100011217265_100000204255 [0,1,0,1,0,0|0,0,0]=2 19307 B16R1.696 CCCC1CCCCN1C/C=C/C(=O)OC 2230a_100000701414_100000742655 [0,1,0,1,0,0|0,0,2]=4 19308 B16R1.696 CCCC1CCCCN1C/C=C/C(=O)OC 269982a_100000701414_100000742655 [0,1,0,1,0,0|0,0,2]=4 19309 B16R1.696 CCCC1CCCCN1C/C=C/C(=O)OC 34a_100000701414_100000742655 [0,1,0,1,0,0|0,0,2]=4 19310 B16R1.696 CCCC1CCCCN1CCCC(=O)NC 2230a_100000701414_100000741757 [0,1,0,1,0,0|1,0,0]=3 19311 B16R1.696 CCCC1CCCCN1CCCC(=O)NC 269982a_100000701414_100000741757 [0,1,0,1,0,0|1,0,0]=3 19312 B16R1.696 CCCC1CCCCN1CCCC(=O)NC 34a_100000701414_100000741757 [0,1,0,1,0,0|1,0,0]=3 19313 B16R1.696 CCCC1CCCCN1CCCC(=O)OC 2230a_100000701414_100011218270 [0,1,0,1,0,0|0,0,0]=2 19314 B16R1.696 CCCC1CCCCN1CCCC(=O)OC 269982a_100000701414_100011218270 [0,1,0,1,0,0|0,0,0]=2 19315 B16R1.696 CCCC1CCCCN1CCCC(=O)OC 34a_100000701414_100000742333 [0,1,0,1,0,0|0,0,0]=2 19316 B16R1.696 CCCC1CCCCN1CCOC(=O)NC 269982a_100000701414_200011997002 [0,1,0,1,0,0|2,0,0]=4 19317 B16R1.696 CCCC1CCCCN1CCOC(=O)NC 34a_100000701414_200011997002 [0,1,0,1,0,0|2,0,0]=4 19318 B16R1.696 CCCC1COCCN1CCCC(=O)NC 2230a_102495339903_100000741757 [0,1,0,1,0,0|2,0,0]=4 19319 B16R1.696 CCCC1COCCN1CCCC(=O)NC 269982a_102495339903_100000741757 [0,1,0,1,0,0|2,0,0]=4 19320 B16R1.696 CCCC1COCCN1CCCC(=O)NC 34a_102495339903_100000741757 [0,1,0,1,0,0|2,0,0]=4 19321 B16R1.696 CCCC1COCCN1CCCC(=O)OC 2230a_102495339903_100011218270 [0,1,0,1,0,0|1,0,0]=3 19322 B16R1.696 CCCC1COCCN1CCCC(=O)OC 269982a_102495339903_100011218270 [0,1,0,1,0,0|1,0,0]=3 19323 B16R1.696 CCCC1COCCN1CCCC(=O)OC 34a_102495339903_100000742333 [0,1,0,1,0,0|1,0,0]=3 19324 B16R1.696 CCOC1CCCCC1NCCC(=O)NC 270004a_100000738227_200000031474 [0,1,0,1,0,0|2,0,0]=4 19325 B16R1.696 CNC(=O)CCCN1CCCCC1CCO 2230a_100000211664_100000741757 [0,1,0,1,0,0|2,0,0]=4 19326 B16R1.696 CNC(=O)CCCN1CCCCC1CCO 269982a_100000211664_100000741757 [0,1,0,1,0,0|2,0,0]=4 19327 B16R1.696 CNC(=O)CCCN1CCCCC1CCO 34a_100000211664_100000741757 [0,1,0,1,0,0|2,0,0]=4 19328 B16R1.696 CNC(=O)CCCN1CCCCC1COC 2230a_100015184032_100000741757 [0,1,0,1,0,0|2,0,0]=4 19329 B16R1.696 CNC(=O)CCCN1CCCCC1COC 269982a_100015184032_100000741757 [0,1,0,1,0,0|2,0,0]=4 19330 B16R1.696 CNC(=O)CCCN1CCCCC1COC 34a_100015184032_100000741757 [0,1,0,1,0,0|2,0,0]=4 19331 B16R1.696 COC(=O)CCCN1CCCCC1CC#N 2230a_100000133382_100011218270 [0,1,0,1,0,0|1,0,1]=4 19332 B16R1.696 COC(=O)CCCN1CCCCC1CC#N 34a_100000133382_100000742333 [0,1,0,1,0,0|1,0,1]=4 19333 B16R1.696 COC(=O)CCCN1CCCCC1CCO 2230a_100000211664_100011218270 [0,1,0,1,0,0|1,0,0]=3 19334 B16R1.696 COC(=O)CCCN1CCCCC1CCO 269982a_100000211664_100011218270 [0,1,0,1,0,0|1,0,0]=3 19335 B16R1.696 COC(=O)CCCN1CCCCC1CCO 34a_100000211664_100000742333 [0,1,0,1,0,0|1,0,0]=3 19336 B16R1.696 COC(=O)COCC1CCCCN1CCN 34a_100011473795_100000747449 [0,1,0,1,0,0|2,0,0]=4 19337 B16R1.696 COCC1CCCCN1CCCC(=O)OC 2230a_100015184032_100011218270 [0,1,0,1,0,0|1,0,0]=3 19338 B16R1.696 COCC1CCCCN1CCCC(=O)OC 269982a_100015184032_100011218270 [0,1,0,1,0,0|1,0,0]=3 19339 B16R1.696 COCC1CCCCN1CCCC(=O)OC 34a_100015184032_100000742333 [0,1,0,1,0,0|1,0,0]=3 19340 B16R1.696 COC[C@H]1COCCN1CCCC(=O)OC 2230a_100016989928_100011218270 [0,1,0,1,0,0|2,0,0]=4 19341 B16R1.696 COC[C@H]1COCCN1CCCC(=O)OC 269982a_100016989928_100011218270 [0,1,0,1,0,0|2,0,0]=4 19342 B16R1.696 COC[C@H]1COCCN1CCCC(=O)OC 34a_100016989928_100000742333 [0,1,0,1,0,0|2,0,0]=4 19343 B16R1.994 CNC(=O)CCN1CCCCC1CCCO 2230a_100011934581_100000737683 [0,1,0,1,0,0|2,0,0]=4 19344 B16R1.994 CNC(=O)CCN1CCCCC1CCCO 269982a_100011934581_100000737683 [0,1,0,1,0,0|2,0,0]=4 19345 B16R1.994 CNC(=O)CCN1CCCCC1CCCO 34a_100011934581_100012179268 [0,1,0,1,0,0|2,0,0]=4 19346 B16R1.994 CNC(=O)CCN1CCCCC1CCOC 2230a_100015186528_100000737683 [0,1,0,1,0,0|2,0,0]=4 19347 B16R1.994 CNC(=O)CCN1CCCCC1CCOC 269982a_100015186528_100000737683 [0,1,0,1,0,0|2,0,0]=4 19348 B16R1.994 CNC(=O)CCN1CCCCC1CCOC 34a_100015186528_100012179268 [0,1,0,1,0,0|2,0,0]=4 19349 B16R1.994 COC(=O)CCN1CCCCC1CCCO 2230a_100011934581_100000204255 [0,1,0,1,0,0|1,0,0]=3 19350 B16R1.994 COC(=O)CCN1CCCCC1CCCO 269982a_100011934581_100000204255 [0,1,0,1,0,0|1,0,0]=3 19351 B16R1.994 COC(=O)CCN1CCCCC1CCCO 34a_100011934581_100000742370 [0,1,0,1,0,0|1,0,0]=3 19352 B16R1.994 COCCC1CCCCN1CCC(=O)OC 2230a_100015186528_100000204255 [0,1,0,1,0,0|1,0,0]=3 19353 B16R1.994 COCCC1CCCCN1CCC(=O)OC 269982a_100015186528_100000204255 [0,1,0,1,0,0|1,0,0]=3 19354 B16R1.994 COCCC1CCCCN1CCC(=O)OC 34a_100015186528_100000742370 [0,1,0,1,0,0|1,0,0]=3 19355 B16R1.1095 CCC(=O)NCCNCCCC1CCCC1 34a_100132302217_100011713738 [0,1,0,1,0,0|2,0,0]=4 19356 B16R1.1095 CCC(=O)NCCOCCCC1CCCC1 34a_200000158885_100011713738 [0,1,0,1,0,0|2,0,0]=4 19357 B16R1.1095 CCC(=O)NCCOCCCC1CCCC1 7a_200000158885_100011713738 [0,1,0,1,0,0|2,0,0]=4 19358 B16R1.1095 CCC(=O)OCCOCCCC1CCCC1 7a_200000031056_100011713738 [0,1,0,1,0,0|2,0,0]=4 19359 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 2230a_100000736752_100000741757 [0,1,0,1,0,0|1,0,0]=3 19360 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 2230a_100000740002_100011713738 [0,1,0,1,0,0|1,0,0]=3 19361 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 34a_100000736752_100000741757 [0,1,0,1,0,0|1,0,0]=3 19362 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 34a_100000740002_100011713738 [0,1,0,1,0,0|1,0,0]=3 19363 B16R1.1095 CNC(=O)CCCNCCCN1CCCC1 2230a_100000740002_100011445909 [0,1,0,1,0,0|2,0,0]=4 19364 B16R1.1095 CNC(=O)CCCNCCCN1CCCC1 34a_100000740002_100016991639 [0,1,0,1,0,0|2,0,0]=4 19365 B16R1.1095 CNC(=O)CCCNCCOC1CCCC1 34a_100000741755_100000741757 [0,1,0,1,0,0|2,0,0]=4 19366 B16R1.1095 CNC(=O)CCCOCCCC1CCCC1 34a_100011215328_100000741757 [0,1,0,1,0,0|1,0,0]=3 19367 B16R1.1095 CNC(=O)CCCOCCCC1CCCC1 7a_100011215328_100000741757 [0,1,0,1,0,0|1,0,0]=3 19368 B16R1.1095 CNC(=O)CCCOCCNC1CCCC1 34a_200000200444_100000741757 [0,1,0,1,0,0|2,0,0]=4 19369 B16R1.1095 CNC(=O)CCCOCCOC1CCCC1 34a_100000738311_100000741757 [0,1,0,1,0,0|2,0,0]=4 19370 B16R1.1095 CNC(=O)CCCOCCOC1CCCC1 7a_100000738311_100000741757 [0,1,0,1,0,0|2,0,0]=4 19371 B16R1.1095 CNC(=O)CCCSCCCC1CCCC1 62a_100000741757_100011713738 [0,1,0,1,0,0|1,0,0]=3 19372 B16R1.1095 CNC(=O)CCCSCCCC1CCCC1 62a_100011713738_100000741757 [0,1,0,1,0,0|1,0,0]=3 19373 B16R1.1095 CNC(=O)CCCSCCCN1CCCC1 62a_100000741757_100011445909 [0,1,0,1,0,0|2,0,0]=4 19374 B16R1.1095 CNC(=O)CCCSCCCN1CCCC1 62a_100016991639_100000741757 [0,1,0,1,0,0|2,0,0]=4 19375 B16R1.1095 CNC(=O)CCNCCCOC1CCCC1 34a_100000747560_100012179268 [0,1,0,1,0,0|2,0,0]=4 19376 B16R1.1095 CNC(=O)NCCNCCCC1CCCC1 34a_100015205895_100011713738 [0,1,0,1,0,0|2,0,0]=4 19377 B16R1.1095 CNC(=O)OCCNCCCC1CCCC1 34a_100000736752_200011997002 [0,1,0,1,0,0|2,0,0]=4 19378 B16R1.1095 CNC(=O)OCCOCCCC1CCCC1 34a_100011215328_200011997002 [0,1,0,1,0,0|2,0,0]=4 19379 B16R1.1095 CNC(=O)OCCOCCCC1CCCC1 7a_100011215328_200011997002 [0,1,0,1,0,0|2,0,0]=4 19380 B16R1.1095 CNC(=O)OCCSCCCC1CCCC1 62a_100011713738_200011997002 [0,1,0,1,0,0|2,0,0]=4 19381 B16R1.1095 CNC(=O)OCCSCCCC1CCCC1 62a_200011997002_100011713738 [0,1,0,1,0,0|2,0,0]=4 19382 B16R1.1095 COC(=O)/C=C/CNCCCC1CCCC1 2230a_100000736752_100000742655 [0,1,0,1,0,0|0,0,2]=4 19383 B16R1.1095 COC(=O)/C=C/CNCCCC1CCCC1 34a_100000736752_100000742655 [0,1,0,1,0,0|0,0,2]=4 19384 B16R1.1095 COC(=O)/C=C/COCCCC1CCCC1 34a_100011215328_100000742655 [0,1,0,1,0,0|0,0,2]=4 19385 B16R1.1095 COC(=O)/C=C/COCCCC1CCCC1 7a_100011215328_100000742655 [0,1,0,1,0,0|0,0,2]=4 19386 B16R1.1095 COC(=O)/C=C/CSCCCC1CCCC1 62a_100000742655_100011713738 [0,1,0,1,0,0|0,0,2]=4 19387 B16R1.1095 COC(=O)/C=C/CSCCCC1CCCC1 62a_100011713738_100000742655 [0,1,0,1,0,0|0,0,2]=4 19388 B16R1.1095 COC(=O)CCCCC=NNC1CCCC1 4a_100000737850_100000052768 [0,1,0,1,0,0|1,0,1]=4 19389 B16R1.1095 COC(=O)CCCCCCCN1CC=CC1 269982a_100015195280_100010004213 [0,1,0,1,0,0|0,0,2]=4 19390 B16R1.1095 COC(=O)CCCCCCCN1CCCC1 2230a_100000188435_100010004213 [0,1,0,1,0,0|0,0,0]=2 19391 B16R1.1095 COC(=O)CCCCCCCN1CCCC1 269982a_100000188435_100010004213 [0,1,0,1,0,0|0,0,0]=2 19392 B16R1.1095 COC(=O)CCCCCCCN1CCSC1 2230a_100011215254_100010004213 [0,1,0,1,0,0|1,0,0]=3 19393 B16R1.1095 COC(=O)CCCCCCCN1CCSC1 269982a_100011215254_100010004213 [0,1,0,1,0,0|1,0,0]=3 19394 B16R1.1095 COC(=O)CCCCCCNC1CC=CC1 2230a_100015188752_100009815986 [0,1,0,1,0,0|0,0,2]=4 19395 B16R1.1095 COC(=O)CCCCCCNC1CCCC1 2230a_100000211070_100009815986 [0,1,0,1,0,0|0,0,0]=2 19396 B16R1.1095 COC(=O)CCCCCCNC1CCCC1 34a_100000211070_100009815986 [0,1,0,1,0,0|0,0,0]=2 19397 B16R1.1095 COC(=O)CCCCCCN[C@@H]1CCOC1 2230a_200015188469_100009815986 [0,1,0,1,0,0|1,0,0]=3 19398 B16R1.1095 COC(=O)CCCCCCN[C@H]1CCOC1 2230a_100015188467_100009815986 [0,1,0,1,0,0|1,0,0]=3 19399 B16R1.1095 COC(=O)CCCCCCN[C@H]1CCOC1 34a_100015188467_100009815986 [0,1,0,1,0,0|1,0,0]=3 19400 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 34a_100000210269_100009815986 [0,1,0,1,0,0|0,0,0]=2 19401 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 34a_100009863599_100000179811 [0,1,0,1,0,0|0,0,0]=2 19402 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 7a_100000210269_100009815986 [0,1,0,1,0,0|0,0,0]=2 19403 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 7a_100009863599_100000179811 [0,1,0,1,0,0|0,0,0]=2 19404 B16R1.1095 COC(=O)CCCCCCOC1CCCO1 34a_100000085407_100009815986 [0,1,0,1,0,0|1,0,0]=3 19405 B16R1.1095 COC(=O)CCCCCCOC1CCOC1 34a_100009863599_100000690089 [0,1,0,1,0,0|1,0,0]=3 19406 B16R1.1095 COC(=O)CCCCCCOC1CCOC1 7a_100009863599_100000731011 [0,1,0,1,0,0|1,0,0]=3 19407 B16R1.1095 COC(=O)CCCCCCOC1CCSC1 7a_100011232664_100009815986 [0,1,0,1,0,0|1,0,0]=3 19408 B16R1.1095 COC(=O)CCCCCCO[C@H]1CCOC1 34a_100000717292_100009815986 [0,1,0,1,0,0|1,0,0]=3 19409 B16R1.1095 COC(=O)CCCCCCSC1CCCC1 62a_100009815986_100000179811 [0,1,0,1,0,0|0,0,0]=2 19410 B16R1.1095 COC(=O)CCCCCCSC1CCCC1 62a_100011217020_100009815986 [0,1,0,1,0,0|0,0,0]=2 19411 B16R1.1095 COC(=O)CCCCCCSC1CCOC1 62a_100009815986_100000690089 [0,1,0,1,0,0|1,0,0]=3 19412 B16R1.1095 COC(=O)CCCCCNCC1CCCC1 2230a_100000737975_100009816466 [0,1,0,1,0,0|0,0,0]=2 19413 B16R1.1095 COC(=O)CCCCCNCC1CCCC1 34a_100000737975_100009816466 [0,1,0,1,0,0|0,0,0]=2 19414 B16R1.1095 COC(=O)CCCCCNCC1CCOC1 2230a_100000737293_100009816466 [0,1,0,1,0,0|1,0,0]=3 19415 B16R1.1095 COC(=O)CCCCCNCC1CCOC1 34a_100000737293_100009816466 [0,1,0,1,0,0|1,0,0]=3 19416 B16R1.1095 COC(=O)CCCCCNCC1OCCO1 2230a_100000036311_100009816466 [0,1,0,1,0,0|2,0,0]=4 19417 B16R1.1095 COC(=O)CCCCCNCC1OCCO1 34a_100000036311_100009816466 [0,1,0,1,0,0|2,0,0]=4 19418 B16R1.1095 COC(=O)CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009816466 [0,1,0,1,0,0|1,0,0]=3 19419 B16R1.1095 COC(=O)CCCCCNC[C@@H]1CCCO1 34a_100020590478_100009816466 [0,1,0,1,0,0|1,0,0]=3 19420 B16R1.1095 COC(=O)CCCCCOCC1CC=CC1 34a_100000688395_100009816466 [0,1,0,1,0,0|0,0,2]=4 19421 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 34a_100000074720_100000740388 [0,1,0,1,0,0|0,0,0]=2 19422 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 34a_100000742336_100009816466 [0,1,0,1,0,0|0,0,0]=2 19423 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 7a_100000074720_100000740388 [0,1,0,1,0,0|0,0,0]=2 19424 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 7a_100000742336_100009816466 [0,1,0,1,0,0|0,0,0]=2 19425 B16R1.1095 COC(=O)CCCCCOCC1CCCO1 34a_100000210270_100009816466 [0,1,0,1,0,0|1,0,0]=3 19426 B16R1.1095 COC(=O)CCCCCOCC1CCCO1 7a_100000074720_100000203698 [0,1,0,1,0,0|1,0,0]=3 19427 B16R1.1095 COC(=O)CCCCCOCC1CCCO1 7a_100000210270_100009816466 [0,1,0,1,0,0|1,0,0]=3 19428 B16R1.1095 COC(=O)CCCCCOCC1CCNC1 34a_100000748654_100009816466 [0,1,0,1,0,0|1,0,0]=3 19429 B16R1.1095 COC(=O)CCCCCOCC1CCOC1 34a_100000074720_100011261433 [0,1,0,1,0,0|1,0,0]=3 19430 B16R1.1095 COC(=O)CCCCCOCC1CCOC1 34a_100000740260_100009816466 [0,1,0,1,0,0|1,0,0]=3 19431 B16R1.1095 COC(=O)CCCCCOCC1CCOC1 7a_100000074720_100000702531 [0,1,0,1,0,0|1,0,0]=3 19432 B16R1.1095 COC(=O)CCCCCOCC1COCO1 34a_100011216627_100009816466 [0,1,0,1,0,0|2,0,0]=4 19433 B16R1.1095 COC(=O)CCCCCOCC1OCCO1 34a_100000074720_100000755774 [0,1,0,1,0,0|2,0,0]=4 19434 B16R1.1095 COC(=O)CCCCCOCC1OCCO1 34a_100000087154_100009816466 [0,1,0,1,0,0|2,0,0]=4 19435 B16R1.1095 COC(=O)CCCCCOCC1OCCO1 7a_100000074720_100000755774 [0,1,0,1,0,0|2,0,0]=4 19436 B16R1.1095 COC(=O)CCCCCOC[C@H]1CCCN1 34a_100000745186_100009816466 [0,1,0,1,0,0|1,0,0]=3 19437 B16R1.1095 COC(=O)CCCCCSCC1CCCC1 62a_100000740388_100009816466 [0,1,0,1,0,0|0,0,0]=2 19438 B16R1.1095 COC(=O)CCCCCSCC1CCCC1 62a_100009816466_100000740388 [0,1,0,1,0,0|0,0,0]=2 19439 B16R1.1095 COC(=O)CCCCCSCC1CCCO1 62a_100000203698_100009816466 [0,1,0,1,0,0|1,0,0]=3 19440 B16R1.1095 COC(=O)CCCCCSCC1CCCO1 62a_100009816466_100000203698 [0,1,0,1,0,0|1,0,0]=3 19441 B16R1.1095 COC(=O)CCCCCSCC1CCOC1 62a_100000702531_100009816466 [0,1,0,1,0,0|1,0,0]=3 19442 B16R1.1095 COC(=O)CCCCCSCC1CCOC1 62a_100009816466_100000702531 [0,1,0,1,0,0|1,0,0]=3 19443 B16R1.1095 COC(=O)CCCCCSCC1OCCO1 62a_100000755774_100009816466 [0,1,0,1,0,0|2,0,0]=4 19444 B16R1.1095 COC(=O)CCCCCSCC1OCCO1 62a_100009816466_100000755774 [0,1,0,1,0,0|2,0,0]=4 19445 B16R1.1095 COC(=O)CCCCNCCC1CCCC1 2230a_100000739158_100000204269 [0,1,0,1,0,0|0,0,0]=2 19446 B16R1.1095 COC(=O)CCCCNCCC1CCCC1 34a_100000739158_100000204269 [0,1,0,1,0,0|0,0,0]=2 19447 B16R1.1095 COC(=O)CCCCNCCC1OCCO1 2230a_100000034215_100000204269 [0,1,0,1,0,0|2,0,0]=4 19448 B16R1.1095 COC(=O)CCCCNCCC1OCCO1 34a_100000034215_100000204269 [0,1,0,1,0,0|2,0,0]=4 19449 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 34a_100000059025_100000760354 [0,1,0,1,0,0|0,0,0]=2 19450 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 34a_100000749090_100000204269 [0,1,0,1,0,0|0,0,0]=2 19451 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 7a_100000059025_100000760354 [0,1,0,1,0,0|0,0,0]=2 19452 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 7a_100000749090_100000204269 [0,1,0,1,0,0|0,0,0]=2 19453 B16R1.1095 COC(=O)CCCCOCCC1CCNC1 34a_100016987287_100000204269 [0,1,0,1,0,0|1,0,0]=3 19454 B16R1.1095 COC(=O)CCCCOCCC1CCOC1 34a_100011879284_100000204269 [0,1,0,1,0,0|1,0,0]=3 19455 B16R1.1095 COC(=O)CCCCOCCC1OCCO1 34a_100000059025_100000740749 [0,1,0,1,0,0|2,0,0]=4 19456 B16R1.1095 COC(=O)CCCCOCCC1OCCO1 7a_100000059025_100000740749 [0,1,0,1,0,0|2,0,0]=4 19457 B16R1.1095 COC(=O)CCCCOCCN1CCCC1 7a_100000059025_100000004467 [0,1,0,1,0,0|1,0,0]=3 19458 B16R1.1095 COC(=O)CCCCSCCC1CCCC1 62a_100000204269_100000760354 [0,1,0,1,0,0|0,0,0]=2 19459 B16R1.1095 COC(=O)CCCCSCCC1CCCC1 62a_100000760354_100000204269 [0,1,0,1,0,0|0,0,0]=2 19460 B16R1.1095 COC(=O)CCCCSCCC1OCCO1 62a_100000204269_100000740749 [0,1,0,1,0,0|2,0,0]=4 19461 B16R1.1095 COC(=O)CCCCSCCN1CCCC1 62a_100000204269_100000004467 [0,1,0,1,0,0|1,0,0]=3 19462 B16R1.1095 COC(=O)CCCCSCCN1CCCC1 62a_100000700749_100000204269 [0,1,0,1,0,0|1,0,0]=3 19463 B16R1.1095 COC(=O)CCCNCCCC1CCCC1 2230a_100000736752_100011218270 [0,1,0,1,0,0|0,0,0]=2 19464 B16R1.1095 COC(=O)CCCNCCCC1CCCC1 34a_100000736752_100000742333 [0,1,0,1,0,0|0,0,0]=2 19465 B16R1.1095 COC(=O)CCCNCCOC1CCCC1 34a_100000741755_100000742333 [0,1,0,1,0,0|1,0,0]=3 19466 B16R1.1095 COC(=O)CCCOCCCC1CCCC1 34a_100011215328_100000742333 [0,1,0,1,0,0|0,0,0]=2 19467 B16R1.1095 COC(=O)CCCOCCCC1CCCC1 7a_100011215328_100011218270 [0,1,0,1,0,0|0,0,0]=2 19468 B16R1.1095 COC(=O)CCCOCCCC1OCCO1 34a_100009871617_100000742333 [0,1,0,1,0,0|2,0,0]=4 19469 B16R1.1095 COC(=O)CCCOCCCC1OCCO1 7a_100009871617_100011218270 [0,1,0,1,0,0|2,0,0]=4 19470 B16R1.1095 COC(=O)CCCOCCNC1CCCC1 34a_200000200444_100000742333 [0,1,0,1,0,0|1,0,0]=3 19471 B16R1.1095 COC(=O)CCCOCCOC1CCCC1 34a_100000738311_100000742333 [0,1,0,1,0,0|1,0,0]=3 19472 B16R1.1095 COC(=O)CCCOCCOC1CCCC1 7a_100000738311_100011218270 [0,1,0,1,0,0|1,0,0]=3 19473 B16R1.1095 COC(=O)CCCSCCCC1CCCC1 62a_100011218270_100011713738 [0,1,0,1,0,0|0,0,0]=2 19474 B16R1.1095 COC(=O)CCCSCCCC1CCCC1 62a_100011713738_100011218270 [0,1,0,1,0,0|0,0,0]=2 19475 B16R1.1095 COC(=O)CCCSCCCC1OCCO1 62a_100011218270_100000042513 [0,1,0,1,0,0|2,0,0]=4 19476 B16R1.1095 COC(=O)CCCSCCCN1CCCC1 62a_100011218270_100011445909 [0,1,0,1,0,0|1,0,0]=3 19477 B16R1.1095 COC(=O)CCCSCCCN1CCCC1 62a_100016991639_100011218270 [0,1,0,1,0,0|1,0,0]=3 19478 B16R1.1095 COC(=O)CCNCCCOC1CCCC1 34a_100000747560_100000742370 [0,1,0,1,0,0|1,0,0]=3 19479 B16R1.1095 COC(=O)CCSCCCCC1OCCO1 62a_100000204255_100000034956 [0,1,0,1,0,0|2,0,0]=4 19480 B16R1.1095 COC(=O)COCCCCOC1CCCO1 34a_100011018183_100000747449 [0,1,0,1,0,0|2,0,0]=4 19481 B16R1.1095 COC(=O)COCCCCOC1CCCO1 7a_100011018183_100000747449 [0,1,0,1,0,0|2,0,0]=4 19482 B16R1.1095 COC(=O)COCCNCCC1CCCC1 2230a_100000739158_100000090808 [0,1,0,1,0,0|1,0,0]=3 19483 B16R1.1095 COC(=O)COCCNCCC1CCCC1 34a_100000739158_100000090808 [0,1,0,1,0,0|1,0,0]=3 19484 B16R1.1095 COC(=O)COCCOCCC1CCCC1 34a_100000749090_100000090808 [0,1,0,1,0,0|1,0,0]=3 19485 B16R1.1095 COC(=O)COCCOCCC1CCCC1 7a_100000749090_100000090808 [0,1,0,1,0,0|1,0,0]=3 19486 B16R1.1095 COC(=O)COCCOCCC1CCNC1 34a_100016987287_100000090808 [0,1,0,1,0,0|2,0,0]=4 19487 B16R1.1095 COC(=O)COCCOCCC1CCOC1 34a_100011879284_100000090808 [0,1,0,1,0,0|2,0,0]=4 19488 B16R1.1095 COC(=O)COCCSCCC1CCCC1 62a_100000090808_100000760354 [0,1,0,1,0,0|1,0,0]=3 19489 B16R1.1095 COC(=O)COCCSCCC1CCCC1 62a_100000760354_100000090808 [0,1,0,1,0,0|1,0,0]=3 19490 B16R1.1095 COC(=O)COCCSCCN1CCCC1 62a_100000090808_100000004467 [0,1,0,1,0,0|2,0,0]=4 19491 B16R1.1095 COC(=O)COCCSCCN1CCCC1 62a_100000700749_100000090808 [0,1,0,1,0,0|2,0,0]=4 19492 B16R1.1095 COC(=O)NCCOCCCC1CCCC1 34a_100000757965_100011713738 [0,1,0,1,0,0|1,0,0]=3 19493 B16R1.1095 COC(=O)NCCOCCCN1CCCC1 34a_100000757965_100016991639 [0,1,0,1,0,0|2,0,0]=4 19494 B16R1.1095 COC(=O)OCCOCCCC1CCCC1 34a_100010262106_100011713738 [0,1,0,1,0,0|1,0,0]=3 19495 B16R1.1095 COC(=O)OCCOCCCN1CCCC1 34a_100010262106_100016991639 [0,1,0,1,0,0|2,0,0]=4 19496 B16R1.1095 NNC(=O)CCCOCCCC1CCCC1 34a_100000211488_100011713738 [0,1,0,1,0,0|2,0,0]=4 19497 B16R1.1100 COC(=O)CCCSC1CCCCCC1=O 62a_100000243696_100011218270 [0,1,0,1,0,0|1,0,1]=4 19498 B16R1.1100 COC(=O)CCCSC1CCCCCC1=O 62a_100011218270_100000243696 [0,1,0,1,0,0|1,0,1]=4 19499 B16R1.1133 CCC(=O)COCCCN1CCCCC1C 7a_100000213889_100000747405 [0,1,0,1,0,0|2,0,0]=4 19500 B16R1.1133 CNC(=O)CCCNCC1CCCCC1O 34a_100011216029_100000741757 [0,1,0,1,0,0|2,0,0]=4 19501 B16R1.1133 CNC(=O)CCCNCC1CCCCN1C 34a_100000740002_100015186950 [0,1,0,1,0,0|2,0,0]=4 19502 B16R1.1133 CNC(=O)CCCNCC1CCCCN1C 34a_100011228421_100000741757 [0,1,0,1,0,0|2,0,0]=4 19503 B16R1.1133 CNC(=O)CCCOCC1CCCCN1C 34a_100000225079_100000741757 [0,1,0,1,0,0|2,0,0]=4 19504 B16R1.1133 CNC(=O)CCCSCC1CCCCN1C 62a_100000741757_100015185383 [0,1,0,1,0,0|2,0,0]=4 19505 B16R1.1133 CNC(=O)CCCSCC1CCCCN1C 62a_100015185383_100000741757 [0,1,0,1,0,0|2,0,0]=4 19506 B16R1.1133 CNC(=O)CCNCCC1CCCCN1C 2230a_100000738227_100000211948 [0,1,0,1,0,0|2,0,0]=4 19507 B16R1.1133 CNC(=O)CCNCCC1CCCCN1C 34a_100000738227_100000211948 [0,1,0,1,0,0|2,0,0]=4 19508 B16R1.1133 CNC(=O)CCNCCN1CCCCC1C 2230a_100000739827_100000737683 [0,1,0,1,0,0|2,0,0]=4 19509 B16R1.1133 CNC(=O)CCNCCN1CCCCC1C 34a_100000739827_100012179268 [0,1,0,1,0,0|2,0,0]=4 19510 B16R1.1133 CNC(=O)CCOCCC1CCCCN1C 34a_100000754576_100000211948 [0,1,0,1,0,0|2,0,0]=4 19511 B16R1.1133 CNC(=O)CCOCCN1CCCCC1C 34a_100011305533_100012179268 [0,1,0,1,0,0|2,0,0]=4 19512 B16R1.1133 CNC(=O)CCSCCC1CCCCN1C 62a_100000211948_100000737683 [0,1,0,1,0,0|2,0,0]=4 19513 B16R1.1133 CNC(=O)CCSCCC1CCCCN1C 62a_100000737683_100000211948 [0,1,0,1,0,0|2,0,0]=4 19514 B16R1.1133 CNC(=O)CNCCCN1CCCCC1C 34a_100000212276_100000183359 [0,1,0,1,0,0|2,0,0]=4 19515 B16R1.1133 CNC(=O)COCCCN1CCCCC1C 34a_100000213889_100000183359 [0,1,0,1,0,0|2,0,0]=4 19516 B16R1.1133 CNC(=O)COCCCN1CCCCC1C 7a_100000213889_100000183359 [0,1,0,1,0,0|2,0,0]=4 19517 B16R1.1133 COC(=O)CCCCCN1CCCCC1C 2230a_100000211376_100009816466 [0,1,0,1,0,0|0,0,0]=2 19518 B16R1.1133 COC(=O)CCCCCN1CCCCC1C 269982a_100000211376_100009816466 [0,1,0,1,0,0|0,0,0]=2 19519 B16R1.1133 COC(=O)CCCCCN1CCCCC1C 34a_100000211376_100009816466 [0,1,0,1,0,0|0,0,0]=2 19520 B16R1.1133 COC(=O)CCCCCN1CCOC[C@@H]1C 2230a_100009815349_100009816466 [0,1,0,1,0,0|1,0,0]=3 19521 B16R1.1133 COC(=O)CCCCCN1CCOC[C@@H]1C 269982a_100009815349_100009816466 [0,1,0,1,0,0|1,0,0]=3 19522 B16R1.1133 COC(=O)CCCCCN1CCOC[C@@H]1C 34a_100009815349_100009816466 [0,1,0,1,0,0|1,0,0]=3 19523 B16R1.1133 COC(=O)CCCCNC1CCCCC1C 2230a_100000211402_100000204269 [0,1,0,1,0,0|0,0,0]=2 19524 B16R1.1133 COC(=O)CCCCNC1CCCCC1C 34a_100000211402_100000204269 [0,1,0,1,0,0|0,0,0]=2 19525 B16R1.1133 COC(=O)CCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000204269 [0,1,0,1,0,0|1,0,0]=3 19526 B16R1.1133 COC(=O)CCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000204269 [0,1,0,1,0,0|1,0,0]=3 19527 B16R1.1133 COC(=O)CCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000204269 [0,1,0,1,0,0|2,0,0]=4 19528 B16R1.1133 COC(=O)CCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000204269 [0,1,0,1,0,0|2,0,0]=4 19529 B16R1.1133 COC(=O)CCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000204269 [0,1,0,1,0,0|2,0,0]=4 19530 B16R1.1133 COC(=O)CCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000204269 [0,1,0,1,0,0|2,0,0]=4 19531 B16R1.1133 COC(=O)CCCCOC1CCCCC1=O 34a_100000059025_100000754470 [0,1,0,1,0,0|1,0,1]=4 19532 B16R1.1133 COC(=O)CCCCOC1CCCCC1=O 34a_100011214950_100000204269 [0,1,0,1,0,0|1,0,1]=4 19533 B16R1.1133 COC(=O)CCCCOC1CCCCC1=O 7a_100000059025_100000204591 [0,1,0,1,0,0|1,0,1]=4 19534 B16R1.1133 COC(=O)CCCCOC1CCCCC1C 34a_100000211207_100000204269 [0,1,0,1,0,0|0,0,0]=2 19535 B16R1.1133 COC(=O)CCCCOC1CCCCC1C 7a_100000211207_100000204269 [0,1,0,1,0,0|0,0,0]=2 19536 B16R1.1133 COC(=O)CCCCOC1CCCCC1Cl 34a_100000038908_100000204269 [0,1,0,1,0,0|1,0,0]=3 19537 B16R1.1133 COC(=O)CCCCOC1CCCCC1Cl 7a_100000038908_100000204269 [0,1,0,1,0,0|1,0,0]=3 19538 B16R1.1133 COC(=O)CCCCOC1CCCCC1F 34a_100000059025_100015423560 [0,1,0,1,0,0|1,0,0]=3 19539 B16R1.1133 COC(=O)CCCCOC1CCCCC1O 34a_100000059025_100000038908 [0,1,0,1,0,0|1,0,0]=3 19540 B16R1.1133 COC(=O)CCCCOC1CCNCC1C 34a_100011998114_100000204269 [0,1,0,1,0,0|1,0,0]=3 19541 B16R1.1133 COC(=O)CCCCOC1CNCCC1C 34a_100000696640_100000204269 [0,1,0,1,0,0|1,0,0]=3 19542 B16R1.1133 COC(=O)CCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000204269 [0,1,0,1,0,0|1,0,0]=3 19543 B16R1.1133 COC(=O)CCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000204269 [0,1,0,1,0,0|1,0,0]=3 19544 B16R1.1133 COC(=O)CCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000204269 [0,1,0,1,0,0|2,0,0]=4 19545 B16R1.1133 COC(=O)CCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000204269 [0,1,0,1,0,0|1,0,0]=3 19546 B16R1.1133 COC(=O)CCCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000204269 [0,1,0,1,0,0|2,0,0]=4 19547 B16R1.1133 COC(=O)CCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000204269 [0,1,0,1,0,0|2,0,0]=4 19548 B16R1.1133 COC(=O)CCCCSC1CCCCC1=O 62a_100000204269_100000204591 [0,1,0,1,0,0|1,0,1]=4 19549 B16R1.1133 COC(=O)CCCCSC1CCCCC1=O 62a_100000204591_100000204269 [0,1,0,1,0,0|1,0,1]=4 19550 B16R1.1133 COC(=O)CCCCSC1CCCCC1F 62a_100000204269_100015423560 [0,1,0,1,0,0|1,0,0]=3 19551 B16R1.1133 COC(=O)CCCCSC1CCCCC1F 62a_100015423560_100000204269 [0,1,0,1,0,0|1,0,0]=3 19552 B16R1.1133 COC(=O)CCCCSC1CCCCC1O 62a_100000038908_100000204269 [0,1,0,1,0,0|1,0,0]=3 19553 B16R1.1133 COC(=O)CCCCSC1CCCCC1O 62a_100000204269_100000038908 [0,1,0,1,0,0|1,0,0]=3 19554 B16R1.1133 COC(=O)CCCNCC1CCCCC1O 34a_100011216029_100000742333 [0,1,0,1,0,0|1,0,0]=3 19555 B16R1.1133 COC(=O)CCCNCC1CCCCN1C 34a_100011228421_100000742333 [0,1,0,1,0,0|1,0,0]=3 19556 B16R1.1133 COC(=O)CCCOCC1CC=CCC1C 34a_100000211322_100000742333 [0,1,0,1,0,0|0,0,2]=4 19557 B16R1.1133 COC(=O)CCCOCC1CCCCC1=O 34a_100009861125_100000742333 [0,1,0,1,0,0|1,0,1]=4 19558 B16R1.1133 COC(=O)CCCOCC1CCCCC1=O 7a_100009861125_100011218270 [0,1,0,1,0,0|1,0,1]=4 19559 B16R1.1133 COC(=O)CCCOCC1CCCCN1C 34a_100000225079_100000742333 [0,1,0,1,0,0|1,0,0]=3 19560 B16R1.1133 COC(=O)CCCOCC1COCCC1N 34a_214813039666_100000742333 [0,1,0,1,0,0|2,0,0]=4 19561 B16R1.1133 COC(=O)CCCOCC1COCCN1C 34a_100013547906_100000742333 [0,1,0,1,0,0|2,0,0]=4 19562 B16R1.1133 COC(=O)CCCSCC1CCCCN1C 62a_100011218270_100015185383 [0,1,0,1,0,0|1,0,0]=3 19563 B16R1.1133 COC(=O)CCCSCC1CCCCN1C 62a_100015185383_100011218270 [0,1,0,1,0,0|1,0,0]=3 19564 B16R1.1133 COC(=O)CCNCCN1CCCCC1C 2230a_100000739827_100000204255 [0,1,0,1,0,0|1,0,0]=3 19565 B16R1.1133 COC(=O)CCNCCN1CCCCC1C 34a_100000739827_100000742370 [0,1,0,1,0,0|1,0,0]=3 19566 B16R1.1133 COC(=O)CCOCCN1CCCCC1C 34a_100011305533_100000742370 [0,1,0,1,0,0|1,0,0]=3 19567 B16R1.1133 COC(=O)CCSCCC1CCCCN1C 62a_100000204255_100000211948 [0,1,0,1,0,0|1,0,0]=3 19568 B16R1.1133 COC(=O)CCSCCC1CCCCN1C 62a_100000211948_100000204255 [0,1,0,1,0,0|1,0,0]=3 19569 B16R1.1133 COC(=O)CNCCCN1CCCCC1C 34a_100000212276_100000747449 [0,1,0,1,0,0|1,0,0]=3 19570 B16R1.1133 COC(=O)COCCCN1CCCCC1C 34a_100000213889_100000747449 [0,1,0,1,0,0|1,0,0]=3 19571 B16R1.1133 COC(=O)COCCCN1CCCCC1C 7a_100000213889_100000747449 [0,1,0,1,0,0|1,0,0]=3 19572 B16R1.1133 COC(=O)COCCNC1CCCCC1C 2230a_100000211402_100000090808 [0,1,0,1,0,0|1,0,0]=3 19573 B16R1.1133 COC(=O)COCCNC1CCCCC1C 34a_100000211402_100000090808 [0,1,0,1,0,0|1,0,0]=3 19574 B16R1.1133 COC(=O)COCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000090808 [0,1,0,1,0,0|2,0,0]=4 19575 B16R1.1133 COC(=O)COCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000090808 [0,1,0,1,0,0|2,0,0]=4 19576 B16R1.1133 COC(=O)COCCOC1CCCCC1C 34a_100000211207_100000090808 [0,1,0,1,0,0|1,0,0]=3 19577 B16R1.1133 COC(=O)COCCOC1CCCCC1C 7a_100000211207_100000090808 [0,1,0,1,0,0|1,0,0]=3 19578 B16R1.1133 COC(=O)COCCOC1CCCCC1Cl 34a_100000038908_100000090808 [0,1,0,1,0,0|2,0,0]=4 19579 B16R1.1133 COC(=O)COCCOC1CCCCC1Cl 7a_100000038908_100000090808 [0,1,0,1,0,0|2,0,0]=4 19580 B16R1.1133 COC(=O)COCCOC1CCNCC1C 34a_100011998114_100000090808 [0,1,0,1,0,0|2,0,0]=4 19581 B16R1.1133 COC(=O)COCCOC1CNCCC1C 34a_100000696640_100000090808 [0,1,0,1,0,0|2,0,0]=4 19582 B16R1.1133 COC(=O)COCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000090808 [0,1,0,1,0,0|2,0,0]=4 19583 B16R1.1133 COC(=O)COCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000090808 [0,1,0,1,0,0|2,0,0]=4 19584 B16R1.1133 COC(=O)COCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000090808 [0,1,0,1,0,0|2,0,0]=4 19585 B16R1.1133 COC(=O)COCCSC1CCCCC1F 62a_100000090808_100015423560 [0,1,0,1,0,0|2,0,0]=4 19586 B16R1.1133 COC(=O)COCCSC1CCCCC1F 62a_100015423560_100000090808 [0,1,0,1,0,0|2,0,0]=4 19587 B16R1.1133 COC(=O)COCCSC1CCCCC1O 62a_100000038908_100000090808 [0,1,0,1,0,0|2,0,0]=4 19588 B16R1.1133 COC(=O)COCCSC1CCCCC1O 62a_100000090808_100000038908 [0,1,0,1,0,0|2,0,0]=4 19589 B16R1.1133 COC(=O)NCCOCC1CCCCN1C 34a_100000757965_100015186950 [0,1,0,1,0,0|2,0,0]=4 19590 B16R1.1133 COC(=O)OCCOCC1CCCCN1C 34a_100010262106_100015186950 [0,1,0,1,0,0|2,0,0]=4 19591 B16R1.1133 COC(=O)OCSCCC1CCCCN1C 62a_100000211948_100000139417 [0,1,0,1,0,0|2,0,0]=4 19592 B16R1.1166 CCC(=O)COCCCCC1CCCCC1 7a_100011215267_100000747405 [0,1,0,1,0,0|1,0,0]=3 19593 B16R1.1166 CCC(=O)NCCCCCN1CCCCC1 240690a_100000754421_100000210414 [0,1,0,1,0,0|2,0,0]=4 19594 B16R1.1166 CCC(=O)NCCCCCN1CCCCC1 527a_100000754421_100000210414 [0,1,0,1,0,0|2,0,0]=4 19595 B16R1.1166 CCC(=O)NCCNCCC1CCCCC1 270004a_100132302217_100011713444 [0,1,0,1,0,0|2,0,0]=4 19596 B16R1.1166 CCC(=O)NCCNCCC1CCCCC1 34a_100132302217_100011209188 [0,1,0,1,0,0|2,0,0]=4 19597 B16R1.1166 CCC(=O)NCCOCCC1CCCCC1 34a_200000158885_100011209188 [0,1,0,1,0,0|2,0,0]=4 19598 B16R1.1166 CCC(=O)NCCOCCC1CCCCC1 7a_200000158885_100011273959 [0,1,0,1,0,0|2,0,0]=4 19599 B16R1.1166 CCC(=O)OCCOCCC1CCCCC1 7a_200000031056_100011273959 [0,1,0,1,0,0|2,0,0]=4 19600 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 2230a_100000738074_100000741757 [0,1,0,1,0,0|1,0,0]=3 19601 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 2230a_100000740002_100012355289 [0,1,0,1,0,0|1,0,0]=3 19602 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 270004a_100000740002_100011713444 [0,1,0,1,0,0|1,0,0]=3 19603 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 34a_100000738074_100000741757 [0,1,0,1,0,0|1,0,0]=3 19604 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 34a_100000740002_100011209188 [0,1,0,1,0,0|1,0,0]=3 19605 B16R1.1166 CNC(=O)CCCNCCC1CCCCO1 2230a_100015183643_100000741757 [0,1,0,1,0,0|2,0,0]=4 19606 B16R1.1166 CNC(=O)CCCNCCC1CCCCO1 34a_100015183643_100000741757 [0,1,0,1,0,0|2,0,0]=4 19607 B16R1.1166 CNC(=O)CCCNCCC1CCOCC1 2230a_100000740002_100011934994 [0,1,0,1,0,0|2,0,0]=4 19608 B16R1.1166 CNC(=O)CCCNCCC1CCOCC1 2230a_100000755988_100000741757 [0,1,0,1,0,0|2,0,0]=4 19609 B16R1.1166 CNC(=O)CCCNCCC1CCOCC1 34a_100000740002_100011934994 [0,1,0,1,0,0|2,0,0]=4 19610 B16R1.1166 CNC(=O)CCCNCCC1CCOCC1 34a_100000755988_100000741757 [0,1,0,1,0,0|2,0,0]=4 19611 B16R1.1166 CNC(=O)CCCNCCN1CCCCC1 2230a_100000740002_100000739454 [0,1,0,1,0,0|2,0,0]=4 19612 B16R1.1166 CNC(=O)CCCNCCN1CCCCC1 34a_100000740002_100000739454 [0,1,0,1,0,0|2,0,0]=4 19613 B16R1.1166 CNC(=O)CCCNCOC1CCCCC1 2230a_100000740002_100011935260 [0,1,0,1,0,0|2,0,0]=4 19614 B16R1.1166 CNC(=O)CCCNCOC1CCCCC1 34a_100000740002_100011935260 [0,1,0,1,0,0|2,0,0]=4 19615 B16R1.1166 CNC(=O)CCCOCCC1CCCCC1 34a_100011217863_100000741757 [0,1,0,1,0,0|1,0,0]=3 19616 B16R1.1166 CNC(=O)CCCOCCC1CCCCC1 7a_100011217863_100000741757 [0,1,0,1,0,0|1,0,0]=3 19617 B16R1.1166 CNC(=O)CCCOCCC1CCCCN1 34a_100000211664_100000741757 [0,1,0,1,0,0|2,0,0]=4 19618 B16R1.1166 CNC(=O)CCCOCCC1CCCNC1 34a_100000752241_100000741757 [0,1,0,1,0,0|2,0,0]=4 19619 B16R1.1166 CNC(=O)CCCOCCC1CCNCC1 34a_100015190746_100000741757 [0,1,0,1,0,0|2,0,0]=4 19620 B16R1.1166 CNC(=O)CCCOCCC1CCOCC1 34a_100011933979_100000741757 [0,1,0,1,0,0|2,0,0]=4 19621 B16R1.1166 CNC(=O)CCCOCCC1CCOCC1 7a_100011933979_100000741757 [0,1,0,1,0,0|2,0,0]=4 19622 B16R1.1166 CNC(=O)CCCSCCC1CCCCC1 62a_100000741757_100012355289 [0,1,0,1,0,0|1,0,0]=3 19623 B16R1.1166 CNC(=O)CCCSCCC1CCCCC1 62a_100012355289_100000741757 [0,1,0,1,0,0|1,0,0]=3 19624 B16R1.1166 CNC(=O)CCCSCCC1CCOCC1 62a_100000741757_100011934994 [0,1,0,1,0,0|2,0,0]=4 19625 B16R1.1166 CNC(=O)CCCSCCC1CCOCC1 62a_100011934994_100000741757 [0,1,0,1,0,0|2,0,0]=4 19626 B16R1.1166 CNC(=O)CCCSCCN1CCCCC1 62a_100000739454_100000741757 [0,1,0,1,0,0|2,0,0]=4 19627 B16R1.1166 CNC(=O)CCCSCCN1CCCCC1 62a_100000741757_100000739454 [0,1,0,1,0,0|2,0,0]=4 19628 B16R1.1166 CNC(=O)CCCSCOC1CCCCC1 62a_100000741757_100011935260 [0,1,0,1,0,0|2,0,0]=4 19629 B16R1.1166 CNC(=O)CCCSCOC1CCCCC1 62a_100011935260_100000741757 [0,1,0,1,0,0|2,0,0]=4 19630 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 2230a_100000738227_100011713725 [0,1,0,1,0,0|1,0,0]=3 19631 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000737683 [0,1,0,1,0,0|1,0,0]=3 19632 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 34a_100000738227_100011713725 [0,1,0,1,0,0|1,0,0]=3 19633 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 34a_100011211642_100012179268 [0,1,0,1,0,0|1,0,0]=3 19634 B16R1.1166 CNC(=O)CCNCCCN1CCCCC1 2230a_100000738227_100000690320 [0,1,0,1,0,0|2,0,0]=4 19635 B16R1.1166 CNC(=O)CCNCCCN1CCCCC1 34a_100000738227_100000690320 [0,1,0,1,0,0|2,0,0]=4 19636 B16R1.1166 CNC(=O)CCNCCOC1CCCCC1 2230a_100000738227_100011211530 [0,1,0,1,0,0|2,0,0]=4 19637 B16R1.1166 CNC(=O)CCNCCOC1CCCCC1 34a_100000738227_100011211530 [0,1,0,1,0,0|2,0,0]=4 19638 B16R1.1166 CNC(=O)CCNCCOC1CCCCC1 34a_100015206981_100012179268 [0,1,0,1,0,0|2,0,0]=4 19639 B16R1.1166 CNC(=O)CCOCCCC1CCCCC1 34a_100000198086_100012179268 [0,1,0,1,0,0|1,0,0]=3 19640 B16R1.1166 CNC(=O)CCOCCCC1CCCCC1 34a_100000754576_100011713725 [0,1,0,1,0,0|1,0,0]=3 19641 B16R1.1166 CNC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000737683 [0,1,0,1,0,0|1,0,0]=3 19642 B16R1.1166 CNC(=O)CCOCCCC1CCCCN1 34a_100011934581_100012179268 [0,1,0,1,0,0|2,0,0]=4 19643 B16R1.1166 CNC(=O)CCOCCCC1CCCNC1 34a_100150707839_100012179268 [0,1,0,1,0,0|2,0,0]=4 19644 B16R1.1166 CNC(=O)CCOCCCC1CCNCC1 34a_100016988962_100012179268 [0,1,0,1,0,0|2,0,0]=4 19645 B16R1.1166 CNC(=O)CCOCCCN1CCCCC1 34a_100000212458_100012179268 [0,1,0,1,0,0|2,0,0]=4 19646 B16R1.1166 CNC(=O)CCOCCCN1CCCCC1 34a_100000754576_100000690320 [0,1,0,1,0,0|2,0,0]=4 19647 B16R1.1166 CNC(=O)CCOCCNC1CCCCC1 34a_100000200466_100012179268 [0,1,0,1,0,0|2,0,0]=4 19648 B16R1.1166 CNC(=O)CCOCCOC1CCCCC1 34a_100000754576_100011211530 [0,1,0,1,0,0|2,0,0]=4 19649 B16R1.1166 CNC(=O)CCOCCOC1CCCCC1 34a_100011249652_100012179268 [0,1,0,1,0,0|2,0,0]=4 19650 B16R1.1166 CNC(=O)CCOCCOC1CCCCC1 7a_100011249652_100000737683 [0,1,0,1,0,0|2,0,0]=4 19651 B16R1.1166 CNC(=O)CCSCCCC1CCCCC1 62a_100000737683_100011713725 [0,1,0,1,0,0|1,0,0]=3 19652 B16R1.1166 CNC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000737683 [0,1,0,1,0,0|1,0,0]=3 19653 B16R1.1166 CNC(=O)CCSCCCN1CCCCC1 62a_100000737683_100000007876 [0,1,0,1,0,0|2,0,0]=4 19654 B16R1.1166 CNC(=O)CCSCCCN1CCCCC1 62a_100132302099_100000737683 [0,1,0,1,0,0|2,0,0]=4 19655 B16R1.1166 CNC(=O)CCSCCOC1CCCCC1 62a_100000737683_100011211530 [0,1,0,1,0,0|2,0,0]=4 19656 B16R1.1166 CNC(=O)CCSCCOC1CCCCC1 62a_100011211530_100000737683 [0,1,0,1,0,0|2,0,0]=4 19657 B16R1.1166 CNC(=O)CNCCCOC1CCCCC1 34a_100000205933_100000183359 [0,1,0,1,0,0|2,0,0]=4 19658 B16R1.1166 CNC(=O)COCCCCC1CCCCC1 34a_100011215267_100000183359 [0,1,0,1,0,0|1,0,0]=3 19659 B16R1.1166 CNC(=O)COCCCCC1CCCCC1 7a_100011215267_100000183359 [0,1,0,1,0,0|1,0,0]=3 19660 B16R1.1166 CNC(=O)COCCCCC1CCNCC1 34a_100016989291_100000183359 [0,1,0,1,0,0|2,0,0]=4 19661 B16R1.1166 CNC(=O)NCCCCCN1CCCCC1 2708a_100000754421_106832991635 [0,1,0,1,0,0|2,0,0]=4 19662 B16R1.1166 CNC(=O)NCCCCCN1CCCCC1 2708a_100102657272_100000754421 [0,1,0,1,0,0|2,0,0]=4 19663 B16R1.1166 CNC(=O)NCCCCCN1CCCCC1 273464a_100000754421_100102657272 [0,1,0,1,0,0|2,0,0]=4 19664 B16R1.1166 CNC(=O)NCCCCCN1CCCCC1 273464a_100102657272_100000754421 [0,1,0,1,0,0|2,0,0]=4 19665 B16R1.1166 CNC(=O)NCCCCCN1CCCCC1 512a_100000754421_100102657272 [0,1,0,1,0,0|2,0,0]=4 19666 B16R1.1166 CNC(=O)NCCCCCN1CCCCC1 512a_106832991638_100000754421 [0,1,0,1,0,0|2,0,0]=4 19667 B16R1.1166 CNC(=O)NCCNCCC1CCCCC1 34a_100015205895_100011209188 [0,1,0,1,0,0|2,0,0]=4 19668 B16R1.1166 CNC(=O)OCCNCCC1CCCCC1 34a_100000738074_200011997002 [0,1,0,1,0,0|2,0,0]=4 19669 B16R1.1166 CNC(=O)OCCOCCC1CCCCC1 34a_100011217863_200011997002 [0,1,0,1,0,0|2,0,0]=4 19670 B16R1.1166 CNC(=O)OCCOCCC1CCCCC1 7a_100011217863_200011997002 [0,1,0,1,0,0|2,0,0]=4 19671 B16R1.1166 CNC(=O)OCCSCCC1CCCCC1 62a_100012355289_200011997002 [0,1,0,1,0,0|2,0,0]=4 19672 B16R1.1166 CNC(=O)OCCSCCC1CCCCC1 62a_200011997002_100012355289 [0,1,0,1,0,0|2,0,0]=4 19673 B16R1.1166 COC(=O)/C=C/CNCCC1CCCCC1 2230a_100000738074_100000742655 [0,1,0,1,0,0|0,0,2]=4 19674 B16R1.1166 COC(=O)/C=C/CNCCC1CCCCC1 34a_100000738074_100000742655 [0,1,0,1,0,0|0,0,2]=4 19675 B16R1.1166 COC(=O)/C=C/COCCC1CCCCC1 34a_100011217863_100000742655 [0,1,0,1,0,0|0,0,2]=4 19676 B16R1.1166 COC(=O)/C=C/COCCC1CCCCC1 7a_100011217863_100000742655 [0,1,0,1,0,0|0,0,2]=4 19677 B16R1.1166 COC(=O)/C=C/CSCCC1CCCCC1 62a_100000742655_100012355289 [0,1,0,1,0,0|0,0,2]=4 19678 B16R1.1166 COC(=O)/C=C/CSCCC1CCCCC1 62a_100012355289_100000742655 [0,1,0,1,0,0|0,0,2]=4 19679 B16R1.1166 COC(=O)CCC=NNCC1CCCCC1 4a_100000740227_100012047195 [0,1,0,1,0,0|1,0,1]=4 19680 B16R1.1166 COC(=O)CCCC=NNC1CCCCC1 4a_100000709804_100000094087 [0,1,0,1,0,0|1,0,1]=4 19681 B16R1.1166 COC(=O)CCCCCCN1CC=CCC1 2230a_100000698166_100009815986 [0,1,0,1,0,0|0,0,2]=4 19682 B16R1.1166 COC(=O)CCCCCCN1CC=CCC1 269982a_100000698166_100009815986 [0,1,0,1,0,0|0,0,2]=4 19683 B16R1.1166 COC(=O)CCCCCCN1CC=CCC1 34a_100000698166_100009815986 [0,1,0,1,0,0|0,0,2]=4 19684 B16R1.1166 COC(=O)CCCCCCN1CCCOC1 2230a_100000131196_100009815986 [0,1,0,1,0,0|1,0,0]=3 19685 B16R1.1166 COC(=O)CCCCCCN1CCCOC1 269982a_100000131196_100009815986 [0,1,0,1,0,0|1,0,0]=3 19686 B16R1.1166 COC(=O)CCCCCCN1CCCOC1 34a_100000131196_100009815986 [0,1,0,1,0,0|1,0,0]=3 19687 B16R1.1166 COC(=O)CCCCCCN1CCOCC1 2230a_100015191051_100009815986 [0,1,0,1,0,0|1,0,0]=3 19688 B16R1.1166 COC(=O)CCCCCCN1CCOCC1 269982a_100015191051_100009815986 [0,1,0,1,0,0|1,0,0]=3 19689 B16R1.1166 COC(=O)CCCCCCN1CCOCC1 34a_100015191051_100009815986 [0,1,0,1,0,0|1,0,0]=3 19690 B16R1.1166 COC(=O)CCCCCCN1CCSCC1 2230a_100000737611_100009815986 [0,1,0,1,0,0|1,0,0]=3 19691 B16R1.1166 COC(=O)CCCCCCN1CCSCC1 269982a_100000737611_100009815986 [0,1,0,1,0,0|1,0,0]=3 19692 B16R1.1166 COC(=O)CCCCCNC1CCCCC1 2230a_100000182618_100009816466 [0,1,0,1,0,0|0,0,0]=2 19693 B16R1.1166 COC(=O)CCCCCNC1CCCCC1 34a_100000182618_100009816466 [0,1,0,1,0,0|0,0,0]=2 19694 B16R1.1166 COC(=O)CCCCCNC1CCCOC1 2230a_100000719290_100009816466 [0,1,0,1,0,0|1,0,0]=3 19695 B16R1.1166 COC(=O)CCCCCNC1CCCOC1 34a_100000719290_100009816466 [0,1,0,1,0,0|1,0,0]=3 19696 B16R1.1166 COC(=O)CCCCCNC1CCOCC1 2230a_100000741149_100009816466 [0,1,0,1,0,0|1,0,0]=3 19697 B16R1.1166 COC(=O)CCCCCNC1CCOCC1 34a_100000741149_100009816466 [0,1,0,1,0,0|1,0,0]=3 19698 B16R1.1166 COC(=O)CCCCCNC1CCSCC1 2230a_100000748639_100009816466 [0,1,0,1,0,0|1,0,0]=3 19699 B16R1.1166 COC(=O)CCCCCNC1CCSCC1 34a_100000748639_100009816466 [0,1,0,1,0,0|1,0,0]=3 19700 B16R1.1166 COC(=O)CCCCCOC1C=CCCC1 34a_100011215024_100009816466 [0,1,0,1,0,0|0,0,2]=4 19701 B16R1.1166 COC(=O)CCCCCOC1C=CCCC1 7a_100000074720_100000751183 [0,1,0,1,0,0|0,0,2]=4 19702 B16R1.1166 COC(=O)CCCCCOC1CC=CCC1 34a_100000073881_100009816466 [0,1,0,1,0,0|0,0,2]=4 19703 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 34a_100000074720_100000210327 [0,1,0,1,0,0|0,0,0]=2 19704 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 34a_100000210231_100009816466 [0,1,0,1,0,0|0,0,0]=2 19705 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 7a_100000074720_100000210327 [0,1,0,1,0,0|0,0,0]=2 19706 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 7a_100000210231_100009816466 [0,1,0,1,0,0|0,0,0]=2 19707 B16R1.1166 COC(=O)CCCCCOC1CCCCO1 34a_100000033831_100009816466 [0,1,0,1,0,0|1,0,0]=3 19708 B16R1.1166 COC(=O)CCCCCOC1CCCOC1 34a_100000074720_100000693364 [0,1,0,1,0,0|1,0,0]=3 19709 B16R1.1166 COC(=O)CCCCCOC1CCCOC1 34a_100000754041_100009816466 [0,1,0,1,0,0|1,0,0]=3 19710 B16R1.1166 COC(=O)CCCCCOC1CCCOC1 7a_100000074720_100000693364 [0,1,0,1,0,0|1,0,0]=3 19711 B16R1.1166 COC(=O)CCCCCOC1CCCSC1 7a_100015962668_100009816466 [0,1,0,1,0,0|1,0,0]=3 19712 B16R1.1166 COC(=O)CCCCCOC1CCOCC1 34a_100000744328_100009816466 [0,1,0,1,0,0|1,0,0]=3 19713 B16R1.1166 COC(=O)CCCCCOC1CCOCC1 7a_100000074720_100000686592 [0,1,0,1,0,0|1,0,0]=3 19714 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 34a_100000074720_100000069128 [0,1,0,1,0,0|1,0,0]=3 19715 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 34a_100000731022_100009816466 [0,1,0,1,0,0|1,0,0]=3 19716 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 7a_100000074720_100011500858 [0,1,0,1,0,0|1,0,0]=3 19717 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 7a_100000731022_100009816466 [0,1,0,1,0,0|1,0,0]=3 19718 B16R1.1166 COC(=O)CCCCCSC1C=CCCC1 62a_100000751183_100009816466 [0,1,0,1,0,0|0,0,2]=4 19719 B16R1.1166 COC(=O)CCCCCSC1C=CCCC1 62a_100009816466_100000751183 [0,1,0,1,0,0|0,0,2]=4 19720 B16R1.1166 COC(=O)CCCCCSC1CCCCC1 62a_100000210327_100009816466 [0,1,0,1,0,0|0,0,0]=2 19721 B16R1.1166 COC(=O)CCCCCSC1CCCCC1 62a_100009816466_100000210327 [0,1,0,1,0,0|0,0,0]=2 19722 B16R1.1166 COC(=O)CCCCCSC1CCCOC1 62a_100009816466_100000693364 [0,1,0,1,0,0|1,0,0]=3 19723 B16R1.1166 COC(=O)CCCCCSC1CCOCC1 62a_100009816466_100011324220 [0,1,0,1,0,0|1,0,0]=3 19724 B16R1.1166 COC(=O)CCCCCSC1CCSCC1 62a_100009816466_100000069128 [0,1,0,1,0,0|1,0,0]=3 19725 B16R1.1166 COC(=O)CCCCNCC1CCCCC1 2230a_100000210473_100000204269 [0,1,0,1,0,0|0,0,0]=2 19726 B16R1.1166 COC(=O)CCCCNCC1CCCCC1 34a_100000210473_100000204269 [0,1,0,1,0,0|0,0,0]=2 19727 B16R1.1166 COC(=O)CCCCNCC1CCCCO1 2230a_100000174945_100000204269 [0,1,0,1,0,0|1,0,0]=3 19728 B16R1.1166 COC(=O)CCCCNCC1CCCCO1 34a_100000174945_100000204269 [0,1,0,1,0,0|1,0,0]=3 19729 B16R1.1166 COC(=O)CCCCNCC1CCCOC1 2230a_100000720124_100000204269 [0,1,0,1,0,0|1,0,0]=3 19730 B16R1.1166 COC(=O)CCCCNCC1CCCOC1 34a_100000720124_100000204269 [0,1,0,1,0,0|1,0,0]=3 19731 B16R1.1166 COC(=O)CCCCNCC1CCOCC1 2230a_100000746373_100000204269 [0,1,0,1,0,0|1,0,0]=3 19732 B16R1.1166 COC(=O)CCCCNCC1CCOCC1 34a_100000746373_100000204269 [0,1,0,1,0,0|1,0,0]=3 19733 B16R1.1166 COC(=O)CCCCNCC1CCSCC1 2230a_100015188806_100000204269 [0,1,0,1,0,0|1,0,0]=3 19734 B16R1.1166 COC(=O)CCCCNCC1CCSCC1 34a_100015188806_100000204269 [0,1,0,1,0,0|1,0,0]=3 19735 B16R1.1166 COC(=O)CCCCNC[C@H]1COCCO1 2230a_100010981119_100000204269 [0,1,0,1,0,0|2,0,0]=4 19736 B16R1.1166 COC(=O)CCCCNC[C@H]1COCCO1 34a_100010981119_100000204269 [0,1,0,1,0,0|2,0,0]=4 19737 B16R1.1166 COC(=O)CCCCOCC1CC=CCC1 34a_100000210713_100000204269 [0,1,0,1,0,0|0,0,2]=4 19738 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 34a_100000059025_100000211423 [0,1,0,1,0,0|0,0,0]=2 19739 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 34a_100000212181_100000204269 [0,1,0,1,0,0|0,0,0]=2 19740 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 7a_100000059025_100000211423 [0,1,0,1,0,0|0,0,0]=2 19741 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 7a_100000212181_100000204269 [0,1,0,1,0,0|0,0,0]=2 19742 B16R1.1166 COC(=O)CCCCOCC1CCCCN1 34a_100000210821_100000204269 [0,1,0,1,0,0|1,0,0]=3 19743 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 34a_100000059025_100000211543 [0,1,0,1,0,0|1,0,0]=3 19744 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 34a_100000211370_100000204269 [0,1,0,1,0,0|1,0,0]=3 19745 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 7a_100000059025_100000211543 [0,1,0,1,0,0|1,0,0]=3 19746 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 7a_100000211370_100000204269 [0,1,0,1,0,0|1,0,0]=3 19747 B16R1.1166 COC(=O)CCCCOCC1CCCNC1 34a_100000211344_100000204269 [0,1,0,1,0,0|1,0,0]=3 19748 B16R1.1166 COC(=O)CCCCOCC1CCCOC1 34a_100000059025_100000741521 [0,1,0,1,0,0|1,0,0]=3 19749 B16R1.1166 COC(=O)CCCCOCC1CCCOC1 34a_100000741520_100000204269 [0,1,0,1,0,0|1,0,0]=3 19750 B16R1.1166 COC(=O)CCCCOCC1CCCOC1 7a_100000059025_100000741521 [0,1,0,1,0,0|1,0,0]=3 19751 B16R1.1166 COC(=O)CCCCOCC1CCNCC1 34a_100000738675_100000204269 [0,1,0,1,0,0|1,0,0]=3 19752 B16R1.1166 COC(=O)CCCCOCC1CCOCC1 34a_100000059025_100000754603 [0,1,0,1,0,0|1,0,0]=3 19753 B16R1.1166 COC(=O)CCCCOCC1CCOCC1 34a_100000749013_100000204269 [0,1,0,1,0,0|1,0,0]=3 19754 B16R1.1166 COC(=O)CCCCOCC1CCOCC1 7a_100000059025_100000754603 [0,1,0,1,0,0|1,0,0]=3 19755 B16R1.1166 COC(=O)CCCCOCC1CCSCC1 34a_100000070558_100000204269 [0,1,0,1,0,0|1,0,0]=3 19756 B16R1.1166 COC(=O)CCCCOCC1CCSCC1 7a_100000070558_100000204269 [0,1,0,1,0,0|1,0,0]=3 19757 B16R1.1166 COC(=O)CCCCOC[C@@H]1CNCCO1 34a_100015189573_100000204269 [0,1,0,1,0,0|2,0,0]=4 19758 B16R1.1166 COC(=O)CCCCOC[C@@H]1COCCN1 34a_100000717676_100000204269 [0,1,0,1,0,0|2,0,0]=4 19759 B16R1.1166 COC(=O)CCCCOC[C@H]1COCCO1 34a_100009875890_100000204269 [0,1,0,1,0,0|2,0,0]=4 19760 B16R1.1166 COC(=O)CCCCSCC1CCCCC1 62a_100000204269_100000211423 [0,1,0,1,0,0|0,0,0]=2 19761 B16R1.1166 COC(=O)CCCCSCC1CCCCC1 62a_100000211423_100000204269 [0,1,0,1,0,0|0,0,0]=2 19762 B16R1.1166 COC(=O)CCCCSCC1CCCCO1 62a_100000204269_100000211543 [0,1,0,1,0,0|1,0,0]=3 19763 B16R1.1166 COC(=O)CCCCSCC1CCCCO1 62a_100000211543_100000204269 [0,1,0,1,0,0|1,0,0]=3 19764 B16R1.1166 COC(=O)CCCCSCC1CCCOC1 62a_100000204269_100000741521 [0,1,0,1,0,0|1,0,0]=3 19765 B16R1.1166 COC(=O)CCCCSCC1CCCOC1 62a_100000741521_100000204269 [0,1,0,1,0,0|1,0,0]=3 19766 B16R1.1166 COC(=O)CCCCSCC1CCOCC1 62a_100000204269_100000749018 [0,1,0,1,0,0|1,0,0]=3 19767 B16R1.1166 COC(=O)CCCCSCC1CCOCC1 62a_100000754603_100000204269 [0,1,0,1,0,0|1,0,0]=3 19768 B16R1.1166 COC(=O)CCCNCCC1=CCCCC1 2230a_100000212019_100011218270 [0,1,0,1,0,0|0,0,2]=4 19769 B16R1.1166 COC(=O)CCCNCCC1=CCCCC1 34a_100000212019_100000742333 [0,1,0,1,0,0|0,0,2]=4 19770 B16R1.1166 COC(=O)CCCNCCC1CCCCC1 2230a_100000738074_100011218270 [0,1,0,1,0,0|0,0,0]=2 19771 B16R1.1166 COC(=O)CCCNCCC1CCCCC1 34a_100000738074_100000742333 [0,1,0,1,0,0|0,0,0]=2 19772 B16R1.1166 COC(=O)CCCNCCC1CCCCO1 2230a_100015183643_100011218270 [0,1,0,1,0,0|1,0,0]=3 19773 B16R1.1166 COC(=O)CCCNCCC1CCCCO1 34a_100015183643_100000742333 [0,1,0,1,0,0|1,0,0]=3 19774 B16R1.1166 COC(=O)CCCNCCC1CCOCC1 2230a_100000755988_100011218270 [0,1,0,1,0,0|1,0,0]=3 19775 B16R1.1166 COC(=O)CCCNCCC1CCOCC1 34a_100000755988_100000742333 [0,1,0,1,0,0|1,0,0]=3 19776 B16R1.1166 COC(=O)CCCNCCN1CCSCC1 2230a_100000755026_100011218270 [0,1,0,1,0,0|2,0,0]=4 19777 B16R1.1166 COC(=O)CCCOCCC1CCCCC1 34a_100011217863_100000742333 [0,1,0,1,0,0|0,0,0]=2 19778 B16R1.1166 COC(=O)CCCOCCC1CCCCC1 7a_100011217863_100011218270 [0,1,0,1,0,0|0,0,0]=2 19779 B16R1.1166 COC(=O)CCCOCCC1CCCCN1 34a_100000211664_100000742333 [0,1,0,1,0,0|1,0,0]=3 19780 B16R1.1166 COC(=O)CCCOCCC1CCCNC1 34a_100000752241_100000742333 [0,1,0,1,0,0|1,0,0]=3 19781 B16R1.1166 COC(=O)CCCOCCC1CCNCC1 34a_100015190746_100000742333 [0,1,0,1,0,0|1,0,0]=3 19782 B16R1.1166 COC(=O)CCCOCCC1CCOCC1 34a_100011933979_100000742333 [0,1,0,1,0,0|1,0,0]=3 19783 B16R1.1166 COC(=O)CCCOCCC1CCOCC1 7a_100011933979_100011218270 [0,1,0,1,0,0|1,0,0]=3 19784 B16R1.1166 COC(=O)CCCOCCC1SCCCS1 34a_200011025297_100000742333 [0,1,0,1,0,0|2,0,0]=4 19785 B16R1.1166 COC(=O)CCCOCCC1SCCCS1 7a_200011025297_100011218270 [0,1,0,1,0,0|2,0,0]=4 19786 B16R1.1166 COC(=O)CCCOCCN1CCSCC1 7a_100000686052_100011218270 [0,1,0,1,0,0|2,0,0]=4 19787 B16R1.1166 COC(=O)CCCOCC[C@@H]1CNCCN1 34a_100016989929_100000742333 [0,1,0,1,0,0|2,0,0]=4 19788 B16R1.1166 COC(=O)CCCSCCC1CCCCC1 62a_100011218270_100012355289 [0,1,0,1,0,0|0,0,0]=2 19789 B16R1.1166 COC(=O)CCCSCCC1CCCCC1 62a_100012355289_100011218270 [0,1,0,1,0,0|0,0,0]=2 19790 B16R1.1166 COC(=O)CCCSCCC1CCOCC1 62a_100011218270_100011934994 [0,1,0,1,0,0|1,0,0]=3 19791 B16R1.1166 COC(=O)CCCSCCC1CCOCC1 62a_100011934994_100011218270 [0,1,0,1,0,0|1,0,0]=3 19792 B16R1.1166 COC(=O)CCCSCCC1OCCCO1 62a_100000764188_100011218270 [0,1,0,1,0,0|2,0,0]=4 19793 B16R1.1166 COC(=O)CCCSCCC1OCCCO1 62a_100011218270_100000764188 [0,1,0,1,0,0|2,0,0]=4 19794 B16R1.1166 COC(=O)CCCSCCN1CCCCC1 62a_100000739454_100011218270 [0,1,0,1,0,0|1,0,0]=3 19795 B16R1.1166 COC(=O)CCCSCCN1CCCCC1 62a_100011218270_100000739454 [0,1,0,1,0,0|1,0,0]=3 19796 B16R1.1166 COC(=O)CCCSCCN1CCOCC1 62a_100011218270_100000211760 [0,1,0,1,0,0|2,0,0]=4 19797 B16R1.1166 COC(=O)CCCSCOC1CCCCC1 62a_100011218270_100011935260 [0,1,0,1,0,0|1,0,0]=3 19798 B16R1.1166 COC(=O)CCCSCOC1CCCCC1 62a_100011935260_100011218270 [0,1,0,1,0,0|1,0,0]=3 19799 B16R1.1166 COC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000204255 [0,1,0,1,0,0|0,0,0]=2 19800 B16R1.1166 COC(=O)CCNCCCC1CCCCC1 34a_100011211642_100000742370 [0,1,0,1,0,0|0,0,0]=2 19801 B16R1.1166 COC(=O)CCNCCOC1CCCCC1 34a_100015206981_100000742370 [0,1,0,1,0,0|1,0,0]=3 19802 B16R1.1166 COC(=O)CCOCCCC1CCCCC1 34a_100000198086_100000742370 [0,1,0,1,0,0|0,0,0]=2 19803 B16R1.1166 COC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000204255 [0,1,0,1,0,0|0,0,0]=2 19804 B16R1.1166 COC(=O)CCOCCCC1CCCCN1 34a_100011934581_100000742370 [0,1,0,1,0,0|1,0,0]=3 19805 B16R1.1166 COC(=O)CCOCCCC1CCCNC1 34a_100150707839_100000742370 [0,1,0,1,0,0|1,0,0]=3 19806 B16R1.1166 COC(=O)CCOCCCC1CCNCC1 34a_100016988962_100000742370 [0,1,0,1,0,0|1,0,0]=3 19807 B16R1.1166 COC(=O)CCOCCCN1CCCCC1 34a_100000212458_100000742370 [0,1,0,1,0,0|1,0,0]=3 19808 B16R1.1166 COC(=O)CCOCCCN1CCOCC1 34a_100000212840_100000742370 [0,1,0,1,0,0|2,0,0]=4 19809 B16R1.1166 COC(=O)CCOCCNC1CCCCC1 34a_100000200466_100000742370 [0,1,0,1,0,0|1,0,0]=3 19810 B16R1.1166 COC(=O)CCOCCNC1CCOCC1 34a_100000708129_100000742370 [0,1,0,1,0,0|2,0,0]=4 19811 B16R1.1166 COC(=O)CCOCCOC1CCCCC1 34a_100011249652_100000742370 [0,1,0,1,0,0|1,0,0]=3 19812 B16R1.1166 COC(=O)CCOCCOC1CCCCC1 7a_100011249652_100000204255 [0,1,0,1,0,0|1,0,0]=3 19813 B16R1.1166 COC(=O)CCOCCOC1CCCCO1 34a_100000034223_100000742370 [0,1,0,1,0,0|2,0,0]=4 19814 B16R1.1166 COC(=O)CCOCCOC1CCCCO1 7a_100000034223_100000204255 [0,1,0,1,0,0|2,0,0]=4 19815 B16R1.1166 COC(=O)CCSCCCC1CCCCC1 62a_100000204255_100011713725 [0,1,0,1,0,0|0,0,0]=2 19816 B16R1.1166 COC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000204255 [0,1,0,1,0,0|0,0,0]=2 19817 B16R1.1166 COC(=O)CCSCCCN1CCCCC1 62a_100000204255_100000007876 [0,1,0,1,0,0|1,0,0]=3 19818 B16R1.1166 COC(=O)CCSCCCN1CCCCC1 62a_100132302099_100000204255 [0,1,0,1,0,0|1,0,0]=3 19819 B16R1.1166 COC(=O)CCSCCCN1CCOCC1 62a_100000204255_100000748698 [0,1,0,1,0,0|2,0,0]=4 19820 B16R1.1166 COC(=O)CCSCCOC1CCCCC1 62a_100000204255_100011211530 [0,1,0,1,0,0|1,0,0]=3 19821 B16R1.1166 COC(=O)CCSCCOC1CCCCC1 62a_100011211530_100000204255 [0,1,0,1,0,0|1,0,0]=3 19822 B16R1.1166 COC(=O)CCSCCOC1CCCCO1 62a_100000204255_100000744793 [0,1,0,1,0,0|2,0,0]=4 19823 B16R1.1166 COC(=O)CCSCCOC1CCCCO1 62a_100000744793_100000204255 [0,1,0,1,0,0|2,0,0]=4 19824 B16R1.1166 COC(=O)CNCCCOC1CCCCC1 34a_100000205933_100000747449 [0,1,0,1,0,0|1,0,0]=3 19825 B16R1.1166 COC(=O)COCCCCC1CCCCC1 34a_100011215267_100000747449 [0,1,0,1,0,0|0,0,0]=2 19826 B16R1.1166 COC(=O)COCCCCC1CCCCC1 7a_100011215267_100000747449 [0,1,0,1,0,0|0,0,0]=2 19827 B16R1.1166 COC(=O)COCCCCC1CCNCC1 34a_100016989291_100000747449 [0,1,0,1,0,0|1,0,0]=3 19828 B16R1.1166 COC(=O)COCCCCN1CCOCC1 34a_100000723369_100000747449 [0,1,0,1,0,0|2,0,0]=4 19829 B16R1.1166 COC(=O)COCCNCC1CCCCC1 2230a_100000210473_100000090808 [0,1,0,1,0,0|1,0,0]=3 19830 B16R1.1166 COC(=O)COCCNCC1CCCCC1 34a_100000210473_100000090808 [0,1,0,1,0,0|1,0,0]=3 19831 B16R1.1166 COC(=O)COCCNCC1CCCCO1 2230a_100000174945_100000090808 [0,1,0,1,0,0|2,0,0]=4 19832 B16R1.1166 COC(=O)COCCNCC1CCCCO1 34a_100000174945_100000090808 [0,1,0,1,0,0|2,0,0]=4 19833 B16R1.1166 COC(=O)COCCNCC1CCCOC1 2230a_100000720124_100000090808 [0,1,0,1,0,0|2,0,0]=4 19834 B16R1.1166 COC(=O)COCCNCC1CCCOC1 34a_100000720124_100000090808 [0,1,0,1,0,0|2,0,0]=4 19835 B16R1.1166 COC(=O)COCCNCC1CCOCC1 2230a_100000746373_100000090808 [0,1,0,1,0,0|2,0,0]=4 19836 B16R1.1166 COC(=O)COCCNCC1CCOCC1 34a_100000746373_100000090808 [0,1,0,1,0,0|2,0,0]=4 19837 B16R1.1166 COC(=O)COCCNCC1CCSCC1 2230a_100015188806_100000090808 [0,1,0,1,0,0|2,0,0]=4 19838 B16R1.1166 COC(=O)COCCNCC1CCSCC1 34a_100015188806_100000090808 [0,1,0,1,0,0|2,0,0]=4 19839 B16R1.1166 COC(=O)COCCOCC1CCCCC1 34a_100000212181_100000090808 [0,1,0,1,0,0|1,0,0]=3 19840 B16R1.1166 COC(=O)COCCOCC1CCCCC1 7a_100000212181_100000090808 [0,1,0,1,0,0|1,0,0]=3 19841 B16R1.1166 COC(=O)COCCOCC1CCCCN1 34a_100000210821_100000090808 [0,1,0,1,0,0|2,0,0]=4 19842 B16R1.1166 COC(=O)COCCOCC1CCCCO1 34a_100000211370_100000090808 [0,1,0,1,0,0|2,0,0]=4 19843 B16R1.1166 COC(=O)COCCOCC1CCCCO1 7a_100000211370_100000090808 [0,1,0,1,0,0|2,0,0]=4 19844 B16R1.1166 COC(=O)COCCOCC1CCCNC1 34a_100000211344_100000090808 [0,1,0,1,0,0|2,0,0]=4 19845 B16R1.1166 COC(=O)COCCOCC1CCCOC1 34a_100000741520_100000090808 [0,1,0,1,0,0|2,0,0]=4 19846 B16R1.1166 COC(=O)COCCOCC1CCNCC1 34a_100000738675_100000090808 [0,1,0,1,0,0|2,0,0]=4 19847 B16R1.1166 COC(=O)COCCOCC1CCOCC1 34a_100000749013_100000090808 [0,1,0,1,0,0|2,0,0]=4 19848 B16R1.1166 COC(=O)COCCOCC1CCSCC1 34a_100000070558_100000090808 [0,1,0,1,0,0|2,0,0]=4 19849 B16R1.1166 COC(=O)COCCOCC1CCSCC1 7a_100000070558_100000090808 [0,1,0,1,0,0|2,0,0]=4 19850 B16R1.1166 COC(=O)COCCSCC1CCCCC1 62a_100000090808_100000211423 [0,1,0,1,0,0|1,0,0]=3 19851 B16R1.1166 COC(=O)COCCSCC1CCCCC1 62a_100000211423_100000090808 [0,1,0,1,0,0|1,0,0]=3 19852 B16R1.1166 COC(=O)COCCSCC1CCCCO1 62a_100000090808_100000211543 [0,1,0,1,0,0|2,0,0]=4 19853 B16R1.1166 COC(=O)COCCSCC1CCCCO1 62a_100000211543_100000090808 [0,1,0,1,0,0|2,0,0]=4 19854 B16R1.1166 COC(=O)COCCSCC1CCCOC1 62a_100000090808_100000741521 [0,1,0,1,0,0|2,0,0]=4 19855 B16R1.1166 COC(=O)COCCSCC1CCCOC1 62a_100000741521_100000090808 [0,1,0,1,0,0|2,0,0]=4 19856 B16R1.1166 COC(=O)COCCSCC1CCOCC1 62a_100000090808_100000749018 [0,1,0,1,0,0|2,0,0]=4 19857 B16R1.1166 COC(=O)COCCSCC1CCOCC1 62a_100000754603_100000090808 [0,1,0,1,0,0|2,0,0]=4 19858 B16R1.1166 COC(=O)CSCCCOC1CCCCO1 62a_100000700653_100000747449 [0,1,0,1,0,0|2,0,0]=4 19859 B16R1.1166 COC(=O)CSCCCOC1CCCCO1 62a_100000747449_100000700653 [0,1,0,1,0,0|2,0,0]=4 19860 B16R1.1166 COC(=O)NCCOCCC1CCCCC1 34a_100000757965_100011209188 [0,1,0,1,0,0|1,0,0]=3 19861 B16R1.1166 COC(=O)NCCOCCC1CCOCC1 34a_100000757965_100011934994 [0,1,0,1,0,0|2,0,0]=4 19862 B16R1.1166 COC(=O)NCCOCCN1CCCCC1 34a_100000757965_100000739454 [0,1,0,1,0,0|2,0,0]=4 19863 B16R1.1166 COC(=O)NCCOCOC1CCCCC1 34a_100000757965_100011935260 [0,1,0,1,0,0|2,0,0]=4 19864 B16R1.1166 COC(=O)OCCOCCC1CCCCC1 34a_100010262106_100011209188 [0,1,0,1,0,0|1,0,0]=3 19865 B16R1.1166 COC(=O)OCCOCCC1CCOCC1 34a_100010262106_100011934994 [0,1,0,1,0,0|2,0,0]=4 19866 B16R1.1166 COC(=O)OCCOCCN1CCCCC1 34a_100010262106_100000739454 [0,1,0,1,0,0|2,0,0]=4 19867 B16R1.1166 COC(=O)OCCOCOC1CCCCC1 34a_100010262106_100011935260 [0,1,0,1,0,0|2,0,0]=4 19868 B16R1.1166 COC(=O)OCSCCCC1CCCCC1 62a_100011713725_100000139417 [0,1,0,1,0,0|1,0,0]=3 19869 B16R1.1166 COC(=O)OCSCCCN1CCCCC1 62a_100132302099_100000139417 [0,1,0,1,0,0|2,0,0]=4 19870 B16R1.1166 COC(=O)OCSCCOC1CCCCC1 62a_100011211530_100000139417 [0,1,0,1,0,0|2,0,0]=4 19871 B16R1.1166 COC(C)CCOCCCC1CCCCC1 7a_100000764861_100011713725 [0,1,0,1,0,0|1,0,1]=4 19872 B16R1.1166 NNC(=O)CCCOCCC1CCCCC1 34a_100000211488_100011209188 [0,1,0,1,0,0|2,0,0]=4 19873 B16R1.1271 CCCCC1C=CCN1CCCC(=O)OC 2230a_100015184376_100011218270 [0,1,0,1,0,0|0,0,2]=4 19874 B16R1.1271 CCCCC1C=CCN1CCCC(=O)OC 269982a_100015184376_100011218270 [0,1,0,1,0,0|0,0,2]=4 19875 B16R1.1271 CCCCC1C=CCN1CCCC(=O)OC 34a_100015184376_100000742333 [0,1,0,1,0,0|0,0,2]=4 19876 B16R1.1271 CCCCC1CCCC1NCCC(=O)NC 269862a_100000738227_100000750825 [0,1,0,1,0,0|1,0,0]=3 19877 B16R1.1271 CCCCC1CCCC1NCCC(=O)NC 270004a_100000738227_100000750825 [0,1,0,1,0,0|1,0,0]=3 19878 B16R1.1353 CCC1C=CCN1CCCCCC(=O)OC 2230a_100000730860_100009816466 [0,1,0,1,0,0|0,0,2]=4 19879 B16R1.1353 CCC1C=CCN1CCCCCC(=O)OC 269982a_100000730860_100009816466 [0,1,0,1,0,0|0,0,2]=4 19880 B16R1.1353 CCC1C=CCN1CCCCCC(=O)OC 34a_100000730860_100009816466 [0,1,0,1,0,0|0,0,2]=4 19881 B16R1.1353 CCC1CCCN1CCCCCC(=O)OC 2230a_100000754278_100009816466 [0,1,0,1,0,0|0,0,0]=2 19882 B16R1.1353 CCC1CCCN1CCCCCC(=O)OC 269982a_100000754278_100009816466 [0,1,0,1,0,0|0,0,0]=2 19883 B16R1.1353 CCC1CCCN1CCCCCC(=O)OC 34a_100000754278_100009816466 [0,1,0,1,0,0|0,0,0]=2 19884 B16R1.1353 CCN1CCCC1CNCCCC(=O)NC 2230a_100000211693_100000741757 [0,1,0,1,0,0|2,0,0]=4 19885 B16R1.1353 CCN1CCCC1CNCCCC(=O)OC 2230a_100000211693_100011218270 [0,1,0,1,0,0|1,0,0]=3 19886 B16R1.1353 CCN1CCC[C@@H]1COCCCC(=O)NC 34a_100011739246_100000741757 [0,1,0,1,0,0|2,0,0]=4 19887 B16R1.1353 CCN1CCC[C@@H]1COCCCC(=O)NC 7a_100011739246_100000741757 [0,1,0,1,0,0|2,0,0]=4 19888 B16R1.1353 CCN1CCC[C@@H]1COCCCC(=O)OC 34a_100011739246_100000742333 [0,1,0,1,0,0|1,0,0]=3 19889 B16R1.1353 CCN1CCC[C@@H]1COCCCC(=O)OC 7a_100011739246_100011218270 [0,1,0,1,0,0|1,0,0]=3 19890 B16R1.1353 COC(=O)CCCCCN1CCCC1C#N 2230a_100000701862_100009816466 [0,1,0,1,0,0|1,0,1]=4 19891 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100009816466 [0,1,0,1,0,0|1,0,1]=4 19892 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100009816466 [0,1,0,1,0,0|1,0,1]=4 19893 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009816466 [0,1,0,1,0,0|1,0,0]=3 19894 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009816466 [0,1,0,1,0,0|1,0,0]=3 19895 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO 34a_100000745186_100009816466 [0,1,0,1,0,0|1,0,0]=3 19896 B16R1.1353 COC(=O)CCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000204269 [0,1,0,1,0,0|1,0,1]=4 19897 B16R1.1353 COC(=O)CCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000204269 [0,1,0,1,0,0|1,0,1]=4 19898 B16R1.1426 CCC(=O)CN1CCCCC1CCCOC 269982a_100011804088_100000747405 [0,1,0,1,0,0|2,0,0]=4 19899 B16R1.1426 CCCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210326 [0,1,0,1,0,0|1,0,0]=3 19900 B16R1.1426 CCCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000718602 [0,1,0,1,0,0|1,0,0]=3 19901 B16R1.1426 CCOCCN1CCOCC1CC(=O)OC 2230a_100000731486_100011215890 [0,1,0,1,0,0|2,0,0]=4 19902 B16R1.1426 CCOCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210147 [0,1,0,1,0,0|2,0,0]=4 19903 B16R1.1426 CCSCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000757381 [0,1,0,1,0,0|2,0,0]=4 19904 B16R1.1426 CCSCCN1CCOCC1CC(=O)OC 34a_100000731486_100000757381 [0,1,0,1,0,0|2,0,0]=4 19905 B16R1.1426 CNC(=O)CN1CCCCC1CCCOC 2230a_100011804088_100000183359 [0,1,0,1,0,0|2,0,0]=4 19906 B16R1.1426 CNC(=O)CN1CCCCC1CCCOC 269982a_100011804088_100000183359 [0,1,0,1,0,0|2,0,0]=4 19907 B16R1.1426 CNC(=O)CN1CCCCC1CCCOC 34a_100011804088_100000183359 [0,1,0,1,0,0|2,0,0]=4 19908 B16R1.1426 COC(=O)CC1COCCN1CCCCF 2230a_100000731486_100000729493 [0,1,0,1,0,0|2,0,0]=4 19909 B16R1.1426 COC(=O)CC1COCCN1CCCCF 34a_100000731486_100000729493 [0,1,0,1,0,0|2,0,0]=4 19910 B16R1.1426 COC(=O)CC1COCCN1CCCCO 2230a_100000731486_100000210776 [0,1,0,1,0,0|2,0,0]=4 19911 B16R1.1426 COC(=O)CC1COCCN1CCCCO 34a_100000731486_100011216708 [0,1,0,1,0,0|2,0,0]=4 19912 B16R1.1426 COCCCC1CCCCN1CC(=O)OC 2230a_100011804088_100000747449 [0,1,0,1,0,0|1,0,0]=3 19913 B16R1.1426 COCCCC1CCCCN1CC(=O)OC 269982a_100011804088_100000747449 [0,1,0,1,0,0|1,0,0]=3 19914 B16R1.1426 COCCCC1CCCCN1CC(=O)OC 34a_100011804088_100000747449 [0,1,0,1,0,0|1,0,0]=3 19915 B16R1.1426 COCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000740836 [0,1,0,1,0,0|2,0,0]=4 19916 B16R1.1426 COCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000740836 [0,1,0,1,0,0|2,0,0]=4 19917 B16R1.3257 COC(=O)CCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100010004213 [0,1,0,1,0,0|1,0,0]=3 19918 B16R1.3257 COC(=O)CCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100010004213 [0,1,0,1,0,0|1,0,0]=3 19919 B16R1.3257 COC(=O)CCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100010004213 [0,1,0,1,0,0|1,0,0]=3 19920 B16R1.3257 COC(=O)CCCCCCOCC1CC1C 34a_100000744939_100009815986 [0,1,0,1,0,0|0,0,0]=2 19921 B16R1.3257 COC(=O)CCCCCCOCC1CC1C 7a_100000744939_100009815986 [0,1,0,1,0,0|0,0,0]=2 19922 B16R1.3258 COC(=O)CCCCC=NNCC1CCC1 4a_200020586977_100000052768 [0,1,0,1,0,0|1,0,1]=4 19923 B16R1.3258 COC(=O)CCCCCCCCN1CCC1 269982a_100000754969_100010282707 [0,1,0,1,0,0|0,0,0]=2 19924 B16R1.3258 COC(=O)CCCCCCCNC1CCC1 2230a_100000749019_100010004213 [0,1,0,1,0,0|0,0,0]=2 19925 B16R1.3258 COC(=O)CCCCCCCNC1CCC1 34a_100000749019_100010004213 [0,1,0,1,0,0|0,0,0]=2 19926 B16R1.3258 COC(=O)CCCCCCCNC1COC1 2230a_100016991112_100010004213 [0,1,0,1,0,0|1,0,0]=3 19927 B16R1.3258 COC(=O)CCCCCCCOC1CCC1 34a_100000748187_100010004213 [0,1,0,1,0,0|0,0,0]=2 19928 B16R1.3258 COC(=O)CCCCCCCOC1CCC1 34a_100011022521_100000749161 [0,1,0,1,0,0|0,0,0]=2 19929 B16R1.3258 COC(=O)CCCCCCCOC1COC1 34a_100011022521_100009818527 [0,1,0,1,0,0|1,0,0]=3 19930 B16R1.3258 COC(=O)CCCCCCCOC1COC1 7a_100011022521_100009818527 [0,1,0,1,0,0|1,0,0]=3 19931 B16R1.3258 COC(=O)CCCCCCCOC1CSC1 7a_100000072292_100010004213 [0,1,0,1,0,0|1,0,0]=3 19932 B16R1.3258 COC(=O)CCCCCCCSC1CCC1 62a_100010004213_100000749161 [0,1,0,1,0,0|0,0,0]=2 19933 B16R1.3258 COC(=O)CCCCCCCSC1COC1 62a_100010004213_100009818527 [0,1,0,1,0,0|1,0,0]=3 19934 B16R1.3258 COC(=O)CCCCCCNCC1CCC1 2230a_100000738700_100009815986 [0,1,0,1,0,0|0,0,0]=2 19935 B16R1.3258 COC(=O)CCCCCCNCC1CCC1 34a_100000738700_100009815986 [0,1,0,1,0,0|0,0,0]=2 19936 B16R1.3258 COC(=O)CCCCCCNCC1COC1 2230a_100015281925_100009815986 [0,1,0,1,0,0|1,0,0]=3 19937 B16R1.3258 COC(=O)CCCCCCNCC1COC1 34a_100015281925_100009815986 [0,1,0,1,0,0|1,0,0]=3 19938 B16R1.3258 COC(=O)CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009815986 [0,1,0,1,0,0|1,0,0]=3 19939 B16R1.3258 COC(=O)CCCCCCNC[C@@H]1CCO1 34a_100020831831_100009815986 [0,1,0,1,0,0|1,0,0]=3 19940 B16R1.3258 COC(=O)CCCCCCOCC1CCC1 34a_100000760304_100009815986 [0,1,0,1,0,0|0,0,0]=2 19941 B16R1.3258 COC(=O)CCCCCCOCC1CCC1 34a_100009863599_100000763275 [0,1,0,1,0,0|0,0,0]=2 19942 B16R1.3258 COC(=O)CCCCCCOCC1CCC1 7a_100009863599_100000763275 [0,1,0,1,0,0|0,0,0]=2 19943 B16R1.3258 COC(=O)CCCCCCOCC1CCO1 34a_100000039022_100009815986 [0,1,0,1,0,0|1,0,0]=3 19944 B16R1.3258 COC(=O)CCCCCCOCC1CCO1 34a_100009863599_100000103362 [0,1,0,1,0,0|1,0,0]=3 19945 B16R1.3258 COC(=O)CCCCCCOCC1CCO1 7a_100009863599_100000103362 [0,1,0,1,0,0|1,0,0]=3 19946 B16R1.3258 COC(=O)CCCCCCOCC1CNC1 34a_100016987283_100009815986 [0,1,0,1,0,0|1,0,0]=3 19947 B16R1.3258 COC(=O)CCCCCCOCC1COC1 34a_100000060846_100009815986 [0,1,0,1,0,0|1,0,0]=3 19948 B16R1.3258 COC(=O)CCCCCCOCC1COC1 34a_100009863599_100010264016 [0,1,0,1,0,0|1,0,0]=3 19949 B16R1.3258 COC(=O)CCCCCCOCC1COC1 7a_100009863599_100010264016 [0,1,0,1,0,0|1,0,0]=3 19950 B16R1.3258 COC(=O)CCCCCCSCC1CCC1 62a_100000763275_100009815986 [0,1,0,1,0,0|0,0,0]=2 19951 B16R1.3258 COC(=O)CCCCCCSCC1CCC1 62a_100009815986_100000763275 [0,1,0,1,0,0|0,0,0]=2 19952 B16R1.3258 COC(=O)CCCCCCSCC1CCO1 62a_100000103362_100009815986 [0,1,0,1,0,0|1,0,0]=3 19953 B16R1.3258 COC(=O)CCCCCCSCC1CCO1 62a_100009815986_100000103362 [0,1,0,1,0,0|1,0,0]=3 19954 B16R1.3258 COC(=O)CCCCCCSCC1COC1 62a_100009815986_100010264016 [0,1,0,1,0,0|1,0,0]=3 19955 B16R1.3258 COC(=O)CCCCCCSCC1COC1 62a_100010264016_100009815986 [0,1,0,1,0,0|1,0,0]=3 19956 B16R1.3258 COC(=O)CCCCCOCCC1COC1 34a_100009855314_100009816466 [0,1,0,1,0,0|1,0,0]=3 19957 B16R1.3258 COC(=O)COCCOCCOC1CCC1 34a_100011023656_100000749161 [0,1,0,1,0,0|2,0,0]=4 19958 B16R1.3891 CCCCCCCCCCNCC1CCO1 2230a_100000684558_100000103362 [0,1,0,1,0,0|1,0,1]=4 19959 B16R1.3891 CCCCCCCCCCNCC1CCO1 34a_100000684558_100000103362 [0,1,0,1,0,0|1,0,1]=4 19960 B16R1.3891 CCCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210320 [0,1,0,1,0,0|1,0,1]=4 19961 B16R1.3891 CCCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210320 [0,1,0,1,0,0|1,0,1]=4 19962 B16R1.3891 CCCCCCCCCCOCC1CCO1 34a_100000039022_100000210320 [0,1,0,1,0,0|1,0,1]=4 19963 B16R1.3891 CCCCCCCCCCOCC1CCO1 34a_100000210711_100000103362 [0,1,0,1,0,0|1,0,1]=4 19964 B16R1.3891 CCCCCCCCCCOCC1CCO1 7a_100000210711_100000103362 [0,1,0,1,0,0|1,0,1]=4 19965 B16R1.3891 CCCCCCCCCCSCC1CCO1 62a_100000103362_100000210320 [0,1,0,1,0,0|1,0,1]=4 19966 B16R1.3907 C#CCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100012094781 [0,1,0,1,0,0|0,0,2]=4 19967 B16R1.3907 C#CCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100012094781 [0,1,0,1,0,0|0,0,2]=4 19968 B16R1.3907 C#CCCCCOC1CCCC1C(=O)OC 34a_200000081814_100010269958 [0,1,0,1,0,0|0,0,2]=4 19969 B16R1.3907 C#CCCCCOC1CCCC1C(=O)OC 7a_200000081814_100010269958 [0,1,0,1,0,0|0,0,2]=4 19970 B16R1.3907 C=CCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000700193 [0,1,0,1,0,0|0,0,2]=4 19971 B16R1.3907 C=CCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000700193 [0,1,0,1,0,0|0,0,2]=4 19972 B16R1.3907 C=CCCCCOC1CCCC1C(=O)OC 34a_200000081814_100011215482 [0,1,0,1,0,0|0,0,2]=4 19973 B16R1.3907 C=CCCCCOC1CCCC1C(=O)OC 7a_200000081814_100011215482 [0,1,0,1,0,0|0,0,2]=4 19974 B16R1.3907 CC/C=C\CCOC1CCCC1C(=O)OC 34a_200000081814_100015370543 [0,1,0,1,0,0|0,0,2]=4 19975 B16R1.3907 CC/C=C\CCOC1CCCC1C(=O)OC 7a_200000081814_100015370543 [0,1,0,1,0,0|0,0,2]=4 19976 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210681 [0,1,0,1,0,0|1,0,0]=3 19977 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210681 [0,1,0,1,0,0|1,0,0]=3 19978 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000210614 [0,1,0,1,0,0|1,0,0]=3 19979 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210681 [0,1,0,1,0,0|0,0,0]=2 19980 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210681 [0,1,0,1,0,0|0,0,0]=2 19981 B16R1.3907 CCCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210681 [0,1,0,1,0,0|1,0,0]=3 19982 B16R1.3907 CCCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210681 [0,1,0,1,0,0|1,0,0]=3 19983 B16R1.3907 CCCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210681 [0,1,0,1,0,0|1,0,0]=3 19984 B16R1.3907 CCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210314 [0,1,0,1,0,0|0,0,0]=2 19985 B16R1.3907 CCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210314 [0,1,0,1,0,0|0,0,0]=2 19986 B16R1.3907 CCCCCNN=C1CCCC1C(=O)OC 4a_100000694160_100000685950 [0,1,0,1,0,0|1,0,1]=4 19987 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000743108 [0,1,0,1,0,0|2,0,0]=4 19988 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000743108 [0,1,0,1,0,0|2,0,0]=4 19989 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000743108 [0,1,0,1,0,0|2,0,0]=4 19990 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000743108 [0,1,0,1,0,0|1,0,0]=3 19991 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000743108 [0,1,0,1,0,0|1,0,0]=3 19992 B16R1.3907 CCCCOCCN1CCSC1C(=O)OC 2230a_100015296106_100000743108 [0,1,0,1,0,0|2,0,0]=4 19993 B16R1.3907 CCCCOCCN1CCSC1C(=O)OC 269982a_100015296106_100000743108 [0,1,0,1,0,0|2,0,0]=4 19994 B16R1.3907 CCCCOCCN1CSCC1C(=O)OC 269982a_200000724679_100000743108 [0,1,0,1,0,0|2,0,0]=4 19995 B16R1.3907 CCCCOCOC1CCCC1C(=O)OC 34a_200000081814_100011995733 [0,1,0,1,0,0|1,0,0]=3 19996 B16R1.3907 CCCOCCOC1CCCC1C(=O)OC 34a_200000081814_100011215938 [0,1,0,1,0,0|1,0,0]=3 19997 B16R1.3907 CCCOCCOC1CCCC1C(=O)OC 7a_200000081814_100011215938 [0,1,0,1,0,0|1,0,0]=3 19998 B16R1.3907 CCOCCCOC1CCCC1C(=O)OC 34a_200000081814_100012232248 [0,1,0,1,0,0|1,0,0]=3 19999 B16R1.3907 CCOCCCOC1CCCC1C(=O)OC 7a_200000081814_100012232248 [0,1,0,1,0,0|1,0,0]=3 20000 B16R1.3907 CNC(=O)[C@@H]1CCCN1CCCCCCF 2230a_100015185040_100015922095 [0,1,0,1,0,0|2,0,0]=4 20001 B16R1.3907 CNC(=O)[C@@H]1CCCN1CCCCCCF 269982a_100015185040_100015922095 [0,1,0,1,0,0|2,0,0]=4 20002 B16R1.3907 CNC(=O)[C@@H]1CCCN1CCCCCCF 34a_100015185040_100015922095 [0,1,0,1,0,0|2,0,0]=4 20003 B16R1.3907 CNC(=O)[C@@H]1CCCN1CCCCCCO 2230a_100015185040_100000766143 [0,1,0,1,0,0|2,0,0]=4 20004 B16R1.3907 CNC(=O)[C@@H]1CCCN1CCCCCCO 269982a_100015185040_100000766143 [0,1,0,1,0,0|2,0,0]=4 20005 B16R1.3907 CNC(=O)[C@@H]1CCCN1CCCCCCO 34a_100015185040_100000766143 [0,1,0,1,0,0|2,0,0]=4 20006 B16R1.3907 COC(=O)C1CCCC1OCCCCC#N 7a_200000081814_100000211819 [0,1,0,1,0,0|1,0,1]=4 20007 B16R1.3907 COC(=O)C1CCCC1OCCCCC=O 7a_200000081814_100000139335 [0,1,0,1,0,0|1,0,1]=4 20008 B16R1.3907 COC(=O)C1CCCC1OCCCCCF 34a_200000081814_100000729378 [0,1,0,1,0,0|1,0,0]=3 20009 B16R1.3907 COC(=O)C1CCCC1OCCCCCF 7a_200000081814_100000729378 [0,1,0,1,0,0|1,0,0]=3 20010 B16R1.3907 COC(=O)C1CCCC1OCCCCCO 34a_200000081814_100000746330 [0,1,0,1,0,0|1,0,0]=3 20011 B16R1.3907 COC(=O)C1CCCC1OCCCCCO 7a_200000081814_100000746330 [0,1,0,1,0,0|1,0,0]=3 20012 B16R1.3907 COC(=O)C1CCCC1OCCOCCO 34a_200000081814_100000692535 [0,1,0,1,0,0|2,0,0]=4 20013 B16R1.3907 COC(=O)C1CCCC1OCCOCCO 7a_200000081814_100011215305 [0,1,0,1,0,0|2,0,0]=4 20014 B16R1.3907 COC(=O)C1CSCN1CCCCCCF 269982a_200000724679_100015922095 [0,1,0,1,0,0|2,0,0]=4 20015 B16R1.3907 COC(=O)C1CSCN1CCCCCCO 269982a_200000724679_100000766143 [0,1,0,1,0,0|2,0,0]=4 20016 B16R1.3907 COC(=O)C1SCCN1CCCCCCF 2230a_100015296106_100015922095 [0,1,0,1,0,0|2,0,0]=4 20017 B16R1.3907 COC(=O)C1SCCN1CCCCCCF 269982a_100015296106_100015922095 [0,1,0,1,0,0|2,0,0]=4 20018 B16R1.3907 COC(=O)C1SCCN1CCCCCCO 2230a_100015296106_100000766143 [0,1,0,1,0,0|2,0,0]=4 20019 B16R1.3907 COC(=O)C1SCCN1CCCCCCO 269982a_100015296106_100000766143 [0,1,0,1,0,0|2,0,0]=4 20020 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCC#N 2230a_100000752040_100009813376 [0,1,0,1,0,0|1,0,1]=4 20021 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCC#N 269982a_100000752040_100009813376 [0,1,0,1,0,0|1,0,1]=4 20022 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCC=O 2230a_100000752040_100000139337 [0,1,0,1,0,0|1,0,1]=4 20023 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCC=O 269982a_100000752040_100000139337 [0,1,0,1,0,0|1,0,1]=4 20024 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCF 2230a_100000752040_100015922095 [0,1,0,1,0,0|1,0,0]=3 20025 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCF 269982a_100000752040_100015922095 [0,1,0,1,0,0|1,0,0]=3 20026 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCO 2230a_100000752040_100000766143 [0,1,0,1,0,0|1,0,0]=3 20027 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCO 269982a_100000752040_100000766143 [0,1,0,1,0,0|1,0,0]=3 20028 B16R1.3907 COCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000755781 [0,1,0,1,0,0|1,0,0]=3 20029 B16R1.3907 COCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000730899 [0,1,0,1,0,0|1,0,0]=3 20030 B16R1.3907 COCCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000695917 [0,1,0,1,0,0|2,0,0]=4 20031 B16R1.3907 COCCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000695917 [0,1,0,1,0,0|2,0,0]=4 20032 B16R1.3910 C#CC1CCCCN1CCCCC(=O)OC 2230a_200020621307_100000204269 [0,1,0,1,0,0|0,0,2]=4 20033 B16R1.3910 C#CC1CCCCN1CCCCC(=O)OC 269982a_200020621307_100000204269 [0,1,0,1,0,0|0,0,2]=4 20034 B16R1.3910 C#CC1CCCCN1CCCCC(=O)OC 34a_200020621307_100000204269 [0,1,0,1,0,0|0,0,2]=4 20035 B16R1.3910 CCC(=O)NCCCN1CCCCC1CC 11a_100011191702_100000210414 [0,1,0,1,0,0|2,0,0]=4 20036 B16R1.3910 CCC(=O)NCCCN1CCCCC1CC 1626a_100011191702_100000210414 [0,1,0,1,0,0|2,0,0]=4 20037 B16R1.3910 CCC(=O)NCCCN1CCCCC1CC 240690a_100011191702_100000210414 [0,1,0,1,0,0|2,0,0]=4 20038 B16R1.3910 CCC(=O)NCCCN1CCCCC1CC 527a_100011191702_100000210414 [0,1,0,1,0,0|2,0,0]=4 20039 B16R1.3910 CCC(=O)NCCNC1CCCCC1CC 269862a_100132302217_100000757040 [0,1,0,1,0,0|2,0,0]=4 20040 B16R1.3910 CCC(=O)NCCNC1CCCCC1CC 270004a_100132302217_100000757040 [0,1,0,1,0,0|2,0,0]=4 20041 B16R1.3910 CCC1CCCCC1NCCCC(=O)NC 269862a_100000740002_100000757040 [0,1,0,1,0,0|1,0,0]=3 20042 B16R1.3910 CCC1CCCCC1NCCCC(=O)NC 270004a_100000740002_100000757040 [0,1,0,1,0,0|1,0,0]=3 20043 B16R1.3910 CCC1CCCCC1NCCNC(=O)NC 269862a_100015205895_100000757040 [0,1,0,1,0,0|2,0,0]=4 20044 B16R1.3910 CCC1CCCCC1OC/C=C/C(=O)OC 34a_100000210738_100000742655 [0,1,0,1,0,0|0,0,2]=4 20045 B16R1.3910 CCC1CCCCC1OC/C=C/C(=O)OC 7a_100000210738_100000742655 [0,1,0,1,0,0|0,0,2]=4 20046 B16R1.3910 CCC1CCCCC1OCCCC(=O)NC 34a_100000210738_100000741757 [0,1,0,1,0,0|1,0,0]=3 20047 B16R1.3910 CCC1CCCCC1OCCCC(=O)NC 7a_100000210738_100000741757 [0,1,0,1,0,0|1,0,0]=3 20048 B16R1.3910 CCC1CCCCC1OCCCC(=O)OC 34a_100000210738_100000742333 [0,1,0,1,0,0|0,0,0]=2 20049 B16R1.3910 CCC1CCCCC1OCCCC(=O)OC 7a_100000210738_100011218270 [0,1,0,1,0,0|0,0,0]=2 20050 B16R1.3910 CCC1CCCCC1OCCOC(=O)NC 34a_100000210738_200011997002 [0,1,0,1,0,0|2,0,0]=4 20051 B16R1.3910 CCC1CCCCC1OCCOC(=O)NC 7a_100000210738_200011997002 [0,1,0,1,0,0|2,0,0]=4 20052 B16R1.3910 CCC1CCCCN1CCCCC(=O)OC 2230a_100000210034_100000204269 [0,1,0,1,0,0|0,0,0]=2 20053 B16R1.3910 CCC1CCCCN1CCCCC(=O)OC 269982a_100000210034_100000204269 [0,1,0,1,0,0|0,0,0]=2 20054 B16R1.3910 CCC1CCCCN1CCCCC(=O)OC 34a_100000210034_100000204269 [0,1,0,1,0,0|0,0,0]=2 20055 B16R1.3910 CCC1CCCCN1CCCNC(=O)NC 2708a_100011191702_106832991635 [0,1,0,1,0,0|2,0,0]=4 20056 B16R1.3910 CCC1CCCCN1CCCNC(=O)NC 2708a_100102657272_100011191702 [0,1,0,1,0,0|2,0,0]=4 20057 B16R1.3910 CCC1CCCCN1CCCNC(=O)NC 273464a_100011191702_100102657272 [0,1,0,1,0,0|2,0,0]=4 20058 B16R1.3910 CCC1CCCCN1CCCNC(=O)NC 273464a_100102657272_100011191702 [0,1,0,1,0,0|2,0,0]=4 20059 B16R1.3910 CCC1CCCCN1CCCNC(=O)NC 512a_106832991638_100011191702 [0,1,0,1,0,0|2,0,0]=4 20060 B16R1.3910 CCC1CCCCN1CCNCC(=O)NC 2230a_100000755458_100000183359 [0,1,0,1,0,0|2,0,0]=4 20061 B16R1.3910 CCC1CCCCN1CCNCC(=O)NC 34a_100000755458_100000183359 [0,1,0,1,0,0|2,0,0]=4 20062 B16R1.3910 CCC1CCCCN1CCNCC(=O)OC 2230a_100000755458_100000747449 [0,1,0,1,0,0|1,0,0]=3 20063 B16R1.3910 CCC1CCCCN1CCNCC(=O)OC 34a_100000755458_100000747449 [0,1,0,1,0,0|1,0,0]=3 20064 B16R1.3910 CCC1CCCCN1CCOCC(=O)OC 2230a_100000210034_100000090808 [0,1,0,1,0,0|1,0,0]=3 20065 B16R1.3910 CCC1CCCCN1CCOCC(=O)OC 34a_100000210034_100000090808 [0,1,0,1,0,0|1,0,0]=3 20066 B16R1.3910 CCN1CCCCC1CNCCC(=O)NC 2230a_100000754393_100000737683 [0,1,0,1,0,0|2,0,0]=4 20067 B16R1.3910 CCN1CCCCC1CNCCC(=O)NC 34a_100000754393_100012179268 [0,1,0,1,0,0|2,0,0]=4 20068 B16R1.3910 CCN1CCCCC1CNCCC(=O)OC 2230a_100000754393_100000204255 [0,1,0,1,0,0|1,0,0]=3 20069 B16R1.3910 CCN1CCCCC1CNCCC(=O)OC 34a_100000754393_100000742370 [0,1,0,1,0,0|1,0,0]=3 20070 B16R1.3910 CCN1CCCCC1COCCC(=O)NC 34a_100000225091_100012179268 [0,1,0,1,0,0|2,0,0]=4 20071 B16R1.3910 CCN1CCCCC1COCCC(=O)NC 7a_100000225091_100000737683 [0,1,0,1,0,0|2,0,0]=4 20072 B16R1.3910 CCN1CCCCC1COCCC(=O)OC 34a_100000225091_100000742370 [0,1,0,1,0,0|1,0,0]=3 20073 B16R1.3910 CCN1CCCCC1COCCC(=O)OC 7a_100000225091_100000204255 [0,1,0,1,0,0|1,0,0]=3 20074 B16R1.3910 CC[C@H]1COCCN1CCCCC(=O)OC 2230a_100016988097_100000204269 [0,1,0,1,0,0|1,0,0]=3 20075 B16R1.3910 CC[C@H]1COCCN1CCCCC(=O)OC 269982a_100016988097_100000204269 [0,1,0,1,0,0|1,0,0]=3 20076 B16R1.3910 CC[C@H]1COCCN1CCCCC(=O)OC 34a_100016988097_100000204269 [0,1,0,1,0,0|1,0,0]=3 20077 B16R1.3910 CC[C@H]1COCCN1CCOCC(=O)OC 2230a_100016988097_100000090808 [0,1,0,1,0,0|2,0,0]=4 20078 B16R1.3910 CC[C@H]1COCCN1CCOCC(=O)OC 34a_100016988097_100000090808 [0,1,0,1,0,0|2,0,0]=4 20079 B16R1.3910 CNC(=O)CCCNC1CCCCC1CO 270004a_100000740002_100009861125 [0,1,0,1,0,0|2,0,0]=4 20080 B16R1.3910 CNC(=O)CCCNC1CCCCC1OC 270004a_100000740002_100000740605 [0,1,0,1,0,0|2,0,0]=4 20081 B16R1.3910 CNC(=O)CCCNC1CCCCC1OC 34a_100011208099_100000741757 [0,1,0,1,0,0|2,0,0]=4 20082 B16R1.3910 CNC(=O)CCCOC1CCCCC1CN 34a_100011216029_100000741757 [0,1,0,1,0,0|2,0,0]=4 20083 B16R1.3910 CNC(=O)CCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000741757 [0,1,0,1,0,0|2,0,0]=4 20084 B16R1.3910 CNC(=O)CCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000741757 [0,1,0,1,0,0|2,0,0]=4 20085 B16R1.3910 CNC(=O)CCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000741757 [0,1,0,1,0,0|2,0,0]=4 20086 B16R1.3910 CN[C@@H]1CCCC[C@H]1OCCCC(=O)OC 34a_100000708425_100000742333 [0,1,0,1,0,0|1,0,0]=3 20087 B16R1.3910 COC(=O)CCCCN1CCCCC1C#N 34a_100016989756_100000204269 [0,1,0,1,0,0|1,0,1]=4 20088 B16R1.3910 COC(=O)CCCCN1CCCCC1CO 2230a_100000210821_100000204269 [0,1,0,1,0,0|1,0,0]=3 20089 B16R1.3910 COC(=O)CCCCN1CCCCC1CO 269982a_100000210821_100000204269 [0,1,0,1,0,0|1,0,0]=3 20090 B16R1.3910 COC(=O)CCCCN1CCCCC1CO 34a_100000210821_100000204269 [0,1,0,1,0,0|1,0,0]=3 20091 B16R1.3910 COC(=O)CCCCN1CCOC[C@H]1CO 2230a_100000717676_100000204269 [0,1,0,1,0,0|2,0,0]=4 20092 B16R1.3910 COC(=O)CCCCN1CCOC[C@H]1CO 269982a_100000717676_100000204269 [0,1,0,1,0,0|2,0,0]=4 20093 B16R1.3910 COC(=O)CCCCN1CCOC[C@H]1CO 34a_100000717676_100000204269 [0,1,0,1,0,0|2,0,0]=4 20094 B16R1.3910 COC(=O)CCCNC1CCCCC1OC 34a_100011208099_100000742333 [0,1,0,1,0,0|1,0,0]=3 20095 B16R1.3910 COC(=O)CCCNC1CCOCC1CO 2230a_214813039666_100011218270 [0,1,0,1,0,0|2,0,0]=4 20096 B16R1.3910 COC(=O)CCCNC1CCOCC1CO 34a_214813039666_100000742333 [0,1,0,1,0,0|2,0,0]=4 20097 B16R1.3910 COC(=O)CCCOC1CCCCC1CN 34a_100011216029_100000742333 [0,1,0,1,0,0|1,0,0]=3 20098 B16R1.3910 COC(=O)CCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000742333 [0,1,0,1,0,0|1,0,0]=3 20099 B16R1.3910 COC(=O)CCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011218270 [0,1,0,1,0,0|1,0,0]=3 20100 B16R1.3910 COC(=O)CNCCN1CCCCC1CO 2230a_100011473795_100000747449 [0,1,0,1,0,0|2,0,0]=4 20101 B16R1.3910 COC(=O)CNCCN1CCCCC1CO 34a_100011473795_100000747449 [0,1,0,1,0,0|2,0,0]=4 20102 B16R1.3910 COC(=O)COCCN1CCCCC1CO 2230a_100000210821_100000090808 [0,1,0,1,0,0|2,0,0]=4 20103 B16R1.3910 COC(=O)COCCN1CCCCC1CO 34a_100000210821_100000090808 [0,1,0,1,0,0|2,0,0]=4 20104 B16R1.4250 CCCNN=C1CCCCCC1C(=O)OC 4a_100000740057_100000183596 [0,1,0,1,0,0|1,0,1]=4 20105 B16R1.6688 CCCCCCCCCCNC1CCC1=O 34a_100000684558_100009892977 [0,1,0,1,0,0|1,0,0]=3 20106 B16R1.6688 CCCCCCCCCCOC1CCC1=O 34a_100000210711_100009892977 [0,1,0,1,0,0|1,0,0]=3 20107 B16R1.6688 CCCCCCCCCCOC1CCC1=O 7a_100000210711_100009892977 [0,1,0,1,0,0|1,0,0]=3 20108 B16R1.6688 CCCCCCCCCCSC1CCC1=O 62a_100009892977_100000210320 [0,1,0,1,0,0|1,0,0]=3 20109 B16R1.6688 CCCCCCCCNCCC1CCC1=O 2230a_100000229939_200016118888 [0,1,0,1,0,0|1,0,0]=3 20110 B16R1.6688 CCCCCCCCOCCC1CCC1=O 7a_100000210232_200016118888 [0,1,0,1,0,0|1,0,0]=3 20111 B16R1.6688 CCCCCCCCSCCC1CCC1=O 62a_100000210759_200016118888 [0,1,0,1,0,0|1,0,0]=3 20112 B16R1.6688 CCCCCCCCSCCC1CCC1=O 62a_200016118888_100000210317 [0,1,0,1,0,0|1,0,0]=3 20113 B16R1.6688 CCCCCOCCOCCC1CCC1=O 7a_100011215259_200016118888 [0,1,0,1,0,0|2,0,0]=4 20114 B16R1.6688 CCCCOCCCNCCC1CCC1=O 2230a_200000211371_200016118888 [0,1,0,1,0,0|2,0,0]=4 20115 B16R1.6688 CCCCOCCCOCCC1CCC1=O 7a_200011215613_200016118888 [0,1,0,1,0,0|2,0,0]=4 20116 B16R1.6688 COCCCCCCOCCC1CCC1=O 7a_200012092642_200016118888 [0,1,0,1,0,0|2,0,0]=4 20117 B16R1.6688 COCCCCCCSCCC1CCC1=O 62a_100011998445_200016118888 [0,1,0,1,0,0|2,0,0]=4 20118 B16R1.6688 COCCCCCCSCCC1CCC1=O 62a_200016118888_100011998445 [0,1,0,1,0,0|2,0,0]=4 20119 B16R1.6688 NCCCCCCCCCOC1CCC1=O 34a_100000078944_100009892977 [0,1,0,1,0,0|2,0,0]=4 20120 B16R1.6688 O=C1CCC1CCNCCCCCCCO 2230a_100011996573_200016118888 [0,1,0,1,0,0|2,0,0]=4 20121 B16R1.6688 O=C1CCC1CCOCCCCCCCBr 7a_100000760002_200016118888 [0,1,0,1,0,0|2,0,0]=4 20122 B16R1.6688 O=C1CCC1CCSCCCCCCCO 62a_100000760002_200016118888 [0,1,0,1,0,0|2,0,0]=4 20123 B16R1.6688 O=C1CCC1CCSCCCCCCCO 62a_200016118888_100000760002 [0,1,0,1,0,0|2,0,0]=4 20124 B16R1.6688 O=C1CCC1NCCCCCCCCCO 34a_100000078944_100009892977 [0,1,0,1,0,0|2,0,0]=4 20125 B16R1.6688 O=C1CCC1OCCCCCCCCCBr 34a_100009813782_100009892977 [0,1,0,1,0,0|2,0,0]=4 20126 B16R1.6688 O=C1CCC1OCCCCCCCCCBr 7a_100009813782_100009892977 [0,1,0,1,0,0|2,0,0]=4 20127 B16R1.6688 O=C1CCC1OCCCCCCCCCCl 34a_100009868337_100009892977 [0,1,0,1,0,0|2,0,0]=4 20128 B16R1.6688 O=C1CCC1OCCCCCCCCCCl 7a_100009868337_100009892977 [0,1,0,1,0,0|2,0,0]=4 20129 B16R1.6688 O=C1CCC1SCCCCCCCCCO 62a_100009813782_100009892977 [0,1,0,1,0,0|2,0,0]=4 20130 B16R1.6688 O=C1CCC1SCCCCCCCCCO 62a_100009892977_100009813782 [0,1,0,1,0,0|2,0,0]=4 20131 B16R1.6695 CCCC1CCCC1NCCCC(=O)NC 269862a_100000740002_100000723119 [0,1,0,1,0,0|1,0,0]=3 20132 B16R1.6695 CCCC1CCCC1NCCCC(=O)NC 270004a_100000740002_100000723119 [0,1,0,1,0,0|1,0,0]=3 20133 B16R1.6695 CCCC1CCCC1NCCNC(=O)CC 269862a_100132302217_100000723119 [0,1,0,1,0,0|2,0,0]=4 20134 B16R1.6695 CCCC1CCCC1NCCNC(=O)CC 270004a_100132302217_100000723119 [0,1,0,1,0,0|2,0,0]=4 20135 B16R1.6695 CCCC1CCCC1NCCNC(=O)NC 269862a_100015205895_100000723119 [0,1,0,1,0,0|2,0,0]=4 20136 B16R1.6695 CCCN1CCCC1COCCC(=O)NC 34a_200000694710_100012179268 [0,1,0,1,0,0|2,0,0]=4 20137 B16R1.6695 CCCN1CCCC1COCCC(=O)NC 7a_200000694710_100000737683 [0,1,0,1,0,0|2,0,0]=4 20138 B16R1.6695 CCCN1CCCC1COCCC(=O)OC 34a_200000694710_100000742370 [0,1,0,1,0,0|1,0,0]=3 20139 B16R1.6695 CCCN1CCCC1COCCC(=O)OC 7a_200000694710_100000204255 [0,1,0,1,0,0|1,0,0]=3 20140 B16R1.6695 COC[C@@H]1CCCN1CCCCC(=O)OC 2230a_100020646714_100000204269 [0,1,0,1,0,0|1,0,0]=3 20141 B16R1.6695 COC[C@@H]1CCCN1CCCCC(=O)OC 269982a_100020646714_100000204269 [0,1,0,1,0,0|1,0,0]=3 20142 B16R1.6695 COC[C@@H]1CCCN1CCCCC(=O)OC 34a_100020646714_100000204269 [0,1,0,1,0,0|1,0,0]=3 20143 B16R1.6695 COC[C@@H]1CCCN1CCOCC(=O)OC 2230a_100020646714_100000090808 [0,1,0,1,0,0|2,0,0]=4 20144 B16R1.6695 COC[C@@H]1CCCN1CCOCC(=O)OC 34a_100020646714_100000090808 [0,1,0,1,0,0|2,0,0]=4 20145 B16R1.8378 CCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210759 [0,1,0,1,0,0|2,0,0]=4 20146 B16R1.8378 CCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210759 [0,1,0,1,0,0|2,0,0]=4 20147 B16R1.12713 CCCCCC1CCCC1NCC(=O)NC 269862a_100000693194_200000198059 [0,1,0,1,0,0|1,0,0]=3 20148 B16R1.12713 CCCCCC1CCCC1NCC(=O)NC 270004a_100000693194_200000198059 [0,1,0,1,0,0|1,0,0]=3 20149 B16R1.12713 CCCCCC1CCCC1NC[C@@H](C)OC 269862a_100020591295_200000198059 [0,1,0,1,0,0|1,0,1]=4 20150 B16R1.12713 CCCCCC1CCCC1NC[C@@H](C)OC 270004a_100020591295_200000198059 [0,1,0,1,0,0|1,0,1]=4 20151 B16R1.12872 C#CCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100012276617 [0,1,0,1,0,0|0,0,2]=4 20152 B16R1.12872 C#CCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100012276617 [0,1,0,1,0,0|0,0,2]=4 20153 B16R1.12872 C=CCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011215473 [0,1,0,1,0,0|0,0,2]=4 20154 B16R1.12872 C=CCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011215473 [0,1,0,1,0,0|0,0,2]=4 20155 B16R1.12872 CCCCCC#CCN1CC[C@H]1C(=O)OC 2230a_102516456887_100009816472 [0,1,0,1,0,0|0,0,2]=4 20156 B16R1.12872 CCCCCC#CCN1CC[C@H]1C(=O)OC 269982a_102516456887_100009816472 [0,1,0,1,0,0|0,0,2]=4 20157 B16R1.12872 CCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210759 [0,1,0,1,0,0|0,0,0]=2 20158 B16R1.12872 CCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210759 [0,1,0,1,0,0|0,0,0]=2 20159 B16R1.12872 CCOCCOCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011211534 [0,1,0,1,0,0|2,0,0]=4 20160 B16R1.12872 CCOCCOCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011211534 [0,1,0,1,0,0|2,0,0]=4 20161 B16R1.12872 COC(=O)[C@@H]1CCN1CCCCCCC#N 2230a_102516456887_100009813337 [0,1,0,1,0,0|1,0,1]=4 20162 B16R1.12872 COC(=O)[C@@H]1CCN1CCCCCCC#N 269982a_102516456887_100009813337 [0,1,0,1,0,0|1,0,1]=4 20163 B16R1.12872 COC(=O)[C@@H]1CCN1CCCCCCCO 2230a_102516456887_100000760002 [0,1,0,1,0,0|1,0,0]=3 20164 B16R1.12872 COC(=O)[C@@H]1CCN1CCCCCCCO 269982a_102516456887_100000760002 [0,1,0,1,0,0|1,0,0]=3 20165 B16R1.12872 COCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011998445 [0,1,0,1,0,0|1,0,0]=3 20166 B16R1.12872 COCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011998445 [0,1,0,1,0,0|1,0,0]=3 20167 B16R1.12872 COCCOCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011216529 [0,1,0,1,0,0|2,0,0]=4 20168 B16R1.12872 COCCOCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011216529 [0,1,0,1,0,0|2,0,0]=4 20169 B16R1.16747 COC(=O)CCCCCCCCNC1CC1 34a_100000212008_100010282707 [0,1,0,1,0,0|0,0,0]=2 20170 B16R1.16747 COC(=O)CCCCCCCCOC1CC1 34a_100000035544_100000211595 [0,1,0,1,0,0|0,0,0]=2 20171 B16R1.16747 COC(=O)CCCCCCCCSC1CC1 62a_100010282707_100000211595 [0,1,0,1,0,0|0,0,0]=2 20172 B16R1.16747 COC(=O)CCCCCCCNCC1CC1 2230a_100000735609_100010004213 [0,1,0,1,0,0|0,0,0]=2 20173 B16R1.16747 COC(=O)CCCCCCCNCC1CC1 34a_100000735609_100010004213 [0,1,0,1,0,0|0,0,0]=2 20174 B16R1.16747 COC(=O)CCCCCCCOCC1CC1 34a_100000211283_100010004213 [0,1,0,1,0,0|0,0,0]=2 20175 B16R1.16747 COC(=O)CCCCCCCOCC1CC1 34a_100011022521_100000742324 [0,1,0,1,0,0|0,0,0]=2 20176 B16R1.16747 COC(=O)CCCCCCCOCC1CC1 7a_100011022521_100000742324 [0,1,0,1,0,0|0,0,0]=2 20177 B16R1.16747 COC(=O)CCCCCCCOCC1CO1 34a_100011022521_102125554688 [0,1,0,1,0,0|1,0,0]=3 20178 B16R1.16747 COC(=O)CCCCCCCOCC1CO1 7a_100011022521_102125554688 [0,1,0,1,0,0|1,0,0]=3 20179 B16R1.16747 COC(=O)CCCCCCCOCC1CS1 7a_100011022521_100000031435 [0,1,0,1,0,0|1,0,0]=3 20180 B16R1.16747 COC(=O)CCCCCCCOC[C@@H]1CO1 34a_100000757423_100010004213 [0,1,0,1,0,0|1,0,0]=3 20181 B16R1.16747 COC(=O)CCCCCCCOC[C@@H]1CO1 7a_100011022521_100000745022 [0,1,0,1,0,0|1,0,0]=3 20182 B16R1.16747 COC(=O)CCCCCCCSCC1CC1 62a_100000756562_100010004213 [0,1,0,1,0,0|0,0,0]=2 20183 B16R1.16747 COC(=O)CCCCCCCSCC1CC1 62a_100010004213_100000742324 [0,1,0,1,0,0|0,0,0]=2 20184 B16R1.16747 COC(=O)CCCCCCCSCC1CO1 62a_100010004213_102125554688 [0,1,0,1,0,0|1,0,0]=3 20185 B16R1.16747 COC(=O)CCCCCCCSCC1CO1 62a_102125554688_100010004213 [0,1,0,1,0,0|1,0,0]=3 20186 B16R1.16747 COC(=O)CCCCCCCSCC1CS1 62a_100000031435_100010004213 [0,1,0,1,0,0|1,0,0]=3 20187 B16R1.16747 COC(=O)CCCCCCCSCC1CS1 62a_100010004213_100000031435 [0,1,0,1,0,0|1,0,0]=3 20188 B16R1.16747 COC(=O)CCCCCCCSC[C@@H]1CO1 62a_100000745022_100010004213 [0,1,0,1,0,0|1,0,0]=3 20189 B16R1.16747 COC(=O)CCCCCCCSC[C@@H]1CO1 62a_100010004213_100000745022 [0,1,0,1,0,0|1,0,0]=3 20190 B16R1.16747 COC(=O)CCCCCCNCCC1CC1 34a_100000764129_100009815986 [0,1,0,1,0,0|0,0,0]=2 20191 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 34a_100000754188_100009815986 [0,1,0,1,0,0|0,0,0]=2 20192 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 34a_100009863599_100000694398 [0,1,0,1,0,0|0,0,0]=2 20193 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 7a_100000754188_100009815986 [0,1,0,1,0,0|0,0,0]=2 20194 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 7a_100009863599_100000764125 [0,1,0,1,0,0|0,0,0]=2 20195 B16R1.16747 COC(=O)CCCCCCOCCC1CO1 34a_100009863599_100000732470 [0,1,0,1,0,0|1,0,0]=3 20196 B16R1.16747 COC(=O)CCCCCCOCCC1CO1 7a_100009863599_100000732470 [0,1,0,1,0,0|1,0,0]=3 20197 B16R1.16747 COC(=O)CCCCCCOCC[C@@H]1CO1 34a_100009820653_100009815986 [0,1,0,1,0,0|1,0,0]=3 20198 B16R1.16747 COC(=O)CCCCCCSCCC1CC1 62a_100000764125_100009815986 [0,1,0,1,0,0|0,0,0]=2 20199 B16R1.16747 COC(=O)CCCCCCSCCC1CC1 62a_100009815986_100000764125 [0,1,0,1,0,0|0,0,0]=2 20200 B16R1.16747 COC(=O)CCCCCCSCCC1CO1 62a_100000732470_100009815986 [0,1,0,1,0,0|1,0,0]=3 20201 B16R1.16747 COC(=O)CCCCCCSCCC1CO1 62a_100009815986_100000732470 [0,1,0,1,0,0|1,0,0]=3 20202 B16R1.16747 COC(=O)CCCCCOCC#CC1CC1 34a_100000074720_100009895102 [0,1,0,1,0,0|0,0,2]=4 20203 B16R1.16747 COC(=O)CCCCCOCC#CC1CC1 34a_100000083941_100009816466 [0,1,0,1,0,0|0,0,2]=4 20204 B16R1.16747 COC(=O)CCCCCOCC#CC1CC1 7a_100000074720_100009895102 [0,1,0,1,0,0|0,0,2]=4 20205 B16R1.16747 COC(=O)CCCCCOCC#CC1CC1 7a_100000083941_100009816466 [0,1,0,1,0,0|0,0,2]=4 20206 B16R1.16747 COC(=O)CCCCCOCCCC1CO1 34a_100000074720_100000733510 [0,1,0,1,0,0|1,0,0]=3 20207 B16R1.16747 COC(=O)CCCCCOCCCC1CO1 7a_100000074720_100000733510 [0,1,0,1,0,0|1,0,0]=3 20208 B16R1.16747 COC(=O)CCCCCOCCNC1CC1 34a_100000738766_100009816466 [0,1,0,1,0,0|1,0,0]=3 20209 B16R1.16747 COC(=O)CCCCCSCC#CC1CC1 62a_100009816466_100009895102 [0,1,0,1,0,0|0,0,2]=4 20210 B16R1.16747 COC(=O)CCCCCSCC#CC1CC1 62a_100009895102_100009816466 [0,1,0,1,0,0|0,0,2]=4 20211 B16R1.16747 COC(=O)CCCCCSCCCC1CO1 62a_100000733510_100009816466 [0,1,0,1,0,0|1,0,0]=3 20212 B16R1.16747 COC(=O)CCCCCSCCCC1CO1 62a_100009816466_100000733510 [0,1,0,1,0,0|1,0,0]=3 20213 B16R1.16747 COC(=O)CCOCCCCOCC1CO1 34a_100010889290_100000742370 [0,1,0,1,0,0|2,0,0]=4 20214 B16R1.16747 COC(=O)CCOCCCCOCC1CO1 7a_100010889290_100000204255 [0,1,0,1,0,0|2,0,0]=4 20215 B16R1.16747 COC(=O)CCOCCOCCOC1CC1 34a_100010982084_100000211595 [0,1,0,1,0,0|2,0,0]=4 20216 B16R1.16747 COC(=O)COCCOCCOCC1CC1 34a_100011023656_100000742324 [0,1,0,1,0,0|2,0,0]=4 20217 B16R1.16747 COC(=O)COCCOCCOCC1CC1 7a_100011023656_100000742324 [0,1,0,1,0,0|2,0,0]=4 20218 B16R1.16885 CNC(=O)CCCNCCC1CCCN1C 2230a_100000740002_100000005710 [0,1,0,1,0,0|2,0,0]=4 20219 B16R1.16885 CNC(=O)CCCNCCC1CCCN1C 34a_100000740002_100000005710 [0,1,0,1,0,0|2,0,0]=4 20220 B16R1.16885 CNC(=O)CCCOCCC1CCCN1C 34a_100011215177_100000741757 [0,1,0,1,0,0|2,0,0]=4 20221 B16R1.16885 CNC(=O)CCCOCCC1CCCN1C 7a_100011215177_100000741757 [0,1,0,1,0,0|2,0,0]=4 20222 B16R1.16885 CNC(=O)CCCSCCC1CCCN1C 62a_100000005710_100000741757 [0,1,0,1,0,0|2,0,0]=4 20223 B16R1.16885 CNC(=O)CCCSCCC1CCCN1C 62a_100000741757_100000005710 [0,1,0,1,0,0|2,0,0]=4 20224 B16R1.16885 COC(=O)CCCCCCN1CCC[C@@H]1C 2230a_100020605311_100009815986 [0,1,0,1,0,0|0,0,0]=2 20225 B16R1.16885 COC(=O)CCCCCCN1CCC[C@@H]1C 269982a_100020605311_100009815986 [0,1,0,1,0,0|0,0,0]=2 20226 B16R1.16885 COC(=O)CCCCCCN1CCC[C@H]1C 2230a_100015189458_100009815986 [0,1,0,1,0,0|0,0,0]=2 20227 B16R1.16885 COC(=O)CCCCCCN1CCC[C@H]1C 269982a_100015189458_100009815986 [0,1,0,1,0,0|0,0,0]=2 20228 B16R1.16885 COC(=O)CCCCCCN1CCC[C@H]1C 34a_100015189458_100009815986 [0,1,0,1,0,0|0,0,0]=2 20229 B16R1.16885 COC(=O)CCCCCCN1CCSC1C 2230a_200011216479_100009815986 [0,1,0,1,0,0|1,0,0]=3 20230 B16R1.16885 COC(=O)CCCCCCN1CCSC1C 269982a_200011216479_100009815986 [0,1,0,1,0,0|1,0,0]=3 20231 B16R1.16885 COC(=O)CCCCCCN1CCSC1C 34a_200011216479_100009815986 [0,1,0,1,0,0|1,0,0]=3 20232 B16R1.16885 COC(=O)CCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100009816466 [0,1,0,1,0,0|2,0,0]=4 20233 B16R1.16885 COC(=O)CCCCCOC1CCCC1=O 34a_100000074720_100000709159 [0,1,0,1,0,0|1,0,1]=4 20234 B16R1.16885 COC(=O)CCCCCOC1CCCC1=O 34a_200000719330_100009816466 [0,1,0,1,0,0|1,0,1]=4 20235 B16R1.16885 COC(=O)CCCCCOC1CCCC1=O 7a_100000074720_100000211823 [0,1,0,1,0,0|1,0,1]=4 20236 B16R1.16885 COC(=O)CCCCCOC1CCCC1C 34a_100011216460_100009816466 [0,1,0,1,0,0|0,0,0]=2 20237 B16R1.16885 COC(=O)CCCCCOC1CCCC1C 7a_100011216460_100009816466 [0,1,0,1,0,0|0,0,0]=2 20238 B16R1.16885 COC(=O)CCCCCOC1COCC1O 34a_100000074720_200000725654 [0,1,0,1,0,0|2,0,0]=4 20239 B16R1.16885 COC(=O)CCCCCOC1COCC1O 7a_100000074720_200000725654 [0,1,0,1,0,0|2,0,0]=4 20240 B16R1.16885 COC(=O)CCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009816466 [0,1,0,1,0,0|1,0,0]=3 20241 B16R1.16885 COC(=O)CCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009816466 [0,1,0,1,0,0|1,0,0]=3 20242 B16R1.16885 COC(=O)CCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009816466 [0,1,0,1,0,0|1,0,0]=3 20243 B16R1.16885 COC(=O)CCCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100009816466 [0,1,0,1,0,0|2,0,0]=4 20244 B16R1.16885 COC(=O)CCCCCSC1CCCC1=O 62a_100000211823_100009816466 [0,1,0,1,0,0|1,0,1]=4 20245 B16R1.16885 COC(=O)CCCCCSC1CCCC1=O 62a_100009816466_100000211823 [0,1,0,1,0,0|1,0,1]=4 20246 B16R1.16885 COC(=O)CCCCCSC1COCC1O 62a_100009816466_200000725654 [0,1,0,1,0,0|2,0,0]=4 20247 B16R1.16885 COC(=O)CCCCCSC1COCC1O 62a_200000725654_100009816466 [0,1,0,1,0,0|2,0,0]=4 20248 B16R1.16885 COC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_100009816466_200016002552 [0,1,0,1,0,0|1,0,0]=3 20249 B16R1.16885 COC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009816466 [0,1,0,1,0,0|1,0,0]=3 20250 B16R1.16885 COC(=O)CCCCOCC1CCCN1C 34a_100000743107_100000204269 [0,1,0,1,0,0|1,0,0]=3 20251 B16R1.16885 COC(=O)CCCOCCC1CCCN1C 34a_100011215177_100000742333 [0,1,0,1,0,0|1,0,0]=3 20252 B16R1.16885 COC(=O)CCCOCCC1CCCN1C 7a_100011215177_100011218270 [0,1,0,1,0,0|1,0,0]=3 20253 B16R1.16885 COC(=O)CCCSCCC1CCCN1C 62a_100000005710_100011218270 [0,1,0,1,0,0|1,0,0]=3 20254 B16R1.16885 COC(=O)CCCSCCC1CCCN1C 62a_100011218270_100000005710 [0,1,0,1,0,0|1,0,0]=3 20255 B16R1.16885 COC(=O)COCCOCC1CCCN1C 34a_100000743107_100000090808 [0,1,0,1,0,0|2,0,0]=4 20256 B16R1.16885 COC(=O)NCCOCCC1CCCN1C 34a_100000757965_100000005710 [0,1,0,1,0,0|2,0,0]=4 20257 B16R1.16885 COC(=O)OCCOCCC1CCCN1C 34a_100010262106_100000005710 [0,1,0,1,0,0|2,0,0]=4 20258 B16R1.16890 COC(=O)CCCCCCCN1CCC1C 269982a_100000755817_100010004213 [0,1,0,1,0,0|0,0,0]=2 20259 B16R1.16890 COC(=O)CCCCCCCN1CCC1C 34a_100000755817_100010004213 [0,1,0,1,0,0|0,0,0]=2 20260 B16R1.16890 COC(=O)CCCCCCOC1CCC1=O 34a_100009863599_100009892977 [0,1,0,1,0,0|1,0,1]=4 20261 B16R1.16890 COC(=O)CCCCCCOC1CCC1=O 7a_100009863599_100009892977 [0,1,0,1,0,0|1,0,1]=4 20262 B16R1.16890 COC(=O)CCCCCCSC1CCC1=O 62a_100009815986_100009892977 [0,1,0,1,0,0|1,0,1]=4 20263 B16R1.16890 COC(=O)CCCCCCSC1CCC1=O 62a_100009892977_100009815986 [0,1,0,1,0,0|1,0,1]=4 20264 B16R1.16890 COC(=O)CCCCOCCC1CCC1=O 7a_100000059025_200016118888 [0,1,0,1,0,0|1,0,1]=4 20265 B16R1.16890 COC(=O)CCCCSCCC1CCC1=O 62a_100000204269_200016118888 [0,1,0,1,0,0|1,0,1]=4 20266 B16R1.16890 COC(=O)CCCCSCCC1CCC1=O 62a_200016118888_100000204269 [0,1,0,1,0,0|1,0,1]=4 20267 B16R1.16924 CCC(=O)COCCCN1CCCCCC1 7a_100102886287_100000747405 [0,1,0,1,0,0|2,0,0]=4 20268 B16R1.16924 CCC(=O)NCCCCN1CCCCCC1 1626a_100011207362_100000210414 [0,1,0,1,0,0|2,0,0]=4 20269 B16R1.16924 CCC(=O)NCCCCN1CCCCCC1 240690a_100011207362_100000210414 [0,1,0,1,0,0|2,0,0]=4 20270 B16R1.16924 CCC(=O)NCCCCN1CCCCCC1 527a_100011207362_100000210414 [0,1,0,1,0,0|2,0,0]=4 20271 B16R1.16924 CCC(=O)NCCNCC1CCCCCC1 269862a_100132302217_200000763224 [0,1,0,1,0,0|2,0,0]=4 20272 B16R1.16924 CCC(=O)NCCNCC1CCCCCC1 34a_100132302217_200000696569 [0,1,0,1,0,0|2,0,0]=4 20273 B16R1.16924 CCC(=O)NCCOCC1CCCCCC1 34a_200000158885_200000696569 [0,1,0,1,0,0|2,0,0]=4 20274 B16R1.16924 CCC(=O)NCCOCC1CCCCCC1 7a_200000158885_200000696569 [0,1,0,1,0,0|2,0,0]=4 20275 B16R1.16924 CCC(=O)OCCOCC1CCCCCC1 7a_200000031056_200000696569 [0,1,0,1,0,0|2,0,0]=4 20276 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 2230a_100000740002_200000696569 [0,1,0,1,0,0|1,0,0]=3 20277 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 2230a_100015204231_100000741757 [0,1,0,1,0,0|1,0,0]=3 20278 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 269862a_100000740002_200000763224 [0,1,0,1,0,0|1,0,0]=3 20279 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 34a_100000740002_200000696569 [0,1,0,1,0,0|1,0,0]=3 20280 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 34a_100015204231_100000741757 [0,1,0,1,0,0|1,0,0]=3 20281 B16R1.16924 CNC(=O)CCCOCC1CCCCCC1 34a_100000699130_100000741757 [0,1,0,1,0,0|1,0,0]=3 20282 B16R1.16924 CNC(=O)CCCOCC1CCCCCC1 7a_100000699130_100000741757 [0,1,0,1,0,0|1,0,0]=3 20283 B16R1.16924 CNC(=O)CCCSCC1CCCCCC1 62a_100000741757_200000696569 [0,1,0,1,0,0|1,0,0]=3 20284 B16R1.16924 CNC(=O)CCCSCC1CCCCCC1 62a_200000696569_100000741757 [0,1,0,1,0,0|1,0,0]=3 20285 B16R1.16924 CNC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000737683 [0,1,0,1,0,0|1,0,0]=3 20286 B16R1.16924 CNC(=O)CCNCCC1CCCCCC1 34a_100011532351_100012179268 [0,1,0,1,0,0|1,0,0]=3 20287 B16R1.16924 CNC(=O)CCOCCN1CCCCCC1 34a_100000238007_100012179268 [0,1,0,1,0,0|2,0,0]=4 20288 B16R1.16924 CNC(=O)CCSCCN1CCCCCC1 62a_100000722644_100000737683 [0,1,0,1,0,0|2,0,0]=4 20289 B16R1.16924 CNC(=O)CCSCCN1CCCCCC1 62a_100000737683_100000722644 [0,1,0,1,0,0|2,0,0]=4 20290 B16R1.16924 CNC(=O)COCCCN1CCCCCC1 34a_100102886287_100000183359 [0,1,0,1,0,0|2,0,0]=4 20291 B16R1.16924 CNC(=O)COCCCN1CCCCCC1 7a_100102886287_100000183359 [0,1,0,1,0,0|2,0,0]=4 20292 B16R1.16924 CNC(=O)NCCCCN1CCCCCC1 2708a_100011207362_106832991635 [0,1,0,1,0,0|2,0,0]=4 20293 B16R1.16924 CNC(=O)NCCCCN1CCCCCC1 2708a_100102657272_100011207362 [0,1,0,1,0,0|2,0,0]=4 20294 B16R1.16924 CNC(=O)NCCCCN1CCCCCC1 273464a_100011207362_100102657272 [0,1,0,1,0,0|2,0,0]=4 20295 B16R1.16924 CNC(=O)NCCCCN1CCCCCC1 273464a_100102657272_100011207362 [0,1,0,1,0,0|2,0,0]=4 20296 B16R1.16924 CNC(=O)NCCCCN1CCCCCC1 512a_106832991638_100011207362 [0,1,0,1,0,0|2,0,0]=4 20297 B16R1.16924 CNC(=O)NCCNCC1CCCCCC1 269862a_100015205895_200000763224 [0,1,0,1,0,0|2,0,0]=4 20298 B16R1.16924 CNC(=O)NCCNCC1CCCCCC1 34a_100015205895_200000696569 [0,1,0,1,0,0|2,0,0]=4 20299 B16R1.16924 CNC(=O)OCCNCC1CCCCCC1 34a_100015204231_200011997002 [0,1,0,1,0,0|2,0,0]=4 20300 B16R1.16924 CNC(=O)OCCOCC1CCCCCC1 34a_100000699130_200011997002 [0,1,0,1,0,0|2,0,0]=4 20301 B16R1.16924 CNC(=O)OCCOCC1CCCCCC1 7a_100000699130_200011997002 [0,1,0,1,0,0|2,0,0]=4 20302 B16R1.16924 CNC(=O)OCCSCC1CCCCCC1 62a_200000696569_200011997002 [0,1,0,1,0,0|2,0,0]=4 20303 B16R1.16924 CNC(=O)OCCSCC1CCCCCC1 62a_200011997002_200000696569 [0,1,0,1,0,0|2,0,0]=4 20304 B16R1.16924 COC(=O)/C=C/CNCC1CCCCCC1 2230a_100015204231_100000742655 [0,1,0,1,0,0|0,0,2]=4 20305 B16R1.16924 COC(=O)/C=C/CNCC1CCCCCC1 34a_100015204231_100000742655 [0,1,0,1,0,0|0,0,2]=4 20306 B16R1.16924 COC(=O)/C=C/COCC1CCCCCC1 34a_100000699130_100000742655 [0,1,0,1,0,0|0,0,2]=4 20307 B16R1.16924 COC(=O)/C=C/COCC1CCCCCC1 7a_100000699130_100000742655 [0,1,0,1,0,0|0,0,2]=4 20308 B16R1.16924 COC(=O)/C=C/CSCC1CCCCCC1 62a_100000742655_200000696569 [0,1,0,1,0,0|0,0,2]=4 20309 B16R1.16924 COC(=O)/C=C/CSCC1CCCCCC1 62a_200000696569_100000742655 [0,1,0,1,0,0|0,0,2]=4 20310 B16R1.16924 COC(=O)CCCCCN1CCCCCC1 2230a_100000185865_100009816466 [0,1,0,1,0,0|0,0,0]=2 20311 B16R1.16924 COC(=O)CCCCCN1CCCCCC1 269982a_100000185865_100009816466 [0,1,0,1,0,0|0,0,0]=2 20312 B16R1.16924 COC(=O)CCCCCN1CCCCCC1 34a_100000185865_100009816466 [0,1,0,1,0,0|0,0,0]=2 20313 B16R1.16924 COC(=O)CCCCCN1CCCOCC1 2230a_100000685342_100009816466 [0,1,0,1,0,0|1,0,0]=3 20314 B16R1.16924 COC(=O)CCCCCN1CCCOCC1 269982a_100000685342_100009816466 [0,1,0,1,0,0|1,0,0]=3 20315 B16R1.16924 COC(=O)CCCCCN1CCCOCC1 34a_100000685342_100009816466 [0,1,0,1,0,0|1,0,0]=3 20316 B16R1.16924 COC(=O)CCCCNC1CCCCCC1 2230a_100000210984_100000204269 [0,1,0,1,0,0|0,0,0]=2 20317 B16R1.16924 COC(=O)CCCCNC1CCCCCC1 34a_100000210984_100000204269 [0,1,0,1,0,0|0,0,0]=2 20318 B16R1.16924 COC(=O)CCCCOC1CCCCCC1 34a_100000059025_100011217769 [0,1,0,1,0,0|0,0,0]=2 20319 B16R1.16924 COC(=O)CCCCOC1CCCCCC1 34a_100000210887_100000204269 [0,1,0,1,0,0|0,0,0]=2 20320 B16R1.16924 COC(=O)CCCCOC1CCCCCC1 7a_100000210887_100000204269 [0,1,0,1,0,0|0,0,0]=2 20321 B16R1.16924 COC(=O)CCCCSC1CCCCCC1 62a_100000204269_100011217769 [0,1,0,1,0,0|0,0,0]=2 20322 B16R1.16924 COC(=O)CCCCSC1CCCCCC1 62a_100011217769_100000204269 [0,1,0,1,0,0|0,0,0]=2 20323 B16R1.16924 COC(=O)CCCNCC1CCCCCC1 2230a_100015204231_100011218270 [0,1,0,1,0,0|0,0,0]=2 20324 B16R1.16924 COC(=O)CCCNCC1CCCCCC1 34a_100015204231_100000742333 [0,1,0,1,0,0|0,0,0]=2 20325 B16R1.16924 COC(=O)CCCOCC1CCCCCC1 34a_100000699130_100000742333 [0,1,0,1,0,0|0,0,0]=2 20326 B16R1.16924 COC(=O)CCCOCC1CCCCCC1 7a_100000699130_100011218270 [0,1,0,1,0,0|0,0,0]=2 20327 B16R1.16924 COC(=O)CCCOCC1CNCCOC1 34a_100103147999_100000742333 [0,1,0,1,0,0|2,0,0]=4 20328 B16R1.16924 COC(=O)CCCSCC1CCCCCC1 62a_100011218270_200000696569 [0,1,0,1,0,0|0,0,0]=2 20329 B16R1.16924 COC(=O)CCCSCC1CCCCCC1 62a_200000696569_100011218270 [0,1,0,1,0,0|0,0,0]=2 20330 B16R1.16924 COC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000204255 [0,1,0,1,0,0|0,0,0]=2 20331 B16R1.16924 COC(=O)CCNCCC1CCCCCC1 34a_100011532351_100000742370 [0,1,0,1,0,0|0,0,0]=2 20332 B16R1.16924 COC(=O)CCOCCN1CCCCCC1 34a_100000238007_100000742370 [0,1,0,1,0,0|1,0,0]=3 20333 B16R1.16924 COC(=O)CCSCCN1CCCCCC1 62a_100000204255_100000722644 [0,1,0,1,0,0|1,0,0]=3 20334 B16R1.16924 COC(=O)CCSCCN1CCCCCC1 62a_100000722644_100000204255 [0,1,0,1,0,0|1,0,0]=3 20335 B16R1.16924 COC(=O)COCCCN1CCCCCC1 34a_100102886287_100000747449 [0,1,0,1,0,0|1,0,0]=3 20336 B16R1.16924 COC(=O)COCCCN1CCCCCC1 7a_100102886287_100000747449 [0,1,0,1,0,0|1,0,0]=3 20337 B16R1.16924 COC(=O)COCCNC1CCCCCC1 2230a_100000210984_100000090808 [0,1,0,1,0,0|1,0,0]=3 20338 B16R1.16924 COC(=O)COCCNC1CCCCCC1 34a_100000210984_100000090808 [0,1,0,1,0,0|1,0,0]=3 20339 B16R1.16924 COC(=O)COCCOC1CCCCCC1 34a_100000210887_100000090808 [0,1,0,1,0,0|1,0,0]=3 20340 B16R1.16924 COC(=O)COCCOC1CCCCCC1 7a_100000210887_100000090808 [0,1,0,1,0,0|1,0,0]=3 20341 B16R1.16924 COC(=O)COCCSC1CCCCCC1 62a_100000090808_100011217769 [0,1,0,1,0,0|1,0,0]=3 20342 B16R1.16924 COC(=O)COCCSC1CCCCCC1 62a_100011217769_100000090808 [0,1,0,1,0,0|1,0,0]=3 20343 B16R1.16924 COC(=O)NCCOCC1CCCCCC1 34a_100000757965_200000696569 [0,1,0,1,0,0|1,0,0]=3 20344 B16R1.16924 COC(=O)OCCOCC1CCCCCC1 34a_100010262106_200000696569 [0,1,0,1,0,0|1,0,0]=3 20345 B16R1.16924 COC(=O)OCSCCN1CCCCCC1 62a_100000722644_100000139417 [0,1,0,1,0,0|2,0,0]=4 20346 B16R1.16924 NNC(=O)CCCOCC1CCCCCC1 34a_100000211488_200000696569 [0,1,0,1,0,0|2,0,0]=4 20347 B16R1.17549 CCCCCCCCCN1CC[C@H](C1)OC 2230a_100000766984_100011214924 [0,1,0,1,0,0|1,0,1]=4 20348 B16R1.17549 CCCCCCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210670 [0,1,0,1,0,0|1,0,1]=4 20349 B16R1.17553 C#CCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100153394163 [0,1,0,1,0,0|0,0,2]=4 20350 B16R1.17553 C=CCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100012355270 [0,1,0,1,0,0|0,0,2]=4 20351 B16R1.17553 CCCCC#CCCCN1CC1C(=O)OC 2230a_200009830135_200000047210 [0,1,0,1,0,0|0,0,2]=4 20352 B16R1.17553 CCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100011214924 [0,1,0,1,0,0|0,0,0]=2 20353 B16R1.17553 COC(=O)C1CN1CCCCCCCCO 2230a_200009830135_100000033203 [0,1,0,1,0,0|1,0,0]=3 20354 B16R1.18261 CCC(=O)NCCNC1CCCCCCC1 270004a_100132302217_100000210524 [0,1,0,1,0,0|2,0,0]=4 20355 B16R1.18261 CNC(=O)CCCNC1CCCCCCC1 2230a_100000211152_100000741757 [0,1,0,1,0,0|1,0,0]=3 20356 B16R1.18261 CNC(=O)CCCNC1CCCCCCC1 270004a_100000740002_100000210524 [0,1,0,1,0,0|1,0,0]=3 20357 B16R1.18261 CNC(=O)CCCNC1CCCCCCC1 34a_100000211152_100000741757 [0,1,0,1,0,0|1,0,0]=3 20358 B16R1.18261 CNC(=O)CCCOC1CCCCCCC1 34a_100000210054_100000741757 [0,1,0,1,0,0|1,0,0]=3 20359 B16R1.18261 CNC(=O)CCCOC1CCCCCCC1 7a_100000210054_100000741757 [0,1,0,1,0,0|1,0,0]=3 20360 B16R1.18261 CNC(=O)CCOCC1CCCCCCC1 34a_100011216312_100012179268 [0,1,0,1,0,0|1,0,0]=3 20361 B16R1.18261 CNC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000737683 [0,1,0,1,0,0|1,0,0]=3 20362 B16R1.18261 CNC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000183359 [0,1,0,1,0,0|1,0,0]=3 20363 B16R1.18261 CNC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000183359 [0,1,0,1,0,0|1,0,0]=3 20364 B16R1.18261 CNC(=O)OCCNC1CCCCCCC1 34a_100000211152_200011997002 [0,1,0,1,0,0|2,0,0]=4 20365 B16R1.18261 CNC(=O)OCCOC1CCCCCCC1 34a_100000210054_200011997002 [0,1,0,1,0,0|2,0,0]=4 20366 B16R1.18261 CNC(=O)OCCOC1CCCCCCC1 7a_100000210054_200011997002 [0,1,0,1,0,0|2,0,0]=4 20367 B16R1.18261 COC(=O)/C=C/CNC1CCCCCCC1 2230a_100000211152_100000742655 [0,1,0,1,0,0|0,0,2]=4 20368 B16R1.18261 COC(=O)/C=C/CNC1CCCCCCC1 34a_100000211152_100000742655 [0,1,0,1,0,0|0,0,2]=4 20369 B16R1.18261 COC(=O)/C=C/COC1CCCCCCC1 34a_100000210054_100000742655 [0,1,0,1,0,0|0,0,2]=4 20370 B16R1.18261 COC(=O)/C=C/COC1CCCCCCC1 7a_100000210054_100000742655 [0,1,0,1,0,0|0,0,2]=4 20371 B16R1.18261 COC(=O)CCCCN1CCCCCCC1 2230a_100000211400_100000204269 [0,1,0,1,0,0|0,0,0]=2 20372 B16R1.18261 COC(=O)CCCCN1CCCCCCC1 269982a_100000211400_100000204269 [0,1,0,1,0,0|0,0,0]=2 20373 B16R1.18261 COC(=O)CCCCN1CCCCCCC1 34a_100000211400_100000204269 [0,1,0,1,0,0|0,0,0]=2 20374 B16R1.18261 COC(=O)CCCNC1CCCCCCC1 2230a_100000211152_100011218270 [0,1,0,1,0,0|0,0,0]=2 20375 B16R1.18261 COC(=O)CCCNC1CCCCCCC1 34a_100000211152_100000742333 [0,1,0,1,0,0|0,0,0]=2 20376 B16R1.18261 COC(=O)CCCOC1C=CCCCCC1 34a_100000688657_100000742333 [0,1,0,1,0,0|0,0,2]=4 20377 B16R1.18261 COC(=O)CCCOC1CC/C=C\CCC1 34a_100016989180_100000742333 [0,1,0,1,0,0|0,0,2]=4 20378 B16R1.18261 COC(=O)CCCOC1CCCCCCC1 34a_100000210054_100000742333 [0,1,0,1,0,0|0,0,0]=2 20379 B16R1.18261 COC(=O)CCCOC1CCCCCCC1 7a_100000210054_100011218270 [0,1,0,1,0,0|0,0,0]=2 20380 B16R1.18261 COC(=O)CCCSC1CC/C=C\CCC1 62a_100011218270_100021000466 [0,1,0,1,0,0|0,0,2]=4 20381 B16R1.18261 COC(=O)CCCSC1CC/C=C\CCC1 62a_100021000466_100011218270 [0,1,0,1,0,0|0,0,2]=4 20382 B16R1.18261 COC(=O)CCNCC1CC/C=C\CCC1 2230a_100102730862_100000204255 [0,1,0,1,0,0|0,0,2]=4 20383 B16R1.18261 COC(=O)CCNCC1CC/C=C\CCC1 34a_100102730862_100000742370 [0,1,0,1,0,0|0,0,2]=4 20384 B16R1.18261 COC(=O)CCOCC1CCCCCCC1 34a_100011216312_100000742370 [0,1,0,1,0,0|0,0,0]=2 20385 B16R1.18261 COC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000204255 [0,1,0,1,0,0|0,0,0]=2 20386 B16R1.18261 COC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000747449 [0,1,0,1,0,0|0,0,0]=2 20387 B16R1.18261 COC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000747449 [0,1,0,1,0,0|0,0,0]=2 20388 B16R1.18261 COC(=O)COCCN1CCCCCCC1 2230a_100000211400_100000090808 [0,1,0,1,0,0|1,0,0]=3 20389 B16R1.18261 COC(=O)COCCN1CCCCCCC1 34a_100000211400_100000090808 [0,1,0,1,0,0|1,0,0]=3 20390 B16R1.18469 CNC(=O)CCCN1CCCCCCCC1 2230a_100000039187_100000741757 [0,1,0,1,0,0|1,0,0]=3 20391 B16R1.18469 CNC(=O)CCCN1CCCCCCCC1 269982a_100000039187_100000741757 [0,1,0,1,0,0|1,0,0]=3 20392 B16R1.18469 CNC(=O)CCCN1CCCCCCCC1 34a_100000039187_100000741757 [0,1,0,1,0,0|1,0,0]=3 20393 B16R1.18469 CNC(=O)CCNC1CCCCCCCC1 270004a_100000738227_100000038600 [0,1,0,1,0,0|1,0,0]=3 20394 B16R1.18469 CNC(=O)OCCN1CCCCCCCC1 269982a_100000039187_200011997002 [0,1,0,1,0,0|2,0,0]=4 20395 B16R1.18469 CNC(=O)OCCN1CCCCCCCC1 34a_100000039187_200011997002 [0,1,0,1,0,0|2,0,0]=4 20396 B16R1.18469 COC(=O)/C=C/CN1CCCCCCCC1 2230a_100000039187_100000742655 [0,1,0,1,0,0|0,0,2]=4 20397 B16R1.18469 COC(=O)/C=C/CN1CCCCCCCC1 269982a_100000039187_100000742655 [0,1,0,1,0,0|0,0,2]=4 20398 B16R1.18469 COC(=O)/C=C/CN1CCCCCCCC1 34a_100000039187_100000742655 [0,1,0,1,0,0|0,0,2]=4 20399 B16R1.18469 COC(=O)CCCN1CCCCCCCC1 2230a_100000039187_100011218270 [0,1,0,1,0,0|0,0,0]=2 20400 B16R1.18469 COC(=O)CCCN1CCCCCCCC1 269982a_100000039187_100011218270 [0,1,0,1,0,0|0,0,0]=2 20401 B16R1.18469 COC(=O)CCCN1CCCCCCCC1 34a_100000039187_100000742333 [0,1,0,1,0,0|0,0,0]=2 20402 B16R1.20277 CCCCCCCCCCNCC1(CO1)C 34a_100000684558_100000760498 [0,1,0,1,0,0|1,0,1]=4 20403 B16R1.20277 CCCCCCCCCCOCC1(CO1)C 34a_100000210711_100000760498 [0,1,0,1,0,0|1,0,1]=4 20404 B16R1.20277 CCCCCCCCCCSCC1(CO1)C 62a_100000760498_100000210320 [0,1,0,1,0,0|1,0,1]=4 20405 B16R1.20336 CCCCCCCCCCN1CC(C1)OC 269982a_100000755009_100000210320 [0,1,0,1,0,0|1,0,1]=4 20406 B16R1.20336 CCCCCCCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100011214924 [0,1,0,1,0,0|1,0,1]=4 20407 B16R1.20496 CCCCCCCCN1CCCC(C1)OC 2230a_100000695604_100000210759 [0,1,0,1,0,0|1,0,1]=4 20408 B16R1.20496 CCCCCCCCN1CCCC(C1)OC 269982a_100000695604_100000210759 [0,1,0,1,0,0|1,0,1]=4 20409 B16R1.20496 CCCCCCCCN1CCCC(C1)OC 34a_100000695604_100000210759 [0,1,0,1,0,0|1,0,1]=4 20410 B16R1.282 CCCCCCN1CCC[C@H]1C(=O)N(C)C 2230a_100020603401_100000210314 [0,1,0,1,0,0|2,0,0]=4 20411 B16R1.282 CCCCCCN1CCC[C@H]1C(=O)N(C)C 34a_100020603401_100000210314 [0,1,0,1,0,0|2,0,0]=4 20412 B16R1.401 CC1CCCCC1NCCCC(=O)N(C)C 2230a_100000211402_100000737642 [0,1,0,1,0,0|2,0,0]=4 20413 B16R1.401 CC1CCCCC1NCCCC(=O)N(C)C 269862a_200000744827_100000210921 [0,1,0,1,0,0|2,0,0]=4 20414 B16R1.401 CC1CCCCC1NCCCC(=O)N(C)C 270004a_200000744827_100000210921 [0,1,0,1,0,0|2,0,0]=4 20415 B16R1.401 CC1CCCCC1OCCCC(=O)N(C)C 7a_100000211207_100000737642 [0,1,0,1,0,0|2,0,0]=4 20416 B16R1.401 CC1CCCCN1CCCCC(=O)N(C)C 269982a_100000211376_100000752486 [0,1,0,1,0,0|2,0,0]=4 20417 B16R1.401 CC1CCCCN1CCCCC(=O)N(C)C 34a_100000211376_100000752486 [0,1,0,1,0,0|2,0,0]=4 20418 B16R1.698 CCCC1CCCCC1NCC(=O)N(C)C 270004a_100015183351_100011218038 [0,1,0,1,0,0|2,0,0]=4 20419 B16R1.698 CCCC1CCCCC1OCC(=O)C(=O)C 34a_100011217265_100011261029 [0,1,0,1,0,0|2,0,0]=4 20420 B16R1.698 CCCC1CCCCC1OCC(=O)C(C)C 34a_100011217265_100000753385 [0,1,0,1,0,0|2,0,0]=4 20421 B16R1.698 CCCC1CCCCC1OCC(=O)C(C)C 7a_100011217265_100000753385 [0,1,0,1,0,0|2,0,0]=4 20422 B16R1.698 CCCC1CCCCC1OCC(=O)N(C)C 34a_100011217265_100000692301 [0,1,0,1,0,0|2,0,0]=4 20423 B16R1.698 CCCC1CCCCC1OCC(=O)N(C)C 7a_100011217265_100000692301 [0,1,0,1,0,0|2,0,0]=4 20424 B16R1.698 CCCC1CCCCN1CCC(=O)N(C)C 2230a_100000701414_100000737620 [0,1,0,1,0,0|2,0,0]=4 20425 B16R1.698 CCCC1CCCCN1CCC(=O)N(C)C 269982a_100000701414_100000737620 [0,1,0,1,0,0|2,0,0]=4 20426 B16R1.1273 CCCCC1CCCC1NCC(=O)N(C)C 270004a_100015183351_100000750825 [0,1,0,1,0,0|2,0,0]=4 20427 B16R1.1355 CCC1CCCC1NCCCC(=O)N(C)C 269862a_200000744827_100000749056 [0,1,0,1,0,0|2,0,0]=4 20428 B16R1.1355 CCC1CCCC1NCCCC(=O)N(C)C 270004a_200000744827_100000749056 [0,1,0,1,0,0|2,0,0]=4 20429 B16R1.1355 CCC1CCCN1CCCCC(=O)N(C)C 269982a_100000754278_100000752486 [0,1,0,1,0,0|2,0,0]=4 20430 B16R1.1355 CCC1CCCN1CCCCC(=O)N(C)C 34a_100000754278_100000752486 [0,1,0,1,0,0|2,0,0]=4 20431 B16R1.3911 CCC1CCCCC1NCCC(=O)N(C)C 269862a_100000738053_100000757040 [0,1,0,1,0,0|2,0,0]=4 20432 B16R1.3911 CCC1CCCCC1NCCC(=O)N(C)C 270004a_100000738053_100000757040 [0,1,0,1,0,0|2,0,0]=4 20433 B16R1.3911 CCC1CCCCC1OCCC(=O)N(C)C 7a_100000210738_100000737620 [0,1,0,1,0,0|2,0,0]=4 20434 B16R1.3911 CCC1CCCCN1CCCC(=O)N(C)C 2230a_100000210034_100000737642 [0,1,0,1,0,0|2,0,0]=4 20435 B16R1.3911 CCC1CCCCN1CCCC(=O)N(C)C 269982a_100000210034_100000737642 [0,1,0,1,0,0|2,0,0]=4 20436 B16R1.4131 CC(=O)C(=O)CNCCCC1CCCCC1 34a_100011211642_100011261029 [0,1,0,1,0,0|2,0,0]=4 20437 B16R1.4131 CC(=O)C(=O)COCCCC1CCCCC1 34a_100000198086_100011261029 [0,1,0,1,0,0|2,0,0]=4 20438 B16R1.4131 CC(=O)C(=O)CSCCCC1CCCCC1 62a_100011261029_100011713725 [0,1,0,1,0,0|2,0,0]=4 20439 B16R1.4131 CC(=O)C(=O)CSCCCC1CCCCC1 62a_100011713725_100011261029 [0,1,0,1,0,0|2,0,0]=4 20440 B16R1.4131 CC(C)C(=O)CCCCCN1CCCCC1 1458a_100012051570_100000210206 [0,1,0,1,0,0|2,0,0]=4 20441 B16R1.4131 CC(C)C(=O)CNCCCC1CCCCC1 2230a_100011211642_100000753385 [0,1,0,1,0,0|2,0,0]=4 20442 B16R1.4131 CC(C)C(=O)CNCCCC1CCCCC1 34a_100011211642_100000753385 [0,1,0,1,0,0|2,0,0]=4 20443 B16R1.4131 CC(C)C(=O)COCCCC1CCCCC1 34a_100000198086_100000753385 [0,1,0,1,0,0|2,0,0]=4 20444 B16R1.4131 CC(C)C(=O)COCCCC1CCCCC1 7a_100000198086_100000753385 [0,1,0,1,0,0|2,0,0]=4 20445 B16R1.4131 CC(C)C(=O)CSCCCC1CCCCC1 62a_100000753385_100011713725 [0,1,0,1,0,0|2,0,0]=4 20446 B16R1.4131 CC(C)C(=O)CSCCCC1CCCCC1 62a_100011713725_100000753385 [0,1,0,1,0,0|2,0,0]=4 20447 B16R1.4131 CN(C)C(=O)CCCCCN1CCCCC1 11a_100102631434_100012051570 [0,1,0,1,0,0|2,0,0]=4 20448 B16R1.4131 CN(C)C(=O)CCCCCN1CCCCC1 240690a_100102631434_100012051570 [0,1,0,1,0,0|2,0,0]=4 20449 B16R1.4131 CN(C)C(=O)CCCCNC1CCCCC1 34a_100000182618_100000752486 [0,1,0,1,0,0|2,0,0]=4 20450 B16R1.4131 CN(C)C(=O)CCCCOC1CCCCC1 34a_100000210231_100000752486 [0,1,0,1,0,0|2,0,0]=4 20451 B16R1.4131 CN(C)C(=O)CCCCOC1CCCCC1 7a_100000210231_100000752486 [0,1,0,1,0,0|2,0,0]=4 20452 B16R1.4131 CN(C)C(=O)CCCCSC1CCCCC1 62a_100000210327_100000752486 [0,1,0,1,0,0|2,0,0]=4 20453 B16R1.4131 CN(C)C(=O)CCCCSC1CCCCC1 62a_100000752486_100000210327 [0,1,0,1,0,0|2,0,0]=4 20454 B16R1.4131 CN(C)C(=O)CCCNCC1CCCCC1 2230a_100000210473_100000737642 [0,1,0,1,0,0|2,0,0]=4 20455 B16R1.4131 CN(C)C(=O)CCCNCC1CCCCC1 2230a_200000744827_100000211423 [0,1,0,1,0,0|2,0,0]=4 20456 B16R1.4131 CN(C)C(=O)CCCNCC1CCCCC1 269862a_200000744827_100000211278 [0,1,0,1,0,0|2,0,0]=4 20457 B16R1.4131 CN(C)C(=O)CCCOCC1CCCCC1 7a_100000212181_100000737642 [0,1,0,1,0,0|2,0,0]=4 20458 B16R1.4131 CN(C)C(=O)CCCSCC1CCCCC1 62a_100000211423_100000737642 [0,1,0,1,0,0|2,0,0]=4 20459 B16R1.4131 CN(C)C(=O)CCCSCC1CCCCC1 62a_100000737642_100000211423 [0,1,0,1,0,0|2,0,0]=4 20460 B16R1.4131 CN(C)C(=O)CCNCCC1CCCCC1 2230a_100000738053_100012355289 [0,1,0,1,0,0|2,0,0]=4 20461 B16R1.4131 CN(C)C(=O)CCNCCC1CCCCC1 2230a_100000738074_100000737620 [0,1,0,1,0,0|2,0,0]=4 20462 B16R1.4131 CN(C)C(=O)CCNCCC1CCCCC1 270004a_100000738053_100011713444 [0,1,0,1,0,0|2,0,0]=4 20463 B16R1.4131 CN(C)C(=O)CCOCCC1CCCCC1 34a_200000747469_100011209188 [0,1,0,1,0,0|2,0,0]=4 20464 B16R1.4131 CN(C)C(=O)CCOCCC1CCCCC1 7a_100011217863_100000737620 [0,1,0,1,0,0|2,0,0]=4 20465 B16R1.4131 CN(C)C(=O)CCSCCC1CCCCC1 62a_100000737620_100012355289 [0,1,0,1,0,0|2,0,0]=4 20466 B16R1.4131 CN(C)C(=O)CCSCCC1CCCCC1 62a_100012355289_100000737620 [0,1,0,1,0,0|2,0,0]=4 20467 B16R1.4131 CN(C)C(=O)CNCCCC1CCCCC1 2230a_100011211642_100000185267 [0,1,0,1,0,0|2,0,0]=4 20468 B16R1.4131 CN(C)C(=O)CNCCCC1CCCCC1 2230a_100015183351_100011713725 [0,1,0,1,0,0|2,0,0]=4 20469 B16R1.4131 CN(C)C(=O)CNCCCC1CCCCC1 34a_100011211642_100000692301 [0,1,0,1,0,0|2,0,0]=4 20470 B16R1.4131 CN(C)C(=O)COCCCC1CCCCC1 34a_100000198086_100000692301 [0,1,0,1,0,0|2,0,0]=4 20471 B16R1.4131 CN(C)C(=O)COCCCC1CCCCC1 7a_100000198086_100000692301 [0,1,0,1,0,0|2,0,0]=4 20472 B16R1.4131 CN(C)C(=O)CSCCCC1CCCCC1 62a_100000692301_100011713725 [0,1,0,1,0,0|2,0,0]=4 20473 B16R1.4131 CN(C)C(=O)CSCCCC1CCCCC1 62a_100011713725_100000692301 [0,1,0,1,0,0|2,0,0]=4 20474 B16R1.4136 CN(C)C(=O)CCCCNCC1CCCC1 34a_100000737975_100000752486 [0,1,0,1,0,0|2,0,0]=4 20475 B16R1.4136 CN(C)C(=O)CCCCOCC1CCCC1 34a_100000742336_100000752486 [0,1,0,1,0,0|2,0,0]=4 20476 B16R1.4136 CN(C)C(=O)CCCCOCC1CCCC1 7a_100000742336_100000752486 [0,1,0,1,0,0|2,0,0]=4 20477 B16R1.4136 CN(C)C(=O)CCCCSCC1CCCC1 62a_100000740388_100000752486 [0,1,0,1,0,0|2,0,0]=4 20478 B16R1.4136 CN(C)C(=O)CCCCSCC1CCCC1 62a_100000752486_100000740388 [0,1,0,1,0,0|2,0,0]=4 20479 B16R1.4136 CN(C)C(=O)CCCNCCC1CCCC1 2230a_100000739158_100000737642 [0,1,0,1,0,0|2,0,0]=4 20480 B16R1.4136 CN(C)C(=O)CCCNCCC1CCCC1 2230a_200000744827_100000760354 [0,1,0,1,0,0|2,0,0]=4 20481 B16R1.4136 CN(C)C(=O)CCCOCCC1CCCC1 7a_100000749090_100000737642 [0,1,0,1,0,0|2,0,0]=4 20482 B16R1.4136 CN(C)C(=O)CCCSCCC1CCCC1 62a_100000737642_100000760354 [0,1,0,1,0,0|2,0,0]=4 20483 B16R1.4136 CN(C)C(=O)CCCSCCC1CCCC1 62a_100000760354_100000737642 [0,1,0,1,0,0|2,0,0]=4 20484 B16R1.4136 CN(C)C(=O)CCNCCCC1CCCC1 2230a_100000736752_100000737620 [0,1,0,1,0,0|2,0,0]=4 20485 B16R1.4136 CN(C)C(=O)CCNCCCC1CCCC1 2230a_100000738053_100011713738 [0,1,0,1,0,0|2,0,0]=4 20486 B16R1.4136 CN(C)C(=O)CCOCCCC1CCCC1 34a_200000747469_100011713738 [0,1,0,1,0,0|2,0,0]=4 20487 B16R1.4136 CN(C)C(=O)CCOCCCC1CCCC1 7a_100011215328_100000737620 [0,1,0,1,0,0|2,0,0]=4 20488 B16R1.4136 CN(C)C(=O)CCSCCCC1CCCC1 62a_100000737620_100011713738 [0,1,0,1,0,0|2,0,0]=4 20489 B16R1.4136 CN(C)C(=O)CCSCCCC1CCCC1 62a_100011713738_100000737620 [0,1,0,1,0,0|2,0,0]=4 20490 B16R1.4696 CCCCCCCCNC1CC(=O)N(C1)C 2230a_100000748898_100000210759 [0,1,0,1,0,0|2,0,0]=4 20491 B16R1.4696 CCCCCCCCNC1CC(=O)N(C1)C 34a_100000748898_100000210759 [0,1,0,1,0,0|2,0,0]=4 20492 B16R1.4696 CCCCCCCOCC1CC(=O)N(C1)C 34a_100015185614_100000210614 [0,1,0,1,0,0|2,0,0]=4 20493 B16R1.6696 CCCC1CCCC1NCCC(=O)N(C)C 269862a_100000738053_100000723119 [0,1,0,1,0,0|2,0,0]=4 20494 B16R1.6696 CCCC1CCCC1NCCC(=O)N(C)C 270004a_100000738053_100000723119 [0,1,0,1,0,0|2,0,0]=4 20495 B16R1.8784 CC1CCCC1OCCCCC(=O)N(C)C 34a_100011216460_100000752486 [0,1,0,1,0,0|2,0,0]=4 20496 B16R1.8784 CC1CCCC1OCCCCC(=O)N(C)C 7a_100011216460_100000752486 [0,1,0,1,0,0|2,0,0]=4 20497 B16R1.20497 CCCCCCCNC1CCC(=O)N(C1)C 2230a_100011935005_100000210681 [0,1,0,1,0,0|2,0,0]=4 20498 B16R1.20497 CCCCCCCNC1CCC(=O)N(C1)C 34a_100011935005_100000210614 [0,1,0,1,0,0|2,0,0]=4 20499 B16R1.20656 C=CCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100009814027 [0,1,0,1,0,0|0,0,2]=4 20500 B16R1.20656 CCCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100011215454 [0,1,0,1,0,0|1,0,0]=3 20501 B16R1.20656 CCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100011215454 [0,1,0,1,0,0|0,0,0]=2 20502 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 11a_100000684558_100000210395 [0,1,0,1,0,0|2,0,0]=4 20503 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 1626a_100000684558_100000210395 [0,1,0,1,0,0|2,0,0]=4 20504 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 240690a_100000684558_100000210395 [0,1,0,1,0,0|2,0,0]=4 20505 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 527a_100000684558_100000210395 [0,1,0,1,0,0|2,0,0]=4 20506 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 11a_100000684558_100000701028 [0,1,0,1,0,0|1,0,0]=3 20507 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 1626a_100000684558_100000701028 [0,1,0,1,0,0|1,0,0]=3 20508 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 240690a_100000684558_100000701028 [0,1,0,1,0,0|1,0,0]=3 20509 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 527a_100000684558_100000701028 [0,1,0,1,0,0|1,0,0]=3 20510 B16R1.20656 CCCCCCCCCNCC(=O)C1CC1 2230a_100000212291_100000746382 [0,1,0,1,0,0|2,0,0]=4 20511 B16R1.20656 CCCCCCCCCNCC(=O)C1CC1 34a_100000212291_100000746382 [0,1,0,1,0,0|2,0,0]=4 20512 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 34a_100000210712_100000746382 [0,1,0,1,0,0|2,0,0]=4 20513 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 34a_100000686663_100011214924 [0,1,0,1,0,0|2,0,0]=4 20514 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 7a_100000210712_100000746382 [0,1,0,1,0,0|2,0,0]=4 20515 B16R1.20656 CCCCCCCCCSCC(=O)C1CC1 62a_100000746382_100000210670 [0,1,0,1,0,0|2,0,0]=4 20516 B16R1.20656 O=C(CCCCCCCCCCO)C1CC1 1458a_100000210395_100009813290 [0,1,0,1,0,0|2,0,0]=4 20517 B16R1.20656 O=C(CCCCCCCCCCO)C1CO1 1458a_100000701028_100009813290 [0,1,0,1,0,0|1,0,0]=3 20518 B16R1.20656 O=C(NCCCCCCCCCO)C1CO1 240690a_100000078944_100000701028 [0,1,0,1,0,0|2,0,0]=4 20519 B16R1.24424 C=C(C)C(=O)NCCC1CCCCCCC1 11a_100011532352_100000185857 [0,1,0,1,0,0|2,0,0]=4 20520 B16R1.24424 C=C(C)C(=O)NCCC1CCCCCCC1 1626a_100011532352_100000185857 [0,1,0,1,0,0|2,0,0]=4 20521 B16R1.24424 CC(=O)C(=O)COCC1CCCCCCC1 34a_100011216312_100011261029 [0,1,0,1,0,0|2,0,0]=4 20522 B16R1.24424 CC(C)C(=O)COCC1CCCCCCC1 34a_100011216312_100000753385 [0,1,0,1,0,0|2,0,0]=4 20523 B16R1.24424 CC(C)C(=O)COCC1CCCCCCC1 7a_100011216312_100000753385 [0,1,0,1,0,0|2,0,0]=4 20524 B16R1.24424 CC(C)C(=O)NCCC1CCCCCCC1 11a_100011532352_100000210198 [0,1,0,1,0,0|2,0,0]=4 20525 B16R1.24424 CC(C)C(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210198 [0,1,0,1,0,0|2,0,0]=4 20526 B16R1.24424 CC(C)C(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210198 [0,1,0,1,0,0|2,0,0]=4 20527 B16R1.24424 CC(C)C(=O)NCCC1CCCCCCC1 527a_100011532352_100000210198 [0,1,0,1,0,0|2,0,0]=4 20528 B16R1.24424 CC(F)C(=O)NCCC1CCCCCCC1 11a_100011532352_100000062450 [0,1,0,1,0,0|2,0,0]=4 20529 B16R1.24424 CC(F)C(=O)NCCC1CCCCCCC1 1626a_100011532352_100000062450 [0,1,0,1,0,0|2,0,0]=4 20530 B16R1.24424 CC(F)C(=O)NCCC1CCCCCCC1 240690a_100011532352_100000062450 [0,1,0,1,0,0|2,0,0]=4 20531 B16R1.24424 CC(F)C(=O)NCCC1CCCCCCC1 527a_100011532352_100000062450 [0,1,0,1,0,0|2,0,0]=4 20532 B16R1.24424 CN(C)C(=O)CCCN1CCCCCCC1 2230a_100000211400_100000737642 [0,1,0,1,0,0|2,0,0]=4 20533 B16R1.24424 CN(C)C(=O)CCCN1CCCCCCC1 269982a_100000211400_100000737642 [0,1,0,1,0,0|2,0,0]=4 20534 B16R1.24424 CN(C)C(=O)CCNC1CCCCCCC1 2230a_100000211152_100000737620 [0,1,0,1,0,0|2,0,0]=4 20535 B16R1.24424 CN(C)C(=O)CCNC1CCCCCCC1 270004a_100000738053_100000210524 [0,1,0,1,0,0|2,0,0]=4 20536 B16R1.24424 CN(C)C(=O)CCOC1CCCCCCC1 7a_100000210054_100000737620 [0,1,0,1,0,0|2,0,0]=4 20537 B16R1.24424 CN(C)C(=O)COCC1CCCCCCC1 34a_100011216312_100000692301 [0,1,0,1,0,0|2,0,0]=4 20538 B16R1.24424 CN(C)C(=O)COCC1CCCCCCC1 7a_100011216312_100000692301 [0,1,0,1,0,0|2,0,0]=4 20539 B16R1.24424 CN(C)C(=O)NCCC1CCCCCCC1 2708a_100011532352_100102631434 [0,1,0,1,0,0|2,0,0]=4 20540 B16R1.24424 C[C@@H](O)C(=O)NCCC1CCCCCCC1 240690a_100011532352_100000717761 [0,1,0,1,0,0|2,0,0]=4 20541 B16R1.24424 C[C@H](O)C(=O)NCCC1CCCCCCC1 1626a_100011532352_217856618621 [0,1,0,1,0,0|2,0,0]=4 20542 B16R1.24424 C[C@H](O)C(=O)NCCC1CCCCCCC1 240690a_100011532352_217856618621 [0,1,0,1,0,0|2,0,0]=4 20543 B16R1.24490 CN(C)C(=O)CCN1CCCCCCCC1 2230a_100000039187_100000737620 [0,1,0,1,0,0|2,0,0]=4 20544 B16R1.24490 CN(C)C(=O)CCN1CCCCCCCC1 269982a_100000039187_100000737620 [0,1,0,1,0,0|2,0,0]=4 20545 B16R1.24490 CN(C)C(=O)CNC1CCCCCCCC1 270004a_100015183351_100000038600 [0,1,0,1,0,0|2,0,0]=4 20546 B16R1.58988 CC(=O)C(=O)CNCCC1CCCCCC1 34a_100011532351_100011261029 [0,1,0,1,0,0|2,0,0]=4 20547 B16R1.58988 CC(C)C(=O)CNCCC1CCCCCC1 2230a_100011532351_100000753385 [0,1,0,1,0,0|2,0,0]=4 20548 B16R1.58988 CC(C)C(=O)CNCCC1CCCCCC1 34a_100011532351_100000753385 [0,1,0,1,0,0|2,0,0]=4 20549 B16R1.58988 CN(C)C(=O)CCCCN1CCCCCC1 269982a_100000185865_100000752486 [0,1,0,1,0,0|2,0,0]=4 20550 B16R1.58988 CN(C)C(=O)CCCCN1CCCCCC1 34a_100000185865_100000752486 [0,1,0,1,0,0|2,0,0]=4 20551 B16R1.58988 CN(C)C(=O)CCCNC1CCCCCC1 2230a_100000210984_100000737642 [0,1,0,1,0,0|2,0,0]=4 20552 B16R1.58988 CN(C)C(=O)CCCNC1CCCCCC1 270004a_200000744827_100000210131 [0,1,0,1,0,0|2,0,0]=4 20553 B16R1.58988 CN(C)C(=O)CCCOC1CCCCCC1 7a_100000210887_100000737642 [0,1,0,1,0,0|2,0,0]=4 20554 B16R1.58988 CN(C)C(=O)CCCSC1CCCCCC1 62a_100000737642_100011217769 [0,1,0,1,0,0|2,0,0]=4 20555 B16R1.58988 CN(C)C(=O)CCCSC1CCCCCC1 62a_100011217769_100000737642 [0,1,0,1,0,0|2,0,0]=4 20556 B16R1.58988 CN(C)C(=O)CCNCC1CCCCCC1 2230a_100000738053_200000696569 [0,1,0,1,0,0|2,0,0]=4 20557 B16R1.58988 CN(C)C(=O)CCNCC1CCCCCC1 2230a_100015204231_100000737620 [0,1,0,1,0,0|2,0,0]=4 20558 B16R1.58988 CN(C)C(=O)CCNCC1CCCCCC1 269862a_100000738053_200000763224 [0,1,0,1,0,0|2,0,0]=4 20559 B16R1.58988 CN(C)C(=O)CCOCC1CCCCCC1 34a_200000747469_200000696569 [0,1,0,1,0,0|2,0,0]=4 20560 B16R1.58988 CN(C)C(=O)CCOCC1CCCCCC1 7a_100000699130_100000737620 [0,1,0,1,0,0|2,0,0]=4 20561 B16R1.58988 CN(C)C(=O)CCSCC1CCCCCC1 62a_100000737620_200000696569 [0,1,0,1,0,0|2,0,0]=4 20562 B16R1.58988 CN(C)C(=O)CCSCC1CCCCCC1 62a_200000696569_100000737620 [0,1,0,1,0,0|2,0,0]=4 20563 B16R1.58988 CN(C)C(=O)CNCCC1CCCCCC1 2230a_100011532351_100000185267 [0,1,0,1,0,0|2,0,0]=4 20564 B16R1.58988 CN(C)C(=O)CNCCC1CCCCCC1 34a_100011532351_100000692301 [0,1,0,1,0,0|2,0,0]=4 20565 B16R1.91 CCCCCCCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210614 [0,1,0,1,0,0|1,0,1]=4 20566 B16R1.692 CCCCCCCC(=O)CC1COC(=O)O1 1458a_100000211969_100000073702 [0,1,0,1,0,0|1,0,1]=4 20567 B16R1.692 CCCCCCCC(=O)C[C@H]1COC(=O)N1 1458a_100000211969_100015307671 [0,1,0,1,0,0|1,0,1]=4 20568 B16R1.692 CCCCCCCC(C)NC1CNC(=O)C1 2230a_100000697751_200011218727 [0,1,0,1,0,0|2,0,0]=4 20569 B16R1.692 CCCCCCCC(C)OC1CCC(=O)C1 34a_100012614533_200011218727 [0,1,0,1,0,0|2,0,0]=4 20570 B16R1.692 CCCCCCCC(C)OC1CNC(=O)C1 34a_100000690082_200011218727 [0,1,0,1,0,0|2,0,0]=4 20571 B16R1.692 CCCCCCCC(C)OC1COC(=O)O1 34a_200011215852_100000032252 [0,1,0,1,0,0|2,0,0]=4 20572 B16R1.692 CCCCCCCC(C)SC1COC(=O)O1 62a_200011218727_100000032252 [0,1,0,1,0,0|2,0,0]=4 20573 B16R1.692 CCCCCCCN(C)CC1COC(=O)O1 269982a_100000228206_100000073702 [0,1,0,1,0,0|2,0,0]=4 20574 B16R1.692 CCCCCCCN(C)C[C@H]1COC(=O)N1 2230a_100000228206_100015307671 [0,1,0,1,0,0|2,0,0]=4 20575 B16R1.692 CCCCCCCN(C)C[C@H]1COC(=O)N1 269982a_100000228206_100015307671 [0,1,0,1,0,0|2,0,0]=4 20576 B16R1.1163 CNC(=O)CCCC(=O)CCC1CCCC1 1458a_100000211120_100000741757 [0,1,0,1,0,0|1,0,1]=4 20577 B16R1.1163 COC(=O)CCCC(=O)CCC1CCCC1 1458a_100000211120_100011218270 [0,1,0,1,0,0|0,0,1]=3 20578 B16R1.1163 COC(=O)CCCC(=O)CCC1CCCC1 1458a_100000239890_100000760354 [0,1,0,1,0,0|0,0,1]=3 20579 B16R1.1163 COC(=O)CCCC(=O)CCC1CCCO1 1458a_100011247709_100011218270 [0,1,0,1,0,0|1,0,1]=4 20580 B16R1.1163 COC(=O)CCCC(=O)CCN1CCCC1 1458a_100000239890_100000004467 [0,1,0,1,0,0|1,0,1]=4 20581 B16R1.1163 COC(=O)CCCC(=O)CCN1CCCC1 1458a_100000738983_100011218270 [0,1,0,1,0,0|1,0,1]=4 20582 B16R1.1163 COC(=O)CCCC(=O)COC1CCCC1 1458a_100000741352_100011218270 [0,1,0,1,0,0|1,0,1]=4 20583 B16R1.1163 COC(=O)CCCC(=O)NCC1CCCC1 11a_100000737975_100000239890 [0,1,0,1,0,0|1,0,1]=4 20584 B16R1.1163 COC(=O)CCCC(=O)NCC1CCCC1 1626a_100000737975_100000239890 [0,1,0,1,0,0|1,0,1]=4 20585 B16R1.1163 COC(=O)CCCC(=O)NCC1CCCC1 240690a_100000737975_100000239890 [0,1,0,1,0,0|1,0,1]=4 20586 B16R1.1163 COC(=O)CCCC(=O)NCC1CCCC1 527a_100000737975_100000239890 [0,1,0,1,0,0|1,0,1]=4 20587 B16R1.1163 COC(=O)CCCN(C)CCC1CCCC1 269982a_100000739225_100000760354 [0,1,0,1,0,0|1,0,0]=3 20588 B16R1.1163 COC(=O)CCCN(C)CCN1CCCC1 2230a_100000225677_100011218270 [0,1,0,1,0,0|2,0,0]=4 20589 B16R1.1163 COC(=O)CCCN(C)CCN1CCCC1 269982a_100000225677_100011218270 [0,1,0,1,0,0|2,0,0]=4 20590 B16R1.1163 COC(=O)CCCN(C)CCN1CCCC1 269982a_100000739225_100000004467 [0,1,0,1,0,0|2,0,0]=4 20591 B16R1.1163 COC(=O)CCNC(=O)CCC1CCCC1 188690a_100000683876_100000211120 [0,1,0,1,0,0|1,0,1]=4 20592 B16R1.1163 COC(=O)CSCC(=O)CCC1CCCC1 1458a_100000191316_100000760354 [0,1,0,1,0,0|1,0,1]=4 20593 B16R1.1329 CNC(=O)CCCC(=O)CC1CCCCC1 1458a_100000211666_100000741757 [0,1,0,1,0,0|1,0,1]=4 20594 B16R1.1329 CNC(=O)CCCN(C)CC1CCCCC1 2230a_100000736448_100000741757 [0,1,0,1,0,0|2,0,0]=4 20595 B16R1.1329 CNC(=O)CCCN(C)CC1CCCCC1 269982a_100000736448_100000741757 [0,1,0,1,0,0|2,0,0]=4 20596 B16R1.1329 CNC(=O)CCCN(C)CC1CCCCC1 34a_100000736448_100000741757 [0,1,0,1,0,0|2,0,0]=4 20597 B16R1.1329 CNC(=O)CCNC(C)CC1CCCCC1 270004a_100000738227_100011215996 [0,1,0,1,0,0|2,0,0]=4 20598 B16R1.1329 CNC(=O)COC[C@@H](N)CC1CCCCC1 34a_100015184289_100000183359 [0,1,0,1,0,0|2,0,0]=4 20599 B16R1.1329 COC(=O)CCCC(=O)CC1CCCCC1 1458a_100000211666_100011218270 [0,1,0,1,0,0|0,0,1]=3 20600 B16R1.1329 COC(=O)CCCC(=O)CC1CCCCC1 1458a_100000239890_100000211423 [0,1,0,1,0,0|0,0,1]=3 20601 B16R1.1329 COC(=O)CCCC(=O)CC1CCCCO1 1458a_100000238585_100011218270 [0,1,0,1,0,0|1,0,1]=4 20602 B16R1.1329 COC(=O)CCCC(=O)CC1CCCCO1 1458a_100000239890_100000211543 [0,1,0,1,0,0|1,0,1]=4 20603 B16R1.1329 COC(=O)CCCC(=O)CC1CCCOC1 1458a_100000239890_100000741521 [0,1,0,1,0,0|1,0,1]=4 20604 B16R1.1329 COC(=O)CCCC(=O)CC1CCCOC1 1458a_100000741523_100011218270 [0,1,0,1,0,0|1,0,1]=4 20605 B16R1.1329 COC(=O)CCCC(=O)CC1CCOCC1 1458a_100000239890_100000754603 [0,1,0,1,0,0|1,0,1]=4 20606 B16R1.1329 COC(=O)CCCC(=O)CC1CCOCC1 1458a_100000757261_100011218270 [0,1,0,1,0,0|1,0,1]=4 20607 B16R1.1329 COC(=O)CCCC(=O)CN1CCCCC1 1458a_100000740322_100011218270 [0,1,0,1,0,0|1,0,1]=4 20608 B16R1.1329 COC(=O)CCCC(=O)NC1CCCCC1 11a_100000182618_100000239890 [0,1,0,1,0,0|1,0,1]=4 20609 B16R1.1329 COC(=O)CCCC(=O)NC1CCCCC1 1626a_100000182618_100000239890 [0,1,0,1,0,0|1,0,1]=4 20610 B16R1.1329 COC(=O)CCCC(=O)NC1CCCCC1 240690a_100000182618_100000239890 [0,1,0,1,0,0|1,0,1]=4 20611 B16R1.1329 COC(=O)CCCC(=O)NC1CCCCC1 527a_100000182618_100000239890 [0,1,0,1,0,0|1,0,1]=4 20612 B16R1.1329 COC(=O)CCCN(C)CC1CCCCC1 2230a_100000736448_100011218270 [0,1,0,1,0,0|1,0,0]=3 20613 B16R1.1329 COC(=O)CCCN(C)CC1CCCCC1 269982a_100000736448_100011218270 [0,1,0,1,0,0|1,0,0]=3 20614 B16R1.1329 COC(=O)CCCN(C)CC1CCCCC1 269982a_100000739225_100000211423 [0,1,0,1,0,0|1,0,0]=3 20615 B16R1.1329 COC(=O)CCCN(C)CC1CCCCC1 34a_100000736448_100000742333 [0,1,0,1,0,0|1,0,0]=3 20616 B16R1.1329 COC(=O)CCCN(C)CC1CCCCO1 2230a_100000225654_100011218270 [0,1,0,1,0,0|2,0,0]=4 20617 B16R1.1329 COC(=O)CCCN(C)CC1CCCCO1 269982a_100000225654_100011218270 [0,1,0,1,0,0|2,0,0]=4 20618 B16R1.1329 COC(=O)CCCN(C)CC1CCCCO1 269982a_100000739225_100000211543 [0,1,0,1,0,0|2,0,0]=4 20619 B16R1.1329 COC(=O)CCCN(C)CC1CCCCO1 34a_100000225654_100000742333 [0,1,0,1,0,0|2,0,0]=4 20620 B16R1.1329 COC(=O)CCCN(C)CC1CCCOC1 269982a_100000739225_100000741521 [0,1,0,1,0,0|2,0,0]=4 20621 B16R1.1329 COC(=O)CCCN(C)CC1CCOCC1 2230a_100025706683_100011218270 [0,1,0,1,0,0|2,0,0]=4 20622 B16R1.1329 COC(=O)CCCN(C)CC1CCOCC1 269982a_100000739225_100000754603 [0,1,0,1,0,0|2,0,0]=4 20623 B16R1.1329 COC(=O)CCCN(C)CC1CCOCC1 269982a_100025706683_100011218270 [0,1,0,1,0,0|2,0,0]=4 20624 B16R1.1329 COC(=O)CCCN(C)CC1CCOCC1 34a_100025706683_100000742333 [0,1,0,1,0,0|2,0,0]=4 20625 B16R1.1329 COC(=O)CCCN(C)CC1CCSCC1 2230a_100011935259_100011218270 [0,1,0,1,0,0|2,0,0]=4 20626 B16R1.1329 COC(=O)CCCN(C)CC1CCSCC1 269982a_100011935259_100011218270 [0,1,0,1,0,0|2,0,0]=4 20627 B16R1.1329 COC(=O)CCCN(C)CC1CCSCC1 34a_100011935259_100000742333 [0,1,0,1,0,0|2,0,0]=4 20628 B16R1.1329 COC(=O)CCNC(=O)CC1CCCCC1 188690a_100000683876_100000211666 [0,1,0,1,0,0|1,0,1]=4 20629 B16R1.1329 COC(=O)CCNC(C)CN1CCCCC1 2230a_100000738326_100000204255 [0,1,0,1,0,0|2,0,0]=4 20630 B16R1.1329 COC(=O)CCSC(C)CN1CCCCC1 62a_100000204255_100009831500 [0,1,0,1,0,0|2,0,0]=4 20631 B16R1.1329 COC(=O)CCSC(C)CN1CCCCC1 62a_100009831500_100000204255 [0,1,0,1,0,0|2,0,0]=4 20632 B16R1.1329 COC(=O)CNC[C@H](O)CN1CCCCC1 2230a_100015205997_100000747449 [0,1,0,1,0,0|2,0,0]=4 20633 B16R1.1329 COC(=O)COCC(C)CN1CCCCC1 34a_200011934647_100000747449 [0,1,0,1,0,0|2,0,0]=4 20634 B16R1.1329 COC(=O)COC[C@@H](N)CC1CCCCC1 34a_100015184289_100000747449 [0,1,0,1,0,0|1,0,0]=3 20635 B16R1.1329 COC(=O)CSCC(=O)CC1CCCCC1 1458a_100000191316_100000211423 [0,1,0,1,0,0|1,0,1]=4 20636 B16R1.5014 CCCCCCCN1CC(C1)CC(=O)OC 269982a_100016993681_100000210681 [0,1,0,1,0,0|1,0,0]=3 20637 B16R1.5014 CCCCOCCN1CC(C1)CC(=O)OC 269982a_100016993681_100000743108 [0,1,0,1,0,0|2,0,0]=4 20638 B16R1.5014 COC(=O)CC1CN(C1)CCCCCCF 269982a_100016993681_100015922095 [0,1,0,1,0,0|2,0,0]=4 20639 B16R1.5014 COC(=O)CC1CN(C1)CCCCCCO 269982a_100016993681_100000766143 [0,1,0,1,0,0|2,0,0]=4 20640 B16R1.5016 CCCCCCCN1CCC(C1)C(=O)NC 2230a_100020588580_100000210681 [0,1,0,1,0,0|2,0,0]=4 20641 B16R1.5016 CCCCCCCN1CCC(C1)C(=O)NC 269982a_100020588580_100000210681 [0,1,0,1,0,0|2,0,0]=4 20642 B16R1.5016 CCCCCCCN1CCC(C1)C(=O)NC 34a_100020588580_100000210614 [0,1,0,1,0,0|2,0,0]=4 20643 B16R1.5016 CCCCCCCN1CC[C@H](C1)C(=O)OC 2230a_100016989057_100000210681 [0,1,0,1,0,0|1,0,0]=3 20644 B16R1.5016 CCCCCCCN1CC[C@H](C1)C(=O)OC 269982a_100016989057_100000210681 [0,1,0,1,0,0|1,0,0]=3 20645 B16R1.5016 CCCCCCOC1CCC(C1)C(=O)OC 34a_100010257243_100000210314 [0,1,0,1,0,0|1,0,0]=3 20646 B16R1.5016 CCCCCCOC1CCC(C1)C(=O)OC 7a_100010257243_100000210314 [0,1,0,1,0,0|1,0,0]=3 20647 B16R1.5016 CCCCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_100000209983_200159312670 [0,1,0,1,0,0|1,0,0]=3 20648 B16R1.5016 CCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000210253_200159312670 [0,1,0,1,0,0|1,0,0]=3 20649 B16R1.5016 CCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100015302752_100000718602 [0,1,0,1,0,0|1,0,0]=3 20650 B16R1.5016 CCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100000210253_200159312670 [0,1,0,1,0,0|1,0,0]=3 20651 B16R1.5016 CCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100015302752_100000210326 [0,1,0,1,0,0|1,0,0]=3 20652 B16R1.5016 CCCCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_100000210326_200159312670 [0,1,0,1,0,0|1,0,0]=3 20653 B16R1.5016 CCCCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_200159312670_100000210326 [0,1,0,1,0,0|1,0,0]=3 20654 B16R1.5016 CCCCOCCN1CC[C@H](C1)C(=O)OC 2230a_100016989057_100000743108 [0,1,0,1,0,0|2,0,0]=4 20655 B16R1.5016 CCCCOCCN1CC[C@H](C1)C(=O)OC 269982a_100016989057_100000743108 [0,1,0,1,0,0|2,0,0]=4 20656 B16R1.5016 CCCCOCOC1CCC(C1)C(=O)OC 34a_100010257243_100011995733 [0,1,0,1,0,0|2,0,0]=4 20657 B16R1.5016 CCCOCCOC1CCC(C1)C(=O)OC 34a_100010257243_100011215938 [0,1,0,1,0,0|2,0,0]=4 20658 B16R1.5016 CCCOCCOC1CCC(C1)C(=O)OC 7a_100010257243_100011215938 [0,1,0,1,0,0|2,0,0]=4 20659 B16R1.5016 CCOCCCOC1CCC(C1)C(=O)OC 34a_100010257243_100012232248 [0,1,0,1,0,0|2,0,0]=4 20660 B16R1.5016 CCOCCCOC1CCC(C1)C(=O)OC 7a_100010257243_100012232248 [0,1,0,1,0,0|2,0,0]=4 20661 B16R1.5016 CCOCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_102516460346_200159312670 [0,1,0,1,0,0|2,0,0]=4 20662 B16R1.5016 CCOCCNC[C@H]1CC[C@H](C1)C(=O)OC 34a_102516460346_200159312670 [0,1,0,1,0,0|2,0,0]=4 20663 B16R1.5016 CCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000210136_200159312670 [0,1,0,1,0,0|2,0,0]=4 20664 B16R1.5016 CCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100015302752_100000210147 [0,1,0,1,0,0|2,0,0]=4 20665 B16R1.5016 CCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100000210136_200159312670 [0,1,0,1,0,0|2,0,0]=4 20666 B16R1.5016 CCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100015302752_100011215890 [0,1,0,1,0,0|2,0,0]=4 20667 B16R1.5016 CCOCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_100000210147_200159312670 [0,1,0,1,0,0|2,0,0]=4 20668 B16R1.5016 CCOCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_200159312670_100011215890 [0,1,0,1,0,0|2,0,0]=4 20669 B16R1.5016 CCSCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_100000106463_200159312670 [0,1,0,1,0,0|2,0,0]=4 20670 B16R1.5016 CCSCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000212035_200159312670 [0,1,0,1,0,0|2,0,0]=4 20671 B16R1.5016 CCSCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100015302752_100000757381 [0,1,0,1,0,0|2,0,0]=4 20672 B16R1.5016 CCSCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100000212035_200159312670 [0,1,0,1,0,0|2,0,0]=4 20673 B16R1.5016 CCSCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100015302752_100000757381 [0,1,0,1,0,0|2,0,0]=4 20674 B16R1.5016 CCSCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_100000757381_200159312670 [0,1,0,1,0,0|2,0,0]=4 20675 B16R1.5016 CCSCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_200159312670_100000757381 [0,1,0,1,0,0|2,0,0]=4 20676 B16R1.5016 CNCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000213112_200159312670 [0,1,0,1,0,0|2,0,0]=4 20677 B16R1.5016 COC(=O)C1CCC(C1)OCCCCCF 34a_100010257243_100000729378 [0,1,0,1,0,0|2,0,0]=4 20678 B16R1.5016 COC(=O)C1CCC(C1)OCCCCCF 7a_100010257243_100000729378 [0,1,0,1,0,0|2,0,0]=4 20679 B16R1.5016 COC(=O)C1CCC(C1)OCCCCCO 34a_100010257243_100000746330 [0,1,0,1,0,0|2,0,0]=4 20680 B16R1.5016 COC(=O)C1CCC(C1)OCCCCCO 7a_100010257243_100000746330 [0,1,0,1,0,0|2,0,0]=4 20681 B16R1.5016 COC(=O)[C@@H]1CCN(C1)CCCCCCF 2230a_100016989057_100015922095 [0,1,0,1,0,0|2,0,0]=4 20682 B16R1.5016 COC(=O)[C@@H]1CCN(C1)CCCCCCF 269982a_100016989057_100015922095 [0,1,0,1,0,0|2,0,0]=4 20683 B16R1.5016 COC(=O)[C@@H]1CCN(C1)CCCCCCO 2230a_100016989057_100000766143 [0,1,0,1,0,0|2,0,0]=4 20684 B16R1.5016 COC(=O)[C@@H]1CCN(C1)CCCCCCO 269982a_100016989057_100000766143 [0,1,0,1,0,0|2,0,0]=4 20685 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CNCCCCO 2230a_100000750430_200159312670 [0,1,0,1,0,0|2,0,0]=4 20686 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CNCCCCO 34a_100000750430_200159312670 [0,1,0,1,0,0|2,0,0]=4 20687 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CNCCCSC 2230a_100000749238_200159312670 [0,1,0,1,0,0|2,0,0]=4 20688 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCBr 34a_100011216708_200159312670 [0,1,0,1,0,0|2,0,0]=4 20689 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCl 34a_100000210776_200159312670 [0,1,0,1,0,0|2,0,0]=4 20690 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCl 7a_100000210776_200159312670 [0,1,0,1,0,0|2,0,0]=4 20691 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCF 34a_100011995726_200159312670 [0,1,0,1,0,0|2,0,0]=4 20692 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCF 34a_100015302752_100000729493 [0,1,0,1,0,0|2,0,0]=4 20693 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCF 7a_100011995726_200159312670 [0,1,0,1,0,0|2,0,0]=4 20694 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCF 7a_100015302752_100000729493 [0,1,0,1,0,0|2,0,0]=4 20695 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCI 34a_200012148704_200159312670 [0,1,0,1,0,0|2,0,0]=4 20696 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCN 34a_100000750430_200159312670 [0,1,0,1,0,0|2,0,0]=4 20697 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCO 34a_100015302752_100011216708 [0,1,0,1,0,0|2,0,0]=4 20698 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCO 7a_100015302752_100000210776 [0,1,0,1,0,0|2,0,0]=4 20699 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCSC 34a_100000690336_200159312670 [0,1,0,1,0,0|2,0,0]=4 20700 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)COCCCSC 7a_100000690336_200159312670 [0,1,0,1,0,0|2,0,0]=4 20701 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCF 62a_100000729493_200159312670 [0,1,0,1,0,0|2,0,0]=4 20702 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCF 62a_200159312670_100000729493 [0,1,0,1,0,0|2,0,0]=4 20703 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCO 62a_100000210776_200159312670 [0,1,0,1,0,0|2,0,0]=4 20704 B16R1.5016 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCO 62a_200159312670_100000210776 [0,1,0,1,0,0|2,0,0]=4 20705 B16R1.5016 COCCCCOC1CCC(C1)C(=O)OC 34a_100010257243_100000755781 [0,1,0,1,0,0|2,0,0]=4 20706 B16R1.5016 COCCCCOC1CCC(C1)C(=O)OC 7a_100010257243_100000730899 [0,1,0,1,0,0|2,0,0]=4 20707 B16R1.5016 COCCCNC[C@H]1CC[C@H](C1)C(=O)OC 34a_100150723488_200159312670 [0,1,0,1,0,0|2,0,0]=4 20708 B16R1.5016 COCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000740835_200159312670 [0,1,0,1,0,0|2,0,0]=4 20709 B16R1.5016 COCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100015302752_100000740836 [0,1,0,1,0,0|2,0,0]=4 20710 B16R1.5016 COCCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100015302752_100000740836 [0,1,0,1,0,0|2,0,0]=4 20711 B16R1.5016 COCCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_100000709357_200159312670 [0,1,0,1,0,0|2,0,0]=4 20712 B16R1.5016 COCCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_200159312670_100000709357 [0,1,0,1,0,0|2,0,0]=4 20713 B16R1.5796 CCC1CCCN1C(=O)CCCC(=O)OC 11a_100000754278_100000239890 [0,1,0,1,0,0|1,0,1]=4 20714 B16R1.5796 CCC1CCCN1C(=O)CCCC(=O)OC 1626a_100000754278_100000239890 [0,1,0,1,0,0|1,0,1]=4 20715 B16R1.5796 CCC1CCCN1C(=O)CCCC(=O)OC 240690a_100000754278_100000239890 [0,1,0,1,0,0|1,0,1]=4 20716 B16R1.5796 CCC1CCCN1C(=O)CCCC(=O)OC 527a_100000754278_100000239890 [0,1,0,1,0,0|1,0,1]=4 20717 B16R1.5796 CCN1CCCC1C(=O)CCCC(=O)OC 1458a_106256033941_100011218270 [0,1,0,1,0,0|1,0,1]=4 20718 B16R1.7598 CCCCCCCC(=O)CCC1CCC1=O 1458a_100000211969_200016118888 [0,1,0,1,0,0|1,0,1]=4 20719 B16R1.7598 CCCCCCCN(C)CCC1CCC1=O 2230a_100000228206_200016118888 [0,1,0,1,0,0|2,0,0]=4 20720 B16R1.7598 CCCCCCCN(C)CCC1CCC1=O 269982a_100000228206_200016118888 [0,1,0,1,0,0|2,0,0]=4 20721 B16R1.13205 CCCN1CCCC(C1)NCCC(=O)OC 2230a_100011435248_100000204255 [0,1,0,1,0,0|2,0,0]=4 20722 B16R1.13205 CCOC1CCCN(C1)CCCC(=O)OC 2230a_100000745229_100011218270 [0,1,0,1,0,0|2,0,0]=4 20723 B16R1.13205 CCOC1CCCN(C1)CCCC(=O)OC 269982a_100000745229_100011218270 [0,1,0,1,0,0|2,0,0]=4 20724 B16R1.13205 CCOC1CCCN(C1)CCCC(=O)OC 34a_100000745229_100000742333 [0,1,0,1,0,0|2,0,0]=4 20725 B16R1.13205 COC(=O)CCCN1CCCC(C1)CCO 2230a_100000752241_100011218270 [0,1,0,1,0,0|2,0,0]=4 20726 B16R1.13205 COC(=O)CCCN1CCCC(C1)CCO 269982a_100000752241_100011218270 [0,1,0,1,0,0|2,0,0]=4 20727 B16R1.13205 COC(=O)CCCN1CCCC(C1)CCO 34a_100000752241_100000742333 [0,1,0,1,0,0|2,0,0]=4 20728 B16R1.13205 COCC1CCCN(C1)CCCC(=O)OC 2230a_100000755410_100011218270 [0,1,0,1,0,0|2,0,0]=4 20729 B16R1.13205 COCC1CCCN(C1)CCCC(=O)OC 269982a_100000755410_100011218270 [0,1,0,1,0,0|2,0,0]=4 20730 B16R1.13205 COCC1CCCN(C1)CCCC(=O)OC 34a_100000755410_100000742333 [0,1,0,1,0,0|2,0,0]=4 20731 B16R1.16971 CNC(=O)CCCC(=O)C1CCCCC1C 1458a_100011215568_100000741757 [0,1,0,1,0,0|1,0,1]=4 20732 B16R1.16971 COC(=O)CCCC(=O)C1CCCCC1C 1458a_100011215568_100011218270 [0,1,0,1,0,0|0,0,1]=3 20733 B16R1.16971 COC(=O)CCCC(=O)C1CCCCC1O 1458a_100011803323_100011218270 [0,1,0,1,0,0|1,0,1]=4 20734 B16R1.16971 COC(=O)CCCC(=O)N1CCCCC1C 11a_100000211376_100000239890 [0,1,0,1,0,0|1,0,1]=4 20735 B16R1.16971 COC(=O)CCCC(=O)N1CCCCC1C 1626a_100000211376_100000239890 [0,1,0,1,0,0|1,0,1]=4 20736 B16R1.16971 COC(=O)CCCC(=O)N1CCCCC1C 240690a_100000211376_100000239890 [0,1,0,1,0,0|1,0,1]=4 20737 B16R1.16971 COC(=O)CCCC(=O)N1CCCCC1C 527a_100000211376_100000239890 [0,1,0,1,0,0|1,0,1]=4 20738 B16R1.16971 COC(=O)CCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100011218270 [0,1,0,1,0,0|1,0,1]=4 20739 B16R1.16971 COC(=O)CCCN(C)C1CCCCC1F 269982a_100000739225_100015423560 [0,1,0,1,0,0|2,0,0]=4 20740 B16R1.16971 COC(=O)CCCN(C)C1CCCCC1O 269982a_100000739225_100000038908 [0,1,0,1,0,0|2,0,0]=4 20741 B16R1.16971 COC(=O)CCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100011218270 [0,1,0,1,0,0|2,0,0]=4 20742 B16R1.16971 COC(=O)CCNC(=O)C1CCCCC1C 188690a_100000683876_100011215568 [0,1,0,1,0,0|1,0,1]=4 20743 B16R1.16971 COC(=O)COCC(C)N1CCCCC1C 34a_200011934825_100000747449 [0,1,0,1,0,0|2,0,0]=4 20744 B16R1.16971 COC(=O)COCC(C)N1CCCCC1C 7a_200011934825_100000747449 [0,1,0,1,0,0|2,0,0]=4 20745 B16R1.40689 CCCCCCCC(=O)C1CC1C(=O)OC 1458a_100000750770_100000210614 [0,1,0,1,0,0|0,0,1]=3 20746 B16R1.40689 CCCCCCCC(=O)N1CC1C(=O)OC 240690a_200009830135_100000211969 [0,1,0,1,0,0|1,0,1]=4 20747 B16R1.40689 CCCCCCCC(C)N1CC1C(=O)OC 2230a_200009830135_200011218727 [0,1,0,1,0,0|1,0,0]=3 20748 B16R1.40689 CCCCCCCC(C)N1CC1C(=O)OC 270004a_200009830135_100000210596 [0,1,0,1,0,0|1,0,0]=3 20749 B16R1.40689 CCCCCCNC(=O)C1CC1C(=O)OC 11a_100000210581_100000750770 [0,1,0,1,0,0|1,0,1]=4 20750 B16R1.40689 CCCCCCNC(=O)C1CC1C(=O)OC 240690a_100000210581_100000750770 [0,1,0,1,0,0|1,0,1]=4 20751 B16R1.40689 CCCCOCCC(=O)C1CC1C(=O)OC 1458a_100000750770_100000743108 [0,1,0,1,0,0|1,0,1]=4 20752 B16R1.40689 COC(=O)C1CC1C(=O)CCCCCCF 1458a_100000750770_100015922095 [0,1,0,1,0,0|1,0,1]=4 20753 B16R1.40689 COC(=O)C1CC1C(=O)CCCCCCO 1458a_100000750770_100000766143 [0,1,0,1,0,0|1,0,1]=4 20754 B16R1.40707 CCCCCCCC(=O)[C@H]1CCC(=O)N1C 1458a_100010979499_100000210614 [0,1,0,1,0,0|1,0,1]=4 20755 B16R1.75429 CNC(=O)CCCC(=O)C1CCCCCC1 1458a_100000749507_100000741757 [0,1,0,1,0,0|1,0,1]=4 20756 B16R1.75429 CNC(=O)CCCN(C)C1CCCCCC1 2230a_100015185097_100000741757 [0,1,0,1,0,0|2,0,0]=4 20757 B16R1.75429 CNC(=O)CCCN(C)C1CCCCCC1 269982a_100015185097_100000741757 [0,1,0,1,0,0|2,0,0]=4 20758 B16R1.75429 CNC(=O)CCCN(C)C1CCCCCC1 34a_100015185097_100000741757 [0,1,0,1,0,0|2,0,0]=4 20759 B16R1.75429 COC(=O)CCCC(=O)C1CCCCCC1 1458a_100000239890_100011217769 [0,1,0,1,0,0|0,0,1]=3 20760 B16R1.75429 COC(=O)CCCC(=O)C1CCCCCC1 1458a_100000749507_100011218270 [0,1,0,1,0,0|0,0,1]=3 20761 B16R1.75429 COC(=O)CCCC(=O)N1CCCCCC1 11a_100000185865_100000239890 [0,1,0,1,0,0|1,0,1]=4 20762 B16R1.75429 COC(=O)CCCC(=O)N1CCCCCC1 1626a_100000185865_100000239890 [0,1,0,1,0,0|1,0,1]=4 20763 B16R1.75429 COC(=O)CCCC(=O)N1CCCCCC1 240690a_100000185865_100000239890 [0,1,0,1,0,0|1,0,1]=4 20764 B16R1.75429 COC(=O)CCCC(=O)N1CCCCCC1 527a_100000185865_100000239890 [0,1,0,1,0,0|1,0,1]=4 20765 B16R1.75429 COC(=O)CCCN(C)C1CCCCCC1 2230a_100015185097_100011218270 [0,1,0,1,0,0|1,0,0]=3 20766 B16R1.75429 COC(=O)CCCN(C)C1CCCCCC1 269982a_100000739225_100011217769 [0,1,0,1,0,0|1,0,0]=3 20767 B16R1.75429 COC(=O)CCCN(C)C1CCCCCC1 269982a_100015185097_100011218270 [0,1,0,1,0,0|1,0,0]=3 20768 B16R1.75429 COC(=O)CCCN(C)C1CCCCCC1 34a_100015185097_100000742333 [0,1,0,1,0,0|1,0,0]=3 20769 B16R1.75429 COC(=O)CCNC(=O)C1CCCCCC1 188690a_100000683876_100000749507 [0,1,0,1,0,0|1,0,1]=4 20770 B16R1.75429 COC(=O)CSCC(=O)C1CCCCCC1 1458a_100000191316_100011217769 [0,1,0,1,0,0|1,0,1]=4 20771 B16R1.7 C=C1CCC(CC1)COCCCC(=O)OC 34a_100000074039_100000742333 [0,1,0,1,0,0|1,0,1]=4 20772 B16R1.7 C=C1CCN(CC1)CCCCCC(=O)OC 2230a_100000752442_100009816466 [0,1,0,1,0,0|1,0,1]=4 20773 B16R1.7 C=C1CCN(CC1)CCCCCC(=O)OC 269982a_100000752442_100009816466 [0,1,0,1,0,0|1,0,1]=4 20774 B16R1.7 C=C1CCN(CC1)CCCCCC(=O)OC 34a_100000752442_100009816466 [0,1,0,1,0,0|1,0,1]=4 20775 B16R1.7 CNC(=O)CCCNCC1CCC(CC1)C 2230a_103436935547_100000741757 [0,1,0,1,0,0|2,0,0]=4 20776 B16R1.7 CNC(=O)CCCNCC1CCC(CC1)C 34a_103436935547_100000741757 [0,1,0,1,0,0|2,0,0]=4 20777 B16R1.7 CNC(=O)CCCOCC1CCC(CC1)C 34a_100000701341_100000741757 [0,1,0,1,0,0|2,0,0]=4 20778 B16R1.7 CNC(=O)CCCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000741757 [0,1,0,1,0,0|2,0,0]=4 20779 B16R1.7 CNC(=O)CCNCCC1CCC(CC1)O 34a_200011935226_100012179268 [0,1,0,1,0,0|2,0,0]=4 20780 B16R1.7 CNC(=O)CCOCCC1CCC(CC1)N 34a_100000070672_100012179268 [0,1,0,1,0,0|2,0,0]=4 20781 B16R1.7 COC(=O)CCCCCN1CCC(CC1)C 2230a_100000188429_100009816466 [0,1,0,1,0,0|1,0,0]=3 20782 B16R1.7 COC(=O)CCCCCN1CCC(CC1)C 269982a_100000188429_100009816466 [0,1,0,1,0,0|1,0,0]=3 20783 B16R1.7 COC(=O)CCCCCN1CCC(CC1)C 34a_100000188429_100009816466 [0,1,0,1,0,0|1,0,0]=3 20784 B16R1.7 COC(=O)CCCCCN1CCC(CC1)F 2230a_100015193889_100009816466 [0,1,0,1,0,0|1,0,0]=3 20785 B16R1.7 COC(=O)CCCCCN1CCC(CC1)F 269982a_100015193889_100009816466 [0,1,0,1,0,0|1,0,0]=3 20786 B16R1.7 COC(=O)CCCCCN1CCC(CC1)F 34a_100015193889_100009816466 [0,1,0,1,0,0|1,0,0]=3 20787 B16R1.7 COC(=O)CCCCCN1CCC(CC1)O 2230a_100025773856_100009816466 [0,1,0,1,0,0|1,0,0]=3 20788 B16R1.7 COC(=O)CCCCCN1CCC(CC1)O 269982a_100025773856_100009816466 [0,1,0,1,0,0|1,0,0]=3 20789 B16R1.7 COC(=O)CCCCCN1CCN(CC1)C 2230a_100000188432_100009816466 [0,1,0,1,0,0|2,0,0]=4 20790 B16R1.7 COC(=O)CCCCCN1CCN(CC1)C 269982a_100000188432_100009816466 [0,1,0,1,0,0|2,0,0]=4 20791 B16R1.7 COC(=O)CCCCCN1CCS(=O)CC1 2230a_100000752083_100009816466 [0,1,0,1,0,0|2,0,0]=4 20792 B16R1.7 COC(=O)CCCCCN1CCS(=O)CC1 269982a_100000752083_100009816466 [0,1,0,1,0,0|2,0,0]=4 20793 B16R1.7 COC(=O)CCCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000204269 [0,1,0,1,0,0|1,0,0]=3 20794 B16R1.7 COC(=O)CCCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000204269 [0,1,0,1,0,0|1,0,0]=3 20795 B16R1.7 COC(=O)CCCCOC1CCC(=O)CC1 34a_100000764474_100000204269 [0,1,0,1,0,0|1,0,1]=4 20796 B16R1.7 COC(=O)CCCCOC1CCC(=O)CC1 7a_100000764474_100000204269 [0,1,0,1,0,0|1,0,1]=4 20797 B16R1.7 COC(=O)CCCCOC1CCC(CC1)C 34a_100000059025_200011216234 [0,1,0,1,0,0|1,0,0]=3 20798 B16R1.7 COC(=O)CCCCOC1CCC(CC1)C 34a_100000210714_100000204269 [0,1,0,1,0,0|1,0,0]=3 20799 B16R1.7 COC(=O)CCCCOC1CCC(CC1)C 7a_100000210714_100000204269 [0,1,0,1,0,0|1,0,0]=3 20800 B16R1.7 COC(=O)CCCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000204269 [0,1,0,1,0,0|1,0,0]=3 20801 B16R1.7 COC(=O)CCCCSC1CCC(CC1)C 62a_100000204269_200011216234 [0,1,0,1,0,0|1,0,0]=3 20802 B16R1.7 COC(=O)CCCCSC1CCN(CC1)C 62a_100000204269_100011215917 [0,1,0,1,0,0|2,0,0]=4 20803 B16R1.7 COC(=O)CCCNCC1CCC(CC1)C 2230a_103436935547_100011218270 [0,1,0,1,0,0|1,0,0]=3 20804 B16R1.7 COC(=O)CCCNCC1CCC(CC1)C 34a_103436935547_100000742333 [0,1,0,1,0,0|1,0,0]=3 20805 B16R1.7 COC(=O)CCCOCC1CCC(=O)CC1 34a_100000062911_100000742333 [0,1,0,1,0,0|1,0,1]=4 20806 B16R1.7 COC(=O)CCCOCC1CCC(CC1)C 34a_100000701341_100000742333 [0,1,0,1,0,0|1,0,0]=3 20807 B16R1.7 COC(=O)CCCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000742333 [0,1,0,1,0,0|1,0,0]=3 20808 B16R1.7 COC(=O)CCCSCC1CCN(CC1)C 62a_100011218270_100015183002 [0,1,0,1,0,0|2,0,0]=4 20809 B16R1.7 COC(=O)CCCSCC1CCN(CC1)C 62a_100015183002_100011218270 [0,1,0,1,0,0|2,0,0]=4 20810 B16R1.7 COC(=O)CCNCCC1CCC(CC1)O 34a_200011935226_100000742370 [0,1,0,1,0,0|1,0,0]=3 20811 B16R1.7 COC(=O)CCOCCC1CCC(CC1)N 34a_100000070672_100000742370 [0,1,0,1,0,0|1,0,0]=3 20812 B16R1.7 COC(=O)COCCCC1CCN(CC1)C 34a_100000083870_100000747449 [0,1,0,1,0,0|2,0,0]=4 20813 B16R1.7 COC(=O)COCCCC1CCN(CC1)C 7a_100000083870_100000747449 [0,1,0,1,0,0|2,0,0]=4 20814 B16R1.7 COC(=O)COCCCN1CCC(CC1)C 34a_200000213400_100000747449 [0,1,0,1,0,0|2,0,0]=4 20815 B16R1.7 COC(=O)COCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000090808 [0,1,0,1,0,0|2,0,0]=4 20816 B16R1.7 COC(=O)COCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000090808 [0,1,0,1,0,0|2,0,0]=4 20817 B16R1.7 COC(=O)COCCOC1CCC(CC1)C 34a_100000210714_100000090808 [0,1,0,1,0,0|2,0,0]=4 20818 B16R1.7 COC(=O)COCCOC1CCC(CC1)C 7a_100000210714_100000090808 [0,1,0,1,0,0|2,0,0]=4 20819 B16R1.7 COC(=O)COCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000090808 [0,1,0,1,0,0|2,0,0]=4 20820 B16R1.7 COC(=O)COCCSC1CCC(CC1)C 62a_100000090808_200011216234 [0,1,0,1,0,0|2,0,0]=4 20821 B16R1.40 CCC1CCCC(C1)NCCCC(=O)NC 270004a_100000740002_100000756783 [0,1,0,1,0,0|2,0,0]=4 20822 B16R1.40 CCC1CCCC(C1)OCCCC(=O)NC 7a_100011985506_100000741757 [0,1,0,1,0,0|2,0,0]=4 20823 B16R1.40 CCC1CCCC(C1)OCCCC(=O)OC 7a_100011985506_100011218270 [0,1,0,1,0,0|1,0,0]=3 20824 B16R1.40 CCC1CN(CCO1)CCCCC(=O)OC 2230a_100000736320_100000204269 [0,1,0,1,0,0|2,0,0]=4 20825 B16R1.40 CCC1CN(CCO1)CCCCC(=O)OC 269982a_100000736320_100000204269 [0,1,0,1,0,0|2,0,0]=4 20826 B16R1.40 CCC1CN(CCO1)CCCCC(=O)OC 34a_100000736320_100000204269 [0,1,0,1,0,0|2,0,0]=4 20827 B16R1.40 CCN1CCCC(C1)CNCCC(=O)OC 2230a_100000747413_100000204255 [0,1,0,1,0,0|2,0,0]=4 20828 B16R1.40 CCN1CCCC(C1)COCCC(=O)OC 7a_200000227639_100000204255 [0,1,0,1,0,0|2,0,0]=4 20829 B16R1.40 CCN1CCC[C@H](C1)NCCCC(=O)OC 2230a_100025775482_100011218270 [0,1,0,1,0,0|2,0,0]=4 20830 B16R1.40 COC(=O)CCCCN1CCCC(C1)CF 2230a_100016992999_100000204269 [0,1,0,1,0,0|2,0,0]=4 20831 B16R1.40 COC(=O)CCCCN1CCCC(C1)CF 269982a_100016992999_100000204269 [0,1,0,1,0,0|2,0,0]=4 20832 B16R1.40 COC(=O)CCCCN1CCCC(C1)CF 34a_100016992999_100000204269 [0,1,0,1,0,0|2,0,0]=4 20833 B16R1.40 COC(=O)CCCCN1CCCC(C1)CO 2230a_100000211344_100000204269 [0,1,0,1,0,0|2,0,0]=4 20834 B16R1.40 COC(=O)CCCCN1CCCC(C1)CO 269982a_100000211344_100000204269 [0,1,0,1,0,0|2,0,0]=4 20835 B16R1.40 COC(=O)CCCCN1CCCC(C1)CO 34a_100000211344_100000204269 [0,1,0,1,0,0|2,0,0]=4 20836 B16R1.40 COC(=O)CCCCN1CCCC(C1)OC 2230a_100000695604_100000204269 [0,1,0,1,0,0|2,0,0]=4 20837 B16R1.40 COC(=O)CCCCN1CCCC(C1)OC 269982a_100000695604_100000204269 [0,1,0,1,0,0|2,0,0]=4 20838 B16R1.40 COC(=O)CCCCN1CCCC(C1)OC 34a_100000695604_100000204269 [0,1,0,1,0,0|2,0,0]=4 20839 B16R1.40 COC(=O)CCCOC1CCCC(C1)CN 34a_100011254705_100000742333 [0,1,0,1,0,0|2,0,0]=4 20840 B16R1.1115 CNC(=O)CCCNC1CCCC(C1C)C 2230a_100000211273_100000741757 [0,1,0,1,0,0|2,0,0]=4 20841 B16R1.1115 CNC(=O)CCCNC1CCCC(C1C)C 34a_100000211273_100000741757 [0,1,0,1,0,0|2,0,0]=4 20842 B16R1.1115 CNC(=O)CCCOC1CCCC(C1C)C 34a_100011217532_100000741757 [0,1,0,1,0,0|2,0,0]=4 20843 B16R1.1115 CNC(=O)CCCOC1CCCC(C1C)C 7a_100011217532_100000741757 [0,1,0,1,0,0|2,0,0]=4 20844 B16R1.1115 COC(=O)CCCNC1CCCC(C1C)C 2230a_100000211273_100011218270 [0,1,0,1,0,0|1,0,0]=3 20845 B16R1.1115 COC(=O)CCCNC1CCCC(C1C)C 34a_100000211273_100000742333 [0,1,0,1,0,0|1,0,0]=3 20846 B16R1.1115 COC(=O)CCCOC1CCCC(C1C)C 34a_100011217532_100000742333 [0,1,0,1,0,0|1,0,0]=3 20847 B16R1.1115 COC(=O)CCCOC1CCCC(C1C)C 7a_100011217532_100011218270 [0,1,0,1,0,0|1,0,0]=3 20848 B16R1.1165 COC(=O)CCCCCCN1CCC(C1)O 2230a_100011215560_100009815986 [0,1,0,1,0,0|1,0,0]=3 20849 B16R1.1165 COC(=O)CCCCCCN1CCC(C1)O 269982a_100011215560_100009815986 [0,1,0,1,0,0|1,0,0]=3 20850 B16R1.1165 COC(=O)CCCCCCN1CC[C@@H](C1)F 2230a_100015203821_100009815986 [0,1,0,1,0,0|1,0,0]=3 20851 B16R1.1165 COC(=O)CCCCCCN1CC[C@@H](C1)F 269982a_100015203821_100009815986 [0,1,0,1,0,0|1,0,0]=3 20852 B16R1.1165 COC(=O)CCCCCCN1CC[C@@H](C1)F 34a_100015203821_100009815986 [0,1,0,1,0,0|1,0,0]=3 20853 B16R1.1165 COC(=O)CCCCCCN1CC[C@H](C1)C 2230a_100016987628_100009815986 [0,1,0,1,0,0|1,0,0]=3 20854 B16R1.1165 COC(=O)CCCCCCN1CC[C@H](C1)C 269982a_100016987628_100009815986 [0,1,0,1,0,0|1,0,0]=3 20855 B16R1.1165 COC(=O)CCCCCCN1CC[C@H](C1)C 34a_100016987628_100009815986 [0,1,0,1,0,0|1,0,0]=3 20856 B16R1.1165 COC(=O)CCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100009816466 [0,1,0,1,0,0|1,0,0]=3 20857 B16R1.1165 COC(=O)CCCCCOC1CCC(=O)C1 34a_100012614533_100009816466 [0,1,0,1,0,0|1,0,1]=4 20858 B16R1.1165 COC(=O)CCCCCOC1CCC(C1)C 34a_100000698185_100009816466 [0,1,0,1,0,0|1,0,0]=3 20859 B16R1.1165 COC(=O)CCCCCOC1CCN(C1)C 7a_100000074720_200012183744 [0,1,0,1,0,0|2,0,0]=4 20860 B16R1.1165 COC(=O)CCCCCSC1CCN(C1)C 62a_100009816466_200012183744 [0,1,0,1,0,0|2,0,0]=4 20861 B16R1.1165 COC(=O)CCCCOCC1CCN(C1)C 34a_100000059025_200000690779 [0,1,0,1,0,0|2,0,0]=4 20862 B16R1.1165 COC(=O)CCCCOCC1CCN(C1)C 7a_100000059025_200000690779 [0,1,0,1,0,0|2,0,0]=4 20863 B16R1.1165 COC(=O)CCCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000204269 [0,1,0,1,0,0|2,0,0]=4 20864 B16R1.1165 COC(=O)CCCCSCC1CCN(C1)C 62a_100000204269_200000690779 [0,1,0,1,0,0|2,0,0]=4 20865 B16R1.1165 COC(=O)CCCCSCC1CCN(C1)C 62a_200000690779_100000204269 [0,1,0,1,0,0|2,0,0]=4 20866 B16R1.1332 CCC(=O)CO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000747405 [0,1,0,1,0,0|1,0,1]=4 20867 B16R1.1332 CCC(C)C1CCCCC1NCC(=O)NC 269862a_100000693194_100011216798 [0,1,0,1,0,0|2,0,0]=4 20868 B16R1.1332 CCC(C)COC1CCNCC1C(=O)OC 34a_200103168510_100000748023 [0,1,0,1,0,0|2,0,0]=4 20869 B16R1.1332 CCC(C)CO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000748023 [0,1,0,1,0,0|1,0,0]=3 20870 B16R1.1332 CCC(C)CO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000748023 [0,1,0,1,0,0|1,0,0]=3 20871 B16R1.1332 CCC(O)COC1CCNCC1C(=O)OC 34a_200103168510_100011218378 [0,1,0,1,0,0|2,0,0]=4 20872 B16R1.1332 CCC(O)CO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011218378 [0,1,0,1,0,0|1,0,0]=3 20873 B16R1.1332 CCC(O)CO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011218378 [0,1,0,1,0,0|1,0,0]=3 20874 B16R1.1332 CC[C@H](C)COC1CCNCC1C(=O)OC 34a_200103168510_100009816398 [0,1,0,1,0,0|2,0,0]=4 20875 B16R1.1332 CC[C@H](C)CO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100009816398 [0,1,0,1,0,0|1,0,0]=3 20876 B16R1.1332 CC[C@H](C)CO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100009816398 [0,1,0,1,0,0|1,0,0]=3 20877 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OCC(O)CO 34a_100015709673_100011219619 [0,1,0,1,0,0|2,0,0]=4 20878 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OCC(O)CO 7a_100015709673_100011219619 [0,1,0,1,0,0|2,0,0]=4 20879 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H](C)CO 34a_100015709673_100000059175 [0,1,0,1,0,0|2,0,0]=4 20880 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H](C)CO 7a_100015709673_100000059175 [0,1,0,1,0,0|2,0,0]=4 20881 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H](O)CF 34a_100015709673_100015614560 [0,1,0,1,0,0|2,0,0]=4 20882 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H](O)CF 7a_100015709673_100015614560 [0,1,0,1,0,0|2,0,0]=4 20883 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H](O)CO 34a_100015709673_100009815848 [0,1,0,1,0,0|2,0,0]=4 20884 B16R1.1332 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H](O)CO 7a_100015709673_100009815848 [0,1,0,1,0,0|2,0,0]=4 20885 B16R1.3268 CCN(C)CCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100015186262 [0,1,0,1,0,0|2,0,0]=4 20886 B16R1.3268 CCN(C)CCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100015186262 [0,1,0,1,0,0|2,0,0]=4 20887 B16R1.4414 CCC(C)CN1CCOCC1CC(=O)OC 2230a_100000731486_100000748023 [0,1,0,1,0,0|2,0,0]=4 20888 B16R1.4414 CCC(C)CN1CCOCC1CC(=O)OC 270004a_100000731486_100000243153 [0,1,0,1,0,0|2,0,0]=4 20889 B16R1.4414 CCC(C)CN1CCOCC1CC(=O)OC 34a_100000731486_100000748023 [0,1,0,1,0,0|2,0,0]=4 20890 B16R1.4414 CCC(O)CN1CCOCC1CC(=O)OC 2230a_100000731486_100011218378 [0,1,0,1,0,0|2,0,0]=4 20891 B16R1.4414 CCC(O)CN1CCOCC1CC(=O)OC 34a_100000731486_100011218378 [0,1,0,1,0,0|2,0,0]=4 20892 B16R1.4414 CC[C@H](C)CN1CCOCC1CC(=O)OC 2230a_100000731486_100009816398 [0,1,0,1,0,0|2,0,0]=4 20893 B16R1.4414 CC[C@H](C)CN1CCOCC1CC(=O)OC 34a_100000731486_100009816398 [0,1,0,1,0,0|2,0,0]=4 20894 B16R1.4853 CCN1CCC(C1)CNCCCC(=O)OC 2230a_100011224064_100011218270 [0,1,0,1,0,0|2,0,0]=4 20895 B16R1.4853 CCN1CCC(C1)CSCCCC(=O)OC 62a_100011218270_100015184589 [0,1,0,1,0,0|2,0,0]=4 20896 B16R1.4853 CCN1CCC(C1)CSCCCC(=O)OC 62a_100015184589_100011218270 [0,1,0,1,0,0|2,0,0]=4 20897 B16R1.4853 CCN1CCC(C1)NCCCCC(=O)OC 2230a_100015188829_100000204269 [0,1,0,1,0,0|2,0,0]=4 20898 B16R1.4853 CCN1CCC(C1)OCCCCC(=O)OC 7a_100000059025_200011861547 [0,1,0,1,0,0|2,0,0]=4 20899 B16R1.4853 CCN1CCC(C1)SCCCCC(=O)OC 62a_100000204269_200011861547 [0,1,0,1,0,0|2,0,0]=4 20900 B16R1.4853 COC(=O)CCCCCN1CCC(C1)CO 2230a_100000748654_100009816466 [0,1,0,1,0,0|2,0,0]=4 20901 B16R1.4853 COC(=O)CCCCCN1CCC(C1)CO 269982a_100000748654_100009816466 [0,1,0,1,0,0|2,0,0]=4 20902 B16R1.4853 COC(=O)CCCCCN1CCC(C1)CO 34a_100000748654_100009816466 [0,1,0,1,0,0|2,0,0]=4 20903 B16R1.4853 COC(=O)CCCCCN1CC[C@H](C1)OC 2230a_100000766984_100009816466 [0,1,0,1,0,0|2,0,0]=4 20904 B16R1.4853 COC(=O)CCCCCN1CC[C@H](C1)OC 269982a_100000766984_100009816466 [0,1,0,1,0,0|2,0,0]=4 20905 B16R1.4853 COC(=O)CCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100000742333 [0,1,0,1,0,0|2,0,0]=4 20906 B16R1.4853 COC(=O)CCCOC[C@H]1CC[C@H](C1)CN 34a_206354213956_100000742333 [0,1,0,1,0,0|2,0,0]=4 20907 B16R1.16893 COC(=O)CCCCN1CCC[C@@]1(C)CO 2230a_100016195882_100000204269 [0,1,0,1,0,0|2,0,0]=4 20908 B16R1.16893 COC(=O)CCCCN1CCC[C@@]1(C)CO 269982a_100016195882_100000204269 [0,1,0,1,0,0|2,0,0]=4 20909 B16R1.16893 COC(=O)CCCCN1CCC[C@@]1(C)CO 34a_100016195882_100000204269 [0,1,0,1,0,0|2,0,0]=4 20910 B16R1.18260 COC(=O)CCCCN1CCCC(CC1)C 2230a_100025706717_100000204269 [0,1,0,1,0,0|1,0,0]=3 20911 B16R1.18260 COC(=O)CCCCN1CCCC(CC1)C 269982a_100025706717_100000204269 [0,1,0,1,0,0|1,0,0]=3 20912 B16R1.18260 COC(=O)CCCCN1CCCC(CC1)C 34a_100025706717_100000204269 [0,1,0,1,0,0|1,0,0]=3 20913 B16R1.18260 COC(=O)CCCCN1CCCC(CC1)O 2230a_100015186869_100000204269 [0,1,0,1,0,0|1,0,0]=3 20914 B16R1.18260 COC(=O)CCCCN1CCCC(CC1)O 269982a_100015186869_100000204269 [0,1,0,1,0,0|1,0,0]=3 20915 B16R1.18260 COC(=O)CCCCN1CCCN(CC1)C 2230a_100000211313_100000204269 [0,1,0,1,0,0|2,0,0]=4 20916 B16R1.18260 COC(=O)CCCCN1CCCN(CC1)C 269982a_100000211313_100000204269 [0,1,0,1,0,0|2,0,0]=4 20917 B16R1.18260 COC(=O)COCCN1CCCC(CC1)C 2230a_100025706717_100000090808 [0,1,0,1,0,0|2,0,0]=4 20918 B16R1.18260 COC(=O)COCCN1CCCC(CC1)C 34a_100025706717_100000090808 [0,1,0,1,0,0|2,0,0]=4 20919 B16R1.18260 COC(=O)COCCN1CCCC(CC1)O 2230a_100015186869_100000090808 [0,1,0,1,0,0|2,0,0]=4 20920 B16R1.18374 COC(=O)CCCCCCCNC1(CC1)C 2230a_100000757604_100010004213 [0,1,0,1,0,0|1,0,0]=3 20921 B16R1.18374 COC(=O)CCCCCCCOC1(CC1)C 7a_100011725673_100010004213 [0,1,0,1,0,0|1,0,0]=3 20922 B16R1.18374 COC(=O)CCCCCCNCC1(CC1)C 2230a_100000766693_100009815986 [0,1,0,1,0,0|1,0,0]=3 20923 B16R1.18374 COC(=O)CCCCCCNCC1(CC1)O 2230a_100011936951_100009815986 [0,1,0,1,0,0|1,0,0]=3 20924 B16R1.18374 COC(=O)CCCCCCOCC1(CC1)C 7a_100000698024_100009815986 [0,1,0,1,0,0|1,0,0]=3 20925 B16R1.18374 COC(=O)CCCCCCOCC1(CC1)F 34a_200000703853_100009815986 [0,1,0,1,0,0|1,0,0]=3 20926 B16R1.18374 COC(=O)CCCCCCOCC1(CC1)F 7a_200000703853_100009815986 [0,1,0,1,0,0|1,0,0]=3 20927 B16R1.18374 COC(=O)CCCCCCOCC1(CO1)C 34a_100009863599_100000760498 [0,1,0,1,0,0|2,0,0]=4 20928 B16R1.18374 COC(=O)CCCCCCSCC1(CO1)C 62a_100000760498_100009815986 [0,1,0,1,0,0|2,0,0]=4 20929 B16R1.18374 COC(=O)CCCCCCSCC1(CO1)C 62a_100009815986_100000760498 [0,1,0,1,0,0|2,0,0]=4 20930 B16R1.19601 CCC1CN(C1)CCCCCCC(=O)OC 2230a_100015205115_100009815986 [0,1,0,1,0,0|1,0,0]=3 20931 B16R1.19601 CCC1CN(C1)CCCCCCC(=O)OC 269982a_100015205115_100009815986 [0,1,0,1,0,0|1,0,0]=3 20932 B16R1.19601 CCN1CC(C1)NCCCCCC(=O)OC 2230a_200015199589_100009816466 [0,1,0,1,0,0|2,0,0]=4 20933 B16R1.19601 COC(=O)CCCCCCN1CC(C1)CF 269982a_100010363649_100009815986 [0,1,0,1,0,0|2,0,0]=4 20934 B16R1.19601 COC(=O)CCCCCCN1CC(C1)CF 34a_100010363649_100009815986 [0,1,0,1,0,0|2,0,0]=4 20935 B16R1.19601 COC(=O)CCCCCCN1CC(C1)CO 269982a_100016987283_100009815986 [0,1,0,1,0,0|2,0,0]=4 20936 B16R1.19601 COC(=O)CCCCCCN1CC(C1)CO 34a_100016987283_100009815986 [0,1,0,1,0,0|2,0,0]=4 20937 B16R1.19601 COC(=O)CCCCCCN1CC(C1)OC 269982a_100000755009_100009815986 [0,1,0,1,0,0|2,0,0]=4 20938 B16R1.19601 COC(=O)CCCCCCN1CC(C1)SC 269982a_100016990038_100009815986 [0,1,0,1,0,0|2,0,0]=4 20939 B16R1.19601 COC(=O)CCCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100009816466 [0,1,0,1,0,0|2,0,0]=4 20940 B16R1.19601 COC(=O)CCCCCSC1CC(C1)CO 62a_100009816466_100009874164 [0,1,0,1,0,0|2,0,0]=4 20941 B16R1.19601 COC(=O)CCCCCSC1CC(C1)CO 62a_100009874164_100009816466 [0,1,0,1,0,0|2,0,0]=4 20942 B16R1.75209 COC(=O)CCCCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100009815986 [0,1,0,1,0,0|1,0,0]=3 20943 B16R1.75209 COC(=O)CCCCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100009815986 [0,1,0,1,0,0|1,0,0]=3 20944 B16R1.54 CCCCCCC(C)NC1CCC(=O)NC1 2230a_100000748762_100011215978 [0,1,0,1,0,0|2,0,0]=4 20945 B16R1.54 CCCCCCC(C)NC1CCC(=O)NC1 270004a_100000748762_100000210826 [0,1,0,1,0,0|2,0,0]=4 20946 B16R1.54 CCCCCCC(C)NC1CCC(=O)NC1 34a_100000748762_100011215978 [0,1,0,1,0,0|2,0,0]=4 20947 B16R1.54 CCCCCCC(C)OC1CCC(=O)CC1 34a_100000764474_100011215978 [0,1,0,1,0,0|2,0,0]=4 20948 B16R1.54 CCCCCCC(C)OC1CCC(=O)CC1 7a_100000764474_100011215978 [0,1,0,1,0,0|2,0,0]=4 20949 B16R1.54 CCCCCCC(C)OC1CCC(=O)NC1 34a_100000079199_100011215978 [0,1,0,1,0,0|2,0,0]=4 20950 B16R1.248 CCCCCCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100000210314 [0,1,0,1,0,0|1,0,0]=3 20951 B16R1.248 CCCCCCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100000210757 [0,1,0,1,0,0|1,0,0]=3 20952 B16R1.248 CCCCOCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100011995733 [0,1,0,1,0,0|2,0,0]=4 20953 B16R1.248 CCCCOCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100011995733 [0,1,0,1,0,0|2,0,0]=4 20954 B16R1.248 CCCOCCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100011215938 [0,1,0,1,0,0|2,0,0]=4 20955 B16R1.248 CCCOCCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100011215938 [0,1,0,1,0,0|2,0,0]=4 20956 B16R1.248 CCOCCCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100012232248 [0,1,0,1,0,0|2,0,0]=4 20957 B16R1.248 CCOCCCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100012232248 [0,1,0,1,0,0|2,0,0]=4 20958 B16R1.248 COC(=O)C[C@H]1CCN(C1)CCCCCF 2230a_100020634416_100000729378 [0,1,0,1,0,0|2,0,0]=4 20959 B16R1.248 COC(=O)C[C@H]1CCN(C1)CCCCCF 269982a_100020634416_100000729378 [0,1,0,1,0,0|2,0,0]=4 20960 B16R1.248 COC(=O)C[C@H]1CCN(C1)CCCCCO 2230a_100020634416_100000746330 [0,1,0,1,0,0|2,0,0]=4 20961 B16R1.248 COC(=O)C[C@H]1CCN(C1)CCCCCO 269982a_100020634416_100000746330 [0,1,0,1,0,0|2,0,0]=4 20962 B16R1.248 COCCCCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100000730899 [0,1,0,1,0,0|2,0,0]=4 20963 B16R1.248 COCCCCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100000730899 [0,1,0,1,0,0|2,0,0]=4 20964 B16R1.264 CCCCCCN1CCCC(C1)C(=O)NC 2230a_100000754358_100000210314 [0,1,0,1,0,0|2,0,0]=4 20965 B16R1.264 CCCCCCN1CCCC(C1)C(=O)NC 269982a_100000754358_100000210757 [0,1,0,1,0,0|2,0,0]=4 20966 B16R1.264 CCCCCCN1CCCC(C1)C(=O)NC 34a_100000754358_100000210314 [0,1,0,1,0,0|2,0,0]=4 20967 B16R1.264 CCCCCCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100000210314 [0,1,0,1,0,0|1,0,0]=3 20968 B16R1.264 CCCCCCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100000210757 [0,1,0,1,0,0|1,0,0]=3 20969 B16R1.264 CCCCCCN1CCOC(C1)C(=O)OC 2230a_100000751517_100000210314 [0,1,0,1,0,0|2,0,0]=4 20970 B16R1.264 CCCCCCN1CCOC(C1)C(=O)OC 269982a_100000751517_100000210757 [0,1,0,1,0,0|2,0,0]=4 20971 B16R1.264 CCCCCCN1CCOC(C1)C(=O)OC 34a_100000751517_100000210314 [0,1,0,1,0,0|2,0,0]=4 20972 B16R1.264 CCCCCOC1CCCC(C1)C(=O)OC 34a_100012184231_100000718602 [0,1,0,1,0,0|1,0,0]=3 20973 B16R1.264 CCCCCOC1CCCC(C1)C(=O)OC 7a_100012184231_100000210326 [0,1,0,1,0,0|1,0,0]=3 20974 B16R1.264 CCCCOCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100011995733 [0,1,0,1,0,0|2,0,0]=4 20975 B16R1.264 CCCCOCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100011995733 [0,1,0,1,0,0|2,0,0]=4 20976 B16R1.264 CCCOCCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100011215938 [0,1,0,1,0,0|2,0,0]=4 20977 B16R1.264 CCCOCCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100011215938 [0,1,0,1,0,0|2,0,0]=4 20978 B16R1.264 CCOCCCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100012232248 [0,1,0,1,0,0|2,0,0]=4 20979 B16R1.264 CCOCCCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100012232248 [0,1,0,1,0,0|2,0,0]=4 20980 B16R1.264 CCOCCOC1CCCC(C1)C(=O)OC 34a_100012184231_100000210147 [0,1,0,1,0,0|2,0,0]=4 20981 B16R1.264 CCOCCOC1CCCC(C1)C(=O)OC 7a_100012184231_100011215890 [0,1,0,1,0,0|2,0,0]=4 20982 B16R1.264 CCSCCOC1CCCC(C1)C(=O)OC 34a_100012184231_100000757381 [0,1,0,1,0,0|2,0,0]=4 20983 B16R1.264 CCSCCOC1CCCC(C1)C(=O)OC 7a_100012184231_100000757381 [0,1,0,1,0,0|2,0,0]=4 20984 B16R1.264 COC(=O)C1CCCC(C1)OCCCCF 34a_100012184231_100000729493 [0,1,0,1,0,0|2,0,0]=4 20985 B16R1.264 COC(=O)C1CCCC(C1)OCCCCF 7a_100012184231_100000729493 [0,1,0,1,0,0|2,0,0]=4 20986 B16R1.264 COC(=O)C1CCCC(C1)OCCCCO 34a_100012184231_100011216708 [0,1,0,1,0,0|2,0,0]=4 20987 B16R1.264 COC(=O)C1CCCC(C1)OCCCCO 7a_100012184231_100000210776 [0,1,0,1,0,0|2,0,0]=4 20988 B16R1.264 COC(=O)[C@H]1CCCN(C1)CCCCCF 2230a_100016988859_100000729378 [0,1,0,1,0,0|2,0,0]=4 20989 B16R1.264 COC(=O)[C@H]1CCCN(C1)CCCCCF 269982a_100016988859_100000729378 [0,1,0,1,0,0|2,0,0]=4 20990 B16R1.264 COC(=O)[C@H]1CCCN(C1)CCCCCO 2230a_100016988859_100000746330 [0,1,0,1,0,0|2,0,0]=4 20991 B16R1.264 COC(=O)[C@H]1CCCN(C1)CCCCCO 269982a_100016988859_100000746330 [0,1,0,1,0,0|2,0,0]=4 20992 B16R1.264 COCCCCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100000730899 [0,1,0,1,0,0|2,0,0]=4 20993 B16R1.264 COCCCCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100000730899 [0,1,0,1,0,0|2,0,0]=4 20994 B16R1.264 COCCCOC1CCCC(C1)C(=O)OC 34a_100012184231_100000740836 [0,1,0,1,0,0|2,0,0]=4 20995 B16R1.264 COCCCOC1CCCC(C1)C(=O)OC 7a_100012184231_100000740836 [0,1,0,1,0,0|2,0,0]=4 20996 B16R1.653 CCCC1CCC(C1)NCCCC(=O)NC 270004a_100000740002_200012087856 [0,1,0,1,0,0|2,0,0]=4 20997 B16R1.653 CCO[C@H]1CCN(C1)CCCCC(=O)OC 2230a_100011787710_100000204269 [0,1,0,1,0,0|2,0,0]=4 20998 B16R1.653 CCO[C@H]1CCN(C1)CCCCC(=O)OC 269982a_100011787710_100000204269 [0,1,0,1,0,0|2,0,0]=4 20999 B16R1.653 CCO[C@H]1CCN(C1)CCCCC(=O)OC 34a_100011787710_100000204269 [0,1,0,1,0,0|2,0,0]=4 21000 B16R1.653 COC(=O)CCCCN1CCC(C1)CCO 2230a_100016987287_100000204269 [0,1,0,1,0,0|2,0,0]=4 21001 B16R1.653 COC(=O)CCCCN1CCC(C1)CCO 269982a_100016987287_100000204269 [0,1,0,1,0,0|2,0,0]=4 21002 B16R1.653 COC(=O)CCCCN1CCC(C1)CCO 34a_100016987287_100000204269 [0,1,0,1,0,0|2,0,0]=4 21003 B16R1.653 COCC1CCN(C1)CCCCC(=O)OC 2230a_100025706693_100000204269 [0,1,0,1,0,0|2,0,0]=4 21004 B16R1.653 COCC1CCN(C1)CCCCC(=O)OC 269982a_100025706693_100000204269 [0,1,0,1,0,0|2,0,0]=4 21005 B16R1.653 COCC1CCN(C1)CCCCC(=O)OC 34a_100025706693_100000204269 [0,1,0,1,0,0|2,0,0]=4 21006 B16R1.687 CCCCCCC(C)NCC1CNC(=O)C1 2230a_100016993742_100011215978 [0,1,0,1,0,0|2,0,0]=4 21007 B16R1.687 CCCCCCC(C)NCC1CNC(=O)C1 34a_100016993742_100011215978 [0,1,0,1,0,0|2,0,0]=4 21008 B16R1.687 CCCCCCC(C)NCC1COC(=O)O1 34a_100000210919_100000073702 [0,1,0,1,0,0|2,0,0]=4 21009 B16R1.687 CCCCCCC(C)NC[C@H]1COC(=O)N1 2230a_100000210919_100015307671 [0,1,0,1,0,0|2,0,0]=4 21010 B16R1.687 CCCCCCC(C)NC[C@H]1COC(=O)N1 34a_100000210919_100015307671 [0,1,0,1,0,0|2,0,0]=4 21011 B16R1.687 CCCCCCC(C)OCC1CNC(=O)C1 34a_100016041077_100011215978 [0,1,0,1,0,0|2,0,0]=4 21012 B16R1.687 CCCCCCC(C)OCC1COC(=O)O1 34a_100000210265_100000073702 [0,1,0,1,0,0|2,0,0]=4 21013 B16R1.687 CCCCCCC(C)OC[C@H]1COC(=O)N1 34a_100000210265_100015307671 [0,1,0,1,0,0|2,0,0]=4 21014 B16R1.687 CCCCCCC(C)OC[C@H]1COC(=O)N1 7a_100000210265_100015307671 [0,1,0,1,0,0|2,0,0]=4 21015 B16R1.687 CCCCCCC(C)SCC1COC(=O)O1 62a_100000073702_100011215978 [0,1,0,1,0,0|2,0,0]=4 21016 B16R1.687 CCCCCCC(C)SCC1COC(=O)O1 62a_100011215978_100000073702 [0,1,0,1,0,0|2,0,0]=4 21017 B16R1.687 CCCCCCC(C)SC[C@H]1COC(=O)N1 62a_100011215978_100015307671 [0,1,0,1,0,0|2,0,0]=4 21018 B16R1.687 CCCCCCC(C)SC[C@H]1COC(=O)N1 62a_100015307671_100011215978 [0,1,0,1,0,0|2,0,0]=4 21019 B16R1.1015 CCCOC1CN(C1)CCCCC(=O)OC 269982a_200020626125_100000204269 [0,1,0,1,0,0|2,0,0]=4 21020 B16R1.1015 CCCOC1CN(C1)CCCCC(=O)OC 34a_200020626125_100000204269 [0,1,0,1,0,0|2,0,0]=4 21021 B16R1.1132 CNC(=O)CCCNC(C)C1CCCCC1 269862a_100000740002_100000210989 [0,1,0,1,0,0|2,0,0]=4 21022 B16R1.1132 CNC(=O)CCCN[C@H](C)C1CCCCC1 2230a_100025707633_100000741757 [0,1,0,1,0,0|2,0,0]=4 21023 B16R1.1132 CNC(=O)CCCN[C@H](C)C1CCCCC1 34a_100025707633_100000741757 [0,1,0,1,0,0|2,0,0]=4 21024 B16R1.1132 CNC(=O)CCCOC(C)C1CCCCC1 34a_100011216961_100000741757 [0,1,0,1,0,0|2,0,0]=4 21025 B16R1.1132 CNC(=O)CCCOC(C)C1CCCCC1 7a_100011216961_100000741757 [0,1,0,1,0,0|2,0,0]=4 21026 B16R1.1132 CNC(=O)CCOC[C@H](N)C1CCCCC1 34a_100009817630_100012179268 [0,1,0,1,0,0|2,0,0]=4 21027 B16R1.1132 CNC(=O)COCCC(N)C1CCCCC1 34a_200020622111_100000183359 [0,1,0,1,0,0|2,0,0]=4 21028 B16R1.1132 COC(=O)CCCCC(=O)C1CCCCC1 1458a_100000210647_100000204269 [0,1,0,1,0,0|0,0,1]=3 21029 B16R1.1132 COC(=O)CCCCC(=O)C1CCCCC1 1458a_100000695723_100000210327 [0,1,0,1,0,0|0,0,1]=3 21030 B16R1.1132 COC(=O)CCCCC(=O)C1CCCCO1 1458a_100000748299_100000204269 [0,1,0,1,0,0|1,0,1]=4 21031 B16R1.1132 COC(=O)CCCCC(=O)C1CCCOC1 1458a_100000695723_100000693364 [0,1,0,1,0,0|1,0,1]=4 21032 B16R1.1132 COC(=O)CCCCC(=O)C1CCCOC1 1458a_100000741522_100000204269 [0,1,0,1,0,0|1,0,1]=4 21033 B16R1.1132 COC(=O)CCCCC(=O)C1CCOCC1 1458a_100000195482_100000204269 [0,1,0,1,0,0|1,0,1]=4 21034 B16R1.1132 COC(=O)CCCCC(=O)C1CCOCC1 1458a_100000695723_100011324220 [0,1,0,1,0,0|1,0,1]=4 21035 B16R1.1132 COC(=O)CCCCC(=O)C1CCSCC1 1458a_100000755232_100000204269 [0,1,0,1,0,0|1,0,1]=4 21036 B16R1.1132 COC(=O)CCCCN(C)C1CCCCC1 2230a_100000207522_100000204269 [0,1,0,1,0,0|1,0,0]=3 21037 B16R1.1132 COC(=O)CCCCN(C)C1CCCCC1 269982a_100000207522_100000204269 [0,1,0,1,0,0|1,0,0]=3 21038 B16R1.1132 COC(=O)CCCCN(C)C1CCCCC1 34a_100000207522_100000204269 [0,1,0,1,0,0|1,0,0]=3 21039 B16R1.1132 COC(=O)CCCCN(C)C1CCOCC1 2230a_100020587155_100000204269 [0,1,0,1,0,0|2,0,0]=4 21040 B16R1.1132 COC(=O)CCCCN(C)C1CCOCC1 269982a_100020587155_100000204269 [0,1,0,1,0,0|2,0,0]=4 21041 B16R1.1132 COC(=O)CCCCN(C)C1CCOCC1 34a_100020587155_100000204269 [0,1,0,1,0,0|2,0,0]=4 21042 B16R1.1132 COC(=O)CCCCN(C)C1CCSCC1 2230a_100015184757_100000204269 [0,1,0,1,0,0|2,0,0]=4 21043 B16R1.1132 COC(=O)CCCCN(C)C1CCSCC1 269982a_100015184757_100000204269 [0,1,0,1,0,0|2,0,0]=4 21044 B16R1.1132 COC(=O)CCCCN(C)C1CCSCC1 34a_100015184757_100000204269 [0,1,0,1,0,0|2,0,0]=4 21045 B16R1.1132 COC(=O)CCCNC(=O)C1CCCCC1 188690a_100000184769_100000210647 [0,1,0,1,0,0|1,0,1]=4 21046 B16R1.1132 COC(=O)CCCN[C@H](C)C1CCCCC1 2230a_100025707633_100011218270 [0,1,0,1,0,0|1,0,0]=3 21047 B16R1.1132 COC(=O)CCCN[C@H](C)C1CCCCC1 34a_100025707633_100000742333 [0,1,0,1,0,0|1,0,0]=3 21048 B16R1.1132 COC(=O)CCCOC(C)C1CCCCC1 34a_100011216961_100000742333 [0,1,0,1,0,0|1,0,0]=3 21049 B16R1.1132 COC(=O)CCCOC(C)C1CCCCC1 7a_100011216961_100011218270 [0,1,0,1,0,0|1,0,0]=3 21050 B16R1.1132 COC(=O)CCCOC(C)C1CCCNC1 34a_100000740858_100000742333 [0,1,0,1,0,0|2,0,0]=4 21051 B16R1.1132 COC(=O)CCCOC(C)C1CCNCC1 34a_100011728446_100000742333 [0,1,0,1,0,0|2,0,0]=4 21052 B16R1.1132 COC(=O)CCCO[C@H](C)C1CCOCC1 34a_100000703848_100000742333 [0,1,0,1,0,0|2,0,0]=4 21053 B16R1.1132 COC(=O)CCCO[C@H](C)C1CCOCC1 7a_100000703848_100011218270 [0,1,0,1,0,0|2,0,0]=4 21054 B16R1.1132 COC(=O)CCOC[C@H](N)C1CCCCC1 34a_100009817630_100000742370 [0,1,0,1,0,0|1,0,0]=3 21055 B16R1.1132 COC(=O)CCSCC(=O)C1CCCCC1 62a_100000204255_100000241979 [0,1,0,1,0,0|1,0,1]=4 21056 B16R1.1132 COC(=O)CCSCC(=O)C1CCCCC1 62a_100000241979_100000204255 [0,1,0,1,0,0|1,0,1]=4 21057 B16R1.1132 COC(=O)COCCC(=O)C1CCCCC1 1458a_100000210647_100000090808 [0,1,0,1,0,0|1,0,1]=4 21058 B16R1.1132 COC(=O)COCCC(N)C1CCCCC1 34a_200020622111_100000747449 [0,1,0,1,0,0|1,0,0]=3 21059 B16R1.1132 COC(=O)COCCN(C)C1CCCCC1 2230a_100000207522_100000090808 [0,1,0,1,0,0|2,0,0]=4 21060 B16R1.1132 COC(=O)COCCN(C)C1CCCCC1 34a_100000207522_100000090808 [0,1,0,1,0,0|2,0,0]=4 21061 B16R1.1132 COC(=O)NCCCC(=O)C1CCCCC1 1458a_100000753017_100000210327 [0,1,0,1,0,0|1,0,1]=4 21062 B16R1.1174 CNC(=O)CCCNC(C)CC1CCCC1 270004a_100000740002_100000692464 [0,1,0,1,0,0|2,0,0]=4 21063 B16R1.1174 COC(=O)CCCCC(=O)CC1CCCC1 1458a_100000210891_100000204269 [0,1,0,1,0,0|0,0,1]=3 21064 B16R1.1174 COC(=O)CCCCC(=O)CC1CCCC1 1458a_100000695723_100000740388 [0,1,0,1,0,0|0,0,1]=3 21065 B16R1.1174 COC(=O)CCCCC(=O)CC1CCCO1 1458a_100000695723_100000203698 [0,1,0,1,0,0|1,0,1]=4 21066 B16R1.1174 COC(=O)CCCCC(=O)CC1CCOC1 1458a_100000695723_100000702531 [0,1,0,1,0,0|1,0,1]=4 21067 B16R1.1174 COC(=O)CCCCC(=O)CC1CCOC1 1458a_100011218419_100000204269 [0,1,0,1,0,0|1,0,1]=4 21068 B16R1.1174 COC(=O)CCCCC(=O)CN1CCCC1 1458a_100000740243_100000204269 [0,1,0,1,0,0|1,0,1]=4 21069 B16R1.1174 COC(=O)CCCCC(=O)NC1CCCC1 11a_100000211070_100000695723 [0,1,0,1,0,0|1,0,1]=4 21070 B16R1.1174 COC(=O)CCCCC(=O)NC1CCCC1 1626a_100000211070_100000695723 [0,1,0,1,0,0|1,0,1]=4 21071 B16R1.1174 COC(=O)CCCCC(=O)NC1CCCC1 240690a_100000211070_100000695723 [0,1,0,1,0,0|1,0,1]=4 21072 B16R1.1174 COC(=O)CCCCC(=O)NC1CCCC1 527a_100000211070_100000695723 [0,1,0,1,0,0|1,0,1]=4 21073 B16R1.1174 COC(=O)CCCCN(C)CC1CCCO1 2230a_100102946541_100000204269 [0,1,0,1,0,0|2,0,0]=4 21074 B16R1.1174 COC(=O)CCCCN(C)CC1CCCO1 269982a_100102946541_100000204269 [0,1,0,1,0,0|2,0,0]=4 21075 B16R1.1174 COC(=O)CCCCN(C)CC1CCCO1 34a_100102946541_100000204269 [0,1,0,1,0,0|2,0,0]=4 21076 B16R1.1174 COC(=O)CCCCN(C)CC1CCOC1 2230a_100000684583_100000204269 [0,1,0,1,0,0|2,0,0]=4 21077 B16R1.1174 COC(=O)CCCCN(C)CC1CCOC1 269982a_100000684583_100000204269 [0,1,0,1,0,0|2,0,0]=4 21078 B16R1.1174 COC(=O)CCCCN(C)CC1CCOC1 34a_100000684583_100000204269 [0,1,0,1,0,0|2,0,0]=4 21079 B16R1.1174 COC(=O)CCCNC(=O)CC1CCCC1 188690a_100000184769_100000210891 [0,1,0,1,0,0|1,0,1]=4 21080 B16R1.1174 COC(=O)CCOCC(C)CN1CCCC1 7a_200011934648_100000204255 [0,1,0,1,0,0|2,0,0]=4 21081 B16R1.1174 COC(=O)COCCC(=O)CC1CCCC1 1458a_100000210891_100000090808 [0,1,0,1,0,0|1,0,1]=4 21082 B16R1.1174 COC(=O)NCCCC(=O)CC1CCCC1 1458a_100000753017_100000740388 [0,1,0,1,0,0|1,0,1]=4 21083 B16R1.4612 CCCCCCC(C)CCOC1CCC1=O 34a_200011024964_100009892977 [0,1,0,1,0,0|2,0,0]=4 21084 B16R1.4612 CCCCCCC(C)CCOC1CCC1=O 7a_200011024964_100009892977 [0,1,0,1,0,0|2,0,0]=4 21085 B16R1.4612 CCCCCCC(C)NCCC1CCC1=O 2230a_100000210919_200016118888 [0,1,0,1,0,0|2,0,0]=4 21086 B16R1.4612 CCCCCCC(C)OCCC1CCC1=O 7a_100000210265_200016118888 [0,1,0,1,0,0|2,0,0]=4 21087 B16R1.4612 CCCCCCC(C)SCCC1CCC1=O 62a_100011215978_200016118888 [0,1,0,1,0,0|2,0,0]=4 21088 B16R1.4612 CCCCCCC(C)SCCC1CCC1=O 62a_200016118888_100011215978 [0,1,0,1,0,0|2,0,0]=4 21089 B16R1.16922 COC(=O)CCCCC(=O)C1CCCC1C 1458a_100000690547_100000204269 [0,1,0,1,0,0|0,0,1]=3 21090 B16R1.16922 COC(=O)CCCCC(=O)N1CCC[C@@H]1C 240690a_100020605311_100000695723 [0,1,0,1,0,0|1,0,1]=4 21091 B16R1.16922 COC(=O)CCCCC(=O)N1CCC[C@@H]1C 527a_100020605311_100000695723 [0,1,0,1,0,0|1,0,1]=4 21092 B16R1.16922 COC(=O)CCCCC(=O)N1CCC[C@H]1C 11a_100015189458_100000695723 [0,1,0,1,0,0|1,0,1]=4 21093 B16R1.16922 COC(=O)CCCCC(=O)N1CCC[C@H]1C 240690a_100015189458_100000695723 [0,1,0,1,0,0|1,0,1]=4 21094 B16R1.16922 COC(=O)CCCCC(=O)N1CCC[C@H]1C 527a_100015189458_100000695723 [0,1,0,1,0,0|1,0,1]=4 21095 B16R1.16922 COC(=O)CCCCC(=O)[C@@H]1CCCN1C 1458a_100009816429_100000204269 [0,1,0,1,0,0|1,0,1]=4 21096 B16R1.16922 COC(=O)CCCNC(=O)C1CCCC1C 188690a_100000184769_100000690547 [0,1,0,1,0,0|1,0,1]=4 21097 B16R1.16922 COC(=O)CCCO[C@@H](C)[C@@H]1CCCN1C 34a_100160487421_100000742333 [0,1,0,1,0,0|2,0,0]=4 21098 B16R1.16922 COC(=O)COCCC(=O)C1CCCC1C 1458a_100000690547_100000090808 [0,1,0,1,0,0|1,0,1]=4 21099 B16R1.17234 COC(=O)CCCCC(=O)NCC1CCC1 11a_100000738700_100000695723 [0,1,0,1,0,0|1,0,1]=4 21100 B16R1.17234 COC(=O)CCCCC(=O)NCC1CCC1 1626a_100000738700_100000695723 [0,1,0,1,0,0|1,0,1]=4 21101 B16R1.17234 COC(=O)CCCCC(=O)NCC1CCC1 240690a_100000738700_100000695723 [0,1,0,1,0,0|1,0,1]=4 21102 B16R1.17234 COC(=O)CCCCC(=O)NCC1CCC1 527a_100000738700_100000695723 [0,1,0,1,0,0|1,0,1]=4 21103 B16R1.17235 COC(=O)CCCCC(=O)CCCC1CO1 1458a_100000695723_100000733510 [0,1,0,1,0,0|1,0,1]=4 21104 B16R1.17235 COC(=O)CCCCC(=O)CSCC1CC1 1458a_200011316215_100000204269 [0,1,0,1,0,0|1,0,1]=4 21105 B16R1.17235 COC(=O)CCCCC(=O)NCCC1CC1 1626a_100000764129_100000695723 [0,1,0,1,0,0|1,0,1]=4 21106 B16R1.17235 COC(=O)CCCCC(=O)NCCC1CC1 240690a_100000764129_100000695723 [0,1,0,1,0,0|1,0,1]=4 21107 B16R1.17235 COC(=O)CCCCC(=O)NCCC1CC1 527a_100000764129_100000695723 [0,1,0,1,0,0|1,0,1]=4 21108 B16R1.18259 COC(=O)CCCCN1CCCCC(C1)O 2230a_100025706797_100000204269 [0,1,0,1,0,0|1,0,0]=3 21109 B16R1.18259 COC(=O)CCCCN1CCCCC(C1)O 269982a_100025706797_100000204269 [0,1,0,1,0,0|1,0,0]=3 21110 B16R1.18259 COC(=O)CCCCN1CCOC[C@@H](C1)O 2230a_100016073750_100000204269 [0,1,0,1,0,0|2,0,0]=4 21111 B16R1.18259 COC(=O)CCCCN1CCOC[C@@H](C1)O 269982a_100016073750_100000204269 [0,1,0,1,0,0|2,0,0]=4 21112 B16R1.18259 COC(=O)COCCN1CCCCC(C1)O 2230a_100025706797_100000090808 [0,1,0,1,0,0|2,0,0]=4 21113 B16R1.26606 CCCCCCC(=O)N1CC[C@H]1C(=O)OC 11a_102516456887_100102632555 [0,1,0,1,0,0|1,0,1]=4 21114 B16R1.26606 CCCCCCC(=O)N1CC[C@H]1C(=O)OC 1626a_102516456887_100102632555 [0,1,0,1,0,0|1,0,1]=4 21115 B16R1.26606 CCCCCCC(=O)N1CC[C@H]1C(=O)OC 240690a_102516456887_100102632555 [0,1,0,1,0,0|1,0,1]=4 21116 B16R1.26606 CCCCCCC(=O)N1CC[C@H]1C(=O)OC 527a_102516456887_100102632555 [0,1,0,1,0,0|1,0,1]=4 21117 B16R1.26606 CCCCCCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100000210757 [0,1,0,1,0,0|0,0,1]=3 21118 B16R1.26606 CCCCCCC(C)N1CC[C@H]1C(=O)OC 2230a_102516456887_100011215978 [0,1,0,1,0,0|1,0,0]=3 21119 B16R1.26606 CCCCCCC(C)N1CC[C@H]1C(=O)OC 269982a_102516456887_100011215978 [0,1,0,1,0,0|1,0,0]=3 21120 B16R1.26606 CCCCCCC(C)N1CC[C@H]1C(=O)OC 270004a_102516456887_100000210826 [0,1,0,1,0,0|1,0,0]=3 21121 B16R1.26606 CCCCCNC(=O)[C@H]1CC[C@H]1C(=O)OC 11a_100000209983_100009908320 [0,1,0,1,0,0|1,0,1]=4 21122 B16R1.26606 CCCCCNC(=O)[C@H]1CC[C@H]1C(=O)OC 240690a_100000209983_100009908320 [0,1,0,1,0,0|1,0,1]=4 21123 B16R1.26606 CCCCOCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100011995733 [0,1,0,1,0,0|1,0,1]=4 21124 B16R1.26606 CCCOCCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100011215938 [0,1,0,1,0,0|1,0,1]=4 21125 B16R1.26606 CCOCCCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100012232248 [0,1,0,1,0,0|1,0,1]=4 21126 B16R1.26606 COC(=O)[C@@H]1CC[C@@H]1C(=O)CCCCCF 1458a_100009908320_100000729378 [0,1,0,1,0,0|1,0,1]=4 21127 B16R1.26606 COC(=O)[C@@H]1CC[C@@H]1C(=O)CCCCCO 1458a_100009908320_100000746330 [0,1,0,1,0,0|1,0,1]=4 21128 B16R1.26606 COCCCCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100000755781 [0,1,0,1,0,0|1,0,1]=4 21129 B16R1.81969 CNC(=O)CCCNC1(CCCCCC1)C 2230a_100000704638_100000741757 [0,1,0,1,0,0|2,0,0]=4 21130 B16R1.81969 CNC(=O)CCCNC1(CCCCCC1)C 34a_100000704638_100000741757 [0,1,0,1,0,0|2,0,0]=4 21131 B16R1.81969 CNC(=O)CCCOC1(CCCCCC1)C 34a_100000708895_100000741757 [0,1,0,1,0,0|2,0,0]=4 21132 B16R1.81969 CNC(=O)CCCOC1(CCCCCC1)C 7a_100000708895_100000741757 [0,1,0,1,0,0|2,0,0]=4 21133 B16R1.81969 COC(=O)CCCNC1(CCCCCC1)C 2230a_100000704638_100011218270 [0,1,0,1,0,0|1,0,0]=3 21134 B16R1.81969 COC(=O)CCCNC1(CCCCCC1)C 34a_100000704638_100000742333 [0,1,0,1,0,0|1,0,0]=3 21135 B16R1.81969 COC(=O)CCCOC1(CCCCCC1)C 34a_100000708895_100000742333 [0,1,0,1,0,0|1,0,0]=3 21136 B16R1.81969 COC(=O)CCCOC1(CCCCCC1)C 7a_100000708895_100011218270 [0,1,0,1,0,0|1,0,0]=3 21137 B16R1.81969 COC(=O)CCCOC1(CCCNCC1)C 34a_100000723723_100000742333 [0,1,0,1,0,0|2,0,0]=4 21138 B16R1.87 CCCCC(C)NCC1CCCC(=O)N1C 2230a_200010383782_200011215066 [0,1,0,1,0,0|2,0,0]=4 21139 B16R1.87 CCCCC(C)NCC1CCCC(=O)N1C 270004a_200010383782_100000210087 [0,1,0,1,0,0|2,0,0]=4 21140 B16R1.87 CCCCC(C)NCC1CCCC(=O)N1C 34a_200010383782_200011215066 [0,1,0,1,0,0|2,0,0]=4 21141 B16R1.1235 CCCCN1CCCC(C1)CCC(=O)NC 2230a_100015187509_100000210211 [0,1,0,1,0,0|2,0,0]=4 21142 B16R1.1235 CCCCN1CCCC(C1)CCC(=O)NC 269982a_100015187509_100000210211 [0,1,0,1,0,0|2,0,0]=4 21143 B16R1.1235 CCCCN1CCCC(C1)CCC(=O)NC 34a_100015187509_100000210210 [0,1,0,1,0,0|2,0,0]=4 21144 B16R1.1235 CCCCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100000210211 [0,1,0,1,0,0|1,0,0]=3 21145 B16R1.1235 CCCCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100000210211 [0,1,0,1,0,0|1,0,0]=3 21146 B16R1.1235 CCCCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100000210210 [0,1,0,1,0,0|1,0,0]=3 21147 B16R1.1235 CCCOC1CCCN(C1)CCC(=O)OC 2230a_100000743837_100000204255 [0,1,0,1,0,0|2,0,0]=4 21148 B16R1.1235 CCCOC1CCCN(C1)CCC(=O)OC 269982a_100000743837_100000204255 [0,1,0,1,0,0|2,0,0]=4 21149 B16R1.1235 CCCOC1CCCN(C1)CCC(=O)OC 34a_100000743837_100000742370 [0,1,0,1,0,0|2,0,0]=4 21150 B16R1.1235 CCOCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100000739092 [0,1,0,1,0,0|2,0,0]=4 21151 B16R1.1235 COC(=O)CCC1CCCN(C1)CCCF 2230a_100015184279_100011934791 [0,1,0,1,0,0|2,0,0]=4 21152 B16R1.1235 COC(=O)CCC1CCCN(C1)CCCF 269982a_100015184279_100011934791 [0,1,0,1,0,0|2,0,0]=4 21153 B16R1.1235 COC(=O)CCC1CCCN(C1)CCCF 34a_100015184279_100011934791 [0,1,0,1,0,0|2,0,0]=4 21154 B16R1.1235 COC(=O)CCC1CCCN(C1)CCCO 2230a_100015184279_100000230001 [0,1,0,1,0,0|2,0,0]=4 21155 B16R1.1235 COC(=O)CCC1CCCN(C1)CCCO 269982a_100015184279_100011215043 [0,1,0,1,0,0|2,0,0]=4 21156 B16R1.1235 COC(=O)CCC1CCCN(C1)CCCO 34a_100015184279_100000230001 [0,1,0,1,0,0|2,0,0]=4 21157 B16R1.1235 COC(=O)CCC1CCCN(C1)CCSC 2230a_100015184279_100000751147 [0,1,0,1,0,0|2,0,0]=4 21158 B16R1.1235 COC(=O)CCC1CCCN(C1)CCSC 269982a_100015184279_100000212216 [0,1,0,1,0,0|2,0,0]=4 21159 B16R1.1235 COC(=O)CCC1CCCN(C1)CCSC 34a_100015184279_100000212216 [0,1,0,1,0,0|2,0,0]=4 21160 B16R1.1235 COC(=O)CCN1CCCC(C1)CCCO 2230a_100150707839_100000204255 [0,1,0,1,0,0|2,0,0]=4 21161 B16R1.1235 COC(=O)CCN1CCCC(C1)CCCO 269982a_100150707839_100000204255 [0,1,0,1,0,0|2,0,0]=4 21162 B16R1.1235 COC(=O)CCN1CCCC(C1)CCCO 34a_100150707839_100000742370 [0,1,0,1,0,0|2,0,0]=4 21163 B16R1.1235 COCCC1CCCN(C1)CCC(=O)OC 2230a_100011653411_100000204255 [0,1,0,1,0,0|2,0,0]=4 21164 B16R1.1235 COCCC1CCCN(C1)CCC(=O)OC 269982a_100011653411_100000204255 [0,1,0,1,0,0|2,0,0]=4 21165 B16R1.1235 COCCC1CCCN(C1)CCC(=O)OC 34a_100011653411_100000742370 [0,1,0,1,0,0|2,0,0]=4 21166 B16R1.1235 COCCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100011201679 [0,1,0,1,0,0|2,0,0]=4 21167 B16R1.1235 COCCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100000233755 [0,1,0,1,0,0|2,0,0]=4 21168 B16R1.1235 COCCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100011201679 [0,1,0,1,0,0|2,0,0]=4 21169 B16R1.1500 CCCCC(=O)C1CCCCN1C(=O)OC 1458a_100000236124_100000210211 [0,1,0,1,0,0|1,0,1]=4 21170 B16R1.1500 CCCCC(=O)N1CCCCC1C(=O)OC 11a_100000734855_100000210183 [0,1,0,1,0,0|1,0,1]=4 21171 B16R1.1500 CCCCC(=O)N1CCCCC1C(=O)OC 1626a_100000734855_100000210183 [0,1,0,1,0,0|1,0,1]=4 21172 B16R1.1500 CCCCC(=O)N1CCCCC1C(=O)OC 240690a_100000734855_100000210183 [0,1,0,1,0,0|1,0,1]=4 21173 B16R1.1500 CCCCC(=O)N1CCCCC1C(=O)OC 527a_100000734855_100000210183 [0,1,0,1,0,0|1,0,1]=4 21174 B16R1.1500 CCCCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100000210211 [0,1,0,1,0,0|0,0,1]=3 21175 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)NC 2230a_100011209383_200011215066 [0,1,0,1,0,0|2,0,0]=4 21176 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)NC 269982a_100011209383_200011215066 [0,1,0,1,0,0|2,0,0]=4 21177 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)NC 270004a_100011209383_100000210087 [0,1,0,1,0,0|2,0,0]=4 21178 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)NC 34a_100011209383_200011215066 [0,1,0,1,0,0|2,0,0]=4 21179 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)OC 2230a_100000734855_200011215066 [0,1,0,1,0,0|1,0,0]=3 21180 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)OC 269982a_100000734855_200011215066 [0,1,0,1,0,0|1,0,0]=3 21181 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)OC 270004a_100000734855_100000210087 [0,1,0,1,0,0|1,0,0]=3 21182 B16R1.1500 CCCCC(C)N1CCCCC1C(=O)OC 34a_100000734855_200011215066 [0,1,0,1,0,0|1,0,0]=3 21183 B16R1.1500 CCCCC(C)N1CCOCC1C(=O)OC 2230a_100000765174_200011215066 [0,1,0,1,0,0|2,0,0]=4 21184 B16R1.1500 CCCCC(C)N1CCOCC1C(=O)OC 270004a_100000765174_100000210087 [0,1,0,1,0,0|2,0,0]=4 21185 B16R1.1500 CCCCC(C)N1CCOCC1C(=O)OC 34a_100000765174_200011215066 [0,1,0,1,0,0|2,0,0]=4 21186 B16R1.1500 CCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 11a_100020643023_100009817520 [0,1,0,1,0,0|1,0,1]=4 21187 B16R1.1500 CCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 240690a_100020643023_100009817520 [0,1,0,1,0,0|1,0,1]=4 21188 B16R1.1500 CCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 527a_100020643023_100009817520 [0,1,0,1,0,0|1,0,1]=4 21189 B16R1.1500 CCSCC(C)N1CCCCC1C(=O)OC 270004a_100000734855_200011216171 [0,1,0,1,0,0|2,0,0]=4 21190 B16R1.1500 COC(=O)C1CCCCN1C(C)CCSC 270004a_100000734855_100011217047 [0,1,0,1,0,0|2,0,0]=4 21191 B16R1.1500 COC(=O)[C@H]1CCCC[C@H]1C(=O)CCCF 1458a_100009817520_100011934791 [0,1,0,1,0,0|1,0,1]=4 21192 B16R1.1500 COC(=O)[C@H]1CCCC[C@H]1C(=O)CCCO 1458a_100009817520_100011215043 [0,1,0,1,0,0|1,0,1]=4 21193 B16R1.1500 COC(=O)[C@H]1CCCC[C@H]1C(=O)CCSC 1458a_100009817520_100000751147 [0,1,0,1,0,0|1,0,1]=4 21194 B16R1.1500 COCCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100000233755 [0,1,0,1,0,0|1,0,1]=4 21195 B16R1.1500 COCCC(C)N1CCCCC1C(=O)OC 270004a_100000734855_100000742357 [0,1,0,1,0,0|2,0,0]=4 21196 B16R1.1511 CCCCC(=O)N1CCC[C@@H]1CC(=O)OC 11a_100025726698_100000210183 [0,1,0,1,0,0|1,0,1]=4 21197 B16R1.1511 CCCCC(=O)N1CCC[C@@H]1CC(=O)OC 1626a_100025726698_100000210183 [0,1,0,1,0,0|1,0,1]=4 21198 B16R1.1511 CCCCC(=O)N1CCC[C@@H]1CC(=O)OC 240690a_100025726698_100000210183 [0,1,0,1,0,0|1,0,1]=4 21199 B16R1.1511 CCCCC(=O)N1CCC[C@@H]1CC(=O)OC 527a_100025726698_100000210183 [0,1,0,1,0,0|1,0,1]=4 21200 B16R1.1511 CCCCC(C)N1CCC[C@@H]1CC(=O)OC 2230a_100025726698_200011215066 [0,1,0,1,0,0|1,0,0]=3 21201 B16R1.1511 CCCCC(C)N1CCC[C@@H]1CC(=O)OC 269982a_100025726698_200011215066 [0,1,0,1,0,0|1,0,0]=3 21202 B16R1.1511 CCCCC(C)N1CCC[C@@H]1CC(=O)OC 270004a_100025726698_100000210087 [0,1,0,1,0,0|1,0,0]=3 21203 B16R1.1511 CCCCC(C)N1CCC[C@@H]1CC(=O)OC 34a_100025726698_200011215066 [0,1,0,1,0,0|1,0,0]=3 21204 B16R1.1511 CCSCC(C)N1CCC[C@@H]1CC(=O)OC 270004a_100025726698_200011216171 [0,1,0,1,0,0|2,0,0]=4 21205 B16R1.1511 COC(=O)C[C@H]1CCCN1C(C)CCSC 270004a_100025726698_100011217047 [0,1,0,1,0,0|2,0,0]=4 21206 B16R1.1511 COCCC(C)N1CCC[C@@H]1CC(=O)OC 270004a_100025726698_100000742357 [0,1,0,1,0,0|2,0,0]=4 21207 B16R1.4501 CCCCC(C)OC1CCCC1C(=O)OC 34a_200000081814_200011215066 [0,1,0,1,0,0|1,0,0]=3 21208 B16R1.4501 CCCCC(C)OC1CCCC1C(=O)OC 7a_200000081814_200011215066 [0,1,0,1,0,0|1,0,0]=3 21209 B16R1.4780 CCC1CN(CCN1CCCC(=O)OC)C 2230a_100011941019_100011218270 [0,1,0,1,0,0|2,0,0]=4 21210 B16R1.4780 CCC1CN(CCN1CCCC(=O)OC)C 269982a_100011941019_100011218270 [0,1,0,1,0,0|2,0,0]=4 21211 B16R1.5096 COC(=O)CCCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000204269 [0,1,0,1,0,0|2,0,0]=4 21212 B16R1.5096 COC(=O)CCCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000204269 [0,1,0,1,0,0|2,0,0]=4 21213 B16R1.5096 COC(=O)CCCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100000204269 [0,1,0,1,0,0|2,0,0]=4 21214 B16R1.5096 COC(=O)CCCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100000204269 [0,1,0,1,0,0|2,0,0]=4 21215 B16R1.5096 COC(=O)CCCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100000204269 [0,1,0,1,0,0|2,0,0]=4 21216 B16R1.7343 CCCCC(C)CCCCOC1CCC1=O 34a_200011021034_100009892977 [0,1,0,1,0,0|2,0,0]=4 21217 B16R1.7343 CCCCC(C)CCCCOC1CCC1=O 7a_200011021034_100009892977 [0,1,0,1,0,0|2,0,0]=4 21218 B16R1.16886 CNC(=O)CCCNC1CC(CCC1C)C 269862a_100000740002_100000034887 [0,1,0,1,0,0|2,0,0]=4 21219 B16R1.16886 CNC(=O)CCCNC1CC(CCC1C)C 270004a_100000740002_100000034887 [0,1,0,1,0,0|2,0,0]=4 21220 B16R1.16886 CNC(=O)CCCOC1CC(CCC1C)C 34a_100011217446_100000741757 [0,1,0,1,0,0|2,0,0]=4 21221 B16R1.16886 CNC(=O)CCCOC1CC(CCC1C)C 7a_100011217446_100000741757 [0,1,0,1,0,0|2,0,0]=4 21222 B16R1.16886 COC(=O)CCCCN1C[C@H](OC[C@H]1C)C 2230a_100016991869_100000204269 [0,1,0,1,0,0|2,0,0]=4 21223 B16R1.16886 COC(=O)CCCCN1C[C@H](OC[C@H]1C)C 269982a_100016991869_100000204269 [0,1,0,1,0,0|2,0,0]=4 21224 B16R1.16886 COC(=O)CCCCN1C[C@H](OC[C@H]1C)C 34a_100016991869_100000204269 [0,1,0,1,0,0|2,0,0]=4 21225 B16R1.16886 COC(=O)CCCOC1CC(CCC1C)C 34a_100011217446_100000742333 [0,1,0,1,0,0|1,0,0]=3 21226 B16R1.16886 COC(=O)CCCOC1CC(CCC1C)C 7a_100011217446_100011218270 [0,1,0,1,0,0|1,0,0]=3 21227 B16R1.17387 COC(=O)CCCCCCC(=O)C1CCC1 1458a_100000036694_100000749161 [0,1,0,1,0,0|0,0,1]=3 21228 B16R1.17387 COC(=O)CCCCCCC(=O)C1CCC1 1458a_100000209988_100009815986 [0,1,0,1,0,0|0,0,1]=3 21229 B16R1.17387 COC(=O)CCCCCCC(=O)C1CCO1 1458a_100000089072_100009815986 [0,1,0,1,0,0|1,0,1]=4 21230 B16R1.17387 COC(=O)CCCCCCC(=O)C1COC1 1458a_100000036694_100000687716 [0,1,0,1,0,0|1,0,1]=4 21231 B16R1.17387 COC(=O)CCCCCCC(=O)C1COC1 1458a_100000758290_100009815986 [0,1,0,1,0,0|1,0,1]=4 21232 B16R1.17387 COC(=O)CCCCCCC(=O)N1CCC1 11a_100000754969_100000036694 [0,1,0,1,0,0|1,0,1]=4 21233 B16R1.17387 COC(=O)CCCCCCC(=O)N1CCC1 240690a_100000754969_100000036694 [0,1,0,1,0,0|1,0,1]=4 21234 B16R1.17387 COC(=O)CCCCCCN(C)C1CCC1 2230a_100000758072_100009815986 [0,1,0,1,0,0|1,0,0]=3 21235 B16R1.17387 COC(=O)CCCCCCN(C)C1CCC1 269982a_100000758072_100009815986 [0,1,0,1,0,0|1,0,0]=3 21236 B16R1.17387 COC(=O)CCCCCCN(C)C1CCC1 34a_100000758072_100009815986 [0,1,0,1,0,0|1,0,0]=3 21237 B16R1.17387 COC(=O)CCCCCCN(C)C1COC1 2230a_100102693430_100009815986 [0,1,0,1,0,0|2,0,0]=4 21238 B16R1.17387 COC(=O)CCCCCCN(C)C1COC1 269982a_100102693430_100009815986 [0,1,0,1,0,0|2,0,0]=4 21239 B16R1.17387 COC(=O)CCCCCNC(=O)C1CCC1 188690a_100000184999_100000209988 [0,1,0,1,0,0|1,0,1]=4 21240 B16R1.17387 COC(=O)CCCCCNC(C)C1CCC1 2230a_100016994624_100009816466 [0,1,0,1,0,0|1,0,0]=3 21241 B16R1.17387 COC(=O)CCCCCNC(C)C1CCC1 34a_100016994624_100009816466 [0,1,0,1,0,0|1,0,0]=3 21242 B16R1.17387 COC(=O)CCCCCOC(C)C1CCC1 34a_100000766398_100009816466 [0,1,0,1,0,0|1,0,0]=3 21243 B16R1.17387 COC(=O)CCCCCOC(C)C1CCC1 7a_100000766398_100009816466 [0,1,0,1,0,0|1,0,0]=3 21244 B16R1.17387 COC(=O)CCCCOCC(=O)C1CCC1 34a_100000059025_100000686122 [0,1,0,1,0,0|1,0,1]=4 21245 B16R1.17387 COC(=O)CCCCOCC(=O)C1CCC1 7a_100000059025_100000686122 [0,1,0,1,0,0|1,0,1]=4 21246 B16R1.17387 COC(=O)CCCCOC[C@@H](N)C1COC1 34a_217856628679_100000204269 [0,1,0,1,0,0|2,0,0]=4 21247 B16R1.17387 COC(=O)CCCCSCC(=O)C1CCC1 62a_100000204269_100000686122 [0,1,0,1,0,0|1,0,1]=4 21248 B16R1.17387 COC(=O)CCCCSCC(=O)C1CCC1 62a_100000686122_100000204269 [0,1,0,1,0,0|1,0,1]=4 21249 B16R1.17389 COC(=O)CCCCCCC(=O)CC1CC1 1458a_100000036694_100000742324 [0,1,0,1,0,0|0,0,1]=3 21250 B16R1.17389 COC(=O)CCCCCCC(=O)CC1CC1 1458a_100000738066_100009815986 [0,1,0,1,0,0|0,0,1]=3 21251 B16R1.17389 COC(=O)CCCCCCC(=O)CC1CO1 1458a_100000036694_100011216344 [0,1,0,1,0,0|1,0,1]=4 21252 B16R1.17389 COC(=O)CCCCCCC(=O)CC1CS1 1458a_100000036694_100000031435 [0,1,0,1,0,0|1,0,1]=4 21253 B16R1.17389 COC(=O)CCCCCCC(=O)C[C@@H]1CO1 1458a_100000036694_100000745022 [0,1,0,1,0,0|1,0,1]=4 21254 B16R1.17389 COC(=O)CCCCCCC(=O)NC1CC1 1626a_100000212008_100000036694 [0,1,0,1,0,0|1,0,1]=4 21255 B16R1.17389 COC(=O)CCCCCCC(=O)NC1CC1 240690a_100000212008_100000036694 [0,1,0,1,0,0|1,0,1]=4 21256 B16R1.17389 COC(=O)CCCCCCN(C)CC1CC1 2230a_100000741881_100009815986 [0,1,0,1,0,0|1,0,0]=3 21257 B16R1.17389 COC(=O)CCCCCCN(C)CC1CC1 269982a_100000741881_100009815986 [0,1,0,1,0,0|1,0,0]=3 21258 B16R1.17389 COC(=O)CCCCCNC(=O)CC1CC1 188690a_100000184999_100000738066 [0,1,0,1,0,0|1,0,1]=4 21259 B16R1.18225 COC(=O)CCCCCN1C(CCC1C)C 2230a_100000687148_100009816466 [0,1,0,1,0,0|1,0,0]=3 21260 B16R1.18225 COC(=O)CCCCCN1C(CCC1C)C 269982a_100000687148_100009816466 [0,1,0,1,0,0|1,0,0]=3 21261 B16R1.18225 COC(=O)CCCCCN1C(CCC1C)C 34a_100000687148_100009816466 [0,1,0,1,0,0|1,0,0]=3 21262 B16R1.75208 CNC(=O)CCCNCCC1(CCCC1)O 34a_100000719956_100000741757 [0,1,0,1,0,0|2,0,0]=4 21263 B16R1.75208 COC(=O)CCCCCNC1(CCOC1)C 2230a_100000693475_100009816466 [0,1,0,1,0,0|2,0,0]=4 21264 B16R1.75208 COC(=O)CCCCCOC1(CCCC1)C 34a_100000751722_100009816466 [0,1,0,1,0,0|1,0,0]=3 21265 B16R1.75208 COC(=O)CCCCCOC1(CCCC1)C 7a_100000751722_100009816466 [0,1,0,1,0,0|1,0,0]=3 21266 B16R1.75208 COC(=O)CCCCNCC1(CCCC1)O 2230a_100000737848_100000204269 [0,1,0,1,0,0|1,0,0]=3 21267 B16R1.75208 COC(=O)CCCCOCC1(CCCC1)N 34a_100000749328_100000204269 [0,1,0,1,0,0|1,0,0]=3 21268 B16R1.75208 COC(=O)CCCCOC[C@@]1(CCCN1)C 34a_100016195882_100000204269 [0,1,0,1,0,0|2,0,0]=4 21269 B16R1.75208 COC(=O)CCCNCCC1(CCCC1)O 34a_100000719956_100000742333 [0,1,0,1,0,0|1,0,0]=3 21270 B16R1.75208 COC(=O)COCCNCC1(CCCC1)O 2230a_100000737848_100000090808 [0,1,0,1,0,0|2,0,0]=4 21271 B16R1.75208 COC(=O)COCCOCC1(CCCC1)N 34a_100000749328_100000090808 [0,1,0,1,0,0|2,0,0]=4 21272 B16R1.82115 COC(=O)CCCCCCC(=O)C1CC1C 1458a_100000211227_100009815986 [0,1,0,1,0,0|0,0,1]=3 21273 B16R1.82115 COC(=O)CCCCCCC(=O)[C@@H]1C[C@@H]1F 1458a_100015396687_100009815986 [0,1,0,1,0,0|1,0,1]=4 21274 B16R1.82115 COC(=O)CCCCCNC(=O)C1CC1C 188690a_100000184999_100000211227 [0,1,0,1,0,0|1,0,1]=4 21275 B16R1.51 CCCCCC(C)OCC1CCC(=O)CC1 34a_100000062911_200011218191 [0,1,0,1,0,0|2,0,0]=4 21276 B16R1.1146 CNC(=O)CCCNCC1CCCC(C1)O 2230a_100011254705_100000741757 [0,1,0,1,0,0|2,0,0]=4 21277 B16R1.1146 COC(=O)CCCCCN1CCCC(C1)F 2230a_100000697950_100009816466 [0,1,0,1,0,0|1,0,0]=3 21278 B16R1.1146 COC(=O)CCCCCN1CCCC(C1)F 269982a_100000697950_100009816466 [0,1,0,1,0,0|1,0,0]=3 21279 B16R1.1146 COC(=O)CCCCCN1CCCC(C1)F 34a_100000697950_100009816466 [0,1,0,1,0,0|1,0,0]=3 21280 B16R1.1146 COC(=O)CCCCCN1CCCC(C1)O 2230a_100000211013_100009816466 [0,1,0,1,0,0|1,0,0]=3 21281 B16R1.1146 COC(=O)CCCCCN1CCCC(C1)O 269982a_100000211013_100009816466 [0,1,0,1,0,0|1,0,0]=3 21282 B16R1.1146 COC(=O)CCCCCN1CCC[C@@H](C1)C 2230a_100000717927_100009816466 [0,1,0,1,0,0|1,0,0]=3 21283 B16R1.1146 COC(=O)CCCCCN1CCC[C@@H](C1)C 269982a_100000717927_100009816466 [0,1,0,1,0,0|1,0,0]=3 21284 B16R1.1146 COC(=O)CCCCCN1CCC[C@@H](C1)C 34a_100000717927_100009816466 [0,1,0,1,0,0|1,0,0]=3 21285 B16R1.1146 COC(=O)CCCCCN1CCOC(C1)C 2230a_100000729577_100009816466 [0,1,0,1,0,0|2,0,0]=4 21286 B16R1.1146 COC(=O)CCCCCN1CCOC(C1)C 269982a_100000729577_100009816466 [0,1,0,1,0,0|2,0,0]=4 21287 B16R1.1146 COC(=O)CCCCCN1CCOC(C1)C 34a_100000729577_100009816466 [0,1,0,1,0,0|2,0,0]=4 21288 B16R1.1146 COC(=O)CCCCCN1CCOC(C1)O 2230a_100000688207_100009816466 [0,1,0,1,0,0|2,0,0]=4 21289 B16R1.1146 COC(=O)CCCCCN1CCOC(C1)O 269982a_100000688207_100009816466 [0,1,0,1,0,0|2,0,0]=4 21290 B16R1.1146 COC(=O)CCCCNC1CCCC(C1)C 2230a_100011194320_100000204269 [0,1,0,1,0,0|1,0,0]=3 21291 B16R1.1146 COC(=O)CCCCNC1CCCC(C1)C 34a_100011194320_100000204269 [0,1,0,1,0,0|1,0,0]=3 21292 B16R1.1146 COC(=O)CCCCNC1CCCC(C1)O 2230a_100015190357_100000204269 [0,1,0,1,0,0|1,0,0]=3 21293 B16R1.1146 COC(=O)CCCCOC1C=C(CCC1)C 34a_100011218613_100000204269 [0,1,0,1,0,0|1,0,1]=4 21294 B16R1.1146 COC(=O)CCCCOC1CCCC(=O)C1 34a_100012613340_100000204269 [0,1,0,1,0,0|1,0,1]=4 21295 B16R1.1146 COC(=O)CCCCOC1CCCC(C1)C 34a_100000211399_100000204269 [0,1,0,1,0,0|1,0,0]=3 21296 B16R1.1146 COC(=O)CCCCOC1CCOC(C1)C 34a_100011986385_100000204269 [0,1,0,1,0,0|2,0,0]=4 21297 B16R1.1146 COC(=O)CCCCOC1CCOC(C1)C 7a_100011986385_100000204269 [0,1,0,1,0,0|2,0,0]=4 21298 B16R1.1146 COC(=O)CCCNCC1CCCC(C1)O 2230a_100011254705_100011218270 [0,1,0,1,0,0|1,0,0]=3 21299 B16R1.1146 COC(=O)CCCOCC1CNCC(C1)C 34a_200012821172_100000742333 [0,1,0,1,0,0|2,0,0]=4 21300 B16R1.1146 COC(=O)CCCSCC1CCCN(C1)C 62a_100000752043_100011218270 [0,1,0,1,0,0|2,0,0]=4 21301 B16R1.1146 COC(=O)CCCSCC1CCCN(C1)C 62a_100011218270_100000752043 [0,1,0,1,0,0|2,0,0]=4 21302 B16R1.1146 COC(=O)CCNCCN1CCCC(C1)C 2230a_100000739826_100000204255 [0,1,0,1,0,0|2,0,0]=4 21303 B16R1.1146 COC(=O)CCSCCN1CCCC(C1)C 62a_100000204255_100000766211 [0,1,0,1,0,0|2,0,0]=4 21304 B16R1.1146 COC(=O)COCCNC1CCCC(C1)C 2230a_100011194320_100000090808 [0,1,0,1,0,0|2,0,0]=4 21305 B16R1.1146 COC(=O)COCCNC1CCCC(C1)C 34a_100011194320_100000090808 [0,1,0,1,0,0|2,0,0]=4 21306 B16R1.1146 COC(=O)COCCNC1CCCC(C1)O 2230a_100015190357_100000090808 [0,1,0,1,0,0|2,0,0]=4 21307 B16R1.1146 COC(=O)COCCOC1CCCC(C1)C 34a_100000211399_100000090808 [0,1,0,1,0,0|2,0,0]=4 21308 B16R1.1172 COC(=O)CCCCCC(=O)C1CCCC1 1458a_100000210718_100009816466 [0,1,0,1,0,0|0,0,1]=3 21309 B16R1.1172 COC(=O)CCCCCC(=O)C1CCCC1 1458a_100009848860_100000179811 [0,1,0,1,0,0|0,0,1]=3 21310 B16R1.1172 COC(=O)CCCCCC(=O)C1CCCS1 1458a_100012002731_100009816466 [0,1,0,1,0,0|1,0,1]=4 21311 B16R1.1172 COC(=O)CCCCCC(=O)C1CCOC1 1458a_100009848860_100000690089 [0,1,0,1,0,0|1,0,1]=4 21312 B16R1.1172 COC(=O)CCCCCC(=O)C1CCOC1 1458a_100011219752_100009816466 [0,1,0,1,0,0|1,0,1]=4 21313 B16R1.1172 COC(=O)CCCCCC(=O)N1CCCC1 240690a_100000188435_100009848860 [0,1,0,1,0,0|1,0,1]=4 21314 B16R1.1172 COC(=O)CCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100009816466 [0,1,0,1,0,0|1,0,1]=4 21315 B16R1.1172 COC(=O)CCCCCN(C)C1CCCC1 2230a_100000207505_100009816466 [0,1,0,1,0,0|1,0,0]=3 21316 B16R1.1172 COC(=O)CCCCCN(C)C1CCCC1 269982a_100000207505_100009816466 [0,1,0,1,0,0|1,0,0]=3 21317 B16R1.1172 COC(=O)CCCCCN(C)C1CCCC1 34a_100000207505_100009816466 [0,1,0,1,0,0|1,0,0]=3 21318 B16R1.1172 COC(=O)CCCCCN(C)C1CCOC1 2230a_100016988252_100009816466 [0,1,0,1,0,0|2,0,0]=4 21319 B16R1.1172 COC(=O)CCCCCN(C)C1CCOC1 269982a_100016988252_100009816466 [0,1,0,1,0,0|2,0,0]=4 21320 B16R1.1172 COC(=O)CCCCCN(C)C1CCOC1 34a_100016988252_100009816466 [0,1,0,1,0,0|2,0,0]=4 21321 B16R1.1172 COC(=O)CCCCNC(=O)C1CCCC1 188690a_100000746077_100000210718 [0,1,0,1,0,0|1,0,1]=4 21322 B16R1.1172 COC(=O)CCCCNC(C)C1CCCC1 2230a_100015185923_100000204269 [0,1,0,1,0,0|1,0,0]=3 21323 B16R1.1172 COC(=O)CCCCNC(C)C1CCCC1 34a_100015185923_100000204269 [0,1,0,1,0,0|1,0,0]=3 21324 B16R1.1172 COC(=O)CCCCNC(C)C1CCCO1 2230a_100025754208_100000204269 [0,1,0,1,0,0|2,0,0]=4 21325 B16R1.1172 COC(=O)CCCCNC(C)C1CCCO1 34a_100025754208_100000204269 [0,1,0,1,0,0|2,0,0]=4 21326 B16R1.1172 COC(=O)CCCCOC(C)C1CCCC1 34a_100011216366_100000204269 [0,1,0,1,0,0|1,0,0]=3 21327 B16R1.1172 COC(=O)CCCCOC(C)C1CCCC1 7a_100011216366_100000204269 [0,1,0,1,0,0|1,0,0]=3 21328 B16R1.1172 COC(=O)CCCSCC(C)N1CCCC1 62a_100011218270_200015187269 [0,1,0,1,0,0|2,0,0]=4 21329 B16R1.1172 COC(=O)CCCSCC(C)N1CCCC1 62a_200015187269_100011218270 [0,1,0,1,0,0|2,0,0]=4 21330 B16R1.1172 COC(=O)CCOCCC(C)N1CCCC1 34a_100011935070_100000742370 [0,1,0,1,0,0|2,0,0]=4 21331 B16R1.1172 COC(=O)CCOCCC(C)N1CCCC1 7a_100011935070_100000204255 [0,1,0,1,0,0|2,0,0]=4 21332 B16R1.1172 COC(=O)COCCNC(C)C1CCCC1 2230a_100015185923_100000090808 [0,1,0,1,0,0|2,0,0]=4 21333 B16R1.1172 COC(=O)COCCNC(C)C1CCCC1 34a_100015185923_100000090808 [0,1,0,1,0,0|2,0,0]=4 21334 B16R1.1172 COC(=O)COCCOC(C)C1CCCC1 34a_100011216366_100000090808 [0,1,0,1,0,0|2,0,0]=4 21335 B16R1.1172 COC(=O)COCCOC(C)C1CCCC1 7a_100011216366_100000090808 [0,1,0,1,0,0|2,0,0]=4 21336 B16R1.1388 CCCCCN1CC[C@H](C1)OCC(=O)OC 2230a_100102564761_100000210326 [0,1,0,1,0,0|2,0,0]=4 21337 B16R1.1388 CCCCCN1CC[C@H](C1)OCC(=O)OC 269982a_100102564761_100000210215 [0,1,0,1,0,0|2,0,0]=4 21338 B16R1.1388 CCCOCC1CCN(C1)CCC(=O)OC 2230a_200011652792_100000204255 [0,1,0,1,0,0|2,0,0]=4 21339 B16R1.1388 CCCOCC1CCN(C1)CCC(=O)OC 269982a_200011652792_100000204255 [0,1,0,1,0,0|2,0,0]=4 21340 B16R1.1388 CCCOCC1CCN(C1)CCC(=O)OC 34a_200011652792_100000742370 [0,1,0,1,0,0|2,0,0]=4 21341 B16R1.1411 CCCCCN1CCCC(C1)CC(=O)OC 2230a_100016989293_100000210326 [0,1,0,1,0,0|1,0,0]=3 21342 B16R1.1411 CCCCCN1CCCC(C1)CC(=O)OC 269982a_100016989293_100000210215 [0,1,0,1,0,0|1,0,0]=3 21343 B16R1.1411 CCCCCN1CCOC(C1)CC(=O)OC 2230a_100000684468_100000210326 [0,1,0,1,0,0|2,0,0]=4 21344 B16R1.1411 CCCCCN1CCOC(C1)CC(=O)OC 269982a_100000684468_100000210215 [0,1,0,1,0,0|2,0,0]=4 21345 B16R1.1411 CCCCOC1CCCC(C1)CC(=O)OC 7a_200010992784_100000210211 [0,1,0,1,0,0|1,0,0]=3 21346 B16R1.1411 CCOCCN1CCCC(C1)CC(=O)OC 2230a_100016989293_100011215890 [0,1,0,1,0,0|2,0,0]=4 21347 B16R1.1411 CCOCCN1CCCC(C1)CC(=O)OC 269982a_100016989293_100011215890 [0,1,0,1,0,0|2,0,0]=4 21348 B16R1.1411 CCSCCN1CCCC(C1)CC(=O)OC 2230a_100016989293_100000757381 [0,1,0,1,0,0|2,0,0]=4 21349 B16R1.1411 CCSCCN1CCCC(C1)CC(=O)OC 269982a_100016989293_100000757381 [0,1,0,1,0,0|2,0,0]=4 21350 B16R1.1411 COC(=O)CC1CCCC(C1)OCCCF 7a_200010992784_100011934791 [0,1,0,1,0,0|2,0,0]=4 21351 B16R1.1411 COC(=O)CC1CCCC(C1)OCCCO 7a_200010992784_100011215043 [0,1,0,1,0,0|2,0,0]=4 21352 B16R1.1411 COC(=O)CC1CCCC(C1)OCCSC 7a_200010992784_100000212216 [0,1,0,1,0,0|2,0,0]=4 21353 B16R1.1411 COC(=O)CC1CCCN(C1)CCCCF 2230a_100016989293_100000729493 [0,1,0,1,0,0|2,0,0]=4 21354 B16R1.1411 COC(=O)CC1CCCN(C1)CCCCF 269982a_100016989293_100000729493 [0,1,0,1,0,0|2,0,0]=4 21355 B16R1.1411 COC(=O)CC1CCCN(C1)CCCCO 2230a_100016989293_100000210776 [0,1,0,1,0,0|2,0,0]=4 21356 B16R1.1411 COC(=O)CC1CCCN(C1)CCCCO 269982a_100016989293_100000210776 [0,1,0,1,0,0|2,0,0]=4 21357 B16R1.1411 COCCCC1CCCN(C1)CC(=O)OC 2230a_200011934583_100000747449 [0,1,0,1,0,0|2,0,0]=4 21358 B16R1.1411 COCCCC1CCCN(C1)CC(=O)OC 269982a_200011934583_100000747449 [0,1,0,1,0,0|2,0,0]=4 21359 B16R1.1411 COCCCC1CCCN(C1)CC(=O)OC 34a_200011934583_100000747449 [0,1,0,1,0,0|2,0,0]=4 21360 B16R1.1411 COCCCN1CCCC(C1)CC(=O)OC 2230a_100016989293_100000740836 [0,1,0,1,0,0|2,0,0]=4 21361 B16R1.1411 COCCCN1CCCC(C1)CC(=O)OC 269982a_100016989293_100000740836 [0,1,0,1,0,0|2,0,0]=4 21362 B16R1.1411 COCCOC1CCCC(C1)CC(=O)OC 7a_200010992784_100000233755 [0,1,0,1,0,0|2,0,0]=4 21363 B16R1.1740 CCCCCC(=O)N1CCC[C@H]1C(=O)OC 11a_100000752040_100000212188 [0,1,0,1,0,0|1,0,1]=4 21364 B16R1.1740 CCCCCC(=O)N1CCC[C@H]1C(=O)OC 1626a_100000752040_100000212188 [0,1,0,1,0,0|1,0,1]=4 21365 B16R1.1740 CCCCCC(=O)N1CCC[C@H]1C(=O)OC 240690a_100000752040_100000212188 [0,1,0,1,0,0|1,0,1]=4 21366 B16R1.1740 CCCCCC(=O)N1CCC[C@H]1C(=O)OC 527a_100000752040_100000212188 [0,1,0,1,0,0|1,0,1]=4 21367 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)NC 2230a_100015185040_200011218191 [0,1,0,1,0,0|2,0,0]=4 21368 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)NC 269982a_100015185040_200011218191 [0,1,0,1,0,0|2,0,0]=4 21369 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)NC 270004a_100015185040_100000211708 [0,1,0,1,0,0|2,0,0]=4 21370 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)NC 34a_100015185040_200011218191 [0,1,0,1,0,0|2,0,0]=4 21371 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)OC 2230a_100000752040_200011218191 [0,1,0,1,0,0|1,0,0]=3 21372 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)OC 269982a_100000752040_200011218191 [0,1,0,1,0,0|1,0,0]=3 21373 B16R1.1740 CCCCCC(C)N1CCC[C@H]1C(=O)OC 270004a_100000752040_100000211708 [0,1,0,1,0,0|1,0,0]=3 21374 B16R1.1740 CCCCCC(C)N1CCSC1C(=O)OC 2230a_100015296106_200011218191 [0,1,0,1,0,0|2,0,0]=4 21375 B16R1.1740 CCCCCC(C)N1CCSC1C(=O)OC 269982a_100015296106_200011218191 [0,1,0,1,0,0|2,0,0]=4 21376 B16R1.1740 CCCCCC(C)N1CCSC1C(=O)OC 270004a_100015296106_100000211708 [0,1,0,1,0,0|2,0,0]=4 21377 B16R1.1740 CCCCCC(C)N1CSCC1C(=O)OC 269982a_200000724679_200011218191 [0,1,0,1,0,0|2,0,0]=4 21378 B16R1.1740 CCCCCC(C)N1CSCC1C(=O)OC 270004a_200000724679_100000211708 [0,1,0,1,0,0|2,0,0]=4 21379 B16R1.1740 CCCSCC(C)N1CCC[C@H]1C(=O)OC 270004a_100000752040_100011343953 [0,1,0,1,0,0|2,0,0]=4 21380 B16R1.1740 CCOCCC(C)N1CCC[C@H]1C(=O)OC 270004a_100000752040_200011216536 [0,1,0,1,0,0|2,0,0]=4 21381 B16R1.1740 COC(=O)[C@@H]1CCCN1C(C)CCCSC 270004a_100000752040_100011399439 [0,1,0,1,0,0|2,0,0]=4 21382 B16R1.3410 CCCCCC(=O)CN1CC[C@H]1C(=O)OC 2230a_102516456887_200012276598 [0,1,0,1,0,0|1,0,1]=4 21383 B16R1.3410 CCCCCC(=O)CN1CC[C@H]1C(=O)OC 269982a_102516456887_200012276598 [0,1,0,1,0,0|1,0,1]=4 21384 B16R1.9717 CCOC1CN(C1)CCCCCC(=O)OC 269982a_100000732654_100009816466 [0,1,0,1,0,0|2,0,0]=4 21385 B16R1.9717 CCOC1CN(C1)CCCCCC(=O)OC 34a_100000732654_100009816466 [0,1,0,1,0,0|2,0,0]=4 21386 B16R1.9717 COCC1CC(C1)NCCCCC(=O)OC 2230a_100012180050_100000204269 [0,1,0,1,0,0|2,0,0]=4 21387 B16R1.9717 COCC1CN(C1)CCCCCC(=O)OC 2230a_100016993750_100009816466 [0,1,0,1,0,0|2,0,0]=4 21388 B16R1.9717 COCC1CN(C1)CCCCCC(=O)OC 269982a_100016993750_100009816466 [0,1,0,1,0,0|2,0,0]=4 21389 B16R1.9717 COCC1CN(C1)CCCCCC(=O)OC 34a_100016993750_100009816466 [0,1,0,1,0,0|2,0,0]=4 21390 B16R1.17213 COC(=O)CCCCCC(=O)CC1CCC1 1458a_100000763092_100009816466 [0,1,0,1,0,0|0,0,1]=3 21391 B16R1.17213 COC(=O)CCCCCC(=O)CC1CCC1 1458a_100009848860_100000763275 [0,1,0,1,0,0|0,0,1]=3 21392 B16R1.17213 COC(=O)CCCCCC(=O)CC1CCO1 1458a_100009848860_100000103362 [0,1,0,1,0,0|1,0,1]=4 21393 B16R1.17213 COC(=O)CCCCCC(=O)CC1COC1 1458a_100000687760_100009816466 [0,1,0,1,0,0|1,0,1]=4 21394 B16R1.17213 COC(=O)CCCCCC(=O)CC1COC1 1458a_100009848860_100010264016 [0,1,0,1,0,0|1,0,1]=4 21395 B16R1.17213 COC(=O)CCCCCC(=O)NC1CCC1 11a_100000749019_100009848860 [0,1,0,1,0,0|1,0,1]=4 21396 B16R1.17213 COC(=O)CCCCCC(=O)NC1CCC1 1626a_100000749019_100009848860 [0,1,0,1,0,0|1,0,1]=4 21397 B16R1.17213 COC(=O)CCCCCC(=O)NC1CCC1 240690a_100000749019_100009848860 [0,1,0,1,0,0|1,0,1]=4 21398 B16R1.17213 COC(=O)CCCCCN(C)CC1CCC1 2230a_200000750244_100009816466 [0,1,0,1,0,0|1,0,0]=3 21399 B16R1.17213 COC(=O)CCCCCN(C)CC1CCC1 269982a_200000750244_100009816466 [0,1,0,1,0,0|1,0,0]=3 21400 B16R1.17213 COC(=O)CCCCCN(C)CC1CCC1 34a_200000750244_100009816466 [0,1,0,1,0,0|1,0,0]=3 21401 B16R1.17213 COC(=O)CCCCNC(=O)CC1CCC1 188690a_100000746077_100000763092 [0,1,0,1,0,0|1,0,1]=4 21402 B16R1.17214 COC(=O)CCCCCC(=O)CCC1CC1 1458a_100000756386_100009816466 [0,1,0,1,0,0|0,0,1]=3 21403 B16R1.17214 COC(=O)CCCCCC(=O)CCC1CC1 1458a_100009848860_100000694398 [0,1,0,1,0,0|0,0,1]=3 21404 B16R1.17214 COC(=O)CCCCCC(=O)CCC1CO1 1458a_100009848860_100000732470 [0,1,0,1,0,0|1,0,1]=4 21405 B16R1.17214 COC(=O)CCCCCC(=O)NCC1CC1 11a_100000735609_100009848860 [0,1,0,1,0,0|1,0,1]=4 21406 B16R1.17214 COC(=O)CCCCCC(=O)NCC1CC1 1626a_100000735609_100009848860 [0,1,0,1,0,0|1,0,1]=4 21407 B16R1.17214 COC(=O)CCCCCC(=O)NCC1CC1 240690a_100000735609_100009848860 [0,1,0,1,0,0|1,0,1]=4 21408 B16R1.17214 COC(=O)CCCCNC(=O)CCC1CC1 188690a_100000746077_100000756386 [0,1,0,1,0,0|1,0,1]=4 21409 B16R1.17215 COC(=O)CCCCCC(=O)N1CCC1C 11a_100000755817_100009848860 [0,1,0,1,0,0|1,0,1]=4 21410 B16R1.17215 COC(=O)CCCCCC(=O)N1CCC1C 240690a_100000755817_100009848860 [0,1,0,1,0,0|1,0,1]=4 21411 B16R1.18637 CCC1CC1C(=O)CCCCCC(=O)OC 1458a_200011661523_100009816466 [0,1,0,1,0,0|0,0,1]=3 21412 B16R1.18637 CCC1CC1C(=O)NCCCCC(=O)OC 188690a_100000746077_200011661523 [0,1,0,1,0,0|1,0,1]=4 21413 B16R1.75498 CNC(=O)CCCNCC1(CCCCC1)C 2230a_100000706052_100000741757 [0,1,0,1,0,0|2,0,0]=4 21414 B16R1.75498 CNC(=O)CCCNCC1(CCCCC1)C 269862a_100000740002_100011935227 [0,1,0,1,0,0|2,0,0]=4 21415 B16R1.75498 CNC(=O)CCCNCC1(CCCCC1)C 34a_100000706052_100000741757 [0,1,0,1,0,0|2,0,0]=4 21416 B16R1.75498 CNC(=O)CCCNCC1(CCCCC1)O 2230a_100000748649_100000741757 [0,1,0,1,0,0|2,0,0]=4 21417 B16R1.75498 CNC(=O)CCCNCC1(CCCCC1)O 34a_100000748649_100000741757 [0,1,0,1,0,0|2,0,0]=4 21418 B16R1.75498 CNC(=O)CCCOCC1(CCCCC1)C 34a_100000688186_100000741757 [0,1,0,1,0,0|2,0,0]=4 21419 B16R1.75498 CNC(=O)CCCOCC1(CCCCC1)C 7a_100000688186_100000741757 [0,1,0,1,0,0|2,0,0]=4 21420 B16R1.75498 CNC(=O)CCCOCC1(CCCCC1)F 34a_100000090305_100000741757 [0,1,0,1,0,0|2,0,0]=4 21421 B16R1.75498 CNC(=O)CCCOCC1(CCCCC1)F 7a_100000090305_100000741757 [0,1,0,1,0,0|2,0,0]=4 21422 B16R1.75498 CNC(=O)CCCOCC1(CCCCC1)N 34a_100000740034_100000741757 [0,1,0,1,0,0|2,0,0]=4 21423 B16R1.75498 CNC(=O)CCNCCC1(CCCCC1)O 2230a_100102740465_100000737683 [0,1,0,1,0,0|2,0,0]=4 21424 B16R1.75498 CNC(=O)CCNCCC1(CCCCC1)O 34a_100102740465_100012179268 [0,1,0,1,0,0|2,0,0]=4 21425 B16R1.75498 COC(=O)CCCCNC1(CCCCC1)C 2230a_100000741114_100000204269 [0,1,0,1,0,0|1,0,0]=3 21426 B16R1.75498 COC(=O)CCCCNC1(CCCCC1)C 34a_100000741114_100000204269 [0,1,0,1,0,0|1,0,0]=3 21427 B16R1.75498 COC(=O)CCCCNC1(CCOCC1)C 2230a_100000692449_100000204269 [0,1,0,1,0,0|2,0,0]=4 21428 B16R1.75498 COC(=O)CCCCNC1(CCOCC1)C 34a_100000692449_100000204269 [0,1,0,1,0,0|2,0,0]=4 21429 B16R1.75498 COC(=O)CCCCOC1(CCCCC1)C 34a_100011215885_100000204269 [0,1,0,1,0,0|1,0,0]=3 21430 B16R1.75498 COC(=O)CCCCOC1(CCCCC1)C 7a_100011215885_100000204269 [0,1,0,1,0,0|1,0,0]=3 21431 B16R1.75498 COC(=O)CCCCOC1(CCOCC1)C 34a_100011827762_100000204269 [0,1,0,1,0,0|2,0,0]=4 21432 B16R1.75498 COC(=O)CCCCOC1(CCOCC1)C 7a_100011827762_100000204269 [0,1,0,1,0,0|2,0,0]=4 21433 B16R1.75498 COC(=O)CCCCOC1(CCSCC1)C 34a_200011004327_100000204269 [0,1,0,1,0,0|2,0,0]=4 21434 B16R1.75498 COC(=O)CCCCOC1(CCSCC1)C 7a_200011004327_100000204269 [0,1,0,1,0,0|2,0,0]=4 21435 B16R1.75498 COC(=O)CCCNCC1(CCCCC1)C 2230a_100000706052_100011218270 [0,1,0,1,0,0|1,0,0]=3 21436 B16R1.75498 COC(=O)CCCNCC1(CCCCC1)C 34a_100000706052_100000742333 [0,1,0,1,0,0|1,0,0]=3 21437 B16R1.75498 COC(=O)CCCNCC1(CCCCC1)O 2230a_100000748649_100011218270 [0,1,0,1,0,0|1,0,0]=3 21438 B16R1.75498 COC(=O)CCCNCC1(CCCCC1)O 34a_100000748649_100000742333 [0,1,0,1,0,0|1,0,0]=3 21439 B16R1.75498 COC(=O)CCCNCC1(CCOCC1)C 2230a_100000695556_100011218270 [0,1,0,1,0,0|2,0,0]=4 21440 B16R1.75498 COC(=O)CCCNCC1(CCOCC1)C 34a_100000695556_100000742333 [0,1,0,1,0,0|2,0,0]=4 21441 B16R1.75498 COC(=O)CCCNCC1(CCOCC1)F 2230a_100016991512_100011218270 [0,1,0,1,0,0|2,0,0]=4 21442 B16R1.75498 COC(=O)CCCNCC1(CCOCC1)F 34a_100016991512_100000742333 [0,1,0,1,0,0|2,0,0]=4 21443 B16R1.75498 COC(=O)CCCNCC1(CCOCC1)O 2230a_100000704115_100011218270 [0,1,0,1,0,0|2,0,0]=4 21444 B16R1.75498 COC(=O)CCCNCC1(CCOCC1)O 34a_100000704115_100000742333 [0,1,0,1,0,0|2,0,0]=4 21445 B16R1.75498 COC(=O)CCCNCC1(CCSCC1)O 2230a_100000758141_100011218270 [0,1,0,1,0,0|2,0,0]=4 21446 B16R1.75498 COC(=O)CCCOCC1(CCCCC1)C 34a_100000688186_100000742333 [0,1,0,1,0,0|1,0,0]=3 21447 B16R1.75498 COC(=O)CCCOCC1(CCCCC1)C 7a_100000688186_100011218270 [0,1,0,1,0,0|1,0,0]=3 21448 B16R1.75498 COC(=O)CCCOCC1(CCCCC1)F 34a_100000090305_100000742333 [0,1,0,1,0,0|1,0,0]=3 21449 B16R1.75498 COC(=O)CCCOCC1(CCCCC1)F 7a_100000090305_100011218270 [0,1,0,1,0,0|1,0,0]=3 21450 B16R1.75498 COC(=O)CCCOCC1(CCCCC1)N 34a_100000740034_100000742333 [0,1,0,1,0,0|1,0,0]=3 21451 B16R1.75498 COC(=O)CCCOCC1(CCNCC1)F 34a_100016990393_100000742333 [0,1,0,1,0,0|2,0,0]=4 21452 B16R1.75498 COC(=O)CCCOCC1(CCOCC1)C 34a_100000704393_100000742333 [0,1,0,1,0,0|2,0,0]=4 21453 B16R1.75498 COC(=O)CCCOCC1(CCOCC1)C 7a_100000704393_100011218270 [0,1,0,1,0,0|2,0,0]=4 21454 B16R1.75498 COC(=O)CCCOCC1(CCOCC1)N 34a_100000751404_100000742333 [0,1,0,1,0,0|2,0,0]=4 21455 B16R1.75498 COC(=O)CCNCCC1(CCCCC1)O 2230a_100102740465_100000204255 [0,1,0,1,0,0|1,0,0]=3 21456 B16R1.75498 COC(=O)CCNCCC1(CCCCC1)O 34a_100102740465_100000742370 [0,1,0,1,0,0|1,0,0]=3 21457 B16R1.75498 COC(=O)COCCNC1(CCCCC1)C 2230a_100000741114_100000090808 [0,1,0,1,0,0|2,0,0]=4 21458 B16R1.75498 COC(=O)COCCNC1(CCCCC1)C 34a_100000741114_100000090808 [0,1,0,1,0,0|2,0,0]=4 21459 B16R1.75498 COC(=O)COCCOC1(CCCCC1)C 34a_100011215885_100000090808 [0,1,0,1,0,0|2,0,0]=4 21460 B16R1.75498 COC(=O)COCCOC1(CCCCC1)C 7a_100011215885_100000090808 [0,1,0,1,0,0|2,0,0]=4 21461 B16R1.81979 CNC(=O)CCCNC1C(CCCC1C)C 269862a_100000740002_100000211995 [0,1,0,1,0,0|2,0,0]=4 21462 B16R1.81979 CNC(=O)CCCOC1C(CCCC1C)C 34a_100011218088_100000741757 [0,1,0,1,0,0|2,0,0]=4 21463 B16R1.81979 CNC(=O)CCCOC1C(CCCC1C)C 7a_100011218088_100000741757 [0,1,0,1,0,0|2,0,0]=4 21464 B16R1.81979 COC(=O)CCCCN1C(CCCC1C)C 2230a_100000210447_100000204269 [0,1,0,1,0,0|1,0,0]=3 21465 B16R1.81979 COC(=O)CCCCN1C(CCCC1C)C 269982a_100000210447_100000204269 [0,1,0,1,0,0|1,0,0]=3 21466 B16R1.81979 COC(=O)CCCCN1C(CCCC1C)C 34a_100000210447_100000204269 [0,1,0,1,0,0|1,0,0]=3 21467 B16R1.81979 COC(=O)CCCCN1[C@@H](COC[C@@H]1C)C 2230a_100103153222_100000204269 [0,1,0,1,0,0|2,0,0]=4 21468 B16R1.81979 COC(=O)CCCCN1[C@@H](COC[C@@H]1C)C 269982a_100103153222_100000204269 [0,1,0,1,0,0|2,0,0]=4 21469 B16R1.81979 COC(=O)CCCCN1[C@@H](COC[C@@H]1C)C 34a_100103153222_100000204269 [0,1,0,1,0,0|2,0,0]=4 21470 B16R1.81979 COC(=O)CCCOC1C(CCCC1C)C 34a_100011218088_100000742333 [0,1,0,1,0,0|1,0,0]=3 21471 B16R1.81979 COC(=O)CCCOC1C(CCCC1C)C 7a_100011218088_100011218270 [0,1,0,1,0,0|1,0,0]=3 21472 B16R1.81979 COC(=O)CNCCN1C(CCCC1C)C 2230a_100000749955_100000747449 [0,1,0,1,0,0|2,0,0]=4 21473 B16R1.81979 COC(=O)CNCCN1C(CCCC1C)C 34a_100000749955_100000747449 [0,1,0,1,0,0|2,0,0]=4 21474 B16R1.81979 COC(=O)COCCN1C(CCCC1C)C 2230a_100000210447_100000090808 [0,1,0,1,0,0|2,0,0]=4 21475 B16R1.81979 COC(=O)COCCN1C(CCCC1C)C 34a_100000210447_100000090808 [0,1,0,1,0,0|2,0,0]=4 21476 B16R1.81979 COC(=O)COCCN1C(CCCC1C)C 34a_100011305576_100000747449 [0,1,0,1,0,0|2,0,0]=4 21477 B16R1.81979 COC(=O)COCCN1C(CCCC1C)C 7a_100011305576_100000747449 [0,1,0,1,0,0|2,0,0]=4 21478 B16R1.196284 COC(=O)CCCCO[C@@]1(CCC[C@H]1N)C 34a_100015977457_100000204269 [0,1,0,1,0,0|2,0,0]=4 21479 B16R1.77 CC(C)CCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210682 [0,1,0,1,0,0|2,0,0]=4 21480 B16R1.77 CC(C)CCCCCNC1CCC(=O)NC1 34a_100000748762_100000210682 [0,1,0,1,0,0|2,0,0]=4 21481 B16R1.77 CC(C)CCCCCOC1CCC(=O)CC1 34a_100000764474_100000210682 [0,1,0,1,0,0|2,0,0]=4 21482 B16R1.77 CC(C)CCCCCOC1CCC(=O)CC1 7a_100000764474_100000210682 [0,1,0,1,0,0|2,0,0]=4 21483 B16R1.77 CC(C)CCCCCOC1CCC(=O)NC1 34a_100000079199_100000210682 [0,1,0,1,0,0|2,0,0]=4 21484 B16R1.77 CC(C)CCCCOCC1CCC(=O)CC1 34a_100000062911_100011216152 [0,1,0,1,0,0|2,0,0]=4 21485 B16R1.84 CC(C)CCCNCC1CCCC(=O)N1C 2230a_200010383782_100011214892 [0,1,0,1,0,0|2,0,0]=4 21486 B16R1.84 CC(C)CCCNCC1CCCC(=O)N1C 34a_200010383782_100011214892 [0,1,0,1,0,0|2,0,0]=4 21487 B16R1.84 CC(O)CCCNCC1CCCC(=O)N1C 2230a_200010383782_200000718107 [0,1,0,1,0,0|2,0,0]=4 21488 B16R1.84 CC(O)CCCNCC1CCCC(=O)N1C 34a_200010383782_200000718107 [0,1,0,1,0,0|2,0,0]=4 21489 B16R1.1178 C=C(C)CCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000730704 [0,1,0,1,0,0|1,0,1]=4 21490 B16R1.1178 C=C(C)CCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000730704 [0,1,0,1,0,0|1,0,1]=4 21491 B16R1.1178 CNC(=O)C1CCCCN1CCCC(C)C 2230a_100011209383_100011214892 [0,1,0,1,0,0|2,0,0]=4 21492 B16R1.1178 CNC(=O)C1CCCCN1CCCC(C)C 269982a_100011209383_100011214892 [0,1,0,1,0,0|2,0,0]=4 21493 B16R1.1178 CNC(=O)C1CCCCN1CCCC(C)C 34a_100011209383_100011214892 [0,1,0,1,0,0|2,0,0]=4 21494 B16R1.1178 CNC(=O)C1CCCCN1CCCC(C)O 2230a_100011209383_200000718107 [0,1,0,1,0,0|2,0,0]=4 21495 B16R1.1178 CNC(=O)C1CCCCN1CCCC(C)O 269982a_100011209383_200000718107 [0,1,0,1,0,0|2,0,0]=4 21496 B16R1.1178 CNC(=O)C1CCCCN1CCCC(C)O 34a_100011209383_200000718107 [0,1,0,1,0,0|2,0,0]=4 21497 B16R1.1178 COC(=O)C1CCCCN1CCCC(=O)C 269982a_100000734855_100011215641 [0,1,0,1,0,0|1,0,1]=4 21498 B16R1.1178 COC(=O)C1CCCCN1CCCC(=O)C 34a_100000734855_100000685027 [0,1,0,1,0,0|1,0,1]=4 21499 B16R1.1178 COC(=O)C1CCCCN1CCCC(C)C 2230a_100000734855_100011214892 [0,1,0,1,0,0|1,0,0]=3 21500 B16R1.1178 COC(=O)C1CCCCN1CCCC(C)C 269982a_100000734855_100011214892 [0,1,0,1,0,0|1,0,0]=3 21501 B16R1.1178 COC(=O)C1CCCCN1CCCC(C)C 34a_100000734855_100011214892 [0,1,0,1,0,0|1,0,0]=3 21502 B16R1.1178 COC(=O)C1CCCCN1CCCC(C)O 2230a_100000734855_200000718107 [0,1,0,1,0,0|1,0,0]=3 21503 B16R1.1178 COC(=O)C1CCCCN1CCCC(C)O 269982a_100000734855_200000718107 [0,1,0,1,0,0|1,0,0]=3 21504 B16R1.1178 COC(=O)C1CCCCN1CCCC(C)O 34a_100000734855_200000718107 [0,1,0,1,0,0|1,0,0]=3 21505 B16R1.1178 COC(=O)C1CCCCN1CCCN(C)C 269982a_100000734855_100000757444 [0,1,0,1,0,0|2,0,0]=4 21506 B16R1.1178 COC(=O)C1CCCCN1CCOC(C)C 2230a_100000734855_100000211751 [0,1,0,1,0,0|2,0,0]=4 21507 B16R1.1178 COC(=O)C1CCCCN1CCOC(C)C 269982a_100000734855_100000211751 [0,1,0,1,0,0|2,0,0]=4 21508 B16R1.1178 COC(=O)C1CCCCN1CCOC(C)C 34a_100000734855_100000211751 [0,1,0,1,0,0|2,0,0]=4 21509 B16R1.1178 COC(=O)C1CCCCN1CCSC(C)C 2230a_100000734855_100000730970 [0,1,0,1,0,0|2,0,0]=4 21510 B16R1.1178 COC(=O)C1CCCCN1CCSC(C)C 269982a_100000734855_100000730970 [0,1,0,1,0,0|2,0,0]=4 21511 B16R1.1178 COC(=O)C1CCCCN1CCSC(C)C 34a_100000734855_100000730970 [0,1,0,1,0,0|2,0,0]=4 21512 B16R1.1178 COC(=O)C1CNCCC1OCCC(C)C 34a_200103168510_100000210312 [0,1,0,1,0,0|2,0,0]=4 21513 B16R1.1178 COC(=O)C1CNCCC1OCCC(C)O 34a_200103168510_100012276601 [0,1,0,1,0,0|2,0,0]=4 21514 B16R1.1178 COC(=O)C1COCCN1CCCC(C)C 2230a_100000765174_100011214892 [0,1,0,1,0,0|2,0,0]=4 21515 B16R1.1178 COC(=O)C1COCCN1CCCC(C)C 34a_100000765174_100011214892 [0,1,0,1,0,0|2,0,0]=4 21516 B16R1.1178 COC(=O)C1COCCN1CCCC(C)O 2230a_100000765174_200000718107 [0,1,0,1,0,0|2,0,0]=4 21517 B16R1.1178 COC(=O)C1COCCN1CCCC(C)O 34a_100000765174_200000718107 [0,1,0,1,0,0|2,0,0]=4 21518 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCCC(=O)C 7a_100015709673_100000053229 [0,1,0,1,0,0|1,0,1]=4 21519 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCCC(C)C 34a_100015709673_100000210312 [0,1,0,1,0,0|1,0,0]=3 21520 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCCC(C)C 7a_100015709673_100000210626 [0,1,0,1,0,0|1,0,0]=3 21521 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCCC(C)O 34a_100015709673_100012276601 [0,1,0,1,0,0|1,0,0]=3 21522 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCCC(C)O 7a_100015709673_100012276601 [0,1,0,1,0,0|1,0,0]=3 21523 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCCN(C)C 7a_100015709673_100000755713 [0,1,0,1,0,0|2,0,0]=4 21524 B16R1.1178 COC(=O)[C@@H]1CCCC[C@@H]1OCOC(C)C 34a_100015709673_100000709892 [0,1,0,1,0,0|2,0,0]=4 21525 B16R1.1188 CNC(=O)[C@@H]1CCCN1CCCCC(C)C 2230a_100015185040_100011216152 [0,1,0,1,0,0|2,0,0]=4 21526 B16R1.1188 CNC(=O)[C@@H]1CCCN1CCCCC(C)C 269982a_100015185040_100011216152 [0,1,0,1,0,0|2,0,0]=4 21527 B16R1.1188 CNC(=O)[C@@H]1CCCN1CCCCC(C)C 34a_100015185040_100011216152 [0,1,0,1,0,0|2,0,0]=4 21528 B16R1.1188 COC(=O)C1CCCC1OCCCC(=O)C 34a_200000081814_100000685027 [0,1,0,1,0,0|1,0,1]=4 21529 B16R1.1188 COC(=O)C1CCCC1OCCCC(=O)C 7a_200000081814_100011215641 [0,1,0,1,0,0|1,0,1]=4 21530 B16R1.1188 COC(=O)C1CCCC1OCCCC(C)C 34a_200000081814_100011214892 [0,1,0,1,0,0|1,0,0]=3 21531 B16R1.1188 COC(=O)C1CCCC1OCCCC(C)C 7a_200000081814_100011214892 [0,1,0,1,0,0|1,0,0]=3 21532 B16R1.1188 COC(=O)C1CCCC1OCCCC(C)O 34a_200000081814_200000718107 [0,1,0,1,0,0|1,0,0]=3 21533 B16R1.1188 COC(=O)C1CCCC1OCCCC(C)O 7a_200000081814_200000718107 [0,1,0,1,0,0|1,0,0]=3 21534 B16R1.1188 COC(=O)C1CCCC1OCCCN(C)C 7a_200000081814_100000757444 [0,1,0,1,0,0|2,0,0]=4 21535 B16R1.1188 COC(=O)C1CCCC1OCCOC(C)C 34a_200000081814_100000211751 [0,1,0,1,0,0|2,0,0]=4 21536 B16R1.1188 COC(=O)C1CCCC1OCCOC(C)C 7a_200000081814_100000211751 [0,1,0,1,0,0|2,0,0]=4 21537 B16R1.1188 COC(=O)C1CCCC1OCCSC(C)C 34a_200000081814_100000730970 [0,1,0,1,0,0|2,0,0]=4 21538 B16R1.1188 COC(=O)C1CCCC1OCCSC(C)C 7a_200000081814_100000730970 [0,1,0,1,0,0|2,0,0]=4 21539 B16R1.1188 COC(=O)C1CSCN1CCCCC(C)C 269982a_200000724679_100011216152 [0,1,0,1,0,0|2,0,0]=4 21540 B16R1.1188 COC(=O)C1SCCN1CCCCC(C)C 2230a_100015296106_100011216152 [0,1,0,1,0,0|2,0,0]=4 21541 B16R1.1188 COC(=O)C1SCCN1CCCCC(C)C 269982a_100015296106_100011216152 [0,1,0,1,0,0|2,0,0]=4 21542 B16R1.1188 COC(=O)[C@@H]1CCCN1CCCCC(=O)C 269982a_100000752040_100000735457 [0,1,0,1,0,0|1,0,1]=4 21543 B16R1.1188 COC(=O)[C@@H]1CCCN1CCCCC(C)C 2230a_100000752040_100011216152 [0,1,0,1,0,0|1,0,0]=3 21544 B16R1.1188 COC(=O)[C@@H]1CCCN1CCCCC(C)C 269982a_100000752040_100011216152 [0,1,0,1,0,0|1,0,0]=3 21545 B16R1.1188 COC(=O)[C@@H]1CCCN1CCCCN(C)C 269982a_100000752040_100000690147 [0,1,0,1,0,0|2,0,0]=4 21546 B16R1.1312 C=C1CC(C1)CNCCCCCC(=O)OC 2230a_100102567296_100009816466 [0,1,0,1,0,0|1,0,1]=4 21547 B16R1.1312 C=C1CC(C1)CNCCCCCC(=O)OC 34a_100102567296_100009816466 [0,1,0,1,0,0|1,0,1]=4 21548 B16R1.1312 C=C1CC(C1)COCCCCCC(=O)OC 34a_100011011225_100009816466 [0,1,0,1,0,0|1,0,1]=4 21549 B16R1.1312 C=C1CC(C1)NCCCCCCC(=O)OC 2230a_100132301982_100009815986 [0,1,0,1,0,0|1,0,1]=4 21550 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)C 2230a_100000702820_100010004213 [0,1,0,1,0,0|1,0,0]=3 21551 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)C 269982a_100000702820_100010004213 [0,1,0,1,0,0|1,0,0]=3 21552 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)C 34a_100000702820_100010004213 [0,1,0,1,0,0|1,0,0]=3 21553 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)F 2230a_100000690557_100010004213 [0,1,0,1,0,0|1,0,0]=3 21554 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)F 269982a_100000690557_100010004213 [0,1,0,1,0,0|1,0,0]=3 21555 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)F 34a_100000690557_100010004213 [0,1,0,1,0,0|1,0,0]=3 21556 B16R1.1312 COC(=O)CCCCCCCN1CC(C1)O 269982a_100000749847_100010004213 [0,1,0,1,0,0|1,0,0]=3 21557 B16R1.1312 COC(=O)CCCCCCNC1CC(C1)F 2230a_100016993743_100009815986 [0,1,0,1,0,0|1,0,0]=3 21558 B16R1.1312 COC(=O)CCCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100009815986 [0,1,0,1,0,0|1,0,0]=3 21559 B16R1.1312 COC(=O)CCCCCCSC1CC(=O)C1 62a_100009894365_100009815986 [0,1,0,1,0,0|1,0,1]=4 21560 B16R1.1312 COC(=O)CCCCCNCC1CC(C1)O 2230a_100016992100_100009816466 [0,1,0,1,0,0|1,0,0]=3 21561 B16R1.1312 COC(=O)CCCCCOCC1CC(=O)C1 34a_100000101936_100009816466 [0,1,0,1,0,0|1,0,1]=4 21562 B16R1.1312 COC(=O)CCCCCOCC1CC(=O)C1 7a_100000074720_100009874392 [0,1,0,1,0,0|1,0,1]=4 21563 B16R1.1312 COC(=O)CCCCCOCC1CC(C1)Cl 34a_100009874164_100009816466 [0,1,0,1,0,0|1,0,0]=3 21564 B16R1.1312 COC(=O)CCCCCSCC1CC(=O)C1 62a_100009816466_100009874392 [0,1,0,1,0,0|1,0,1]=4 21565 B16R1.1312 COC(=O)CCCCCSCC1CC(=O)C1 62a_100009874392_100009816466 [0,1,0,1,0,0|1,0,1]=4 21566 B16R1.1330 COC(=O)CCN1CCCCC1CN(C)C 2230a_100000746231_100000204255 [0,1,0,1,0,0|2,0,0]=4 21567 B16R1.1330 COC(=O)CCN1CCCCC1CN(C)C 269982a_100000746231_100000204255 [0,1,0,1,0,0|2,0,0]=4 21568 B16R1.1330 COC(=O)CCN1CCOCC1CC(C)C 2230a_100000755734_100000204255 [0,1,0,1,0,0|2,0,0]=4 21569 B16R1.1330 COC(=O)CCN1CCOCC1CC(C)C 269982a_100000755734_100000204255 [0,1,0,1,0,0|2,0,0]=4 21570 B16R1.1330 COC(=O)CCN1CCOCC1CC(C)C 34a_100000755734_100000742370 [0,1,0,1,0,0|2,0,0]=4 21571 B16R1.1330 COC(=O)COC1CCCCC1NC(C)C 34a_100000692356_100000747449 [0,1,0,1,0,0|2,0,0]=4 21572 B16R1.3262 CNC(=O)CCCN1CCCCC1C(C)C 2230a_100000757267_100000741757 [0,1,0,1,0,0|2,0,0]=4 21573 B16R1.3262 CNC(=O)CCCN1CCCCC1C(C)C 269982a_100000757267_100000741757 [0,1,0,1,0,0|2,0,0]=4 21574 B16R1.3262 CNC(=O)CCCN1CCCCC1C(C)C 34a_100000757267_100000741757 [0,1,0,1,0,0|2,0,0]=4 21575 B16R1.3262 CNC(=O)CCOC1CCCCC1C(C)C 34a_100011709184_100012179268 [0,1,0,1,0,0|2,0,0]=4 21576 B16R1.3262 CNC(=O)CCOC1CCCCC1C(C)C 7a_100011709184_100000737683 [0,1,0,1,0,0|2,0,0]=4 21577 B16R1.3262 COC(=O)CCCN1CCCCC1C(C)C 2230a_100000757267_100011218270 [0,1,0,1,0,0|1,0,0]=3 21578 B16R1.3262 COC(=O)CCCN1CCCCC1C(C)C 269982a_100000757267_100011218270 [0,1,0,1,0,0|1,0,0]=3 21579 B16R1.3262 COC(=O)CCCN1CCCCC1C(C)C 34a_100000757267_100000742333 [0,1,0,1,0,0|1,0,0]=3 21580 B16R1.3262 COC(=O)CCCN1CCOC[C@@H]1C(C)C 2230a_100025712635_100011218270 [0,1,0,1,0,0|2,0,0]=4 21581 B16R1.3262 COC(=O)CCCN1CCOC[C@@H]1C(C)C 269982a_100025712635_100011218270 [0,1,0,1,0,0|2,0,0]=4 21582 B16R1.3262 COC(=O)CCCN1CCOC[C@@H]1C(C)C 34a_100025712635_100000742333 [0,1,0,1,0,0|2,0,0]=4 21583 B16R1.3262 COC(=O)CCOC1CCCCC1C(C)C 34a_100011709184_100000742370 [0,1,0,1,0,0|1,0,0]=3 21584 B16R1.3262 COC(=O)CCOC1CCCCC1C(C)C 7a_100011709184_100000204255 [0,1,0,1,0,0|1,0,0]=3 21585 B16R1.3266 CNC(=O)CCCN1CCCC1CC(C)C 2230a_100000748429_100000741757 [0,1,0,1,0,0|2,0,0]=4 21586 B16R1.3266 CNC(=O)CCCN1CCCC1CC(C)C 269982a_100000748429_100000741757 [0,1,0,1,0,0|2,0,0]=4 21587 B16R1.3266 CNC(=O)CCCN1CCCC1CC(C)C 34a_100000748429_100000741757 [0,1,0,1,0,0|2,0,0]=4 21588 B16R1.3266 COC(=O)CCCN1CCCC1CC(C)C 2230a_100000748429_100011218270 [0,1,0,1,0,0|1,0,0]=3 21589 B16R1.3266 COC(=O)CCCN1CCCC1CC(C)C 269982a_100000748429_100011218270 [0,1,0,1,0,0|1,0,0]=3 21590 B16R1.3266 COC(=O)CCCN1CCCC1CC(C)C 34a_100000748429_100000742333 [0,1,0,1,0,0|1,0,0]=3 21591 B16R1.3266 COC(=O)CCCN1CCC[C@@H]1CN(C)C 269982a_200020645772_100011218270 [0,1,0,1,0,0|2,0,0]=4 21592 B16R1.4413 COC(=O)CC1COCCN1CCC(C)C 2230a_100000731486_100000210312 [0,1,0,1,0,0|2,0,0]=4 21593 B16R1.4413 COC(=O)CC1COCCN1CCC(C)C 34a_100000731486_100000210312 [0,1,0,1,0,0|2,0,0]=4 21594 B16R1.4413 COC(=O)CC1COCCN1CCC(C)O 2230a_100000731486_100012276601 [0,1,0,1,0,0|2,0,0]=4 21595 B16R1.4413 COC(=O)CC1COCCN1CCC(C)O 34a_100000731486_100012276601 [0,1,0,1,0,0|2,0,0]=4 21596 B16R1.4413 COC(=O)CN1CCCCC1CCN(C)C 269982a_100000243220_100000747449 [0,1,0,1,0,0|2,0,0]=4 21597 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(=O)C 269982a_100025726698_100011215641 [0,1,0,1,0,0|1,0,1]=4 21598 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(=O)C 34a_100025726698_100000685027 [0,1,0,1,0,0|1,0,1]=4 21599 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(C)C 2230a_100025726698_100011214892 [0,1,0,1,0,0|1,0,0]=3 21600 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(C)C 269982a_100025726698_100011214892 [0,1,0,1,0,0|1,0,0]=3 21601 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(C)C 34a_100025726698_100011214892 [0,1,0,1,0,0|1,0,0]=3 21602 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(C)O 2230a_100025726698_200000718107 [0,1,0,1,0,0|1,0,0]=3 21603 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(C)O 269982a_100025726698_200000718107 [0,1,0,1,0,0|1,0,0]=3 21604 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCC(C)O 34a_100025726698_200000718107 [0,1,0,1,0,0|1,0,0]=3 21605 B16R1.4426 COC(=O)C[C@H]1CCCN1CCCN(C)C 269982a_100025726698_100000757444 [0,1,0,1,0,0|2,0,0]=4 21606 B16R1.4426 COC(=O)C[C@H]1CCCN1CCOC(C)C 2230a_100025726698_100000211751 [0,1,0,1,0,0|2,0,0]=4 21607 B16R1.4426 COC(=O)C[C@H]1CCCN1CCOC(C)C 269982a_100025726698_100000211751 [0,1,0,1,0,0|2,0,0]=4 21608 B16R1.4426 COC(=O)C[C@H]1CCCN1CCOC(C)C 34a_100025726698_100000211751 [0,1,0,1,0,0|2,0,0]=4 21609 B16R1.4426 COC(=O)C[C@H]1CCCN1CCSC(C)C 2230a_100025726698_100000730970 [0,1,0,1,0,0|2,0,0]=4 21610 B16R1.4426 COC(=O)C[C@H]1CCCN1CCSC(C)C 269982a_100025726698_100000730970 [0,1,0,1,0,0|2,0,0]=4 21611 B16R1.4426 COC(=O)C[C@H]1CCCN1CCSC(C)C 34a_100025726698_100000730970 [0,1,0,1,0,0|2,0,0]=4 21612 B16R1.6868 CC(C)CCCCCCNC1COC(=O)O1 34a_100000211014_100000032252 [0,1,0,1,0,0|2,0,0]=4 21613 B16R1.6868 CC(C)CCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210682 [0,1,0,1,0,0|2,0,0]=4 21614 B16R1.6868 CC(C)CCCCCNCC1CNC(=O)C1 34a_100016993742_100000210682 [0,1,0,1,0,0|2,0,0]=4 21615 B16R1.6868 CC(C)CCCCCNCC1COC(=O)O1 34a_100011290863_100000073702 [0,1,0,1,0,0|2,0,0]=4 21616 B16R1.6868 CC(C)CCCCCNC[C@H]1COC(=O)N1 2230a_100011290863_100015307671 [0,1,0,1,0,0|2,0,0]=4 21617 B16R1.6868 CC(C)CCCCCNC[C@H]1COC(=O)N1 34a_100011290863_100015307671 [0,1,0,1,0,0|2,0,0]=4 21618 B16R1.6868 CC(C)CCCCCOCC1CNC(=O)C1 34a_100016041077_100000210682 [0,1,0,1,0,0|2,0,0]=4 21619 B16R1.6868 CC(C)CCCCCOCC1COC(=O)O1 34a_100011995859_100000073702 [0,1,0,1,0,0|2,0,0]=4 21620 B16R1.6868 CC(C)CCCCCOC[C@H]1COC(=O)N1 34a_100011995859_100015307671 [0,1,0,1,0,0|2,0,0]=4 21621 B16R1.6868 CC(C)CCCCCOC[C@H]1COC(=O)N1 7a_100011995859_100015307671 [0,1,0,1,0,0|2,0,0]=4 21622 B16R1.6868 CC(C)CCCCCSCC1COC(=O)O1 62a_100000073702_100000210682 [0,1,0,1,0,0|2,0,0]=4 21623 B16R1.6868 CC(C)CCCCCSCC1COC(=O)O1 62a_100000210682_100000073702 [0,1,0,1,0,0|2,0,0]=4 21624 B16R1.6868 CC(C)CCCCCSC[C@H]1COC(=O)N1 62a_100000210682_100015307671 [0,1,0,1,0,0|2,0,0]=4 21625 B16R1.6868 CC(C)CCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210682 [0,1,0,1,0,0|2,0,0]=4 21626 B16R1.7318 CC(C)CCCCCCCOC1CCC1=O 34a_200000210741_100009892977 [0,1,0,1,0,0|2,0,0]=4 21627 B16R1.7318 CC(C)CCCCCCCOC1CCC1=O 7a_200000210741_100009892977 [0,1,0,1,0,0|2,0,0]=4 21628 B16R1.7318 CC(C)CCCCCNCCC1CCC1=O 2230a_100011290863_200016118888 [0,1,0,1,0,0|2,0,0]=4 21629 B16R1.7318 CC(C)CCCCCOCCC1CCC1=O 7a_100011995859_200016118888 [0,1,0,1,0,0|2,0,0]=4 21630 B16R1.7318 CC(C)CCCCCSCCC1CCC1=O 62a_100000210682_200016118888 [0,1,0,1,0,0|2,0,0]=4 21631 B16R1.7318 CC(C)CCCCCSCCC1CCC1=O 62a_200016118888_100000210682 [0,1,0,1,0,0|2,0,0]=4 21632 B16R1.16730 CCC(=O)CN1CCCCCC1CC(C)C 269982a_100000759364_100000747405 [0,1,0,1,0,0|2,0,0]=4 21633 B16R1.16730 CNC(=O)CN1CCCCCC1CC(C)C 2230a_100000759364_100000183359 [0,1,0,1,0,0|2,0,0]=4 21634 B16R1.16730 CNC(=O)CN1CCCCCC1CC(C)C 269982a_100000759364_100000183359 [0,1,0,1,0,0|2,0,0]=4 21635 B16R1.16730 CNC(=O)CN1CCCCCC1CC(C)C 34a_100000759364_100000183359 [0,1,0,1,0,0|2,0,0]=4 21636 B16R1.16730 COC(=O)CN1CCCCCC1CC(C)C 2230a_100000759364_100000747449 [0,1,0,1,0,0|1,0,0]=3 21637 B16R1.16730 COC(=O)CN1CCCCCC1CC(C)C 269982a_100000759364_100000747449 [0,1,0,1,0,0|1,0,0]=3 21638 B16R1.16730 COC(=O)CN1CCCCCC1CC(C)C 34a_100000759364_100000747449 [0,1,0,1,0,0|1,0,0]=3 21639 B16R1.16804 CNC(=O)CCN1CCCCCC1C(C)C 2230a_100000697956_100000737683 [0,1,0,1,0,0|2,0,0]=4 21640 B16R1.16804 CNC(=O)CCN1CCCCCC1C(C)C 269982a_100000697956_100000737683 [0,1,0,1,0,0|2,0,0]=4 21641 B16R1.16804 CNC(=O)CCN1CCCCCC1C(C)C 34a_100000697956_100012179268 [0,1,0,1,0,0|2,0,0]=4 21642 B16R1.16804 COC(=O)CCN1CCCCCC1C(C)C 2230a_100000697956_100000204255 [0,1,0,1,0,0|1,0,0]=3 21643 B16R1.16804 COC(=O)CCN1CCCCCC1C(C)C 269982a_100000697956_100000204255 [0,1,0,1,0,0|1,0,0]=3 21644 B16R1.16804 COC(=O)CCN1CCCCCC1C(C)C 34a_100000697956_100000742370 [0,1,0,1,0,0|1,0,0]=3 21645 B16R1.16891 CNC(=O)CCCNC1CCCCC1(C)C 269862a_100000740002_100000031690 [0,1,0,1,0,0|2,0,0]=4 21646 B16R1.16891 COC(=O)CCCCN1CCOCC1(C)C 2230a_100000724681_100000204269 [0,1,0,1,0,0|2,0,0]=4 21647 B16R1.16891 COC(=O)CCCCN1CCOCC1(C)C 269982a_100000724681_100000204269 [0,1,0,1,0,0|2,0,0]=4 21648 B16R1.16891 COC(=O)CCCCN1CCOCC1(C)C 34a_100000724681_100000204269 [0,1,0,1,0,0|2,0,0]=4 21649 B16R1.16891 COC(=O)CCCNC1CCCCC1(F)F 2230a_100000686509_100011218270 [0,1,0,1,0,0|2,0,0]=4 21650 B16R1.16891 COC(=O)CCCNC1CCCCC1(F)F 34a_100000686509_100000742333 [0,1,0,1,0,0|2,0,0]=4 21651 B16R1.16891 COC(=O)CCCOC1CCNCC1(C)C 34a_100000709803_100000742333 [0,1,0,1,0,0|2,0,0]=4 21652 B16R1.16891 COC(=O)CCCSC1CCCCC1(F)F 62a_100011218270_200009832135 [0,1,0,1,0,0|2,0,0]=4 21653 B16R1.16891 COC(=O)CCCSC1CCCCC1(F)F 62a_200009832135_100011218270 [0,1,0,1,0,0|2,0,0]=4 21654 B16R1.16892 COC(=O)CCCCN1CCCC1C(C)C 2230a_100000762757_100000204269 [0,1,0,1,0,0|1,0,0]=3 21655 B16R1.16892 COC(=O)CCCCN1CCCC1C(C)C 269982a_100000762757_100000204269 [0,1,0,1,0,0|1,0,0]=3 21656 B16R1.16892 COC(=O)CCCCN1CCCC1C(C)C 34a_100000762757_100000204269 [0,1,0,1,0,0|1,0,0]=3 21657 B16R1.16892 COC(=O)COCCN1CCCC1C(C)C 2230a_100000762757_100000090808 [0,1,0,1,0,0|2,0,0]=4 21658 B16R1.16892 COC(=O)COCCN1CCCC1C(C)C 34a_100000762757_100000090808 [0,1,0,1,0,0|2,0,0]=4 21659 B16R1.16981 COC(=O)CCCCCN1CCCC1(C)C 2230a_100000761399_100009816466 [0,1,0,1,0,0|1,0,0]=3 21660 B16R1.16981 COC(=O)CCCCCN1CCCC1(C)C 269982a_100000761399_100009816466 [0,1,0,1,0,0|1,0,0]=3 21661 B16R1.16981 COC(=O)CCCCCN1CCCC1(C)C 34a_100000761399_100009816466 [0,1,0,1,0,0|1,0,0]=3 21662 B16R1.16981 COC(=O)CCCCCN1CCSC1(C)C 2230a_100011217261_100009816466 [0,1,0,1,0,0|2,0,0]=4 21663 B16R1.16981 COC(=O)CCCCCN1CCSC1(C)C 269982a_100011217261_100009816466 [0,1,0,1,0,0|2,0,0]=4 21664 B16R1.16981 COC(=O)CCCCCN1CCSC1(C)C 34a_100011217261_100009816466 [0,1,0,1,0,0|2,0,0]=4 21665 B16R1.16981 COC(=O)CCCCCN1COCC1(C)C 2230a_100000043020_100009816466 [0,1,0,1,0,0|2,0,0]=4 21666 B16R1.16981 COC(=O)CCCCCN1COCC1(C)C 269982a_100000043020_100009816466 [0,1,0,1,0,0|2,0,0]=4 21667 B16R1.16981 COC(=O)CCCCNC1CCCC1(F)F 2230a_100000767123_100000204269 [0,1,0,1,0,0|2,0,0]=4 21668 B16R1.16981 COC(=O)CCCCNC1CCCC1(F)F 34a_100000767123_100000204269 [0,1,0,1,0,0|2,0,0]=4 21669 B16R1.16981 COC(=O)CCCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000204269 [0,1,0,1,0,0|1,0,0]=3 21670 B16R1.16981 COC(=O)CCCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000204269 [0,1,0,1,0,0|1,0,0]=3 21671 B16R1.16981 COC(=O)CCCCOC1CCCC1(C)C 34a_100000726220_100000204269 [0,1,0,1,0,0|1,0,0]=3 21672 B16R1.16981 COC(=O)CCCCOC1CCCC1(C)C 7a_100000726220_100000204269 [0,1,0,1,0,0|1,0,0]=3 21673 B16R1.16981 COC(=O)CCCCOC1CCCC1(F)F 34a_100000059025_100119073726 [0,1,0,1,0,0|2,0,0]=4 21674 B16R1.16981 COC(=O)CCCCSC1CCCC1(F)F 62a_100000204269_100119073726 [0,1,0,1,0,0|2,0,0]=4 21675 B16R1.16981 COC(=O)CCCCSC1CCCC1(F)F 62a_100119073726_100000204269 [0,1,0,1,0,0|2,0,0]=4 21676 B16R1.16981 COC(=O)CCNCCN1CCCC1(C)C 2230a_100015204988_100000204255 [0,1,0,1,0,0|2,0,0]=4 21677 B16R1.16981 COC(=O)COCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000090808 [0,1,0,1,0,0|2,0,0]=4 21678 B16R1.16981 COC(=O)COCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000090808 [0,1,0,1,0,0|2,0,0]=4 21679 B16R1.16981 COC(=O)COCCOC1CCCC1(C)C 34a_100000726220_100000090808 [0,1,0,1,0,0|2,0,0]=4 21680 B16R1.16981 COC(=O)COCCOC1CCCC1(C)C 7a_100000726220_100000090808 [0,1,0,1,0,0|2,0,0]=4 21681 B16R1.17266 COC(=O)[C@@H]1CCN1CCCCCC(C)C 2230a_102516456887_100000210682 [0,1,0,1,0,0|1,0,0]=3 21682 B16R1.17266 COC(=O)[C@@H]1CCN1CCCCCC(C)C 269982a_102516456887_100000210682 [0,1,0,1,0,0|1,0,0]=3 21683 B16R1.18314 COC(=O)CCCCCCNC1CC1(F)F 2230a_100020610826_100009815986 [0,1,0,1,0,0|2,0,0]=4 21684 B16R1.18314 COC(=O)CCCCCCNC1CC1(F)F 34a_100020610826_100009815986 [0,1,0,1,0,0|2,0,0]=4 21685 B16R1.18314 COC(=O)CCCCCOCC1CC1(C)C 34a_100000728257_100009816466 [0,1,0,1,0,0|1,0,0]=3 21686 B16R1.18314 COC(=O)CCCCCOCC1CC1(C)C 7a_100000728257_100009816466 [0,1,0,1,0,0|1,0,0]=3 21687 B16R1.18314 COC(=O)CCCCCOCC1CC1(F)F 34a_100000056500_100009816466 [0,1,0,1,0,0|2,0,0]=4 21688 B16R1.18314 COC(=O)CCCCCOCC1CC1(F)F 34a_100000074720_100009817841 [0,1,0,1,0,0|2,0,0]=4 21689 B16R1.18314 COC(=O)CCCCCOCC1CC1(F)F 7a_100000056500_100009816466 [0,1,0,1,0,0|2,0,0]=4 21690 B16R1.18314 COC(=O)CCCCCOCC1CC1(F)F 7a_100000074720_100009817841 [0,1,0,1,0,0|2,0,0]=4 21691 B16R1.18314 COC(=O)CCCCCOCC1OC1(C)C 34a_200010283642_100009816466 [0,1,0,1,0,0|2,0,0]=4 21692 B16R1.18314 COC(=O)CCCCCOCC1OC1(C)C 7a_200010283642_100009816466 [0,1,0,1,0,0|2,0,0]=4 21693 B16R1.18314 COC(=O)CCCCCSCC1CC1(F)F 62a_100009816466_100009817841 [0,1,0,1,0,0|2,0,0]=4 21694 B16R1.18314 COC(=O)CCCCCSCC1CC1(F)F 62a_100009817841_100009816466 [0,1,0,1,0,0|2,0,0]=4 21695 B16R1.18314 COC(=O)CCCCOCCC1CC1(F)F 34a_100009864177_100000204269 [0,1,0,1,0,0|2,0,0]=4 21696 B16R1.18314 COC(=O)CCCCOCCC1CC1(F)F 7a_100009864177_100000204269 [0,1,0,1,0,0|2,0,0]=4 21697 B16R1.287 CCCCCCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100000210314 [0,1,0,1,0,0|1,0,0]=3 21698 B16R1.287 CCCCCCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100000210757 [0,1,0,1,0,0|1,0,0]=3 21699 B16R1.287 CCCCCCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100000210314 [0,1,0,1,0,0|1,0,0]=3 21700 B16R1.287 CCCCOCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100011995733 [0,1,0,1,0,0|2,0,0]=4 21701 B16R1.287 CCCCOCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100011995733 [0,1,0,1,0,0|2,0,0]=4 21702 B16R1.287 CCCCOCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100011995733 [0,1,0,1,0,0|2,0,0]=4 21703 B16R1.287 CCCOCCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100011215938 [0,1,0,1,0,0|2,0,0]=4 21704 B16R1.287 CCCOCCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100011215938 [0,1,0,1,0,0|2,0,0]=4 21705 B16R1.287 CCCOCCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100011215938 [0,1,0,1,0,0|2,0,0]=4 21706 B16R1.287 CCOCCCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100012232248 [0,1,0,1,0,0|2,0,0]=4 21707 B16R1.287 CCOCCCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100012232248 [0,1,0,1,0,0|2,0,0]=4 21708 B16R1.287 CCOCCCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100012232248 [0,1,0,1,0,0|2,0,0]=4 21709 B16R1.287 COC(=O)[C@@]1(CCCN1CCCCCF)C 2230a_100000719487_100000729378 [0,1,0,1,0,0|2,0,0]=4 21710 B16R1.287 COC(=O)[C@@]1(CCCN1CCCCCF)C 269982a_100000719487_100000729378 [0,1,0,1,0,0|2,0,0]=4 21711 B16R1.287 COC(=O)[C@@]1(CCCN1CCCCCF)C 34a_100000719487_100000729378 [0,1,0,1,0,0|2,0,0]=4 21712 B16R1.287 COC(=O)[C@@]1(CCCN1CCCCCO)C 2230a_100000719487_100000746330 [0,1,0,1,0,0|2,0,0]=4 21713 B16R1.287 COC(=O)[C@@]1(CCCN1CCCCCO)C 269982a_100000719487_100000746330 [0,1,0,1,0,0|2,0,0]=4 21714 B16R1.287 COC(=O)[C@@]1(CCCN1CCCCCO)C 34a_100000719487_100000746330 [0,1,0,1,0,0|2,0,0]=4 21715 B16R1.287 COCCCCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100000730899 [0,1,0,1,0,0|2,0,0]=4 21716 B16R1.287 COCCCCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100000730899 [0,1,0,1,0,0|2,0,0]=4 21717 B16R1.287 COCCCCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100000755781 [0,1,0,1,0,0|2,0,0]=4 21718 B16R1.295 C=C(CN1CCCCC1CCC)C(=O)OC 34a_100000701414_100009813391 [0,1,0,1,0,0|1,0,1]=4 21719 B16R1.295 CCCC1CCCCC1OC(C)C(=O)CC 7a_100011217265_100000742827 [0,1,0,1,0,0|2,0,0]=4 21720 B16R1.295 CCCC1CCCCC1OC(C)C(=O)NC 34a_100011217265_100000731044 [0,1,0,1,0,0|2,0,0]=4 21721 B16R1.295 CCCC1CCCCC1OC(C)C(=O)NC 7a_100011217265_100000209862 [0,1,0,1,0,0|2,0,0]=4 21722 B16R1.295 CCCC1CCCCC1OC(C)C(=O)OC 34a_100011217265_100000211248 [0,1,0,1,0,0|1,0,0]=3 21723 B16R1.295 CCCC1CCCCC1OC(C)C(=O)OC 7a_100011217265_100000211248 [0,1,0,1,0,0|1,0,0]=3 21724 B16R1.295 CCCC1CCCCC1OC(F)C(=O)NC 34a_100011217265_100009813575 [0,1,0,1,0,0|2,0,0]=4 21725 B16R1.295 CCCC1CCCCC1OC(F)C(=O)NC 7a_100011217265_100009813575 [0,1,0,1,0,0|2,0,0]=4 21726 B16R1.295 CCCC1CCCCN1CC(=O)C(=O)OC 34a_100000701414_100011610305 [0,1,0,1,0,0|1,0,1]=4 21727 B16R1.295 CCCC1CCCCN1CC(C)C(=O)OC 269982a_100000701414_100000698445 [0,1,0,1,0,0|1,0,0]=3 21728 B16R1.295 CCCC1CCCCN1CC(C)C(=O)OC 34a_100000701414_100000698445 [0,1,0,1,0,0|1,0,0]=3 21729 B16R1.295 CCCC1COCCN1CC(C)C(=O)OC 269982a_102495339903_100000698445 [0,1,0,1,0,0|2,0,0]=4 21730 B16R1.295 CCCC1COCCN1CC(C)C(=O)OC 34a_102495339903_100000698445 [0,1,0,1,0,0|2,0,0]=4 21731 B16R1.295 COC(=O)C(C)CN1CCCCC1CCO 269982a_100000211664_100000698445 [0,1,0,1,0,0|2,0,0]=4 21732 B16R1.295 COC(=O)C(C)CN1CCCCC1CCO 34a_100000211664_100000698445 [0,1,0,1,0,0|2,0,0]=4 21733 B16R1.295 COCC1CCCCN1CC(C)C(=O)OC 269982a_100015184032_100000698445 [0,1,0,1,0,0|2,0,0]=4 21734 B16R1.295 COCC1CCCCN1CC(C)C(=O)OC 34a_100015184032_100000698445 [0,1,0,1,0,0|2,0,0]=4 21735 B16R1.313 CCCC1CCCC1NCC(C)C(=O)NC 269862a_100015187722_100000723119 [0,1,0,1,0,0|2,0,0]=4 21736 B16R1.313 CCCC1CCCC1NCC(C)C(=O)NC 270004a_100015187722_100000723119 [0,1,0,1,0,0|2,0,0]=4 21737 B16R1.313 CCCN1CCCC1COC(C)C(=O)OC 34a_200000694710_100000211248 [0,1,0,1,0,0|2,0,0]=4 21738 B16R1.313 CCCN1CCCC1COC(C)C(=O)OC 7a_200000694710_100000211248 [0,1,0,1,0,0|2,0,0]=4 21739 B16R1.313 COC[C@@H]1CCCN1CCC(C)C(=O)OC 2230a_100020646714_100000034942 [0,1,0,1,0,0|2,0,0]=4 21740 B16R1.313 COC[C@@H]1CCCN1CCC(C)C(=O)OC 269982a_100020646714_100000034942 [0,1,0,1,0,0|2,0,0]=4 21741 B16R1.313 COC[C@@H]1CCCN1CCC(C)C(=O)OC 34a_100020646714_100000034942 [0,1,0,1,0,0|2,0,0]=4 21742 B16R1.1254 COC(=O)C(C)N1CCCCC1CCCO 2230a_100011934581_100000211248 [0,1,0,1,0,0|2,0,0]=4 21743 B16R1.1254 COC(=O)C(C)N1CCCCC1CCCO 269982a_100011934581_100000211248 [0,1,0,1,0,0|2,0,0]=4 21744 B16R1.1254 COC(=O)C(C)N1CCCCC1CCCO 34a_100011934581_100000211248 [0,1,0,1,0,0|2,0,0]=4 21745 B16R1.1254 COCCC1CCCCN1C(C)C(=O)OC 2230a_100015186528_100000211248 [0,1,0,1,0,0|2,0,0]=4 21746 B16R1.1254 COCCC1CCCCN1C(C)C(=O)OC 269982a_100015186528_100000211248 [0,1,0,1,0,0|2,0,0]=4 21747 B16R1.1254 COCCC1CCCCN1C(C)C(=O)OC 34a_100015186528_100000211248 [0,1,0,1,0,0|2,0,0]=4 21748 B16R1.1368 C=C(COC1CCCCC1CC)C(=O)OC 34a_100000210738_100009813391 [0,1,0,1,0,0|1,0,1]=4 21749 B16R1.1368 CCC1CCCCC1NCC(C)C(=O)NC 269862a_100015187722_100000757040 [0,1,0,1,0,0|2,0,0]=4 21750 B16R1.1368 CCC1CCCCC1NCC(C)C(=O)NC 270004a_100015187722_100000757040 [0,1,0,1,0,0|2,0,0]=4 21751 B16R1.1368 CCC1CCCCC1OCC(=O)C(=O)OC 34a_100000210738_100011610305 [0,1,0,1,0,0|1,0,1]=4 21752 B16R1.1368 CCC1CCCCC1OCC(C)C(=O)OC 34a_100000210738_100000698445 [0,1,0,1,0,0|1,0,0]=3 21753 B16R1.1368 CCC1CCCCN1CCC(C)C(=O)OC 2230a_100000210034_100000034942 [0,1,0,1,0,0|1,0,0]=3 21754 B16R1.1368 CCC1CCCCN1CCC(C)C(=O)OC 269982a_100000210034_100000034942 [0,1,0,1,0,0|1,0,0]=3 21755 B16R1.1368 CCC1CCCCN1CCC(C)C(=O)OC 34a_100000210034_100000034942 [0,1,0,1,0,0|1,0,0]=3 21756 B16R1.1368 CCN1CCCCC1CNC(C)C(=O)OC 2230a_100000754393_100000211248 [0,1,0,1,0,0|2,0,0]=4 21757 B16R1.1368 CCN1CCCCC1CNC(C)C(=O)OC 34a_100000754393_100000211248 [0,1,0,1,0,0|2,0,0]=4 21758 B16R1.1368 CCN1CCCCC1COC(C)C(=O)OC 34a_100000225091_100000211248 [0,1,0,1,0,0|2,0,0]=4 21759 B16R1.1368 CCN1CCCCC1COC(C)C(=O)OC 7a_100000225091_100000211248 [0,1,0,1,0,0|2,0,0]=4 21760 B16R1.1368 CC[C@H]1COCCN1CCC(C)C(=O)OC 2230a_100016988097_100000034942 [0,1,0,1,0,0|2,0,0]=4 21761 B16R1.1368 CC[C@H]1COCCN1CCC(C)C(=O)OC 269982a_100016988097_100000034942 [0,1,0,1,0,0|2,0,0]=4 21762 B16R1.1368 CC[C@H]1COCCN1CCC(C)C(=O)OC 34a_100016988097_100000034942 [0,1,0,1,0,0|2,0,0]=4 21763 B16R1.1368 CN[C@@H]1CCCC[C@H]1OCC(C)C(=O)OC 34a_100000708425_100000698445 [0,1,0,1,0,0|2,0,0]=4 21764 B16R1.1368 COC(=O)C(C)CCN1CCCCC1CO 2230a_100000210821_100000034942 [0,1,0,1,0,0|2,0,0]=4 21765 B16R1.1368 COC(=O)C(C)CCN1CCCCC1CO 269982a_100000210821_100000034942 [0,1,0,1,0,0|2,0,0]=4 21766 B16R1.1368 COC(=O)C(C)CCN1CCCCC1CO 34a_100000210821_100000034942 [0,1,0,1,0,0|2,0,0]=4 21767 B16R1.1368 COC(=O)C(C)CNC1CCCCC1OC 34a_100011208099_100000698445 [0,1,0,1,0,0|2,0,0]=4 21768 B16R1.1368 COC(=O)C(C)COC1CCCCC1CN 34a_100011216029_100000698445 [0,1,0,1,0,0|2,0,0]=4 21769 B16R1.1368 COC(=O)C(C)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000698445 [0,1,0,1,0,0|2,0,0]=4 21770 B16R1.1428 CCCCCN1CCCCC1(C)C(=O)OC 2230a_100015186357_100000210326 [0,1,0,1,0,0|1,0,0]=3 21771 B16R1.1428 CCCCCN1CCCCC1(C)C(=O)OC 269982a_100015186357_100000210215 [0,1,0,1,0,0|1,0,0]=3 21772 B16R1.1428 CCCCCN1CCCCC1(C)C(=O)OC 34a_100015186357_100000718602 [0,1,0,1,0,0|1,0,0]=3 21773 B16R1.1428 CCOCCN1CCCCC1(C)C(=O)OC 2230a_100015186357_100011215890 [0,1,0,1,0,0|2,0,0]=4 21774 B16R1.1428 CCOCCN1CCCCC1(C)C(=O)OC 269982a_100015186357_100011215890 [0,1,0,1,0,0|2,0,0]=4 21775 B16R1.1428 CCOCCN1CCCCC1(C)C(=O)OC 34a_100015186357_100000210147 [0,1,0,1,0,0|2,0,0]=4 21776 B16R1.1428 CCSCCN1CCCCC1(C)C(=O)OC 2230a_100015186357_100000757381 [0,1,0,1,0,0|2,0,0]=4 21777 B16R1.1428 CCSCCN1CCCCC1(C)C(=O)OC 269982a_100015186357_100000757381 [0,1,0,1,0,0|2,0,0]=4 21778 B16R1.1428 CCSCCN1CCCCC1(C)C(=O)OC 34a_100015186357_100000757381 [0,1,0,1,0,0|2,0,0]=4 21779 B16R1.1428 COC(=O)C1(CCCCN1CCCCF)C 2230a_100015186357_100000729493 [0,1,0,1,0,0|2,0,0]=4 21780 B16R1.1428 COC(=O)C1(CCCCN1CCCCF)C 269982a_100015186357_100000729493 [0,1,0,1,0,0|2,0,0]=4 21781 B16R1.1428 COC(=O)C1(CCCCN1CCCCF)C 34a_100015186357_100000729493 [0,1,0,1,0,0|2,0,0]=4 21782 B16R1.1428 COC(=O)C1(CCCCN1CCCCO)C 2230a_100015186357_100000210776 [0,1,0,1,0,0|2,0,0]=4 21783 B16R1.1428 COC(=O)C1(CCCCN1CCCCO)C 269982a_100015186357_100000210776 [0,1,0,1,0,0|2,0,0]=4 21784 B16R1.1428 COC(=O)C1(CCCCN1CCCCO)C 34a_100015186357_100011216708 [0,1,0,1,0,0|2,0,0]=4 21785 B16R1.1428 COCCCN1CCCCC1(C)C(=O)OC 2230a_100015186357_100000740836 [0,1,0,1,0,0|2,0,0]=4 21786 B16R1.1428 COCCCN1CCCCC1(C)C(=O)OC 269982a_100015186357_100000740836 [0,1,0,1,0,0|2,0,0]=4 21787 B16R1.1428 COCCCN1CCCCC1(C)C(=O)OC 34a_100015186357_100000740836 [0,1,0,1,0,0|2,0,0]=4 21788 B16R1.1635 C=C(CNCCC1CCCCC1)C(=O)OC 34a_100000738074_100009813391 [0,1,0,1,0,0|1,0,1]=4 21789 B16R1.1635 C=C(COCCC1CCCCC1)C(=O)OC 34a_100011217863_100009813391 [0,1,0,1,0,0|1,0,1]=4 21790 B16R1.1635 C=C(CSCCC1CCCCC1)C(=O)OC 62a_100009813391_100012355289 [0,1,0,1,0,0|1,0,1]=4 21791 B16R1.1635 C=C(CSCCC1CCCCC1)C(=O)OC 62a_100012355289_100009813391 [0,1,0,1,0,0|1,0,1]=4 21792 B16R1.1635 CCC(=O)C(C)NCCCC1CCCCC1 2230a_100011211642_100000742827 [0,1,0,1,0,0|2,0,0]=4 21793 B16R1.1635 CCC(=O)C(C)OCCCC1CCCCC1 7a_100000198086_100000742827 [0,1,0,1,0,0|2,0,0]=4 21794 B16R1.1635 CCC(=O)C(C)SCCCC1CCCCC1 62a_100000742827_100011713725 [0,1,0,1,0,0|2,0,0]=4 21795 B16R1.1635 CCC(=O)C(C)SCCCC1CCCCC1 62a_100011713725_100000742827 [0,1,0,1,0,0|2,0,0]=4 21796 B16R1.1635 CNC(=O)C(C)CNCCC1CCCCC1 2230a_100015187722_100012355289 [0,1,0,1,0,0|2,0,0]=4 21797 B16R1.1635 CNC(=O)C(C)CNCCC1CCCCC1 270004a_100015187722_100011713444 [0,1,0,1,0,0|2,0,0]=4 21798 B16R1.1635 CNC(=O)C(C)CNCCC1CCCCC1 34a_100015187722_100011209188 [0,1,0,1,0,0|2,0,0]=4 21799 B16R1.1635 CNC(=O)C(C)NCCCC1CCCCC1 2230a_100011211642_100000731044 [0,1,0,1,0,0|2,0,0]=4 21800 B16R1.1635 CNC(=O)C(C)NCCCC1CCCCC1 34a_100011211642_100000731044 [0,1,0,1,0,0|2,0,0]=4 21801 B16R1.1635 CNC(=O)C(C)OCCCC1CCCCC1 34a_100000198086_100000731044 [0,1,0,1,0,0|2,0,0]=4 21802 B16R1.1635 CNC(=O)C(C)OCCCC1CCCCC1 7a_100000198086_100000209862 [0,1,0,1,0,0|2,0,0]=4 21803 B16R1.1635 CNC(=O)C(C)SCCCC1CCCCC1 62a_100000209862_100011713725 [0,1,0,1,0,0|2,0,0]=4 21804 B16R1.1635 CNC(=O)C(C)SCCCC1CCCCC1 62a_100011713725_100000731044 [0,1,0,1,0,0|2,0,0]=4 21805 B16R1.1635 CNC(=O)C(F)NCCCC1CCCCC1 2230a_100011211642_100009813575 [0,1,0,1,0,0|2,0,0]=4 21806 B16R1.1635 CNC(=O)C(F)NCCCC1CCCCC1 34a_100011211642_100009813575 [0,1,0,1,0,0|2,0,0]=4 21807 B16R1.1635 CNC(=O)C(F)OCCCC1CCCCC1 34a_100000198086_100009813575 [0,1,0,1,0,0|2,0,0]=4 21808 B16R1.1635 CNC(=O)C(F)OCCCC1CCCCC1 7a_100000198086_100009813575 [0,1,0,1,0,0|2,0,0]=4 21809 B16R1.1635 CNC(=O)C(F)SCCCC1CCCCC1 62a_100009813575_100011713725 [0,1,0,1,0,0|2,0,0]=4 21810 B16R1.1635 CNC(=O)C(F)SCCCC1CCCCC1 62a_100011713725_100009813575 [0,1,0,1,0,0|2,0,0]=4 21811 B16R1.1635 CNC(=O)[C@@H](C)NCCCC1CCCCC1 2230a_100000684985_100011713725 [0,1,0,1,0,0|2,0,0]=4 21812 B16R1.1635 CNC(=O)[C@@H](C)NCCCC1CCCCC1 34a_100000684985_100011713725 [0,1,0,1,0,0|2,0,0]=4 21813 B16R1.1635 COC(=O)C(=O)CNCCC1CCCCC1 34a_100000738074_100011610305 [0,1,0,1,0,0|1,0,1]=4 21814 B16R1.1635 COC(=O)C(=O)COCCC1CCCCC1 34a_100011217863_100011610305 [0,1,0,1,0,0|1,0,1]=4 21815 B16R1.1635 COC(=O)C(=O)CSCCC1CCCCC1 62a_100011610305_100012355289 [0,1,0,1,0,0|1,0,1]=4 21816 B16R1.1635 COC(=O)C(=O)CSCCC1CCCCC1 62a_100012355289_100011610305 [0,1,0,1,0,0|1,0,1]=4 21817 B16R1.1635 COC(=O)C(=O)NCCCC1CCCCC1 11a_100011211642_100000024059 [0,1,0,1,0,0|1,0,1]=4 21818 B16R1.1635 COC(=O)C(=O)NCCCC1CCCCC1 1626a_100011211642_100000024059 [0,1,0,1,0,0|1,0,1]=4 21819 B16R1.1635 COC(=O)C(=O)NCCCC1CCCCC1 240690a_100011211642_100000024059 [0,1,0,1,0,0|1,0,1]=4 21820 B16R1.1635 COC(=O)C(=O)NCCCC1CCCCC1 527a_100011211642_100000024059 [0,1,0,1,0,0|1,0,1]=4 21821 B16R1.1635 COC(=O)C(C)CCNCC1CCCCC1 2230a_100000210473_100000034942 [0,1,0,1,0,0|1,0,0]=3 21822 B16R1.1635 COC(=O)C(C)CCNCC1CCCCC1 34a_100000210473_100000034942 [0,1,0,1,0,0|1,0,0]=3 21823 B16R1.1635 COC(=O)C(C)CCNCC1CCCCO1 2230a_100000174945_100000034942 [0,1,0,1,0,0|2,0,0]=4 21824 B16R1.1635 COC(=O)C(C)CCNCC1CCCCO1 34a_100000174945_100000034942 [0,1,0,1,0,0|2,0,0]=4 21825 B16R1.1635 COC(=O)C(C)CCNCC1CCCOC1 2230a_100000720124_100000034942 [0,1,0,1,0,0|2,0,0]=4 21826 B16R1.1635 COC(=O)C(C)CCNCC1CCCOC1 34a_100000720124_100000034942 [0,1,0,1,0,0|2,0,0]=4 21827 B16R1.1635 COC(=O)C(C)CCNCC1CCOCC1 2230a_100000746373_100000034942 [0,1,0,1,0,0|2,0,0]=4 21828 B16R1.1635 COC(=O)C(C)CCNCC1CCOCC1 34a_100000746373_100000034942 [0,1,0,1,0,0|2,0,0]=4 21829 B16R1.1635 COC(=O)C(C)CCNCC1CCSCC1 2230a_100015188806_100000034942 [0,1,0,1,0,0|2,0,0]=4 21830 B16R1.1635 COC(=O)C(C)CCNCC1CCSCC1 34a_100015188806_100000034942 [0,1,0,1,0,0|2,0,0]=4 21831 B16R1.1635 COC(=O)C(C)CCOCC1CCCCC1 34a_100000212181_100000034942 [0,1,0,1,0,0|1,0,0]=3 21832 B16R1.1635 COC(=O)C(C)CCOCC1CCCCC1 7a_100000212181_100000034942 [0,1,0,1,0,0|1,0,0]=3 21833 B16R1.1635 COC(=O)C(C)CCOCC1CCCCN1 34a_100000210821_100000034942 [0,1,0,1,0,0|2,0,0]=4 21834 B16R1.1635 COC(=O)C(C)CCOCC1CCCCO1 34a_100000211370_100000034942 [0,1,0,1,0,0|2,0,0]=4 21835 B16R1.1635 COC(=O)C(C)CCOCC1CCCCO1 7a_100000211370_100000034942 [0,1,0,1,0,0|2,0,0]=4 21836 B16R1.1635 COC(=O)C(C)CCOCC1CCCNC1 34a_100000211344_100000034942 [0,1,0,1,0,0|2,0,0]=4 21837 B16R1.1635 COC(=O)C(C)CCOCC1CCCOC1 34a_100000741520_100000034942 [0,1,0,1,0,0|2,0,0]=4 21838 B16R1.1635 COC(=O)C(C)CCOCC1CCNCC1 34a_100000738675_100000034942 [0,1,0,1,0,0|2,0,0]=4 21839 B16R1.1635 COC(=O)C(C)CCOCC1CCOCC1 34a_100000749013_100000034942 [0,1,0,1,0,0|2,0,0]=4 21840 B16R1.1635 COC(=O)C(C)CCOCC1CCSCC1 34a_100000070558_100000034942 [0,1,0,1,0,0|2,0,0]=4 21841 B16R1.1635 COC(=O)C(C)CCOCC1CCSCC1 7a_100000070558_100000034942 [0,1,0,1,0,0|2,0,0]=4 21842 B16R1.1635 COC(=O)C(C)CCSCC1CCCCC1 62a_100000034942_100000211423 [0,1,0,1,0,0|1,0,0]=3 21843 B16R1.1635 COC(=O)C(C)CCSCC1CCCCC1 62a_100000211423_100000034942 [0,1,0,1,0,0|1,0,0]=3 21844 B16R1.1635 COC(=O)C(C)CCSCC1CCCCO1 62a_100000034942_100000211543 [0,1,0,1,0,0|2,0,0]=4 21845 B16R1.1635 COC(=O)C(C)CCSCC1CCCCO1 62a_100000211543_100000034942 [0,1,0,1,0,0|2,0,0]=4 21846 B16R1.1635 COC(=O)C(C)CCSCC1CCCOC1 62a_100000034942_100000741521 [0,1,0,1,0,0|2,0,0]=4 21847 B16R1.1635 COC(=O)C(C)CCSCC1CCCOC1 62a_100000741521_100000034942 [0,1,0,1,0,0|2,0,0]=4 21848 B16R1.1635 COC(=O)C(C)CCSCC1CCOCC1 62a_100000034942_100000749018 [0,1,0,1,0,0|2,0,0]=4 21849 B16R1.1635 COC(=O)C(C)CCSCC1CCOCC1 62a_100000754603_100000034942 [0,1,0,1,0,0|2,0,0]=4 21850 B16R1.1635 COC(=O)C(C)CNCCC1CCCCC1 34a_100000738074_100000698445 [0,1,0,1,0,0|1,0,0]=3 21851 B16R1.1635 COC(=O)C(C)CNCCC1CCCCO1 34a_100015183643_100000698445 [0,1,0,1,0,0|2,0,0]=4 21852 B16R1.1635 COC(=O)C(C)CNCCC1CCOCC1 34a_100000755988_100000698445 [0,1,0,1,0,0|2,0,0]=4 21853 B16R1.1635 COC(=O)C(C)COCCC1CCCCC1 34a_100000749362_100011209188 [0,1,0,1,0,0|1,0,0]=3 21854 B16R1.1635 COC(=O)C(C)COCCC1CCCCC1 34a_100011217863_100000698445 [0,1,0,1,0,0|1,0,0]=3 21855 B16R1.1635 COC(=O)C(C)COCCC1CCCCC1 7a_100000749362_100011273959 [0,1,0,1,0,0|1,0,0]=3 21856 B16R1.1635 COC(=O)C(C)COCCC1CCCCN1 34a_100000211664_100000698445 [0,1,0,1,0,0|2,0,0]=4 21857 B16R1.1635 COC(=O)C(C)COCCC1CCCNC1 34a_100000752241_100000698445 [0,1,0,1,0,0|2,0,0]=4 21858 B16R1.1635 COC(=O)C(C)COCCC1CCNCC1 34a_100015190746_100000698445 [0,1,0,1,0,0|2,0,0]=4 21859 B16R1.1635 COC(=O)C(C)COCCC1CCOCC1 34a_100000749362_100011934994 [0,1,0,1,0,0|2,0,0]=4 21860 B16R1.1635 COC(=O)C(C)COCCC1CCOCC1 34a_100011933979_100000698445 [0,1,0,1,0,0|2,0,0]=4 21861 B16R1.1635 COC(=O)C(C)COCCC1CCOCC1 7a_100000749362_100011934994 [0,1,0,1,0,0|2,0,0]=4 21862 B16R1.1635 COC(=O)C(C)COCCN1CCCCC1 34a_100000749362_100000739454 [0,1,0,1,0,0|2,0,0]=4 21863 B16R1.1635 COC(=O)C(C)COCCN1CCCCC1 7a_100000749362_100000739454 [0,1,0,1,0,0|2,0,0]=4 21864 B16R1.1635 COC(=O)C(C)COCOC1CCCCC1 34a_100000749362_100011935260 [0,1,0,1,0,0|2,0,0]=4 21865 B16R1.1635 COC(=O)C(C)COCOC1CCCCC1 7a_100000749362_100011935260 [0,1,0,1,0,0|2,0,0]=4 21866 B16R1.1635 COC(=O)C(C)CSCCC1CCCCC1 62a_100000698445_100012355289 [0,1,0,1,0,0|1,0,0]=3 21867 B16R1.1635 COC(=O)C(C)CSCCC1CCCCC1 62a_100012355289_100000698445 [0,1,0,1,0,0|1,0,0]=3 21868 B16R1.1635 COC(=O)C(C)CSCCC1CCOCC1 62a_100000698445_100011934994 [0,1,0,1,0,0|2,0,0]=4 21869 B16R1.1635 COC(=O)C(C)CSCCC1CCOCC1 62a_100011934994_100000698445 [0,1,0,1,0,0|2,0,0]=4 21870 B16R1.1635 COC(=O)C(C)CSCCN1CCCCC1 62a_100000698445_100000739454 [0,1,0,1,0,0|2,0,0]=4 21871 B16R1.1635 COC(=O)C(C)CSCCN1CCCCC1 62a_100000739454_100000698445 [0,1,0,1,0,0|2,0,0]=4 21872 B16R1.1635 COC(=O)C(C)CSCOC1CCCCC1 62a_100000698445_100011935260 [0,1,0,1,0,0|2,0,0]=4 21873 B16R1.1635 COC(=O)C(C)CSCOC1CCCCC1 62a_100011935260_100000698445 [0,1,0,1,0,0|2,0,0]=4 21874 B16R1.1635 COC(=O)C(C)NCCCC1CCCCC1 2230a_100011211642_100000211248 [0,1,0,1,0,0|1,0,0]=3 21875 B16R1.1635 COC(=O)C(C)NCCCC1CCCCC1 34a_100011211642_100000211248 [0,1,0,1,0,0|1,0,0]=3 21876 B16R1.1635 COC(=O)C(C)NCCOC1CCCCC1 34a_100015206981_100000211248 [0,1,0,1,0,0|2,0,0]=4 21877 B16R1.1635 COC(=O)C(C)OCCCC1CCCCC1 34a_100000198086_100000211248 [0,1,0,1,0,0|1,0,0]=3 21878 B16R1.1635 COC(=O)C(C)OCCCC1CCCCC1 34a_100011215400_100011713725 [0,1,0,1,0,0|1,0,0]=3 21879 B16R1.1635 COC(=O)C(C)OCCCC1CCCCC1 7a_100000198086_100000211248 [0,1,0,1,0,0|1,0,0]=3 21880 B16R1.1635 COC(=O)C(C)OCCCC1CCCCN1 34a_100011934581_100000211248 [0,1,0,1,0,0|2,0,0]=4 21881 B16R1.1635 COC(=O)C(C)OCCCC1CCCNC1 34a_100150707839_100000211248 [0,1,0,1,0,0|2,0,0]=4 21882 B16R1.1635 COC(=O)C(C)OCCCC1CCNCC1 34a_100016988962_100000211248 [0,1,0,1,0,0|2,0,0]=4 21883 B16R1.1635 COC(=O)C(C)OCCCN1CCCCC1 34a_100000212458_100000211248 [0,1,0,1,0,0|2,0,0]=4 21884 B16R1.1635 COC(=O)C(C)OCCCN1CCCCC1 34a_100011215400_100000690320 [0,1,0,1,0,0|2,0,0]=4 21885 B16R1.1635 COC(=O)C(C)OCCNC1CCCCC1 34a_100000200466_100000211248 [0,1,0,1,0,0|2,0,0]=4 21886 B16R1.1635 COC(=O)C(C)OCCOC1CCCCC1 34a_100011215400_100011211530 [0,1,0,1,0,0|2,0,0]=4 21887 B16R1.1635 COC(=O)C(C)OCCOC1CCCCC1 34a_100011249652_100000211248 [0,1,0,1,0,0|2,0,0]=4 21888 B16R1.1635 COC(=O)C(C)OCCOC1CCCCC1 7a_100011249652_100000211248 [0,1,0,1,0,0|2,0,0]=4 21889 B16R1.1635 COC(=O)C(C)SCCCC1CCCCC1 62a_100000211248_100011713725 [0,1,0,1,0,0|1,0,0]=3 21890 B16R1.1635 COC(=O)C(C)SCCCC1CCCCC1 62a_100011713725_100000211248 [0,1,0,1,0,0|1,0,0]=3 21891 B16R1.1635 COC(=O)C(C)SCCCN1CCCCC1 62a_100000211248_100000007876 [0,1,0,1,0,0|2,0,0]=4 21892 B16R1.1635 COC(=O)C(C)SCCCN1CCCCC1 62a_100132302099_100000211248 [0,1,0,1,0,0|2,0,0]=4 21893 B16R1.1635 COC(=O)C(C)SCCOC1CCCCC1 62a_100000211248_100011211530 [0,1,0,1,0,0|2,0,0]=4 21894 B16R1.1635 COC(=O)C(C)SCCOC1CCCCC1 62a_100011211530_100000211248 [0,1,0,1,0,0|2,0,0]=4 21895 B16R1.1635 COC(=O)C(F)COCCC1CCCCC1 34a_200009849844_100011209188 [0,1,0,1,0,0|1,0,0]=3 21896 B16R1.1635 COC(=O)C(F)COCCC1CCOCC1 34a_200009849844_100011934994 [0,1,0,1,0,0|2,0,0]=4 21897 B16R1.1635 COC(=O)C(F)COCCN1CCCCC1 34a_200009849844_100000739454 [0,1,0,1,0,0|2,0,0]=4 21898 B16R1.1635 COC(=O)C(F)COCOC1CCCCC1 34a_200009849844_100011935260 [0,1,0,1,0,0|2,0,0]=4 21899 B16R1.1635 COC(=O)[C@H](N)COCCC1CCCCC1 34a_100000003586_100011209188 [0,1,0,1,0,0|1,0,0]=3 21900 B16R1.1635 COC(=O)[C@H](N)COCCC1CCOCC1 34a_100000003586_100011934994 [0,1,0,1,0,0|2,0,0]=4 21901 B16R1.1635 COC(=O)[C@H](N)COCCN1CCCCC1 34a_100000003586_100000739454 [0,1,0,1,0,0|2,0,0]=4 21902 B16R1.1635 COC(=O)[C@H](N)COCOC1CCCCC1 34a_100000003586_100011935260 [0,1,0,1,0,0|2,0,0]=4 21903 B16R1.1648 C=C(CNCCCC1CCCC1)C(=O)OC 34a_100000736752_100009813391 [0,1,0,1,0,0|1,0,1]=4 21904 B16R1.1648 C=C(COCCCC1CCCC1)C(=O)OC 34a_100011215328_100009813391 [0,1,0,1,0,0|1,0,1]=4 21905 B16R1.1648 C=C(CSCCCC1CCCC1)C(=O)OC 62a_100009813391_100011713738 [0,1,0,1,0,0|1,0,1]=4 21906 B16R1.1648 C=C(CSCCCC1CCCC1)C(=O)OC 62a_100011713738_100009813391 [0,1,0,1,0,0|1,0,1]=4 21907 B16R1.1648 CNC(=O)C(C)CNCCCC1CCCC1 2230a_100015187722_100011713738 [0,1,0,1,0,0|2,0,0]=4 21908 B16R1.1648 CNC(=O)C(C)CNCCCC1CCCC1 34a_100015187722_100011713738 [0,1,0,1,0,0|2,0,0]=4 21909 B16R1.1648 COC(=O)C(=O)CNCCCC1CCCC1 34a_100000736752_100011610305 [0,1,0,1,0,0|1,0,1]=4 21910 B16R1.1648 COC(=O)C(=O)COCCCC1CCCC1 34a_100011215328_100011610305 [0,1,0,1,0,0|1,0,1]=4 21911 B16R1.1648 COC(=O)C(=O)CSCCCC1CCCC1 62a_100011610305_100011713738 [0,1,0,1,0,0|1,0,1]=4 21912 B16R1.1648 COC(=O)C(=O)CSCCCC1CCCC1 62a_100011713738_100011610305 [0,1,0,1,0,0|1,0,1]=4 21913 B16R1.1648 COC(=O)C(C)CCNCCC1CCCC1 2230a_100000739158_100000034942 [0,1,0,1,0,0|1,0,0]=3 21914 B16R1.1648 COC(=O)C(C)CCNCCC1CCCC1 34a_100000739158_100000034942 [0,1,0,1,0,0|1,0,0]=3 21915 B16R1.1648 COC(=O)C(C)CCOCCC1CCCC1 34a_100000749090_100000034942 [0,1,0,1,0,0|1,0,0]=3 21916 B16R1.1648 COC(=O)C(C)CCOCCC1CCCC1 7a_100000749090_100000034942 [0,1,0,1,0,0|1,0,0]=3 21917 B16R1.1648 COC(=O)C(C)CCOCCC1CCNC1 34a_100016987287_100000034942 [0,1,0,1,0,0|2,0,0]=4 21918 B16R1.1648 COC(=O)C(C)CCOCCC1CCOC1 34a_100011879284_100000034942 [0,1,0,1,0,0|2,0,0]=4 21919 B16R1.1648 COC(=O)C(C)CCSCCC1CCCC1 62a_100000034942_100000760354 [0,1,0,1,0,0|1,0,0]=3 21920 B16R1.1648 COC(=O)C(C)CCSCCC1CCCC1 62a_100000760354_100000034942 [0,1,0,1,0,0|1,0,0]=3 21921 B16R1.1648 COC(=O)C(C)CCSCCN1CCCC1 62a_100000034942_100000004467 [0,1,0,1,0,0|2,0,0]=4 21922 B16R1.1648 COC(=O)C(C)CCSCCN1CCCC1 62a_100000700749_100000034942 [0,1,0,1,0,0|2,0,0]=4 21923 B16R1.1648 COC(=O)C(C)CNCCCC1CCCC1 34a_100000736752_100000698445 [0,1,0,1,0,0|1,0,0]=3 21924 B16R1.1648 COC(=O)C(C)CNCCOC1CCCC1 34a_100000741755_100000698445 [0,1,0,1,0,0|2,0,0]=4 21925 B16R1.1648 COC(=O)C(C)COCCCC1CCCC1 34a_100000749362_100011713738 [0,1,0,1,0,0|1,0,0]=3 21926 B16R1.1648 COC(=O)C(C)COCCCC1CCCC1 34a_100011215328_100000698445 [0,1,0,1,0,0|1,0,0]=3 21927 B16R1.1648 COC(=O)C(C)COCCCC1CCCC1 7a_100000749362_100011713738 [0,1,0,1,0,0|1,0,0]=3 21928 B16R1.1648 COC(=O)C(C)COCCCN1CCCC1 34a_100000749362_100016991639 [0,1,0,1,0,0|2,0,0]=4 21929 B16R1.1648 COC(=O)C(C)COCCCN1CCCC1 7a_100000749362_100011445909 [0,1,0,1,0,0|2,0,0]=4 21930 B16R1.1648 COC(=O)C(C)COCCNC1CCCC1 34a_200000200444_100000698445 [0,1,0,1,0,0|2,0,0]=4 21931 B16R1.1648 COC(=O)C(C)COCCOC1CCCC1 34a_100000738311_100000698445 [0,1,0,1,0,0|2,0,0]=4 21932 B16R1.1648 COC(=O)C(C)CSCCCC1CCCC1 62a_100000698445_100011713738 [0,1,0,1,0,0|1,0,0]=3 21933 B16R1.1648 COC(=O)C(C)CSCCCC1CCCC1 62a_100011713738_100000698445 [0,1,0,1,0,0|1,0,0]=3 21934 B16R1.1648 COC(=O)C(C)CSCCCN1CCCC1 62a_100000698445_100011445909 [0,1,0,1,0,0|2,0,0]=4 21935 B16R1.1648 COC(=O)C(C)CSCCCN1CCCC1 62a_100016991639_100000698445 [0,1,0,1,0,0|2,0,0]=4 21936 B16R1.1648 COC(=O)C(C)NCCCOC1CCCC1 34a_100000747560_100000211248 [0,1,0,1,0,0|2,0,0]=4 21937 B16R1.1648 COC(=O)C(F)COCCCC1CCCC1 34a_200009849844_100011713738 [0,1,0,1,0,0|1,0,0]=3 21938 B16R1.1648 COC(=O)C(F)COCCCN1CCCC1 34a_200009849844_100016991639 [0,1,0,1,0,0|2,0,0]=4 21939 B16R1.1648 COC(=O)[C@H](N)COCCCC1CCCC1 34a_100000003586_100011713738 [0,1,0,1,0,0|1,0,0]=3 21940 B16R1.1648 COC(=O)[C@H](N)COCCCN1CCCC1 34a_100000003586_100016991639 [0,1,0,1,0,0|2,0,0]=4 21941 B16R1.2611 C=C(CNC1CCCCCCC1)C(=O)OC 34a_100000211152_100009813391 [0,1,0,1,0,0|1,0,1]=4 21942 B16R1.2611 C=C(COC1CCCCCCC1)C(=O)OC 34a_100000210054_100009813391 [0,1,0,1,0,0|1,0,1]=4 21943 B16R1.2611 CCC(=O)C(C)OCC1CCCCCCC1 7a_100011216312_100000742827 [0,1,0,1,0,0|2,0,0]=4 21944 B16R1.2611 CNC(=O)C(C)CNC1CCCCCCC1 270004a_100015187722_100000210524 [0,1,0,1,0,0|2,0,0]=4 21945 B16R1.2611 CNC(=O)C(C)OCC1CCCCCCC1 34a_100011216312_100000731044 [0,1,0,1,0,0|2,0,0]=4 21946 B16R1.2611 CNC(=O)C(C)OCC1CCCCCCC1 7a_100011216312_100000209862 [0,1,0,1,0,0|2,0,0]=4 21947 B16R1.2611 CNC(=O)C(F)OCC1CCCCCCC1 34a_100011216312_100009813575 [0,1,0,1,0,0|2,0,0]=4 21948 B16R1.2611 CNC(=O)C(F)OCC1CCCCCCC1 7a_100011216312_100009813575 [0,1,0,1,0,0|2,0,0]=4 21949 B16R1.2611 COC(=O)C(=O)CNC1CCCCCCC1 34a_100000211152_100011610305 [0,1,0,1,0,0|1,0,1]=4 21950 B16R1.2611 COC(=O)C(=O)COC1CCCCCCC1 34a_100000210054_100011610305 [0,1,0,1,0,0|1,0,1]=4 21951 B16R1.2611 COC(=O)C(C)CCN1CCCCCCC1 2230a_100000211400_100000034942 [0,1,0,1,0,0|1,0,0]=3 21952 B16R1.2611 COC(=O)C(C)CCN1CCCCCCC1 269982a_100000211400_100000034942 [0,1,0,1,0,0|1,0,0]=3 21953 B16R1.2611 COC(=O)C(C)CCN1CCCCCCC1 34a_100000211400_100000034942 [0,1,0,1,0,0|1,0,0]=3 21954 B16R1.2611 COC(=O)C(C)CNC1CCCCCCC1 34a_100000211152_100000698445 [0,1,0,1,0,0|1,0,0]=3 21955 B16R1.2611 COC(=O)C(C)COC1CCCCCCC1 34a_100000210054_100000698445 [0,1,0,1,0,0|1,0,0]=3 21956 B16R1.2611 COC(=O)C(C)OCC1CCCCCCC1 34a_100011216312_100000211248 [0,1,0,1,0,0|1,0,0]=3 21957 B16R1.2611 COC(=O)C(C)OCC1CCCCCCC1 7a_100011216312_100000211248 [0,1,0,1,0,0|1,0,0]=3 21958 B16R1.2741 C=C(CNCC1CCCCCC1)C(=O)OC 34a_100015204231_100009813391 [0,1,0,1,0,0|1,0,1]=4 21959 B16R1.2741 C=C(COCC1CCCCCC1)C(=O)OC 34a_100000699130_100009813391 [0,1,0,1,0,0|1,0,1]=4 21960 B16R1.2741 C=C(CSCC1CCCCCC1)C(=O)OC 62a_100009813391_200000696569 [0,1,0,1,0,0|1,0,1]=4 21961 B16R1.2741 C=C(CSCC1CCCCCC1)C(=O)OC 62a_200000696569_100009813391 [0,1,0,1,0,0|1,0,1]=4 21962 B16R1.2741 CCC(=O)C(C)NCCC1CCCCCC1 2230a_100011532351_100000742827 [0,1,0,1,0,0|2,0,0]=4 21963 B16R1.2741 CNC(=O)C(C)CNCC1CCCCCC1 2230a_100015187722_200000696569 [0,1,0,1,0,0|2,0,0]=4 21964 B16R1.2741 CNC(=O)C(C)CNCC1CCCCCC1 269862a_100015187722_200000763224 [0,1,0,1,0,0|2,0,0]=4 21965 B16R1.2741 CNC(=O)C(C)CNCC1CCCCCC1 34a_100015187722_200000696569 [0,1,0,1,0,0|2,0,0]=4 21966 B16R1.2741 CNC(=O)C(C)NCCC1CCCCCC1 2230a_100011532351_100000731044 [0,1,0,1,0,0|2,0,0]=4 21967 B16R1.2741 CNC(=O)C(C)NCCC1CCCCCC1 34a_100011532351_100000731044 [0,1,0,1,0,0|2,0,0]=4 21968 B16R1.2741 CNC(=O)C(F)NCCC1CCCCCC1 2230a_100011532351_100009813575 [0,1,0,1,0,0|2,0,0]=4 21969 B16R1.2741 CNC(=O)C(F)NCCC1CCCCCC1 34a_100011532351_100009813575 [0,1,0,1,0,0|2,0,0]=4 21970 B16R1.2741 COC(=O)C(=O)CNCC1CCCCCC1 34a_100015204231_100011610305 [0,1,0,1,0,0|1,0,1]=4 21971 B16R1.2741 COC(=O)C(=O)COCC1CCCCCC1 34a_100000699130_100011610305 [0,1,0,1,0,0|1,0,1]=4 21972 B16R1.2741 COC(=O)C(=O)CSCC1CCCCCC1 62a_100011610305_200000696569 [0,1,0,1,0,0|1,0,1]=4 21973 B16R1.2741 COC(=O)C(=O)CSCC1CCCCCC1 62a_200000696569_100011610305 [0,1,0,1,0,0|1,0,1]=4 21974 B16R1.2741 COC(=O)C(=O)NCCC1CCCCCC1 11a_100011532351_100000024059 [0,1,0,1,0,0|1,0,1]=4 21975 B16R1.2741 COC(=O)C(=O)NCCC1CCCCCC1 1626a_100011532351_100000024059 [0,1,0,1,0,0|1,0,1]=4 21976 B16R1.2741 COC(=O)C(=O)NCCC1CCCCCC1 240690a_100011532351_100000024059 [0,1,0,1,0,0|1,0,1]=4 21977 B16R1.2741 COC(=O)C(=O)NCCC1CCCCCC1 527a_100011532351_100000024059 [0,1,0,1,0,0|1,0,1]=4 21978 B16R1.2741 COC(=O)C(C)CCNC1CCCCCC1 2230a_100000210984_100000034942 [0,1,0,1,0,0|1,0,0]=3 21979 B16R1.2741 COC(=O)C(C)CCNC1CCCCCC1 34a_100000210984_100000034942 [0,1,0,1,0,0|1,0,0]=3 21980 B16R1.2741 COC(=O)C(C)CCOC1CCCCCC1 34a_100000210887_100000034942 [0,1,0,1,0,0|1,0,0]=3 21981 B16R1.2741 COC(=O)C(C)CCOC1CCCCCC1 7a_100000210887_100000034942 [0,1,0,1,0,0|1,0,0]=3 21982 B16R1.2741 COC(=O)C(C)CCSC1CCCCCC1 62a_100000034942_100011217769 [0,1,0,1,0,0|1,0,0]=3 21983 B16R1.2741 COC(=O)C(C)CCSC1CCCCCC1 62a_100011217769_100000034942 [0,1,0,1,0,0|1,0,0]=3 21984 B16R1.2741 COC(=O)C(C)CNCC1CCCCCC1 34a_100015204231_100000698445 [0,1,0,1,0,0|1,0,0]=3 21985 B16R1.2741 COC(=O)C(C)COCC1CCCCCC1 34a_100000699130_100000698445 [0,1,0,1,0,0|1,0,0]=3 21986 B16R1.2741 COC(=O)C(C)COCC1CCCCCC1 34a_100000749362_200000696569 [0,1,0,1,0,0|1,0,0]=3 21987 B16R1.2741 COC(=O)C(C)COCC1CCCCCC1 7a_100000749362_200000696569 [0,1,0,1,0,0|1,0,0]=3 21988 B16R1.2741 COC(=O)C(C)CSCC1CCCCCC1 62a_100000698445_200000696569 [0,1,0,1,0,0|1,0,0]=3 21989 B16R1.2741 COC(=O)C(C)CSCC1CCCCCC1 62a_200000696569_100000698445 [0,1,0,1,0,0|1,0,0]=3 21990 B16R1.2741 COC(=O)C(C)NCCC1CCCCCC1 2230a_100011532351_100000211248 [0,1,0,1,0,0|1,0,0]=3 21991 B16R1.2741 COC(=O)C(C)NCCC1CCCCCC1 34a_100011532351_100000211248 [0,1,0,1,0,0|1,0,0]=3 21992 B16R1.2741 COC(=O)C(C)OCCN1CCCCCC1 34a_100000238007_100000211248 [0,1,0,1,0,0|2,0,0]=4 21993 B16R1.2741 COC(=O)C(C)SCCN1CCCCCC1 62a_100000211248_100000722644 [0,1,0,1,0,0|2,0,0]=4 21994 B16R1.2741 COC(=O)C(C)SCCN1CCCCCC1 62a_100000722644_100000211248 [0,1,0,1,0,0|2,0,0]=4 21995 B16R1.2741 COC(=O)C(F)COCC1CCCCCC1 34a_200009849844_200000696569 [0,1,0,1,0,0|1,0,0]=3 21996 B16R1.2741 COC(=O)[C@H](N)COCC1CCCCCC1 34a_100000003586_200000696569 [0,1,0,1,0,0|1,0,0]=3 21997 B16R1.2882 C=C(CN1CCCCCCCC1)C(=O)OC 34a_100000039187_100009813391 [0,1,0,1,0,0|1,0,1]=4 21998 B16R1.2882 COC(=O)C(=O)CN1CCCCCCCC1 34a_100000039187_100011610305 [0,1,0,1,0,0|1,0,1]=4 21999 B16R1.2882 COC(=O)C(C)CN1CCCCCCCC1 269982a_100000039187_100000698445 [0,1,0,1,0,0|1,0,0]=3 22000 B16R1.2882 COC(=O)C(C)CN1CCCCCCCC1 34a_100000039187_100000698445 [0,1,0,1,0,0|1,0,0]=3 22001 B16R1.6680 CCCCCCCCCNC1CCCC1=O 2230a_100000212291_100000211823 [0,1,0,1,0,0|2,0,0]=4 22002 B16R1.6680 CCCCCCCCCNC1CCCC1=O 34a_100000212291_100000709159 [0,1,0,1,0,0|2,0,0]=4 22003 B16R1.6680 CCCCCCCCCNC1CCNC1=O 2230a_100016995588_100011214924 [0,1,0,1,0,0|2,0,0]=4 22004 B16R1.6680 CCCCCCCCCNC1CCNC1=O 34a_100016995588_100011214924 [0,1,0,1,0,0|2,0,0]=4 22005 B16R1.6680 CCCCCCCCCNC1CCOC1=O 2230a_100000212291_100000211211 [0,1,0,1,0,0|1,0,0]=3 22006 B16R1.6680 CCCCCCCCCNC1CCOC1=O 34a_100000212291_100000211211 [0,1,0,1,0,0|1,0,0]=3 22007 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100011214924 [0,1,0,1,0,0|1,0,0]=3 22008 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100011214924 [0,1,0,1,0,0|1,0,0]=3 22009 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_100000210712_100000709159 [0,1,0,1,0,0|2,0,0]=4 22010 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_200000719330_100011214924 [0,1,0,1,0,0|2,0,0]=4 22011 B16R1.6680 CCCCCCCCCOC1CCCC1=O 7a_100000210712_100000211823 [0,1,0,1,0,0|2,0,0]=4 22012 B16R1.6680 CCCCCCCCCOC1CCOC1=O 34a_100000210712_100000211211 [0,1,0,1,0,0|1,0,0]=3 22013 B16R1.6680 CCCCCCCCCOC1CCOC1=O 7a_100000210712_100000211211 [0,1,0,1,0,0|1,0,0]=3 22014 B16R1.6680 CCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011214924 [0,1,0,1,0,0|2,0,0]=4 22015 B16R1.6680 CCCCCCCCCSC1CCCC1=O 62a_100000211823_100000210670 [0,1,0,1,0,0|2,0,0]=4 22016 B16R1.6680 CCCCCCCCCSC1CCOC1=O 62a_100000211211_100000210670 [0,1,0,1,0,0|1,0,0]=3 22017 B16R1.6680 CCCCCCCCOCC1CCNC1=O 34a_100000133458_100000210759 [0,1,0,1,0,0|2,0,0]=4 22018 B16R1.6680 CCCCCCOCCOC1CCOC1=O 34a_100000691444_100000211211 [0,1,0,1,0,0|2,0,0]=4 22019 B16R1.6680 CCCCCCOCCOC1CCOC1=O 7a_100000691444_100000211211 [0,1,0,1,0,0|2,0,0]=4 22020 B16R1.6680 CCCCNCCCCOC1CCOC1=O 34a_200011216965_100000211211 [0,1,0,1,0,0|2,0,0]=4 22021 B16R1.6680 CCCCOCCCCOC1CCOC1=O 34a_200000760531_100000211211 [0,1,0,1,0,0|2,0,0]=4 22022 B16R1.6680 CCCCOCCCCOC1CCOC1=O 7a_200000760531_100000211211 [0,1,0,1,0,0|2,0,0]=4 22023 B16R1.6680 NCCCCCCCCOC1CCOC1=O 34a_102515433106_100000211211 [0,1,0,1,0,0|2,0,0]=4 22024 B16R1.6680 O=C1NOC[C@H]1NCCCCCCCCO 2230a_100000765999_100000033203 [0,1,0,1,0,0|2,0,0]=4 22025 B16R1.6680 O=C1NOC[C@H]1NCCCCCCCCO 34a_100000765999_100000033203 [0,1,0,1,0,0|2,0,0]=4 22026 B16R1.6680 O=C1OCCC1NCCCCCCCCO 2230a_102515433106_100000211211 [0,1,0,1,0,0|2,0,0]=4 22027 B16R1.6680 O=C1OCCC1NCCCCCCCCO 34a_102515433106_100000211211 [0,1,0,1,0,0|2,0,0]=4 22028 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 34a_100009813846_100000211211 [0,1,0,1,0,0|2,0,0]=4 22029 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 7a_100009813846_100000211211 [0,1,0,1,0,0|2,0,0]=4 22030 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 34a_100000033203_100000211211 [0,1,0,1,0,0|2,0,0]=4 22031 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 7a_100000033203_100000211211 [0,1,0,1,0,0|2,0,0]=4 22032 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000033203_100000211211 [0,1,0,1,0,0|2,0,0]=4 22033 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000211211_100000033203 [0,1,0,1,0,0|2,0,0]=4 22034 B16R1.6945 COC(=O)C(C)CCNC1CCCCC1C 2230a_100000211402_100000034942 [0,1,0,1,0,0|1,0,0]=3 22035 B16R1.6945 COC(=O)C(C)CCNC1CCCCC1C 34a_100000211402_100000034942 [0,1,0,1,0,0|1,0,0]=3 22036 B16R1.6945 COC(=O)C(C)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000034942 [0,1,0,1,0,0|2,0,0]=4 22037 B16R1.6945 COC(=O)C(C)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000034942 [0,1,0,1,0,0|2,0,0]=4 22038 B16R1.6945 COC(=O)C(C)CCOC1CCCCC1C 34a_100000211207_100000034942 [0,1,0,1,0,0|1,0,0]=3 22039 B16R1.6945 COC(=O)C(C)CCOC1CCCCC1C 7a_100000211207_100000034942 [0,1,0,1,0,0|1,0,0]=3 22040 B16R1.6945 COC(=O)C(C)CCOC1CCCCC1Cl 34a_100000038908_100000034942 [0,1,0,1,0,0|2,0,0]=4 22041 B16R1.6945 COC(=O)C(C)CCOC1CCCCC1Cl 7a_100000038908_100000034942 [0,1,0,1,0,0|2,0,0]=4 22042 B16R1.6945 COC(=O)C(C)CCOC1CCNCC1C 34a_100011998114_100000034942 [0,1,0,1,0,0|2,0,0]=4 22043 B16R1.6945 COC(=O)C(C)CCOC1CNCCC1C 34a_100000696640_100000034942 [0,1,0,1,0,0|2,0,0]=4 22044 B16R1.6945 COC(=O)C(C)CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000034942 [0,1,0,1,0,0|2,0,0]=4 22045 B16R1.6945 COC(=O)C(C)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000034942 [0,1,0,1,0,0|2,0,0]=4 22046 B16R1.6945 COC(=O)C(C)CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000034942 [0,1,0,1,0,0|2,0,0]=4 22047 B16R1.6945 COC(=O)C(C)CCSC1CCCCC1F 62a_100000034942_100015423560 [0,1,0,1,0,0|2,0,0]=4 22048 B16R1.6945 COC(=O)C(C)CCSC1CCCCC1F 62a_100015423560_100000034942 [0,1,0,1,0,0|2,0,0]=4 22049 B16R1.6945 COC(=O)C(C)CCSC1CCCCC1O 62a_100000034942_100000038908 [0,1,0,1,0,0|2,0,0]=4 22050 B16R1.6945 COC(=O)C(C)CCSC1CCCCC1O 62a_100000038908_100000034942 [0,1,0,1,0,0|2,0,0]=4 22051 B16R1.6945 COC(=O)C(C)CNCC1CCCCC1O 34a_100011216029_100000698445 [0,1,0,1,0,0|2,0,0]=4 22052 B16R1.6945 COC(=O)C(C)CNCC1CCCCN1C 34a_100011228421_100000698445 [0,1,0,1,0,0|2,0,0]=4 22053 B16R1.6945 COC(=O)C(C)COCC1CCCCN1C 34a_100000225079_100000698445 [0,1,0,1,0,0|2,0,0]=4 22054 B16R1.6945 COC(=O)C(C)COCC1CCCCN1C 34a_100000749362_100015186950 [0,1,0,1,0,0|2,0,0]=4 22055 B16R1.6945 COC(=O)C(C)COCC1CCCCN1C 7a_100000749362_100015185383 [0,1,0,1,0,0|2,0,0]=4 22056 B16R1.6945 COC(=O)C(C)CSCC1CCCCN1C 62a_100000698445_100015185383 [0,1,0,1,0,0|2,0,0]=4 22057 B16R1.6945 COC(=O)C(C)CSCC1CCCCN1C 62a_100015185383_100000698445 [0,1,0,1,0,0|2,0,0]=4 22058 B16R1.6945 COC(=O)C(C)NCCN1CCCCC1C 2230a_100000739827_100000211248 [0,1,0,1,0,0|2,0,0]=4 22059 B16R1.6945 COC(=O)C(C)NCCN1CCCCC1C 34a_100000739827_100000211248 [0,1,0,1,0,0|2,0,0]=4 22060 B16R1.6945 COC(=O)C(C)OCCC1CCCCN1C 34a_100011215400_100000211948 [0,1,0,1,0,0|2,0,0]=4 22061 B16R1.6945 COC(=O)C(C)OCCN1CCCCC1C 34a_100011305533_100000211248 [0,1,0,1,0,0|2,0,0]=4 22062 B16R1.6945 COC(=O)C(C)SCCC1CCCCN1C 62a_100000211248_100000211948 [0,1,0,1,0,0|2,0,0]=4 22063 B16R1.6945 COC(=O)C(C)SCCC1CCCCN1C 62a_100000211948_100000211248 [0,1,0,1,0,0|2,0,0]=4 22064 B16R1.6945 COC(=O)C(F)COCC1CCCCN1C 34a_200009849844_100015186950 [0,1,0,1,0,0|2,0,0]=4 22065 B16R1.6945 COC(=O)[C@H](N)COCC1CCCCN1C 34a_100000003586_100015186950 [0,1,0,1,0,0|2,0,0]=4 22066 B16R1.8380 CCCCCCCCN1CC(C1)C(=O)NC 34a_100000703363_100000210759 [0,1,0,1,0,0|2,0,0]=4 22067 B16R1.8380 CCCCCCCCN1CC(C1)C(=O)OC 269982a_100015188540_100000210759 [0,1,0,1,0,0|1,0,0]=3 22068 B16R1.8380 CCCCCCCOC1CC(C1)C(=O)OC 34a_100000210272_100009897219 [0,1,0,1,0,0|1,0,0]=3 22069 B16R1.8380 CCCCCCCOC1CC(C1)C(=O)OC 7a_100000076263_100000210614 [0,1,0,1,0,0|1,0,0]=3 22070 B16R1.8380 CCCCCCCOC1CC(C1)C(=O)OC 7a_100000210272_100009897219 [0,1,0,1,0,0|1,0,0]=3 22071 B16R1.8380 CCCCCCCSC1CC(C1)C(=O)OC 62a_100000210614_100009897219 [0,1,0,1,0,0|1,0,0]=3 22072 B16R1.8380 CCCCCCCSC1CC(C1)C(=O)OC 62a_100009897219_100000210316 [0,1,0,1,0,0|1,0,0]=3 22073 B16R1.8380 CCCCCCOCC1CC(C1)C(=O)OC 34a_100009884387_100000210314 [0,1,0,1,0,0|1,0,0]=3 22074 B16R1.8380 CCCCCCOCC1CC(C1)C(=O)OC 7a_100009884387_100000210314 [0,1,0,1,0,0|1,0,0]=3 22075 B16R1.8380 CCCCOCCOC1CC(C1)C(=O)OC 34a_100000210238_100009897219 [0,1,0,1,0,0|2,0,0]=4 22076 B16R1.8380 CCCCOCCOC1CC(C1)C(=O)OC 7a_100000076263_100000743108 [0,1,0,1,0,0|2,0,0]=4 22077 B16R1.8380 CCCCOCCOC1CC(C1)C(=O)OC 7a_100000210238_100009897219 [0,1,0,1,0,0|2,0,0]=4 22078 B16R1.8380 CCCCOCCSC1CC(C1)C(=O)OC 62a_100000743108_100009897219 [0,1,0,1,0,0|2,0,0]=4 22079 B16R1.8380 CCCCOCCSC1CC(C1)C(=O)OC 62a_100009897219_100000743108 [0,1,0,1,0,0|2,0,0]=4 22080 B16R1.8380 CCCCOCOCC1CC(C1)C(=O)OC 34a_100009884387_100011995733 [0,1,0,1,0,0|2,0,0]=4 22081 B16R1.8380 CCCCSCCOC1CC(C1)C(=O)OC 34a_200000230436_100009897219 [0,1,0,1,0,0|2,0,0]=4 22082 B16R1.8380 CCCCSCCOC1CC(C1)C(=O)OC 7a_200000230436_100009897219 [0,1,0,1,0,0|2,0,0]=4 22083 B16R1.8380 CCCOCCCNC1CC(C1)C(=O)OC 34a_100011217757_100009897219 [0,1,0,1,0,0|2,0,0]=4 22084 B16R1.8380 CCCOCCOCC1CC(C1)C(=O)OC 34a_100009884387_100011215938 [0,1,0,1,0,0|2,0,0]=4 22085 B16R1.8380 CCCOCCOCC1CC(C1)C(=O)OC 7a_100009884387_100011215938 [0,1,0,1,0,0|2,0,0]=4 22086 B16R1.8380 CCOCCCOCC1CC(C1)C(=O)OC 34a_100009884387_100012232248 [0,1,0,1,0,0|2,0,0]=4 22087 B16R1.8380 CCOCCCOCC1CC(C1)C(=O)OC 7a_100009884387_100012232248 [0,1,0,1,0,0|2,0,0]=4 22088 B16R1.8380 CNCCCCCOC1CC(C1)C(=O)OC 34a_100000722520_100009897219 [0,1,0,1,0,0|2,0,0]=4 22089 B16R1.8380 COC(=O)C1CC(C1)COCCCCCF 34a_100009884387_100000729378 [0,1,0,1,0,0|2,0,0]=4 22090 B16R1.8380 COC(=O)C1CC(C1)COCCCCCF 7a_100009884387_100000729378 [0,1,0,1,0,0|2,0,0]=4 22091 B16R1.8380 COC(=O)C1CC(C1)COCCCCCO 34a_100009884387_100000746330 [0,1,0,1,0,0|2,0,0]=4 22092 B16R1.8380 COC(=O)C1CC(C1)COCCCCCO 7a_100009884387_100000746330 [0,1,0,1,0,0|2,0,0]=4 22093 B16R1.8380 COC(=O)C1CC(C1)NCCCCCCO 34a_100000686447_100009897219 [0,1,0,1,0,0|2,0,0]=4 22094 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCBr 34a_100011215345_100009897219 [0,1,0,1,0,0|2,0,0]=4 22095 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCBr 7a_100011215345_100009897219 [0,1,0,1,0,0|2,0,0]=4 22096 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCCl 34a_100000766143_100009897219 [0,1,0,1,0,0|2,0,0]=4 22097 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCCl 7a_100000766143_100009897219 [0,1,0,1,0,0|2,0,0]=4 22098 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCF 34a_100000732779_100009897219 [0,1,0,1,0,0|2,0,0]=4 22099 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCF 7a_100000076263_100015922095 [0,1,0,1,0,0|2,0,0]=4 22100 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCF 7a_100000732779_100009897219 [0,1,0,1,0,0|2,0,0]=4 22101 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCN 34a_100000686447_100009897219 [0,1,0,1,0,0|2,0,0]=4 22102 B16R1.8380 COC(=O)C1CC(C1)OCCCCCCO 7a_100000076263_100000766143 [0,1,0,1,0,0|2,0,0]=4 22103 B16R1.8380 COC(=O)C1CC(C1)SCCCCCCF 62a_100009897219_100015922095 [0,1,0,1,0,0|2,0,0]=4 22104 B16R1.8380 COC(=O)C1CC(C1)SCCCCCCF 62a_100015922095_100009897219 [0,1,0,1,0,0|2,0,0]=4 22105 B16R1.8380 COC(=O)C1CC(C1)SCCCCCCO 62a_100000766143_100009897219 [0,1,0,1,0,0|2,0,0]=4 22106 B16R1.8380 COC(=O)C1CC(C1)SCCCCCCO 62a_100009897219_100000766143 [0,1,0,1,0,0|2,0,0]=4 22107 B16R1.8380 COC(=O)C1CN(C1)CCCCCCCO 269982a_100015188540_100000760002 [0,1,0,1,0,0|2,0,0]=4 22108 B16R1.8380 COCCCCCCN1CC(C1)C(=O)OC 269982a_100015188540_100011998445 [0,1,0,1,0,0|2,0,0]=4 22109 B16R1.8380 COCCCCCNC1CC(C1)C(=O)OC 34a_100000747528_100009897219 [0,1,0,1,0,0|2,0,0]=4 22110 B16R1.8380 COCCCCOCC1CC(C1)C(=O)OC 34a_100009884387_100000755781 [0,1,0,1,0,0|2,0,0]=4 22111 B16R1.8380 COCCCCOCC1CC(C1)C(=O)OC 7a_100009884387_100000730899 [0,1,0,1,0,0|2,0,0]=4 22112 B16R1.17409 COC(=O)C(C)CCOCC1CCCN1C 34a_100000743107_100000034942 [0,1,0,1,0,0|2,0,0]=4 22113 B16R1.17409 COC(=O)C(C)COCCC1CCCN1C 34a_100000749362_100000005710 [0,1,0,1,0,0|2,0,0]=4 22114 B16R1.17409 COC(=O)C(C)COCCC1CCCN1C 34a_100011215177_100000698445 [0,1,0,1,0,0|2,0,0]=4 22115 B16R1.17409 COC(=O)C(C)COCCC1CCCN1C 7a_100000749362_100000005710 [0,1,0,1,0,0|2,0,0]=4 22116 B16R1.17409 COC(=O)C(C)CSCCC1CCCN1C 62a_100000005710_100000698445 [0,1,0,1,0,0|2,0,0]=4 22117 B16R1.17409 COC(=O)C(C)CSCCC1CCCN1C 62a_100000698445_100000005710 [0,1,0,1,0,0|2,0,0]=4 22118 B16R1.17409 COC(=O)C(F)COCCC1CCCN1C 34a_200009849844_100000005710 [0,1,0,1,0,0|2,0,0]=4 22119 B16R1.17409 COC(=O)[C@H](N)COCCC1CCCN1C 34a_100000003586_100000005710 [0,1,0,1,0,0|2,0,0]=4 22120 B16R1.18732 CCN1CCC[C@@H]1COCC(C)C(=O)OC 34a_100011739246_100000698445 [0,1,0,1,0,0|2,0,0]=4 22121 B16R1.27 CCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100011214924 [0,1,0,1,0,0|2,0,0]=4 22122 B16R1.27 CCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011214924 [0,1,0,1,0,0|1,0,0]=3 22123 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210759 [0,1,0,1,0,0|2,0,0]=4 22124 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210759 [0,1,0,1,0,0|2,0,0]=4 22125 B16R1.27 CCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210759 [0,1,0,1,0,0|2,0,0]=4 22126 B16R1.27 CCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210759 [0,1,0,1,0,0|2,0,0]=4 22127 B16R1.27 CCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210614 [0,1,0,1,0,0|2,0,0]=4 22128 B16R1.27 CCCCCCCOCC1COCC(=O)N1 34a_200000101122_100000210614 [0,1,0,1,0,0|2,0,0]=4 22129 B16R1.27 O=C1CN(CCO1)CCCCCCCCO 2230a_100000131268_100000033203 [0,1,0,1,0,0|2,0,0]=4 22130 B16R1.298 CCOC(=O)CCCCN1CCC1COC 2230a_100015195929_100000750268 [0,1,0,1,0,0|2,0,0]=4 22131 B16R1.298 CCOC(=O)CCCCN1CCC1COC 269982a_100015195929_100000750268 [0,1,0,1,0,0|2,0,0]=4 22132 B16R1.298 CCOC(=O)CCCCN1CCC1COC 34a_100015195929_100000750268 [0,1,0,1,0,0|2,0,0]=4 22133 B16R1.694 C=COC(=O)COC1CCCCC1CCC 34a_100011217265_100000036128 [0,1,0,1,0,0|1,0,1]=4 22134 B16R1.694 CCCC(=O)COC1CCCCC1CCC 7a_100011217265_100000747444 [0,1,0,1,0,0|2,0,0]=4 22135 B16R1.694 CCCC1CCCCC1NCC(=O)NCC 270004a_100016988866_100011218038 [0,1,0,1,0,0|2,0,0]=4 22136 B16R1.694 CCCC1CCCCC1OCC(=O)NCC 34a_100011217265_100000183381 [0,1,0,1,0,0|2,0,0]=4 22137 B16R1.694 CCCC1CCCCC1OCC(=O)NCC 7a_100011217265_100000183381 [0,1,0,1,0,0|2,0,0]=4 22138 B16R1.694 CCCC1CCCCC1OCC(=O)NCO 34a_100011217265_100000185155 [0,1,0,1,0,0|2,0,0]=4 22139 B16R1.694 CCCC1CCCCC1OCC(=O)NCO 7a_100011217265_100000185155 [0,1,0,1,0,0|2,0,0]=4 22140 B16R1.694 CCCC1CCCCC1OCC(=O)OCC 34a_100011217265_100000188475 [0,1,0,1,0,0|1,0,0]=3 22141 B16R1.694 CCCC1CCCCC1OCC(=O)OCC 7a_100011217265_100000188475 [0,1,0,1,0,0|1,0,0]=3 22142 B16R1.694 CCCC1CCCCN1CCC(=O)NCC 2230a_100000701414_100000737597 [0,1,0,1,0,0|2,0,0]=4 22143 B16R1.694 CCCC1CCCCN1CCC(=O)NCC 269982a_100000701414_100000737597 [0,1,0,1,0,0|2,0,0]=4 22144 B16R1.694 CCCC1CCCCN1CCC(=O)OCC 2230a_100000701414_100011206558 [0,1,0,1,0,0|1,0,0]=3 22145 B16R1.694 CCCC1CCCCN1CCC(=O)OCC 269982a_100000701414_100011206558 [0,1,0,1,0,0|1,0,0]=3 22146 B16R1.694 CCCC1CCCCN1CCC(=O)OCC 34a_100000701414_100000765890 [0,1,0,1,0,0|1,0,0]=3 22147 B16R1.694 CCCC1COCCN1CCC(=O)OCC 2230a_102495339903_100011206558 [0,1,0,1,0,0|2,0,0]=4 22148 B16R1.694 CCCC1COCCN1CCC(=O)OCC 269982a_102495339903_100011206558 [0,1,0,1,0,0|2,0,0]=4 22149 B16R1.694 CCCC1COCCN1CCC(=O)OCC 34a_102495339903_100000765890 [0,1,0,1,0,0|2,0,0]=4 22150 B16R1.694 CCOC(=O)CCN1CCCCC1CCO 2230a_100000211664_100011206558 [0,1,0,1,0,0|2,0,0]=4 22151 B16R1.694 CCOC(=O)CCN1CCCCC1CCO 269982a_100000211664_100011206558 [0,1,0,1,0,0|2,0,0]=4 22152 B16R1.694 CCOC(=O)CCN1CCCCC1CCO 34a_100000211664_100000765890 [0,1,0,1,0,0|2,0,0]=4 22153 B16R1.694 CCOC(=O)CCN1CCCCC1COC 2230a_100015184032_100011206558 [0,1,0,1,0,0|2,0,0]=4 22154 B16R1.694 CCOC(=O)CCN1CCCCC1COC 269982a_100015184032_100011206558 [0,1,0,1,0,0|2,0,0]=4 22155 B16R1.694 CCOC(=O)CCN1CCCCC1COC 34a_100015184032_100000765890 [0,1,0,1,0,0|2,0,0]=4 22156 B16R1.889 CCOC(=O)CCCCN1CCCCC1C 2230a_100000211376_100000750268 [0,1,0,1,0,0|1,0,0]=3 22157 B16R1.889 CCOC(=O)CCCCN1CCCCC1C 269982a_100000211376_100000750268 [0,1,0,1,0,0|1,0,0]=3 22158 B16R1.889 CCOC(=O)CCCCN1CCCCC1C 34a_100000211376_100000750268 [0,1,0,1,0,0|1,0,0]=3 22159 B16R1.889 CCOC(=O)CCCCN1CCOC[C@@H]1C 2230a_100009815349_100000750268 [0,1,0,1,0,0|2,0,0]=4 22160 B16R1.889 CCOC(=O)CCCCN1CCOC[C@@H]1C 269982a_100009815349_100000750268 [0,1,0,1,0,0|2,0,0]=4 22161 B16R1.889 CCOC(=O)CCCCN1CCOC[C@@H]1C 34a_100009815349_100000750268 [0,1,0,1,0,0|2,0,0]=4 22162 B16R1.889 CCOC(=O)CCCNC1CCCCC1C 2230a_100000211402_100009991533 [0,1,0,1,0,0|1,0,0]=3 22163 B16R1.889 CCOC(=O)CCCNC1CCCCC1C 34a_100000211402_100009991533 [0,1,0,1,0,0|1,0,0]=3 22164 B16R1.889 CCOC(=O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009991533 [0,1,0,1,0,0|2,0,0]=4 22165 B16R1.889 CCOC(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009991533 [0,1,0,1,0,0|2,0,0]=4 22166 B16R1.889 CCOC(=O)CCCOC1CCCCC1C 34a_100000211207_100009991533 [0,1,0,1,0,0|1,0,0]=3 22167 B16R1.889 CCOC(=O)CCCOC1CCCCC1C 7a_100000211207_100011215271 [0,1,0,1,0,0|1,0,0]=3 22168 B16R1.889 CCOC(=O)CCCOC1CCCCC1Cl 34a_100000038908_100009991533 [0,1,0,1,0,0|2,0,0]=4 22169 B16R1.889 CCOC(=O)CCCOC1CCCCC1Cl 7a_100000038908_100011215271 [0,1,0,1,0,0|2,0,0]=4 22170 B16R1.889 CCOC(=O)CCCOC1CCNCC1C 34a_100011998114_100009991533 [0,1,0,1,0,0|2,0,0]=4 22171 B16R1.889 CCOC(=O)CCCOC1CNCCC1C 34a_100000696640_100009991533 [0,1,0,1,0,0|2,0,0]=4 22172 B16R1.889 CCOC(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009991533 [0,1,0,1,0,0|2,0,0]=4 22173 B16R1.889 CCOC(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215271 [0,1,0,1,0,0|2,0,0]=4 22174 B16R1.889 CCOC(=O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100009991533 [0,1,0,1,0,0|2,0,0]=4 22175 B16R1.889 CCOC(=O)CCCSC1CCCCC1F 62a_100009991533_100015423560 [0,1,0,1,0,0|2,0,0]=4 22176 B16R1.889 CCOC(=O)CCCSC1CCCCC1F 62a_100015423560_100009991533 [0,1,0,1,0,0|2,0,0]=4 22177 B16R1.889 CCOC(=O)CCCSC1CCCCC1O 62a_100000038908_100009991533 [0,1,0,1,0,0|2,0,0]=4 22178 B16R1.889 CCOC(=O)CCCSC1CCCCC1O 62a_100009991533_100000038908 [0,1,0,1,0,0|2,0,0]=4 22179 B16R1.889 CCOC(=O)CCNCC1CCCCC1O 34a_100011216029_100000765890 [0,1,0,1,0,0|2,0,0]=4 22180 B16R1.889 CCOC(=O)CCNCC1CCCCN1C 34a_100011228421_100000765890 [0,1,0,1,0,0|2,0,0]=4 22181 B16R1.889 CCOC(=O)CCOCC1CCCCN1C 34a_100000225079_100000765890 [0,1,0,1,0,0|2,0,0]=4 22182 B16R1.889 CCOC(=O)CCSCC1CCCCN1C 62a_100000765890_100015185383 [0,1,0,1,0,0|2,0,0]=4 22183 B16R1.889 CCOC(=O)CCSCC1CCCCN1C 62a_100015185383_100000765890 [0,1,0,1,0,0|2,0,0]=4 22184 B16R1.889 CCOC(=O)CNCCN1CCCCC1C 2230a_100000739827_100000188475 [0,1,0,1,0,0|2,0,0]=4 22185 B16R1.889 CCOC(=O)CNCCN1CCCCC1C 34a_100000739827_100000188475 [0,1,0,1,0,0|2,0,0]=4 22186 B16R1.889 CCOC(=O)COCCN1CCCCC1C 2230a_100000211376_100000088970 [0,1,0,1,0,0|2,0,0]=4 22187 B16R1.889 CCOC(=O)COCCN1CCCCC1C 269982a_100000211376_100000088970 [0,1,0,1,0,0|2,0,0]=4 22188 B16R1.889 CCOC(=O)COCCN1CCCCC1C 34a_100000211376_100000088970 [0,1,0,1,0,0|2,0,0]=4 22189 B16R1.889 CCOC(=O)COCCN1CCCCC1C 34a_100011305533_100000188475 [0,1,0,1,0,0|2,0,0]=4 22190 B16R1.889 CCOC(=O)CSCCC1CCCCN1C 62a_100000188475_100000211948 [0,1,0,1,0,0|2,0,0]=4 22191 B16R1.889 CCOC(=O)CSCCC1CCCCN1C 62a_100000211948_100000188475 [0,1,0,1,0,0|2,0,0]=4 22192 B16R1.889 CCOC(=O)NCCOC1CCCCC1C 7a_100000211207_200011445536 [0,1,0,1,0,0|2,0,0]=4 22193 B16R1.889 COCC(=O)NCCCN1CCCCC1C 240690a_100000212276_100000210968 [0,1,0,1,0,0|2,0,0]=4 22194 B16R1.889 COCC(=O)NCCCN1CCCCC1C 527a_100000212276_100000210968 [0,1,0,1,0,0|2,0,0]=4 22195 B16R1.889 COCC(=O)NCCOC1CCCCC1C 34a_100138415774_100000048872 [0,1,0,1,0,0|2,0,0]=4 22196 B16R1.890 CCOC(=O)CCCCN1CCCC1CC 2230a_100000754278_100000750268 [0,1,0,1,0,0|1,0,0]=3 22197 B16R1.890 CCOC(=O)CCCCN1CCCC1CC 269982a_100000754278_100000750268 [0,1,0,1,0,0|1,0,0]=3 22198 B16R1.890 CCOC(=O)CCCCN1CCCC1CC 34a_100000754278_100000750268 [0,1,0,1,0,0|1,0,0]=3 22199 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1CO 2230a_100000745186_100000750268 [0,1,0,1,0,0|2,0,0]=4 22200 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100000750268 [0,1,0,1,0,0|2,0,0]=4 22201 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1CO 34a_100000745186_100000750268 [0,1,0,1,0,0|2,0,0]=4 22202 B16R1.890 CCOC(=O)CCNCC1CCCN1CC 2230a_100000211693_100011206558 [0,1,0,1,0,0|2,0,0]=4 22203 B16R1.890 CCOC(=O)CCOC[C@H]1CCCN1CC 34a_100011739246_100000765890 [0,1,0,1,0,0|2,0,0]=4 22204 B16R1.890 CCOC(=O)CCOC[C@H]1CCCN1CC 7a_100011739246_100011206558 [0,1,0,1,0,0|2,0,0]=4 22205 B16R1.890 CCOC(=O)COCCN1CCCC1CC 2230a_100000754278_100000088970 [0,1,0,1,0,0|2,0,0]=4 22206 B16R1.890 CCOC(=O)COCCN1CCCC1CC 269982a_100000754278_100000088970 [0,1,0,1,0,0|2,0,0]=4 22207 B16R1.890 CCOC(=O)COCCN1CCCC1CC 34a_100000754278_100000088970 [0,1,0,1,0,0|2,0,0]=4 22208 B16R1.932 C=COC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000036128 [0,1,0,1,0,0|1,0,1]=4 22209 B16R1.932 C=COC(=O)CNCCCC1CCCCC1 34a_100011211642_100000036128 [0,1,0,1,0,0|1,0,1]=4 22210 B16R1.932 C=COC(=O)COCCCC1CCCCC1 34a_100000198086_100000036128 [0,1,0,1,0,0|1,0,1]=4 22211 B16R1.932 C=COC(=O)CSCCCC1CCCCC1 62a_100000036128_100011713725 [0,1,0,1,0,0|1,0,1]=4 22212 B16R1.932 C=COC(=O)CSCCCC1CCCCC1 62a_100011713725_100000036128 [0,1,0,1,0,0|1,0,1]=4 22213 B16R1.932 CCCC(=O)CCCCCN1CCCCC1 1458a_100012051570_100000210303 [0,1,0,1,0,0|2,0,0]=4 22214 B16R1.932 CCCC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000747444 [0,1,0,1,0,0|2,0,0]=4 22215 B16R1.932 CCCC(=O)COCCCC1CCCCC1 7a_100000198086_100000747444 [0,1,0,1,0,0|2,0,0]=4 22216 B16R1.932 CCCC(=O)CSCCCC1CCCCC1 62a_100000747444_100011713725 [0,1,0,1,0,0|2,0,0]=4 22217 B16R1.932 CCCC(=O)CSCCCC1CCCCC1 62a_100011713725_100000747444 [0,1,0,1,0,0|2,0,0]=4 22218 B16R1.932 CCNC(=O)CCCCCN1CCCCC1 11a_100015525214_100012051570 [0,1,0,1,0,0|2,0,0]=4 22219 B16R1.932 CCNC(=O)CCCCCN1CCCCC1 240690a_100015525214_100012051570 [0,1,0,1,0,0|2,0,0]=4 22220 B16R1.932 CCNC(=O)CCNCCC1CCCCC1 2230a_100000738074_100000737597 [0,1,0,1,0,0|2,0,0]=4 22221 B16R1.932 CCNC(=O)CCNCCC1CCCCC1 270004a_100025743525_100011713444 [0,1,0,1,0,0|2,0,0]=4 22222 B16R1.932 CCNC(=O)CCNCCC1CCCCC1 34a_100025743525_100011209188 [0,1,0,1,0,0|2,0,0]=4 22223 B16R1.932 CCNC(=O)CCOCCC1CCCCC1 7a_100011217863_100000737597 [0,1,0,1,0,0|2,0,0]=4 22224 B16R1.932 CCNC(=O)CCSCCC1CCCCC1 62a_100000737597_100012355289 [0,1,0,1,0,0|2,0,0]=4 22225 B16R1.932 CCNC(=O)CCSCCC1CCCCC1 62a_100012355289_100000737597 [0,1,0,1,0,0|2,0,0]=4 22226 B16R1.932 CCNC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000183381 [0,1,0,1,0,0|2,0,0]=4 22227 B16R1.932 CCNC(=O)CNCCCC1CCCCC1 2230a_100016988866_100011713725 [0,1,0,1,0,0|2,0,0]=4 22228 B16R1.932 CCNC(=O)CNCCCC1CCCCC1 34a_100011211642_100000183381 [0,1,0,1,0,0|2,0,0]=4 22229 B16R1.932 CCNC(=O)COCCCC1CCCCC1 34a_100000198086_100000183381 [0,1,0,1,0,0|2,0,0]=4 22230 B16R1.932 CCNC(=O)COCCCC1CCCCC1 7a_100000198086_100000183381 [0,1,0,1,0,0|2,0,0]=4 22231 B16R1.932 CCNC(=O)CSCCCC1CCCCC1 62a_100000183381_100011713725 [0,1,0,1,0,0|2,0,0]=4 22232 B16R1.932 CCNC(=O)CSCCCC1CCCCC1 62a_100011713725_100000183381 [0,1,0,1,0,0|2,0,0]=4 22233 B16R1.932 CCOC(=O)CCCCCN1CCCOC1 2230a_100000131196_100000755133 [0,1,0,1,0,0|2,0,0]=4 22234 B16R1.932 CCOC(=O)CCCCCN1CCCOC1 269982a_100000131196_100000755133 [0,1,0,1,0,0|2,0,0]=4 22235 B16R1.932 CCOC(=O)CCCCCN1CCCOC1 34a_100000131196_100000755133 [0,1,0,1,0,0|2,0,0]=4 22236 B16R1.932 CCOC(=O)CCCCCN1CCOCC1 2230a_100015191051_100000755133 [0,1,0,1,0,0|2,0,0]=4 22237 B16R1.932 CCOC(=O)CCCCCN1CCOCC1 269982a_100015191051_100000755133 [0,1,0,1,0,0|2,0,0]=4 22238 B16R1.932 CCOC(=O)CCCCCN1CCOCC1 34a_100015191051_100000755133 [0,1,0,1,0,0|2,0,0]=4 22239 B16R1.932 CCOC(=O)CCCCCN1CCSCC1 2230a_100000737611_100000755133 [0,1,0,1,0,0|2,0,0]=4 22240 B16R1.932 CCOC(=O)CCCCCN1CCSCC1 269982a_100000737611_100000755133 [0,1,0,1,0,0|2,0,0]=4 22241 B16R1.932 CCOC(=O)CCCCNC1CCCCC1 2230a_100000182618_100000750268 [0,1,0,1,0,0|1,0,0]=3 22242 B16R1.932 CCOC(=O)CCCCNC1CCCCC1 34a_100000182618_100000750268 [0,1,0,1,0,0|1,0,0]=3 22243 B16R1.932 CCOC(=O)CCCCNC1CCCOC1 2230a_100000719290_100000750268 [0,1,0,1,0,0|2,0,0]=4 22244 B16R1.932 CCOC(=O)CCCCNC1CCCOC1 34a_100000719290_100000750268 [0,1,0,1,0,0|2,0,0]=4 22245 B16R1.932 CCOC(=O)CCCCNC1CCOCC1 2230a_100000741149_100000750268 [0,1,0,1,0,0|2,0,0]=4 22246 B16R1.932 CCOC(=O)CCCCNC1CCOCC1 34a_100000741149_100000750268 [0,1,0,1,0,0|2,0,0]=4 22247 B16R1.932 CCOC(=O)CCCCNC1CCSCC1 2230a_100000748639_100000750268 [0,1,0,1,0,0|2,0,0]=4 22248 B16R1.932 CCOC(=O)CCCCNC1CCSCC1 34a_100000748639_100000750268 [0,1,0,1,0,0|2,0,0]=4 22249 B16R1.932 CCOC(=O)CCCCOC1CCCCC1 34a_100000210231_100000750268 [0,1,0,1,0,0|1,0,0]=3 22250 B16R1.932 CCOC(=O)CCCCOC1CCCCC1 7a_100000210231_100000750268 [0,1,0,1,0,0|1,0,0]=3 22251 B16R1.932 CCOC(=O)CCCCOC1CCCCO1 34a_100000033831_100000750268 [0,1,0,1,0,0|2,0,0]=4 22252 B16R1.932 CCOC(=O)CCCCOC1CCCOC1 34a_100000754041_100000750268 [0,1,0,1,0,0|2,0,0]=4 22253 B16R1.932 CCOC(=O)CCCCOC1CCCSC1 7a_100015962668_100000750268 [0,1,0,1,0,0|2,0,0]=4 22254 B16R1.932 CCOC(=O)CCCCOC1CCOCC1 34a_100000744328_100000750268 [0,1,0,1,0,0|2,0,0]=4 22255 B16R1.932 CCOC(=O)CCCCOC1CCSCC1 34a_100000731022_100000750268 [0,1,0,1,0,0|2,0,0]=4 22256 B16R1.932 CCOC(=O)CCCCOC1CCSCC1 7a_100000731022_100000750268 [0,1,0,1,0,0|2,0,0]=4 22257 B16R1.932 CCOC(=O)CCCCSC1CCCCC1 62a_100000210327_100000750268 [0,1,0,1,0,0|1,0,0]=3 22258 B16R1.932 CCOC(=O)CCCCSC1CCCCC1 62a_100000750268_100000210327 [0,1,0,1,0,0|1,0,0]=3 22259 B16R1.932 CCOC(=O)CCCCSC1CCCOC1 62a_100000750268_100000693364 [0,1,0,1,0,0|2,0,0]=4 22260 B16R1.932 CCOC(=O)CCCCSC1CCOCC1 62a_100000750268_100011324220 [0,1,0,1,0,0|2,0,0]=4 22261 B16R1.932 CCOC(=O)CCCCSC1CCSCC1 62a_100000750268_100000069128 [0,1,0,1,0,0|2,0,0]=4 22262 B16R1.932 CCOC(=O)CCCNCC1CCCCC1 2230a_100000210473_100009991533 [0,1,0,1,0,0|1,0,0]=3 22263 B16R1.932 CCOC(=O)CCCNCC1CCCCC1 34a_100000210473_100009991533 [0,1,0,1,0,0|1,0,0]=3 22264 B16R1.932 CCOC(=O)CCCNCC1CCCCO1 2230a_100000174945_100009991533 [0,1,0,1,0,0|2,0,0]=4 22265 B16R1.932 CCOC(=O)CCCNCC1CCCCO1 34a_100000174945_100009991533 [0,1,0,1,0,0|2,0,0]=4 22266 B16R1.932 CCOC(=O)CCCNCC1CCCOC1 2230a_100000720124_100009991533 [0,1,0,1,0,0|2,0,0]=4 22267 B16R1.932 CCOC(=O)CCCNCC1CCCOC1 34a_100000720124_100009991533 [0,1,0,1,0,0|2,0,0]=4 22268 B16R1.932 CCOC(=O)CCCNCC1CCOCC1 2230a_100000746373_100009991533 [0,1,0,1,0,0|2,0,0]=4 22269 B16R1.932 CCOC(=O)CCCNCC1CCOCC1 34a_100000746373_100009991533 [0,1,0,1,0,0|2,0,0]=4 22270 B16R1.932 CCOC(=O)CCCNCC1CCSCC1 2230a_100015188806_100009991533 [0,1,0,1,0,0|2,0,0]=4 22271 B16R1.932 CCOC(=O)CCCNCC1CCSCC1 34a_100015188806_100009991533 [0,1,0,1,0,0|2,0,0]=4 22272 B16R1.932 CCOC(=O)CCCOCC1CCCCC1 34a_100000212181_100009991533 [0,1,0,1,0,0|1,0,0]=3 22273 B16R1.932 CCOC(=O)CCCOCC1CCCCC1 7a_100000212181_100011215271 [0,1,0,1,0,0|1,0,0]=3 22274 B16R1.932 CCOC(=O)CCCOCC1CCCCC1 7a_100012001163_100000211423 [0,1,0,1,0,0|1,0,0]=3 22275 B16R1.932 CCOC(=O)CCCOCC1CCCCN1 34a_100000210821_100009991533 [0,1,0,1,0,0|2,0,0]=4 22276 B16R1.932 CCOC(=O)CCCOCC1CCCCO1 34a_100000211370_100009991533 [0,1,0,1,0,0|2,0,0]=4 22277 B16R1.932 CCOC(=O)CCCOCC1CCCCO1 7a_100000211370_100011215271 [0,1,0,1,0,0|2,0,0]=4 22278 B16R1.932 CCOC(=O)CCCOCC1CCCCO1 7a_100012001163_100000211543 [0,1,0,1,0,0|2,0,0]=4 22279 B16R1.932 CCOC(=O)CCCOCC1CCCNC1 34a_100000211344_100009991533 [0,1,0,1,0,0|2,0,0]=4 22280 B16R1.932 CCOC(=O)CCCOCC1CCCOC1 34a_100000741520_100009991533 [0,1,0,1,0,0|2,0,0]=4 22281 B16R1.932 CCOC(=O)CCCOCC1CCCOC1 7a_100012001163_100000741521 [0,1,0,1,0,0|2,0,0]=4 22282 B16R1.932 CCOC(=O)CCCOCC1CCNCC1 34a_100000738675_100009991533 [0,1,0,1,0,0|2,0,0]=4 22283 B16R1.932 CCOC(=O)CCCOCC1CCOCC1 34a_100000749013_100009991533 [0,1,0,1,0,0|2,0,0]=4 22284 B16R1.932 CCOC(=O)CCCOCC1CCOCC1 7a_100012001163_100000754603 [0,1,0,1,0,0|2,0,0]=4 22285 B16R1.932 CCOC(=O)CCCOCC1CCSCC1 34a_100000070558_100009991533 [0,1,0,1,0,0|2,0,0]=4 22286 B16R1.932 CCOC(=O)CCCOCC1CCSCC1 7a_100000070558_100011215271 [0,1,0,1,0,0|2,0,0]=4 22287 B16R1.932 CCOC(=O)CCCSCC1CCCCC1 62a_100000211423_100009991533 [0,1,0,1,0,0|1,0,0]=3 22288 B16R1.932 CCOC(=O)CCCSCC1CCCCC1 62a_100009991533_100000211423 [0,1,0,1,0,0|1,0,0]=3 22289 B16R1.932 CCOC(=O)CCCSCC1CCCCO1 62a_100000211543_100009991533 [0,1,0,1,0,0|2,0,0]=4 22290 B16R1.932 CCOC(=O)CCCSCC1CCCCO1 62a_100009991533_100000211543 [0,1,0,1,0,0|2,0,0]=4 22291 B16R1.932 CCOC(=O)CCCSCC1CCCOC1 62a_100000741521_100009991533 [0,1,0,1,0,0|2,0,0]=4 22292 B16R1.932 CCOC(=O)CCCSCC1CCCOC1 62a_100009991533_100000741521 [0,1,0,1,0,0|2,0,0]=4 22293 B16R1.932 CCOC(=O)CCCSCC1CCOCC1 62a_100000754603_100009991533 [0,1,0,1,0,0|2,0,0]=4 22294 B16R1.932 CCOC(=O)CCCSCC1CCOCC1 62a_100009991533_100000749018 [0,1,0,1,0,0|2,0,0]=4 22295 B16R1.932 CCOC(=O)CCNCCC1CCCCC1 2230a_100000738074_100011206558 [0,1,0,1,0,0|1,0,0]=3 22296 B16R1.932 CCOC(=O)CCNCCC1CCCCC1 34a_100000738074_100000765890 [0,1,0,1,0,0|1,0,0]=3 22297 B16R1.932 CCOC(=O)CCNCCC1CCCCO1 2230a_100015183643_100011206558 [0,1,0,1,0,0|2,0,0]=4 22298 B16R1.932 CCOC(=O)CCNCCC1CCCCO1 34a_100015183643_100000765890 [0,1,0,1,0,0|2,0,0]=4 22299 B16R1.932 CCOC(=O)CCNCCC1CCOCC1 2230a_100000755988_100011206558 [0,1,0,1,0,0|2,0,0]=4 22300 B16R1.932 CCOC(=O)CCNCCC1CCOCC1 34a_100000755988_100000765890 [0,1,0,1,0,0|2,0,0]=4 22301 B16R1.932 CCOC(=O)CCOCCC1CCCCC1 34a_100011217863_100000765890 [0,1,0,1,0,0|1,0,0]=3 22302 B16R1.932 CCOC(=O)CCOCCC1CCCCC1 7a_100011217863_100011206558 [0,1,0,1,0,0|1,0,0]=3 22303 B16R1.932 CCOC(=O)CCOCCC1CCCCN1 34a_100000211664_100000765890 [0,1,0,1,0,0|2,0,0]=4 22304 B16R1.932 CCOC(=O)CCOCCC1CCCNC1 34a_100000752241_100000765890 [0,1,0,1,0,0|2,0,0]=4 22305 B16R1.932 CCOC(=O)CCOCCC1CCNCC1 34a_100015190746_100000765890 [0,1,0,1,0,0|2,0,0]=4 22306 B16R1.932 CCOC(=O)CCOCCC1CCOCC1 34a_100011933979_100000765890 [0,1,0,1,0,0|2,0,0]=4 22307 B16R1.932 CCOC(=O)CCOCCC1CCOCC1 7a_100011933979_100011206558 [0,1,0,1,0,0|2,0,0]=4 22308 B16R1.932 CCOC(=O)CCSCCC1CCCCC1 62a_100000765890_100012355289 [0,1,0,1,0,0|1,0,0]=3 22309 B16R1.932 CCOC(=O)CCSCCC1CCCCC1 62a_100012355289_100000765890 [0,1,0,1,0,0|1,0,0]=3 22310 B16R1.932 CCOC(=O)CCSCCC1CCOCC1 62a_100000765890_100011934994 [0,1,0,1,0,0|2,0,0]=4 22311 B16R1.932 CCOC(=O)CCSCCC1CCOCC1 62a_100011934994_100000765890 [0,1,0,1,0,0|2,0,0]=4 22312 B16R1.932 CCOC(=O)CCSCCN1CCCCC1 62a_100000739454_100000765890 [0,1,0,1,0,0|2,0,0]=4 22313 B16R1.932 CCOC(=O)CCSCCN1CCCCC1 62a_100000765890_100000739454 [0,1,0,1,0,0|2,0,0]=4 22314 B16R1.932 CCOC(=O)CCSCOC1CCCCC1 62a_100000765890_100011935260 [0,1,0,1,0,0|2,0,0]=4 22315 B16R1.932 CCOC(=O)CCSCOC1CCCCC1 62a_100011935260_100000765890 [0,1,0,1,0,0|2,0,0]=4 22316 B16R1.932 CCOC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000188475 [0,1,0,1,0,0|1,0,0]=3 22317 B16R1.932 CCOC(=O)CNCCCC1CCCCC1 34a_100011211642_100000188475 [0,1,0,1,0,0|1,0,0]=3 22318 B16R1.932 CCOC(=O)CNCCOC1CCCCC1 34a_100015206981_100000188475 [0,1,0,1,0,0|2,0,0]=4 22319 B16R1.932 CCOC(=O)COCCCC1CCCCC1 34a_100000198086_100000188475 [0,1,0,1,0,0|1,0,0]=3 22320 B16R1.932 CCOC(=O)COCCCC1CCCCC1 7a_100000198086_100000188475 [0,1,0,1,0,0|1,0,0]=3 22321 B16R1.932 CCOC(=O)COCCCC1CCCCN1 34a_100011934581_100000188475 [0,1,0,1,0,0|2,0,0]=4 22322 B16R1.932 CCOC(=O)COCCCC1CCCNC1 34a_100150707839_100000188475 [0,1,0,1,0,0|2,0,0]=4 22323 B16R1.932 CCOC(=O)COCCCC1CCNCC1 34a_100016988962_100000188475 [0,1,0,1,0,0|2,0,0]=4 22324 B16R1.932 CCOC(=O)COCCCN1CCCCC1 34a_100000212458_100000188475 [0,1,0,1,0,0|2,0,0]=4 22325 B16R1.932 CCOC(=O)COCCNC1CCCCC1 2230a_100000182618_100000088970 [0,1,0,1,0,0|2,0,0]=4 22326 B16R1.932 CCOC(=O)COCCNC1CCCCC1 34a_100000182618_100000088970 [0,1,0,1,0,0|2,0,0]=4 22327 B16R1.932 CCOC(=O)COCCNC1CCCCC1 34a_100000200466_100000188475 [0,1,0,1,0,0|2,0,0]=4 22328 B16R1.932 CCOC(=O)COCCOC1CCCCC1 34a_100000210231_100000088970 [0,1,0,1,0,0|2,0,0]=4 22329 B16R1.932 CCOC(=O)COCCOC1CCCCC1 34a_100011249652_100000188475 [0,1,0,1,0,0|2,0,0]=4 22330 B16R1.932 CCOC(=O)COCCOC1CCCCC1 7a_100000210231_100000088970 [0,1,0,1,0,0|2,0,0]=4 22331 B16R1.932 CCOC(=O)COCCOC1CCCCC1 7a_100011249652_100000188475 [0,1,0,1,0,0|2,0,0]=4 22332 B16R1.932 CCOC(=O)COCCSC1CCCCC1 62a_100000088970_100000210327 [0,1,0,1,0,0|2,0,0]=4 22333 B16R1.932 CCOC(=O)COCCSC1CCCCC1 62a_100000210327_100000088970 [0,1,0,1,0,0|2,0,0]=4 22334 B16R1.932 CCOC(=O)CSCCCC1CCCCC1 62a_100000188475_100011713725 [0,1,0,1,0,0|1,0,0]=3 22335 B16R1.932 CCOC(=O)CSCCCC1CCCCC1 62a_100011713725_100000188475 [0,1,0,1,0,0|1,0,0]=3 22336 B16R1.932 CCOC(=O)CSCCCN1CCCCC1 62a_100000188475_100000007876 [0,1,0,1,0,0|2,0,0]=4 22337 B16R1.932 CCOC(=O)CSCCCN1CCCCC1 62a_100132302099_100000188475 [0,1,0,1,0,0|2,0,0]=4 22338 B16R1.932 CCOC(=O)CSCCOC1CCCCC1 62a_100000188475_100011211530 [0,1,0,1,0,0|2,0,0]=4 22339 B16R1.932 CCOC(=O)CSCCOC1CCCCC1 62a_100011211530_100000188475 [0,1,0,1,0,0|2,0,0]=4 22340 B16R1.932 CCOC(=O)CSCCOC1CCCCC1 7a_200000230590_100000210327 [0,1,0,1,0,0|2,0,0]=4 22341 B16R1.932 CCOC(=O)NCCOCC1CCCCC1 34a_100000158857_100000211423 [0,1,0,1,0,0|2,0,0]=4 22342 B16R1.932 CCOC(=O)NCCOCC1CCCCC1 7a_100000212181_200011445536 [0,1,0,1,0,0|2,0,0]=4 22343 B16R1.932 CCOC(=O)NCCSCC1CCCCC1 62a_100000211423_200011445536 [0,1,0,1,0,0|2,0,0]=4 22344 B16R1.932 CCOC(=O)OCSCCC1CCCCC1 62a_100012355289_100000075025 [0,1,0,1,0,0|2,0,0]=4 22345 B16R1.932 CNNC(=O)CCCCCN1CCCCC1 22a_100016993582_100012051570 [0,1,0,1,0,0|2,0,0]=4 22346 B16R1.932 COCC(=O)CCCCOC1CCCCO1 1458a_100000210968_100000031530 [0,1,0,1,0,0|2,0,0]=4 22347 B16R1.932 COCC(=O)NCCCCN1CCCCC1 240690a_200011207366_100000210968 [0,1,0,1,0,0|2,0,0]=4 22348 B16R1.932 COCC(=O)NCCCOC1CCCCC1 11a_100000205933_100000210968 [0,1,0,1,0,0|2,0,0]=4 22349 B16R1.932 COCC(=O)NCCCOC1CCCCC1 1626a_100000205933_100000210968 [0,1,0,1,0,0|2,0,0]=4 22350 B16R1.932 COCC(=O)NCCCOC1CCCCC1 240690a_100000205933_100000210968 [0,1,0,1,0,0|2,0,0]=4 22351 B16R1.932 COCC(=O)NCCCOC1CCCCC1 34a_100138415774_100000742070 [0,1,0,1,0,0|2,0,0]=4 22352 B16R1.932 COCC(=O)NCCCOC1CCCCC1 527a_100000205933_100000210968 [0,1,0,1,0,0|2,0,0]=4 22353 B16R1.932 O=C(CCF)CCCCCN1CCCCC1 1458a_100012051570_100011217306 [0,1,0,1,0,0|2,0,0]=4 22354 B16R1.932 O=C(CCO)CCCCCN1CCCCC1 1458a_100012051570_100000211926 [0,1,0,1,0,0|2,0,0]=4 22355 B16R1.932 O=C(CNCCCC1CCCCC1)NCO 2230a_100011211642_100000185155 [0,1,0,1,0,0|2,0,0]=4 22356 B16R1.932 O=C(CNCCCC1CCCCC1)NCO 34a_100011211642_100000185155 [0,1,0,1,0,0|2,0,0]=4 22357 B16R1.932 O=C(COCCCC1CCCCC1)NCO 34a_100000198086_100000185155 [0,1,0,1,0,0|2,0,0]=4 22358 B16R1.932 O=C(COCCCC1CCCCC1)NCO 7a_100000198086_100000185155 [0,1,0,1,0,0|2,0,0]=4 22359 B16R1.932 O=C(CSCCCC1CCCCC1)NCO 62a_100000185155_100011713725 [0,1,0,1,0,0|2,0,0]=4 22360 B16R1.932 O=C(CSCCCC1CCCCC1)NCO 62a_100011713725_100000185155 [0,1,0,1,0,0|2,0,0]=4 22361 B16R1.948 CCC1CCCCN1CCNC(=O)COC 11a_100000755458_100000210968 [0,1,0,1,0,0|2,0,0]=4 22362 B16R1.948 CCC1CCCCN1CCNC(=O)COC 1626a_100000755458_100000210968 [0,1,0,1,0,0|2,0,0]=4 22363 B16R1.948 CCC1CCCCN1CCNC(=O)COC 240690a_100000755458_100000210968 [0,1,0,1,0,0|2,0,0]=4 22364 B16R1.948 CCC1CCCCN1CCNC(=O)COC 527a_100000755458_100000210968 [0,1,0,1,0,0|2,0,0]=4 22365 B16R1.948 CCNC(=O)CCNC1CCCCC1CC 269862a_100025743525_100000757040 [0,1,0,1,0,0|2,0,0]=4 22366 B16R1.948 CCNC(=O)CCNC1CCCCC1CC 270004a_100025743525_100000757040 [0,1,0,1,0,0|2,0,0]=4 22367 B16R1.948 CCNC(=O)CCOC1CCCCC1CC 7a_100000210738_100000737597 [0,1,0,1,0,0|2,0,0]=4 22368 B16R1.948 CCOC(=O)CCCN1CCCCC1CC 2230a_100000210034_100009991533 [0,1,0,1,0,0|1,0,0]=3 22369 B16R1.948 CCOC(=O)CCCN1CCCCC1CC 269982a_100000210034_100009991533 [0,1,0,1,0,0|1,0,0]=3 22370 B16R1.948 CCOC(=O)CCCN1CCCCC1CC 34a_100000210034_100009991533 [0,1,0,1,0,0|1,0,0]=3 22371 B16R1.948 CCOC(=O)CCCN1CCCCC1CO 2230a_100000210821_100009991533 [0,1,0,1,0,0|2,0,0]=4 22372 B16R1.948 CCOC(=O)CCCN1CCCCC1CO 269982a_100000210821_100009991533 [0,1,0,1,0,0|2,0,0]=4 22373 B16R1.948 CCOC(=O)CCCN1CCCCC1CO 34a_100000210821_100009991533 [0,1,0,1,0,0|2,0,0]=4 22374 B16R1.948 CCOC(=O)CCCN1CCOC[C@@H]1CC 2230a_100016988097_100009991533 [0,1,0,1,0,0|2,0,0]=4 22375 B16R1.948 CCOC(=O)CCCN1CCOC[C@@H]1CC 269982a_100016988097_100009991533 [0,1,0,1,0,0|2,0,0]=4 22376 B16R1.948 CCOC(=O)CCCN1CCOC[C@@H]1CC 34a_100016988097_100009991533 [0,1,0,1,0,0|2,0,0]=4 22377 B16R1.948 CCOC(=O)CCNC1CCCCC1OC 34a_100011208099_100000765890 [0,1,0,1,0,0|2,0,0]=4 22378 B16R1.948 CCOC(=O)CCOC1CCCCC1CC 34a_100000210738_100000765890 [0,1,0,1,0,0|1,0,0]=3 22379 B16R1.948 CCOC(=O)CCOC1CCCCC1CC 7a_100000210738_100011206558 [0,1,0,1,0,0|1,0,0]=3 22380 B16R1.948 CCOC(=O)CCOC1CCCCC1CN 34a_100011216029_100000765890 [0,1,0,1,0,0|2,0,0]=4 22381 B16R1.948 CCOC(=O)CCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000765890 [0,1,0,1,0,0|2,0,0]=4 22382 B16R1.948 CCOC(=O)CCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000765890 [0,1,0,1,0,0|2,0,0]=4 22383 B16R1.948 CCOC(=O)CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011206558 [0,1,0,1,0,0|2,0,0]=4 22384 B16R1.948 CCOC(=O)CNCC1CCCCN1CC 2230a_100000754393_100000188475 [0,1,0,1,0,0|2,0,0]=4 22385 B16R1.948 CCOC(=O)CNCC1CCCCN1CC 34a_100000754393_100000188475 [0,1,0,1,0,0|2,0,0]=4 22386 B16R1.948 CCOC(=O)COCC1CCCCN1CC 34a_100000225091_100000188475 [0,1,0,1,0,0|2,0,0]=4 22387 B16R1.948 CCOC(=O)COCC1CCCCN1CC 7a_100000225091_100000188475 [0,1,0,1,0,0|2,0,0]=4 22388 B16R1.948 CCOC(=O)NCCN1CCCCC1CC 269982a_100000210034_200011445536 [0,1,0,1,0,0|2,0,0]=4 22389 B16R1.949 CCNC(=O)CCNCCCC1CCCC1 2230a_100000736752_100000737597 [0,1,0,1,0,0|2,0,0]=4 22390 B16R1.949 CCNC(=O)CCNCCCC1CCCC1 34a_100025743525_100011713738 [0,1,0,1,0,0|2,0,0]=4 22391 B16R1.949 CCNC(=O)CCOCCCC1CCCC1 7a_100011215328_100000737597 [0,1,0,1,0,0|2,0,0]=4 22392 B16R1.949 CCNC(=O)CCSCCCC1CCCC1 62a_100000737597_100011713738 [0,1,0,1,0,0|2,0,0]=4 22393 B16R1.949 CCNC(=O)CCSCCCC1CCCC1 62a_100011713738_100000737597 [0,1,0,1,0,0|2,0,0]=4 22394 B16R1.949 CCOC(=O)CCCCCCN1CCCC1 2230a_100000188435_100009814379 [0,1,0,1,0,0|1,0,0]=3 22395 B16R1.949 CCOC(=O)CCCCCCN1CCCC1 269982a_100000188435_100009814379 [0,1,0,1,0,0|1,0,0]=3 22396 B16R1.949 CCOC(=O)CCCCCCN1CCSC1 2230a_100011215254_100009814379 [0,1,0,1,0,0|2,0,0]=4 22397 B16R1.949 CCOC(=O)CCCCCCN1CCSC1 269982a_100011215254_100009814379 [0,1,0,1,0,0|2,0,0]=4 22398 B16R1.949 CCOC(=O)CCCCCNC1CCCC1 2230a_100000211070_100000755133 [0,1,0,1,0,0|1,0,0]=3 22399 B16R1.949 CCOC(=O)CCCCCNC1CCCC1 34a_100000211070_100000755133 [0,1,0,1,0,0|1,0,0]=3 22400 B16R1.949 CCOC(=O)CCCCCN[C@@H]1CCOC1 2230a_200015188469_100000755133 [0,1,0,1,0,0|2,0,0]=4 22401 B16R1.949 CCOC(=O)CCCCCN[C@H]1CCOC1 2230a_100015188467_100000755133 [0,1,0,1,0,0|2,0,0]=4 22402 B16R1.949 CCOC(=O)CCCCCN[C@H]1CCOC1 34a_100015188467_100000755133 [0,1,0,1,0,0|2,0,0]=4 22403 B16R1.949 CCOC(=O)CCCCCOC1CCCC1 34a_100000210269_100000755133 [0,1,0,1,0,0|1,0,0]=3 22404 B16R1.949 CCOC(=O)CCCCCOC1CCCC1 7a_100000210269_100000755133 [0,1,0,1,0,0|1,0,0]=3 22405 B16R1.949 CCOC(=O)CCCCCOC1CCCC1 7a_100011214988_100000179811 [0,1,0,1,0,0|1,0,0]=3 22406 B16R1.949 CCOC(=O)CCCCCOC1CCCO1 34a_100000085407_100000755133 [0,1,0,1,0,0|2,0,0]=4 22407 B16R1.949 CCOC(=O)CCCCCOC1CCOC1 7a_100011214988_100000731011 [0,1,0,1,0,0|2,0,0]=4 22408 B16R1.949 CCOC(=O)CCCCCOC1CCSC1 7a_100011232664_100000755133 [0,1,0,1,0,0|2,0,0]=4 22409 B16R1.949 CCOC(=O)CCCCCO[C@H]1CCOC1 34a_100000717292_100000755133 [0,1,0,1,0,0|2,0,0]=4 22410 B16R1.949 CCOC(=O)CCCCCSC1CCCC1 62a_100000755133_100000179811 [0,1,0,1,0,0|1,0,0]=3 22411 B16R1.949 CCOC(=O)CCCCCSC1CCCC1 62a_100011217020_100000755133 [0,1,0,1,0,0|1,0,0]=3 22412 B16R1.949 CCOC(=O)CCCCCSC1CCOC1 62a_100000755133_100000690089 [0,1,0,1,0,0|2,0,0]=4 22413 B16R1.949 CCOC(=O)CCCCNCC1CCCC1 2230a_100000737975_100000750268 [0,1,0,1,0,0|1,0,0]=3 22414 B16R1.949 CCOC(=O)CCCCNCC1CCCC1 34a_100000737975_100000750268 [0,1,0,1,0,0|1,0,0]=3 22415 B16R1.949 CCOC(=O)CCCCNCC1CCOC1 2230a_100000737293_100000750268 [0,1,0,1,0,0|2,0,0]=4 22416 B16R1.949 CCOC(=O)CCCCNCC1CCOC1 34a_100000737293_100000750268 [0,1,0,1,0,0|2,0,0]=4 22417 B16R1.949 CCOC(=O)CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000750268 [0,1,0,1,0,0|2,0,0]=4 22418 B16R1.949 CCOC(=O)CCCCNC[C@@H]1CCCO1 34a_100020590478_100000750268 [0,1,0,1,0,0|2,0,0]=4 22419 B16R1.949 CCOC(=O)CCCCOCC1CCCC1 34a_100000742336_100000750268 [0,1,0,1,0,0|1,0,0]=3 22420 B16R1.949 CCOC(=O)CCCCOCC1CCCC1 7a_100000742336_100000750268 [0,1,0,1,0,0|1,0,0]=3 22421 B16R1.949 CCOC(=O)CCCCOCC1CCCO1 34a_100000210270_100000750268 [0,1,0,1,0,0|2,0,0]=4 22422 B16R1.949 CCOC(=O)CCCCOCC1CCCO1 7a_100000210270_100000750268 [0,1,0,1,0,0|2,0,0]=4 22423 B16R1.949 CCOC(=O)CCCCOCC1CCNC1 34a_100000748654_100000750268 [0,1,0,1,0,0|2,0,0]=4 22424 B16R1.949 CCOC(=O)CCCCOCC1CCOC1 34a_100000740260_100000750268 [0,1,0,1,0,0|2,0,0]=4 22425 B16R1.949 CCOC(=O)CCCCOC[C@H]1CCCN1 34a_100000745186_100000750268 [0,1,0,1,0,0|2,0,0]=4 22426 B16R1.949 CCOC(=O)CCCCSCC1CCCC1 62a_100000740388_100000750268 [0,1,0,1,0,0|1,0,0]=3 22427 B16R1.949 CCOC(=O)CCCCSCC1CCCC1 62a_100000750268_100000740388 [0,1,0,1,0,0|1,0,0]=3 22428 B16R1.949 CCOC(=O)CCCCSCC1CCCO1 62a_100000203698_100000750268 [0,1,0,1,0,0|2,0,0]=4 22429 B16R1.949 CCOC(=O)CCCCSCC1CCCO1 62a_100000750268_100000203698 [0,1,0,1,0,0|2,0,0]=4 22430 B16R1.949 CCOC(=O)CCCCSCC1CCOC1 62a_100000702531_100000750268 [0,1,0,1,0,0|2,0,0]=4 22431 B16R1.949 CCOC(=O)CCCCSCC1CCOC1 62a_100000750268_100000702531 [0,1,0,1,0,0|2,0,0]=4 22432 B16R1.949 CCOC(=O)CCCNCCC1CCCC1 2230a_100000739158_100009991533 [0,1,0,1,0,0|1,0,0]=3 22433 B16R1.949 CCOC(=O)CCCNCCC1CCCC1 34a_100000739158_100009991533 [0,1,0,1,0,0|1,0,0]=3 22434 B16R1.949 CCOC(=O)CCCOCCC1CCCC1 34a_100000749090_100009991533 [0,1,0,1,0,0|1,0,0]=3 22435 B16R1.949 CCOC(=O)CCCOCCC1CCCC1 7a_100000749090_100011215271 [0,1,0,1,0,0|1,0,0]=3 22436 B16R1.949 CCOC(=O)CCCOCCC1CCCC1 7a_100012001163_100000760354 [0,1,0,1,0,0|1,0,0]=3 22437 B16R1.949 CCOC(=O)CCCOCCC1CCNC1 34a_100016987287_100009991533 [0,1,0,1,0,0|2,0,0]=4 22438 B16R1.949 CCOC(=O)CCCOCCC1CCOC1 34a_100011879284_100009991533 [0,1,0,1,0,0|2,0,0]=4 22439 B16R1.949 CCOC(=O)CCCOCCN1CCCC1 7a_100012001163_100000004467 [0,1,0,1,0,0|2,0,0]=4 22440 B16R1.949 CCOC(=O)CCCSCCC1CCCC1 62a_100000760354_100009991533 [0,1,0,1,0,0|1,0,0]=3 22441 B16R1.949 CCOC(=O)CCCSCCC1CCCC1 62a_100009991533_100000760354 [0,1,0,1,0,0|1,0,0]=3 22442 B16R1.949 CCOC(=O)CCCSCCN1CCCC1 62a_100000700749_100009991533 [0,1,0,1,0,0|2,0,0]=4 22443 B16R1.949 CCOC(=O)CCCSCCN1CCCC1 62a_100009991533_100000004467 [0,1,0,1,0,0|2,0,0]=4 22444 B16R1.949 CCOC(=O)CCNCCCC1CCCC1 2230a_100000736752_100011206558 [0,1,0,1,0,0|1,0,0]=3 22445 B16R1.949 CCOC(=O)CCNCCCC1CCCC1 34a_100000736752_100000765890 [0,1,0,1,0,0|1,0,0]=3 22446 B16R1.949 CCOC(=O)CCNCCOC1CCCC1 34a_100000741755_100000765890 [0,1,0,1,0,0|2,0,0]=4 22447 B16R1.949 CCOC(=O)CCOCCCC1CCCC1 34a_100011215328_100000765890 [0,1,0,1,0,0|1,0,0]=3 22448 B16R1.949 CCOC(=O)CCOCCCC1CCCC1 7a_100011215328_100011206558 [0,1,0,1,0,0|1,0,0]=3 22449 B16R1.949 CCOC(=O)CCOCCNC1CCCC1 34a_200000200444_100000765890 [0,1,0,1,0,0|2,0,0]=4 22450 B16R1.949 CCOC(=O)CCOCCOC1CCCC1 34a_100000738311_100000765890 [0,1,0,1,0,0|2,0,0]=4 22451 B16R1.949 CCOC(=O)CCOCCOC1CCCC1 7a_100000738311_100011206558 [0,1,0,1,0,0|2,0,0]=4 22452 B16R1.949 CCOC(=O)CCSCCCC1CCCC1 62a_100000765890_100011713738 [0,1,0,1,0,0|1,0,0]=3 22453 B16R1.949 CCOC(=O)CCSCCCC1CCCC1 62a_100011713738_100000765890 [0,1,0,1,0,0|1,0,0]=3 22454 B16R1.949 CCOC(=O)CCSCCCN1CCCC1 62a_100000765890_100011445909 [0,1,0,1,0,0|2,0,0]=4 22455 B16R1.949 CCOC(=O)CCSCCCN1CCCC1 62a_100016991639_100000765890 [0,1,0,1,0,0|2,0,0]=4 22456 B16R1.949 CCOC(=O)CNCCCOC1CCCC1 34a_100000747560_100000188475 [0,1,0,1,0,0|2,0,0]=4 22457 B16R1.949 CCOC(=O)COCCCNC1CCCC1 2230a_100000211070_100009893628 [0,1,0,1,0,0|2,0,0]=4 22458 B16R1.949 CCOC(=O)COCCCNC1CCCC1 34a_100000211070_100009893628 [0,1,0,1,0,0|2,0,0]=4 22459 B16R1.949 CCOC(=O)COCCCOC1CCCC1 34a_100000210269_100009893628 [0,1,0,1,0,0|2,0,0]=4 22460 B16R1.949 CCOC(=O)COCCCOC1CCCC1 7a_100000210269_100009893628 [0,1,0,1,0,0|2,0,0]=4 22461 B16R1.949 CCOC(=O)COCCCSC1CCCC1 62a_100009893628_100000179811 [0,1,0,1,0,0|2,0,0]=4 22462 B16R1.949 CCOC(=O)COCCCSC1CCCC1 62a_100011217020_100009893628 [0,1,0,1,0,0|2,0,0]=4 22463 B16R1.949 CCOC(=O)COCCNCC1CCCC1 2230a_100000737975_100000088970 [0,1,0,1,0,0|2,0,0]=4 22464 B16R1.949 CCOC(=O)COCCNCC1CCCC1 34a_100000737975_100000088970 [0,1,0,1,0,0|2,0,0]=4 22465 B16R1.949 CCOC(=O)COCCOCC1CCCC1 34a_100000742336_100000088970 [0,1,0,1,0,0|2,0,0]=4 22466 B16R1.949 CCOC(=O)COCCOCC1CCCC1 7a_100000742336_100000088970 [0,1,0,1,0,0|2,0,0]=4 22467 B16R1.949 CCOC(=O)COCCSCC1CCCC1 62a_100000088970_100000740388 [0,1,0,1,0,0|2,0,0]=4 22468 B16R1.949 CCOC(=O)COCCSCC1CCCC1 62a_100000740388_100000088970 [0,1,0,1,0,0|2,0,0]=4 22469 B16R1.949 CCOC(=O)CSCCOCC1CCCC1 7a_200000230590_100000740388 [0,1,0,1,0,0|2,0,0]=4 22470 B16R1.949 CCOC(=O)NCCOCCC1CCCC1 34a_100000158857_100000760354 [0,1,0,1,0,0|2,0,0]=4 22471 B16R1.949 CCOC(=O)NCCOCCC1CCCC1 7a_100000749090_200011445536 [0,1,0,1,0,0|2,0,0]=4 22472 B16R1.949 CCOC(=O)NCCSCCC1CCCC1 62a_100000760354_200011445536 [0,1,0,1,0,0|2,0,0]=4 22473 B16R1.949 CCOC(=O)OCSCCCC1CCCC1 62a_100011713738_100000075025 [0,1,0,1,0,0|2,0,0]=4 22474 B16R1.949 COCC(=O)NCCCCCN1CCCC1 1626a_100011491779_100000210968 [0,1,0,1,0,0|2,0,0]=4 22475 B16R1.949 COCC(=O)NCCCCCN1CCCC1 240690a_100011491779_100000210968 [0,1,0,1,0,0|2,0,0]=4 22476 B16R1.1269 CCCCC1CCCC1NCC(=O)NCC 270004a_100016988866_100000750825 [0,1,0,1,0,0|2,0,0]=4 22477 B16R1.2034 C=COC(=O)COCC1CCCCCCC1 34a_100011216312_100000036128 [0,1,0,1,0,0|1,0,1]=4 22478 B16R1.2034 CC=CC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210699 [0,1,0,1,0,0|2,0,0]=4 22479 B16R1.2034 CC=CC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210699 [0,1,0,1,0,0|2,0,0]=4 22480 B16R1.2034 CC=CC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210699 [0,1,0,1,0,0|2,0,0]=4 22481 B16R1.2034 CCCC(=O)COCC1CCCCCCC1 7a_100011216312_100000747444 [0,1,0,1,0,0|2,0,0]=4 22482 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000211992 [0,1,0,1,0,0|2,0,0]=4 22483 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000211992 [0,1,0,1,0,0|2,0,0]=4 22484 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000211992 [0,1,0,1,0,0|2,0,0]=4 22485 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000211992 [0,1,0,1,0,0|2,0,0]=4 22486 B16R1.2034 CCNC(=O)CCNC1CCCCCCC1 2230a_100000211152_100000737597 [0,1,0,1,0,0|2,0,0]=4 22487 B16R1.2034 CCNC(=O)CCNC1CCCCCCC1 270004a_100025743525_100000210524 [0,1,0,1,0,0|2,0,0]=4 22488 B16R1.2034 CCNC(=O)CCOC1CCCCCCC1 7a_100000210054_100000737597 [0,1,0,1,0,0|2,0,0]=4 22489 B16R1.2034 CCNC(=O)COCC1CCCCCCC1 34a_100011216312_100000183381 [0,1,0,1,0,0|2,0,0]=4 22490 B16R1.2034 CCNC(=O)COCC1CCCCCCC1 7a_100011216312_100000183381 [0,1,0,1,0,0|2,0,0]=4 22491 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 2708a_100011532352_100015525214 [0,1,0,1,0,0|2,0,0]=4 22492 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 2708a_100015525214_100011532352 [0,1,0,1,0,0|2,0,0]=4 22493 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100015525214 [0,1,0,1,0,0|2,0,0]=4 22494 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 273464a_100015525214_100011532352 [0,1,0,1,0,0|2,0,0]=4 22495 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 512a_100015525214_100011532352 [0,1,0,1,0,0|2,0,0]=4 22496 B16R1.2034 CCOC(=O)CCCN1CCCCCCC1 2230a_100000211400_100009991533 [0,1,0,1,0,0|1,0,0]=3 22497 B16R1.2034 CCOC(=O)CCCN1CCCCCCC1 269982a_100000211400_100009991533 [0,1,0,1,0,0|1,0,0]=3 22498 B16R1.2034 CCOC(=O)CCCN1CCCCCCC1 34a_100000211400_100009991533 [0,1,0,1,0,0|1,0,0]=3 22499 B16R1.2034 CCOC(=O)CCNC1CCCCCCC1 2230a_100000211152_100011206558 [0,1,0,1,0,0|1,0,0]=3 22500 B16R1.2034 CCOC(=O)CCNC1CCCCCCC1 34a_100000211152_100000765890 [0,1,0,1,0,0|1,0,0]=3 22501 B16R1.2034 CCOC(=O)CCOC1CCCCCCC1 34a_100000210054_100000765890 [0,1,0,1,0,0|1,0,0]=3 22502 B16R1.2034 CCOC(=O)CCOC1CCCCCCC1 7a_100000210054_100011206558 [0,1,0,1,0,0|1,0,0]=3 22503 B16R1.2034 CCOC(=O)COCC1CCCCCCC1 34a_100011216312_100000188475 [0,1,0,1,0,0|1,0,0]=3 22504 B16R1.2034 CCOC(=O)COCC1CCCCCCC1 7a_100011216312_100000188475 [0,1,0,1,0,0|1,0,0]=3 22505 B16R1.2034 CCOC(=O)NCCN1CCCCCCC1 269982a_100000211400_200011445536 [0,1,0,1,0,0|2,0,0]=4 22506 B16R1.2034 CNNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100016993582 [0,1,0,1,0,0|2,0,0]=4 22507 B16R1.2034 CNNC(=O)NCCC1CCCCCCC1 512a_100016993582_100011532352 [0,1,0,1,0,0|2,0,0]=4 22508 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210968 [0,1,0,1,0,0|1,0,0]=3 22509 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210968 [0,1,0,1,0,0|1,0,0]=3 22510 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210968 [0,1,0,1,0,0|1,0,0]=3 22511 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000210968 [0,1,0,1,0,0|1,0,0]=3 22512 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000184570 [0,1,0,1,0,0|1,1,0]=4 22513 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000184570 [0,1,0,1,0,0|1,1,0]=4 22514 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000184570 [0,1,0,1,0,0|1,1,0]=4 22515 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000184570 [0,1,0,1,0,0|1,1,0]=4 22516 B16R1.2034 O=C(CCO)NCCC1CCCCCCC1 240690a_100011532352_100011216618 [0,1,0,1,0,0|2,0,0]=4 22517 B16R1.2034 O=C(COCC1CCCCCCC1)NCO 34a_100011216312_100000185155 [0,1,0,1,0,0|2,0,0]=4 22518 B16R1.2034 O=C(COCC1CCCCCCC1)NCO 7a_100011216312_100000185155 [0,1,0,1,0,0|2,0,0]=4 22519 B16R1.4433 CCOC(=O)CCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009814379 [0,1,0,1,0,0|2,0,0]=4 22520 B16R1.4433 CCOC(=O)CCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009814379 [0,1,0,1,0,0|2,0,0]=4 22521 B16R1.4433 CCOC(=O)CCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009814379 [0,1,0,1,0,0|2,0,0]=4 22522 B16R1.4433 CCOC(=O)CCCCCOCC1CC1C 34a_100000744939_100000755133 [0,1,0,1,0,0|1,0,0]=3 22523 B16R1.4433 CCOC(=O)CCCCCOCC1CC1C 7a_100000744939_100000755133 [0,1,0,1,0,0|1,0,0]=3 22524 B16R1.4433 CCOC(=O)COCCCOCC1CC1C 34a_100000744939_100009893628 [0,1,0,1,0,0|2,0,0]=4 22525 B16R1.4433 CCOC(=O)COCCCOCC1CC1C 7a_100000744939_100009893628 [0,1,0,1,0,0|2,0,0]=4 22526 B16R1.4434 CCOC(=O)CCCCCCCN1CCC1 269982a_100000754969_100009991516 [0,1,0,1,0,0|1,0,0]=3 22527 B16R1.4434 CCOC(=O)CCCCCCNC1CCC1 2230a_100000749019_100009814379 [0,1,0,1,0,0|1,0,0]=3 22528 B16R1.4434 CCOC(=O)CCCCCCNC1CCC1 34a_100000749019_100009814379 [0,1,0,1,0,0|1,0,0]=3 22529 B16R1.4434 CCOC(=O)CCCCCCNC1COC1 2230a_100016991112_100009814379 [0,1,0,1,0,0|2,0,0]=4 22530 B16R1.4434 CCOC(=O)CCCCCCOC1CCC1 34a_100000748187_100009814379 [0,1,0,1,0,0|1,0,0]=3 22531 B16R1.4434 CCOC(=O)CCCCCCOC1CSC1 7a_100000072292_100009814379 [0,1,0,1,0,0|2,0,0]=4 22532 B16R1.4434 CCOC(=O)CCCCCNCC1CCC1 2230a_100000738700_100000755133 [0,1,0,1,0,0|1,0,0]=3 22533 B16R1.4434 CCOC(=O)CCCCCNCC1CCC1 34a_100000738700_100000755133 [0,1,0,1,0,0|1,0,0]=3 22534 B16R1.4434 CCOC(=O)CCCCCNCC1COC1 2230a_100015281925_100000755133 [0,1,0,1,0,0|2,0,0]=4 22535 B16R1.4434 CCOC(=O)CCCCCNCC1COC1 34a_100015281925_100000755133 [0,1,0,1,0,0|2,0,0]=4 22536 B16R1.4434 CCOC(=O)CCCCCNC[C@@H]1CCO1 2230a_100020831831_100000755133 [0,1,0,1,0,0|2,0,0]=4 22537 B16R1.4434 CCOC(=O)CCCCCNC[C@@H]1CCO1 34a_100020831831_100000755133 [0,1,0,1,0,0|2,0,0]=4 22538 B16R1.4434 CCOC(=O)CCCCCOCC1CCC1 34a_100000760304_100000755133 [0,1,0,1,0,0|1,0,0]=3 22539 B16R1.4434 CCOC(=O)CCCCCOCC1CCC1 7a_100011214988_100000763275 [0,1,0,1,0,0|1,0,0]=3 22540 B16R1.4434 CCOC(=O)CCCCCOCC1CCO1 34a_100000039022_100000755133 [0,1,0,1,0,0|2,0,0]=4 22541 B16R1.4434 CCOC(=O)CCCCCOCC1CCO1 7a_100011214988_100000103362 [0,1,0,1,0,0|2,0,0]=4 22542 B16R1.4434 CCOC(=O)CCCCCOCC1CNC1 34a_100016987283_100000755133 [0,1,0,1,0,0|2,0,0]=4 22543 B16R1.4434 CCOC(=O)CCCCCOCC1COC1 34a_100000060846_100000755133 [0,1,0,1,0,0|2,0,0]=4 22544 B16R1.4434 CCOC(=O)CCCCCOCC1COC1 7a_100011214988_100010264016 [0,1,0,1,0,0|2,0,0]=4 22545 B16R1.4434 CCOC(=O)CCCCCSCC1CCC1 62a_100000755133_100000763275 [0,1,0,1,0,0|1,0,0]=3 22546 B16R1.4434 CCOC(=O)CCCCCSCC1CCC1 62a_100000763275_100000755133 [0,1,0,1,0,0|1,0,0]=3 22547 B16R1.4434 CCOC(=O)CCCCCSCC1CCO1 62a_100000103362_100000755133 [0,1,0,1,0,0|2,0,0]=4 22548 B16R1.4434 CCOC(=O)CCCCCSCC1CCO1 62a_100000755133_100000103362 [0,1,0,1,0,0|2,0,0]=4 22549 B16R1.4434 CCOC(=O)CCCCCSCC1COC1 62a_100000755133_100010264016 [0,1,0,1,0,0|2,0,0]=4 22550 B16R1.4434 CCOC(=O)CCCCCSCC1COC1 62a_100010264016_100000755133 [0,1,0,1,0,0|2,0,0]=4 22551 B16R1.4434 CCOC(=O)CCCCOCCC1COC1 34a_100009855314_100000750268 [0,1,0,1,0,0|2,0,0]=4 22552 B16R1.4434 CCOC(=O)COCCCNCC1CCC1 2230a_100000738700_100009893628 [0,1,0,1,0,0|2,0,0]=4 22553 B16R1.4434 CCOC(=O)COCCCNCC1CCC1 34a_100000738700_100009893628 [0,1,0,1,0,0|2,0,0]=4 22554 B16R1.4434 CCOC(=O)COCCCOCC1CCC1 34a_100000760304_100009893628 [0,1,0,1,0,0|2,0,0]=4 22555 B16R1.4434 CCOC(=O)COCCCSCC1CCC1 62a_100000763275_100009893628 [0,1,0,1,0,0|2,0,0]=4 22556 B16R1.4434 CCOC(=O)COCCCSCC1CCC1 62a_100009893628_100000763275 [0,1,0,1,0,0|2,0,0]=4 22557 B16R1.6694 CCCC1CCCC1NCCC(=O)NCC 269862a_100025743525_100000723119 [0,1,0,1,0,0|2,0,0]=4 22558 B16R1.6694 CCCC1CCCC1NCCC(=O)NCC 270004a_100025743525_100000723119 [0,1,0,1,0,0|2,0,0]=4 22559 B16R1.6694 CCCN1CCCC1COCC(=O)OCC 34a_200000694710_100000188475 [0,1,0,1,0,0|2,0,0]=4 22560 B16R1.6694 CCCN1CCCC1COCC(=O)OCC 7a_200000694710_100000188475 [0,1,0,1,0,0|2,0,0]=4 22561 B16R1.6694 CCOC(=O)CCCN1CCC[C@H]1COC 2230a_100020646714_100009991533 [0,1,0,1,0,0|2,0,0]=4 22562 B16R1.6694 CCOC(=O)CCCN1CCC[C@H]1COC 269982a_100020646714_100009991533 [0,1,0,1,0,0|2,0,0]=4 22563 B16R1.6694 CCOC(=O)CCCN1CCC[C@H]1COC 34a_100020646714_100009991533 [0,1,0,1,0,0|2,0,0]=4 22564 B16R1.7359 CCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210211 [0,1,0,1,0,0|1,0,0]=3 22565 B16R1.7359 CCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210211 [0,1,0,1,0,0|1,0,0]=3 22566 B16R1.7359 CCOC(=O)CC1CCCCN1CCCF 2230a_100116209990_100011934791 [0,1,0,1,0,0|2,0,0]=4 22567 B16R1.7359 CCOC(=O)CC1CCCCN1CCCF 269982a_100116209990_100011934791 [0,1,0,1,0,0|2,0,0]=4 22568 B16R1.7359 CCOC(=O)CC1CCCCN1CCCO 2230a_100116209990_100000230001 [0,1,0,1,0,0|2,0,0]=4 22569 B16R1.7359 CCOC(=O)CC1CCCCN1CCCO 269982a_100116209990_100011215043 [0,1,0,1,0,0|2,0,0]=4 22570 B16R1.7359 CCOC(=O)CC1CCCCN1CCOC 2230a_100116209990_100011201679 [0,1,0,1,0,0|2,0,0]=4 22571 B16R1.7359 CCOC(=O)CC1CCCCN1CCOC 269982a_100116209990_100000233755 [0,1,0,1,0,0|2,0,0]=4 22572 B16R1.7359 CCOC(=O)CC1CCCCN1CCSC 2230a_100116209990_100000751147 [0,1,0,1,0,0|2,0,0]=4 22573 B16R1.7359 CCOC(=O)CC1CCCCN1CCSC 269982a_100116209990_100000212216 [0,1,0,1,0,0|2,0,0]=4 22574 B16R1.7359 CCOC(=O)CN1CCCCC1CCCO 2230a_100011934581_100000188475 [0,1,0,1,0,0|2,0,0]=4 22575 B16R1.7359 CCOC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000188475 [0,1,0,1,0,0|2,0,0]=4 22576 B16R1.7359 CCOC(=O)CN1CCCCC1CCCO 34a_100011934581_100000188475 [0,1,0,1,0,0|2,0,0]=4 22577 B16R1.7359 CCOC(=O)CN1CCCCC1CCOC 2230a_100015186528_100000188475 [0,1,0,1,0,0|2,0,0]=4 22578 B16R1.7359 CCOC(=O)CN1CCCCC1CCOC 269982a_100015186528_100000188475 [0,1,0,1,0,0|2,0,0]=4 22579 B16R1.7359 CCOC(=O)CN1CCCCC1CCOC 34a_100015186528_100000188475 [0,1,0,1,0,0|2,0,0]=4 22580 B16R1.7359 CCOCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000739092 [0,1,0,1,0,0|2,0,0]=4 22581 B16R1.12723 CCCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210326 [0,1,0,1,0,0|1,0,0]=3 22582 B16R1.12723 CCCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210215 [0,1,0,1,0,0|1,0,0]=3 22583 B16R1.12723 CCCCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210326 [0,1,0,1,0,0|2,0,0]=4 22584 B16R1.12723 CCCCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210215 [0,1,0,1,0,0|2,0,0]=4 22585 B16R1.12723 CCCCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210326 [0,1,0,1,0,0|2,0,0]=4 22586 B16R1.12723 CCCCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210215 [0,1,0,1,0,0|2,0,0]=4 22587 B16R1.12723 CCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000210211 [0,1,0,1,0,0|1,0,0]=3 22588 B16R1.12723 CCOC(=O)C1CCCCC1OCCCF 7a_100000038711_100011934791 [0,1,0,1,0,0|2,0,0]=4 22589 B16R1.12723 CCOC(=O)C1CCCCC1OCCCO 7a_100000038711_100011215043 [0,1,0,1,0,0|2,0,0]=4 22590 B16R1.12723 CCOC(=O)C1CCCCC1OCCOC 7a_100000038711_100000233755 [0,1,0,1,0,0|2,0,0]=4 22591 B16R1.12723 CCOC(=O)C1CCCCC1OCCSC 7a_100000038711_100000212216 [0,1,0,1,0,0|2,0,0]=4 22592 B16R1.12723 CCOC(=O)C1CCCCN1CCCCF 2230a_100016990872_100000729493 [0,1,0,1,0,0|2,0,0]=4 22593 B16R1.12723 CCOC(=O)C1CCCCN1CCCCF 269982a_100016990872_100000729493 [0,1,0,1,0,0|2,0,0]=4 22594 B16R1.12723 CCOC(=O)C1CCCCN1CCCCO 2230a_100016990872_100000210776 [0,1,0,1,0,0|2,0,0]=4 22595 B16R1.12723 CCOC(=O)C1CCCCN1CCCCO 269982a_100016990872_100000210776 [0,1,0,1,0,0|2,0,0]=4 22596 B16R1.12723 CCOC(=O)C1CCCCN1CCCOC 2230a_100016990872_100000740836 [0,1,0,1,0,0|2,0,0]=4 22597 B16R1.12723 CCOC(=O)C1CCCCN1CCCOC 269982a_100016990872_100000740836 [0,1,0,1,0,0|2,0,0]=4 22598 B16R1.12723 CCOC(=O)C1CCCCN1CCSCC 2230a_100016990872_100000757381 [0,1,0,1,0,0|2,0,0]=4 22599 B16R1.12723 CCOC(=O)C1CCCCN1CCSCC 269982a_100016990872_100000757381 [0,1,0,1,0,0|2,0,0]=4 22600 B16R1.12723 CCOCCN1CCCCC1C(=O)OCC 2230a_100016990872_100011215890 [0,1,0,1,0,0|2,0,0]=4 22601 B16R1.12723 CCOCCN1CCCCC1C(=O)OCC 269982a_100016990872_100011215890 [0,1,0,1,0,0|2,0,0]=4 22602 B16R1.12723 COCCCC1CCCCN1C(=O)COC 11a_100011804088_100000210968 [0,1,0,1,0,0|2,0,0]=4 22603 B16R1.12723 COCCCC1CCCCN1C(=O)COC 1626a_100011804088_100000210968 [0,1,0,1,0,0|2,0,0]=4 22604 B16R1.12723 COCCCC1CCCCN1C(=O)COC 240690a_100011804088_100000210968 [0,1,0,1,0,0|2,0,0]=4 22605 B16R1.12723 COCCCC1CCCCN1C(=O)COC 527a_100011804088_100000210968 [0,1,0,1,0,0|2,0,0]=4 22606 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@@H]1C 2230a_100020605311_100000755133 [0,1,0,1,0,0|1,0,0]=3 22607 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@@H]1C 269982a_100020605311_100000755133 [0,1,0,1,0,0|1,0,0]=3 22608 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@H]1C 2230a_100015189458_100000755133 [0,1,0,1,0,0|1,0,0]=3 22609 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@H]1C 269982a_100015189458_100000755133 [0,1,0,1,0,0|1,0,0]=3 22610 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@H]1C 34a_100015189458_100000755133 [0,1,0,1,0,0|1,0,0]=3 22611 B16R1.14009 CCOC(=O)CCCCCN1CCSC1C 2230a_200011216479_100000755133 [0,1,0,1,0,0|2,0,0]=4 22612 B16R1.14009 CCOC(=O)CCCCCN1CCSC1C 269982a_200011216479_100000755133 [0,1,0,1,0,0|2,0,0]=4 22613 B16R1.14009 CCOC(=O)CCCCCN1CCSC1C 34a_200011216479_100000755133 [0,1,0,1,0,0|2,0,0]=4 22614 B16R1.14009 CCOC(=O)CCCCOC1CCCC1C 34a_100011216460_100000750268 [0,1,0,1,0,0|1,0,0]=3 22615 B16R1.14009 CCOC(=O)CCCCOC1CCCC1C 7a_100011216460_100000750268 [0,1,0,1,0,0|1,0,0]=3 22616 B16R1.14009 CCOC(=O)CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000750268 [0,1,0,1,0,0|2,0,0]=4 22617 B16R1.14009 CCOC(=O)CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000750268 [0,1,0,1,0,0|2,0,0]=4 22618 B16R1.14009 CCOC(=O)CCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000750268 [0,1,0,1,0,0|2,0,0]=4 22619 B16R1.14009 CCOC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_100000750268_200016002552 [0,1,0,1,0,0|2,0,0]=4 22620 B16R1.14009 CCOC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000750268 [0,1,0,1,0,0|2,0,0]=4 22621 B16R1.14009 CCOC(=O)CCCOCC1CCCN1C 34a_100000743107_100009991533 [0,1,0,1,0,0|2,0,0]=4 22622 B16R1.14009 CCOC(=O)CCOCCC1CCCN1C 34a_100011215177_100000765890 [0,1,0,1,0,0|2,0,0]=4 22623 B16R1.14009 CCOC(=O)CCOCCC1CCCN1C 7a_100011215177_100011206558 [0,1,0,1,0,0|2,0,0]=4 22624 B16R1.14009 CCOC(=O)CCSCCC1CCCN1C 62a_100000005710_100000765890 [0,1,0,1,0,0|2,0,0]=4 22625 B16R1.14009 CCOC(=O)CCSCCC1CCCN1C 62a_100000765890_100000005710 [0,1,0,1,0,0|2,0,0]=4 22626 B16R1.14009 CCOC(=O)COCCCN1CCC[C@@H]1C 2230a_100020605311_100009893628 [0,1,0,1,0,0|2,0,0]=4 22627 B16R1.14009 CCOC(=O)COCCCN1CCC[C@@H]1C 269982a_100020605311_100009893628 [0,1,0,1,0,0|2,0,0]=4 22628 B16R1.14009 CCOC(=O)COCCCN1CCC[C@H]1C 2230a_100015189458_100009893628 [0,1,0,1,0,0|2,0,0]=4 22629 B16R1.14009 CCOC(=O)COCCCN1CCC[C@H]1C 269982a_100015189458_100009893628 [0,1,0,1,0,0|2,0,0]=4 22630 B16R1.14009 CCOC(=O)COCCCN1CCC[C@H]1C 34a_100015189458_100009893628 [0,1,0,1,0,0|2,0,0]=4 22631 B16R1.14009 CCOC(=O)COCCOC1CCCC1C 34a_100011216460_100000088970 [0,1,0,1,0,0|2,0,0]=4 22632 B16R1.14009 CCOC(=O)COCCOC1CCCC1C 7a_100011216460_100000088970 [0,1,0,1,0,0|2,0,0]=4 22633 B16R1.14018 CCCC(C)CCCOCCC1CCC1=O 7a_100011713154_200016118888 [0,1,0,1,0,0|2,0,0]=4 22634 B16R1.14018 CCOC(=O)CCCCCCN1CCC1C 269982a_100000755817_100009814379 [0,1,0,1,0,0|1,0,0]=3 22635 B16R1.14018 CCOC(=O)CCCCCCN1CCC1C 34a_100000755817_100009814379 [0,1,0,1,0,0|1,0,0]=3 22636 B16R1.15027 CCNC(=O)CCN1CCCCCCCC1 2230a_100000039187_100000737597 [0,1,0,1,0,0|2,0,0]=4 22637 B16R1.15027 CCNC(=O)CCN1CCCCCCCC1 269982a_100000039187_100000737597 [0,1,0,1,0,0|2,0,0]=4 22638 B16R1.15027 CCNC(=O)CNC1CCCCCCCC1 270004a_100016988866_100000038600 [0,1,0,1,0,0|2,0,0]=4 22639 B16R1.15027 CCOC(=O)CCN1CCCCCCCC1 2230a_100000039187_100011206558 [0,1,0,1,0,0|1,0,0]=3 22640 B16R1.15027 CCOC(=O)CCN1CCCCCCCC1 269982a_100000039187_100011206558 [0,1,0,1,0,0|1,0,0]=3 22641 B16R1.15027 CCOC(=O)CCN1CCCCCCCC1 34a_100000039187_100000765890 [0,1,0,1,0,0|1,0,0]=3 22642 B16R1.15047 C=COC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000036128 [0,1,0,1,0,0|1,0,1]=4 22643 B16R1.15047 C=COC(=O)CNCCC1CCCCCC1 34a_100011532351_100000036128 [0,1,0,1,0,0|1,0,1]=4 22644 B16R1.15047 CCCC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000747444 [0,1,0,1,0,0|2,0,0]=4 22645 B16R1.15047 CCNC(=O)CCNCC1CCCCCC1 2230a_100015204231_100000737597 [0,1,0,1,0,0|2,0,0]=4 22646 B16R1.15047 CCNC(=O)CCNCC1CCCCCC1 269862a_100025743525_200000763224 [0,1,0,1,0,0|2,0,0]=4 22647 B16R1.15047 CCNC(=O)CCNCC1CCCCCC1 34a_100025743525_200000696569 [0,1,0,1,0,0|2,0,0]=4 22648 B16R1.15047 CCNC(=O)CCOCC1CCCCCC1 7a_100000699130_100000737597 [0,1,0,1,0,0|2,0,0]=4 22649 B16R1.15047 CCNC(=O)CCSCC1CCCCCC1 62a_100000737597_200000696569 [0,1,0,1,0,0|2,0,0]=4 22650 B16R1.15047 CCNC(=O)CCSCC1CCCCCC1 62a_200000696569_100000737597 [0,1,0,1,0,0|2,0,0]=4 22651 B16R1.15047 CCNC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000183381 [0,1,0,1,0,0|2,0,0]=4 22652 B16R1.15047 CCNC(=O)CNCCC1CCCCCC1 34a_100011532351_100000183381 [0,1,0,1,0,0|2,0,0]=4 22653 B16R1.15047 CCOC(=O)CCCCN1CCCCCC1 2230a_100000185865_100000750268 [0,1,0,1,0,0|1,0,0]=3 22654 B16R1.15047 CCOC(=O)CCCCN1CCCCCC1 269982a_100000185865_100000750268 [0,1,0,1,0,0|1,0,0]=3 22655 B16R1.15047 CCOC(=O)CCCCN1CCCCCC1 34a_100000185865_100000750268 [0,1,0,1,0,0|1,0,0]=3 22656 B16R1.15047 CCOC(=O)CCCCN1CCCOCC1 2230a_100000685342_100000750268 [0,1,0,1,0,0|2,0,0]=4 22657 B16R1.15047 CCOC(=O)CCCCN1CCCOCC1 269982a_100000685342_100000750268 [0,1,0,1,0,0|2,0,0]=4 22658 B16R1.15047 CCOC(=O)CCCCN1CCCOCC1 34a_100000685342_100000750268 [0,1,0,1,0,0|2,0,0]=4 22659 B16R1.15047 CCOC(=O)CCCNC1CCCCCC1 2230a_100000210984_100009991533 [0,1,0,1,0,0|1,0,0]=3 22660 B16R1.15047 CCOC(=O)CCCNC1CCCCCC1 34a_100000210984_100009991533 [0,1,0,1,0,0|1,0,0]=3 22661 B16R1.15047 CCOC(=O)CCCOC1CCCCCC1 34a_100000210887_100009991533 [0,1,0,1,0,0|1,0,0]=3 22662 B16R1.15047 CCOC(=O)CCCOC1CCCCCC1 7a_100000210887_100011215271 [0,1,0,1,0,0|1,0,0]=3 22663 B16R1.15047 CCOC(=O)CCCSC1CCCCCC1 62a_100009991533_100011217769 [0,1,0,1,0,0|1,0,0]=3 22664 B16R1.15047 CCOC(=O)CCCSC1CCCCCC1 62a_100011217769_100009991533 [0,1,0,1,0,0|1,0,0]=3 22665 B16R1.15047 CCOC(=O)CCNCC1CCCCCC1 2230a_100015204231_100011206558 [0,1,0,1,0,0|1,0,0]=3 22666 B16R1.15047 CCOC(=O)CCNCC1CCCCCC1 34a_100015204231_100000765890 [0,1,0,1,0,0|1,0,0]=3 22667 B16R1.15047 CCOC(=O)CCOCC1CCCCCC1 34a_100000699130_100000765890 [0,1,0,1,0,0|1,0,0]=3 22668 B16R1.15047 CCOC(=O)CCOCC1CCCCCC1 7a_100000699130_100011206558 [0,1,0,1,0,0|1,0,0]=3 22669 B16R1.15047 CCOC(=O)CCSCC1CCCCCC1 62a_100000765890_200000696569 [0,1,0,1,0,0|1,0,0]=3 22670 B16R1.15047 CCOC(=O)CCSCC1CCCCCC1 62a_200000696569_100000765890 [0,1,0,1,0,0|1,0,0]=3 22671 B16R1.15047 CCOC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000188475 [0,1,0,1,0,0|1,0,0]=3 22672 B16R1.15047 CCOC(=O)CNCCC1CCCCCC1 34a_100011532351_100000188475 [0,1,0,1,0,0|1,0,0]=3 22673 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 2230a_100000185865_100000088970 [0,1,0,1,0,0|2,0,0]=4 22674 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 269982a_100000185865_100000088970 [0,1,0,1,0,0|2,0,0]=4 22675 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 34a_100000185865_100000088970 [0,1,0,1,0,0|2,0,0]=4 22676 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 34a_100000238007_100000188475 [0,1,0,1,0,0|2,0,0]=4 22677 B16R1.15047 CCOC(=O)CSCCN1CCCCCC1 62a_100000188475_100000722644 [0,1,0,1,0,0|2,0,0]=4 22678 B16R1.15047 CCOC(=O)CSCCN1CCCCCC1 62a_100000722644_100000188475 [0,1,0,1,0,0|2,0,0]=4 22679 B16R1.15047 CCOC(=O)NCCOC1CCCCCC1 34a_100000158857_100011217769 [0,1,0,1,0,0|2,0,0]=4 22680 B16R1.15047 CCOC(=O)NCCOC1CCCCCC1 7a_100000210887_200011445536 [0,1,0,1,0,0|2,0,0]=4 22681 B16R1.15047 CCOC(=O)NCCSC1CCCCCC1 62a_100011217769_200011445536 [0,1,0,1,0,0|2,0,0]=4 22682 B16R1.15047 CCOC(=O)OCSCC1CCCCCC1 62a_200000696569_100000075025 [0,1,0,1,0,0|2,0,0]=4 22683 B16R1.15047 COCC(=O)NCCCN1CCCCCC1 11a_100000181460_100000210968 [0,1,0,1,0,0|2,0,0]=4 22684 B16R1.15047 COCC(=O)NCCCN1CCCCCC1 240690a_100000181460_100000210968 [0,1,0,1,0,0|2,0,0]=4 22685 B16R1.15047 COCC(=O)NCCCN1CCCCCC1 527a_100000181460_100000210968 [0,1,0,1,0,0|2,0,0]=4 22686 B16R1.15047 O=C(CNCCC1CCCCCC1)NCO 2230a_100011532351_100000185155 [0,1,0,1,0,0|2,0,0]=4 22687 B16R1.15047 O=C(CNCCC1CCCCCC1)NCO 34a_100011532351_100000185155 [0,1,0,1,0,0|2,0,0]=4 22688 B16R1.15313 CCOC(=O)CCCCCCCNC1CC1 34a_100000212008_100009991516 [0,1,0,1,0,0|1,0,0]=3 22689 B16R1.15313 CCOC(=O)CCCCCCNCC1CC1 2230a_100000735609_100009814379 [0,1,0,1,0,0|1,0,0]=3 22690 B16R1.15313 CCOC(=O)CCCCCCNCC1CC1 34a_100000735609_100009814379 [0,1,0,1,0,0|1,0,0]=3 22691 B16R1.15313 CCOC(=O)CCCCCCOCC1CC1 34a_100000211283_100009814379 [0,1,0,1,0,0|1,0,0]=3 22692 B16R1.15313 CCOC(=O)CCCCCCOC[C@@H]1CO1 34a_100000757423_100009814379 [0,1,0,1,0,0|2,0,0]=4 22693 B16R1.15313 CCOC(=O)CCCCCCSCC1CC1 62a_100000756562_100009814379 [0,1,0,1,0,0|1,0,0]=3 22694 B16R1.15313 CCOC(=O)CCCCCCSCC1CO1 62a_102125554688_100009814379 [0,1,0,1,0,0|2,0,0]=4 22695 B16R1.15313 CCOC(=O)CCCCCCSCC1CS1 62a_100000031435_100009814379 [0,1,0,1,0,0|2,0,0]=4 22696 B16R1.15313 CCOC(=O)CCCCCCSC[C@@H]1CO1 62a_100000745022_100009814379 [0,1,0,1,0,0|2,0,0]=4 22697 B16R1.15313 CCOC(=O)CCCCCNCCC1CC1 34a_100000764129_100000755133 [0,1,0,1,0,0|1,0,0]=3 22698 B16R1.15313 CCOC(=O)CCCCCOCCC1CC1 34a_100000754188_100000755133 [0,1,0,1,0,0|1,0,0]=3 22699 B16R1.15313 CCOC(=O)CCCCCOCCC1CC1 7a_100000754188_100000755133 [0,1,0,1,0,0|1,0,0]=3 22700 B16R1.15313 CCOC(=O)CCCCCOCCC1CC1 7a_100011214988_100000764125 [0,1,0,1,0,0|1,0,0]=3 22701 B16R1.15313 CCOC(=O)CCCCCOCCC1CO1 7a_100011214988_100000732470 [0,1,0,1,0,0|2,0,0]=4 22702 B16R1.15313 CCOC(=O)CCCCCOCC[C@@H]1CO1 34a_100009820653_100000755133 [0,1,0,1,0,0|2,0,0]=4 22703 B16R1.15313 CCOC(=O)CCCCCSCCC1CC1 62a_100000755133_100000764125 [0,1,0,1,0,0|1,0,0]=3 22704 B16R1.15313 CCOC(=O)CCCCCSCCC1CC1 62a_100000764125_100000755133 [0,1,0,1,0,0|1,0,0]=3 22705 B16R1.15313 CCOC(=O)CCCCCSCCC1CO1 62a_100000732470_100000755133 [0,1,0,1,0,0|2,0,0]=4 22706 B16R1.15313 CCOC(=O)CCCCCSCCC1CO1 62a_100000755133_100000732470 [0,1,0,1,0,0|2,0,0]=4 22707 B16R1.15313 CCOC(=O)CCCCOCCNC1CC1 34a_100000738766_100000750268 [0,1,0,1,0,0|2,0,0]=4 22708 B16R1.15313 CCOC(=O)CCCCSCCCC1CO1 62a_100000733510_100000750268 [0,1,0,1,0,0|2,0,0]=4 22709 B16R1.15313 CCOC(=O)CCCCSCCCC1CO1 62a_100000750268_100000733510 [0,1,0,1,0,0|2,0,0]=4 22710 B16R1.15313 CCOC(=O)COCCCNCCC1CC1 34a_100000764129_100009893628 [0,1,0,1,0,0|2,0,0]=4 22711 B16R1.15313 CCOC(=O)COCCCOCCC1CC1 34a_100000754188_100009893628 [0,1,0,1,0,0|2,0,0]=4 22712 B16R1.15313 CCOC(=O)COCCCOCCC1CC1 7a_100000754188_100009893628 [0,1,0,1,0,0|2,0,0]=4 22713 B16R1.15313 CCOC(=O)COCCCSCCC1CC1 62a_100000764125_100009893628 [0,1,0,1,0,0|2,0,0]=4 22714 B16R1.15313 CCOC(=O)COCCCSCCC1CC1 62a_100009893628_100000764125 [0,1,0,1,0,0|2,0,0]=4 22715 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210314 [0,1,0,1,0,0|2,0,0]=4 22716 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210757 [0,1,0,1,0,0|2,0,0]=4 22717 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000210314 [0,1,0,1,0,0|2,0,0]=4 22718 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210314 [0,1,0,1,0,0|1,0,0]=3 22719 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210757 [0,1,0,1,0,0|1,0,0]=3 22720 B16R1.17465 CCCCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210757 [0,1,0,1,0,0|2,0,0]=4 22721 B16R1.17465 CCCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210326 [0,1,0,1,0,0|1,0,0]=3 22722 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011995733 [0,1,0,1,0,0|2,0,0]=4 22723 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011995733 [0,1,0,1,0,0|2,0,0]=4 22724 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011215938 [0,1,0,1,0,0|2,0,0]=4 22725 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011215938 [0,1,0,1,0,0|2,0,0]=4 22726 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCF 2230a_100000703725_100000729378 [0,1,0,1,0,0|2,0,0]=4 22727 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCF 269982a_100000703725_100000729378 [0,1,0,1,0,0|2,0,0]=4 22728 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCO 2230a_100000703725_100000746330 [0,1,0,1,0,0|2,0,0]=4 22729 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCO 269982a_100000703725_100000746330 [0,1,0,1,0,0|2,0,0]=4 22730 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCOC 2230a_100000703725_100000730899 [0,1,0,1,0,0|2,0,0]=4 22731 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCOC 269982a_100000703725_100000730899 [0,1,0,1,0,0|2,0,0]=4 22732 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCF 7a_200015395474_100000729493 [0,1,0,1,0,0|2,0,0]=4 22733 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCO 7a_200015395474_100000210776 [0,1,0,1,0,0|2,0,0]=4 22734 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCOC 7a_200015395474_100000740836 [0,1,0,1,0,0|2,0,0]=4 22735 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCSCC 7a_200015395474_100000757381 [0,1,0,1,0,0|2,0,0]=4 22736 B16R1.17465 CCOCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100012232248 [0,1,0,1,0,0|2,0,0]=4 22737 B16R1.17465 CCOCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100012232248 [0,1,0,1,0,0|2,0,0]=4 22738 B16R1.17465 CCOCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100011215890 [0,1,0,1,0,0|2,0,0]=4 22739 B16R1.738 CCCC(C)CNCC1CCCC(=O)N1C 2230a_200010383782_100011216630 [0,1,0,1,0,0|2,0,0]=4 22740 B16R1.738 CCCC(C)CNCC1CCCC(=O)N1C 270004a_200010383782_100000243154 [0,1,0,1,0,0|2,0,0]=4 22741 B16R1.738 CCCC(C)CNCC1CCCC(=O)N1C 34a_200010383782_100011216630 [0,1,0,1,0,0|2,0,0]=4 22742 B16R1.931 CCCC(C)CCCOCC1COC(=O)O1 34a_100011713154_100000073702 [0,1,0,1,0,0|2,0,0]=4 22743 B16R1.931 CCCC(C)CCCOC[C@H]1COC(=O)N1 34a_100011713154_100015307671 [0,1,0,1,0,0|2,0,0]=4 22744 B16R1.931 CCCC(C)CCCOC[C@H]1COC(=O)N1 7a_100011713154_100015307671 [0,1,0,1,0,0|2,0,0]=4 22745 B16R1.960 CCCC(C)N1CCOCC1CC(=O)OC 2230a_100000731486_100000766640 [0,1,0,1,0,0|2,0,0]=4 22746 B16R1.960 CCCC(C)N1CCOCC1CC(=O)OC 270004a_100000731486_100000211909 [0,1,0,1,0,0|2,0,0]=4 22747 B16R1.960 CCCC(C)N1CCOCC1CC(=O)OC 34a_100000731486_100000766640 [0,1,0,1,0,0|2,0,0]=4 22748 B16R1.1318 CNC(=O)CCCOC1CCC(CC1C)C 34a_100011539931_100000741757 [0,1,0,1,0,0|2,0,0]=4 22749 B16R1.1318 CNC(=O)CCCOC1CCC(CC1C)C 7a_100011539931_100000741757 [0,1,0,1,0,0|2,0,0]=4 22750 B16R1.1318 COC(=O)CCCCN1CCN(C[C@@H]1C)C 2230a_100012002466_100000204269 [0,1,0,1,0,0|2,0,0]=4 22751 B16R1.1318 COC(=O)CCCCN1CCN(C[C@@H]1C)C 269982a_100012002466_100000204269 [0,1,0,1,0,0|2,0,0]=4 22752 B16R1.1318 COC(=O)CCCOC1CCC(CC1C)C 34a_100011539931_100000742333 [0,1,0,1,0,0|1,0,0]=3 22753 B16R1.1318 COC(=O)CCCOC1CCC(CC1C)C 7a_100011539931_100011218270 [0,1,0,1,0,0|1,0,0]=3 22754 B16R1.1556 CCCC(=O)CN1CCCCC1C(=O)OC 2230a_100000734855_100000747444 [0,1,0,1,0,0|1,0,1]=4 22755 B16R1.1556 CCCC(=O)CN1CCCCC1C(=O)OC 269982a_100000734855_100000747444 [0,1,0,1,0,0|1,0,1]=4 22756 B16R1.1556 CCCC(=O)NC1CCCCC1C(=O)OC 188690a_100015195387_100000211992 [0,1,0,1,0,0|1,0,1]=4 22757 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)NC 2230a_100011209383_100011216630 [0,1,0,1,0,0|2,0,0]=4 22758 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)NC 269982a_100011209383_100011216630 [0,1,0,1,0,0|2,0,0]=4 22759 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)NC 270004a_100011209383_100000243154 [0,1,0,1,0,0|2,0,0]=4 22760 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)NC 34a_100011209383_100011216630 [0,1,0,1,0,0|2,0,0]=4 22761 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)OC 2230a_100000734855_100011216630 [0,1,0,1,0,0|1,0,0]=3 22762 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)OC 269982a_100000734855_100011216630 [0,1,0,1,0,0|1,0,0]=3 22763 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)OC 270004a_100000734855_100000243154 [0,1,0,1,0,0|1,0,0]=3 22764 B16R1.1556 CCCC(C)CN1CCCCC1C(=O)OC 34a_100000734855_100011216630 [0,1,0,1,0,0|1,0,0]=3 22765 B16R1.1556 CCCC(C)CN1CCOCC1C(=O)OC 2230a_100000765174_100011216630 [0,1,0,1,0,0|2,0,0]=4 22766 B16R1.1556 CCCC(C)CN1CCOCC1C(=O)OC 270004a_100000765174_100000243154 [0,1,0,1,0,0|2,0,0]=4 22767 B16R1.1556 CCCC(C)CN1CCOCC1C(=O)OC 34a_100000765174_100011216630 [0,1,0,1,0,0|2,0,0]=4 22768 B16R1.1556 CCCC(C)OC1CCNCC1C(=O)OC 34a_200103168510_100000766640 [0,1,0,1,0,0|2,0,0]=4 22769 B16R1.1556 CCCC(C)O[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000766640 [0,1,0,1,0,0|1,0,0]=3 22770 B16R1.1556 CCCC(C)O[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000766640 [0,1,0,1,0,0|1,0,0]=3 22771 B16R1.1556 COC(=O)[C@@H]1CCCC[C@@H]1OC(C)CCO 34a_100015709673_100009893172 [0,1,0,1,0,0|2,0,0]=4 22772 B16R1.1556 COC(=O)[C@@H]1CCCC[C@@H]1OC(C)CCO 7a_100015709673_100009893172 [0,1,0,1,0,0|2,0,0]=4 22773 B16R1.1556 COCC(C)O[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000765312 [0,1,0,1,0,0|2,0,0]=4 22774 B16R1.1556 COCC(C)O[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000765312 [0,1,0,1,0,0|2,0,0]=4 22775 B16R1.1556 COCC(O)CN1CCCCC1C(=O)OC 34a_100000734855_100011215053 [0,1,0,1,0,0|2,0,0]=4 22776 B16R1.1565 CCCC(=O)CN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000747444 [0,1,0,1,0,0|1,0,1]=4 22777 B16R1.1565 CCCC(=O)CN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000747444 [0,1,0,1,0,0|1,0,1]=4 22778 B16R1.1565 CCCC(C)CN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011216630 [0,1,0,1,0,0|1,0,0]=3 22779 B16R1.1565 CCCC(C)CN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011216630 [0,1,0,1,0,0|1,0,0]=3 22780 B16R1.1565 CCCC(C)CN1CCC[C@@H]1CC(=O)OC 270004a_100025726698_100000243154 [0,1,0,1,0,0|1,0,0]=3 22781 B16R1.1565 CCCC(C)CN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011216630 [0,1,0,1,0,0|1,0,0]=3 22782 B16R1.1565 COCC(O)CN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011215053 [0,1,0,1,0,0|2,0,0]=4 22783 B16R1.4446 CCCC(=O)COC1CCCC1C(=O)OC 7a_200000081814_100000747444 [0,1,0,1,0,0|1,0,1]=4 22784 B16R1.4446 CCCC(C)COC1CCCC1C(=O)OC 34a_200000081814_100011216630 [0,1,0,1,0,0|1,0,0]=3 22785 B16R1.4446 CCCC(C)COC1CCCC1C(=O)OC 7a_200000081814_100011216630 [0,1,0,1,0,0|1,0,0]=3 22786 B16R1.4446 COCC(O)COC1CCCC1C(=O)OC 34a_200000081814_100011215053 [0,1,0,1,0,0|2,0,0]=4 22787 B16R1.4446 COCC(O)COC1CCCC1C(=O)OC 7a_200000081814_100011215053 [0,1,0,1,0,0|2,0,0]=4 22788 B16R1.18403 COC(=O)CCCCCCCC(=O)C1CC1 1458a_100000210395_100010004213 [0,1,0,1,0,0|0,0,1]=3 22789 B16R1.18403 COC(=O)CCCCCCCC(=O)C1CO1 1458a_100000701028_100010004213 [0,1,0,1,0,0|1,0,1]=4 22790 B16R1.18403 COC(=O)CCCCCCCN(C)C1CC1 2230a_100000226674_100010004213 [0,1,0,1,0,0|1,0,0]=3 22791 B16R1.18403 COC(=O)CCCCCCCN(C)C1CC1 269982a_100000226674_100010004213 [0,1,0,1,0,0|1,0,0]=3 22792 B16R1.18403 COC(=O)CCCCCCNC(=O)C1CC1 188690a_100000739044_100000210395 [0,1,0,1,0,0|1,0,1]=4 22793 B16R1.18403 COC(=O)CCCCCCNC(C)C1CC1 2230a_100000700016_100009815986 [0,1,0,1,0,0|1,0,0]=3 22794 B16R1.18403 COC(=O)CCCCCCNC(C)C1CC1 34a_100000700016_100009815986 [0,1,0,1,0,0|1,0,0]=3 22795 B16R1.18403 COC(=O)CCCCCCOC(C)C1CC1 34a_100000744524_100009815986 [0,1,0,1,0,0|1,0,0]=3 22796 B16R1.18403 COC(=O)CCCCCCOC(C)C1CC1 7a_100000744524_100009815986 [0,1,0,1,0,0|1,0,0]=3 22797 B16R1.18403 COC(=O)CCCCCNCC(O)C1CC1 2230a_100000751198_100009816466 [0,1,0,1,0,0|1,0,0]=3 22798 B16R1.18403 COC(=O)CCCCCNCC(O)C1CC1 34a_100000751198_100009816466 [0,1,0,1,0,0|1,0,0]=3 22799 B16R1.18403 COC(=O)CCCCCOCC(=O)C1CC1 34a_100000074720_100000746382 [0,1,0,1,0,0|1,0,1]=4 22800 B16R1.18403 COC(=O)CCCCCOCC(=O)C1CC1 34a_100000686663_100009816466 [0,1,0,1,0,0|1,0,1]=4 22801 B16R1.18403 COC(=O)CCCCCOCC(=O)C1CC1 7a_100000074720_100000746382 [0,1,0,1,0,0|1,0,1]=4 22802 B16R1.18403 COC(=O)CCCCCOC[C@H](N)C1CC1 34a_100020623730_100009816466 [0,1,0,1,0,0|1,0,0]=3 22803 B16R1.18403 COC(=O)CCCCCSCC(=O)C1CC1 62a_100000746382_100009816466 [0,1,0,1,0,0|1,0,1]=4 22804 B16R1.18403 COC(=O)CCCCCSCC(=O)C1CC1 62a_100009816466_100000746382 [0,1,0,1,0,0|1,0,1]=4 22805 B16R1.75497 COC(=O)CCCCCCNC1(CCC1)C 2230a_100000692455_100009815986 [0,1,0,1,0,0|1,0,0]=3 22806 B16R1.75497 COC(=O)CCCCCCNC1(CCC1)C 34a_100000692455_100009815986 [0,1,0,1,0,0|1,0,0]=3 22807 B16R1.75497 COC(=O)CCCCCCNC1(COC1)C 2230a_100000732644_100009815986 [0,1,0,1,0,0|2,0,0]=4 22808 B16R1.75497 COC(=O)CCCCCCOC1(CCC1)C 34a_100000759064_100009815986 [0,1,0,1,0,0|1,0,0]=3 22809 B16R1.75497 COC(=O)CCCCCCOC1(CCC1)C 7a_100000759064_100009815986 [0,1,0,1,0,0|1,0,0]=3 22810 B16R1.75497 COC(=O)CCCCCCOC1(CSC1)C 7a_100016018533_100009815986 [0,1,0,1,0,0|2,0,0]=4 22811 B16R1.75497 COC(=O)CCCCCNCC1(CCC1)C 2230a_100000706607_100009816466 [0,1,0,1,0,0|1,0,0]=3 22812 B16R1.75497 COC(=O)CCCCCNCC1(CCC1)O 2230a_100000752638_100009816466 [0,1,0,1,0,0|1,0,0]=3 22813 B16R1.75497 COC(=O)CCCCCNCC1(COC1)C 2230a_100020631278_100009816466 [0,1,0,1,0,0|2,0,0]=4 22814 B16R1.75497 COC(=O)CCCCCNCC1(COC1)O 2230a_100010264505_100009816466 [0,1,0,1,0,0|2,0,0]=4 22815 B16R1.75497 COC(=O)CCCCCOCC1(CCC1)C 34a_100000074720_100000726658 [0,1,0,1,0,0|1,0,0]=3 22816 B16R1.75497 COC(=O)CCCCCOCC1(CCC1)C 7a_100000074720_100000726658 [0,1,0,1,0,0|1,0,0]=3 22817 B16R1.75497 COC(=O)CCCCCOCC1(COC1)C 34a_100000074720_100009817586 [0,1,0,1,0,0|2,0,0]=4 22818 B16R1.75497 COC(=O)CCCCCOCC1(COC1)C 7a_100000074720_100009817586 [0,1,0,1,0,0|2,0,0]=4 22819 B16R1.75497 COC(=O)CCCCCOCC1(CSC1)C 34a_100000732658_100009816466 [0,1,0,1,0,0|2,0,0]=4 22820 B16R1.75497 COC(=O)CCCCCOCC1(CSC1)C 7a_100000732658_100009816466 [0,1,0,1,0,0|2,0,0]=4 22821 B16R1.75497 COC(=O)CCCCCSCC1(CCC1)C 62a_100000726658_100009816466 [0,1,0,1,0,0|1,0,0]=3 22822 B16R1.75497 COC(=O)CCCCCSCC1(CCC1)C 62a_100009816466_100000726658 [0,1,0,1,0,0|1,0,0]=3 22823 B16R1.75497 COC(=O)CCCCCSCC1(COC1)C 62a_100009816466_100009817586 [0,1,0,1,0,0|2,0,0]=4 22824 B16R1.75497 COC(=O)CCCCCSCC1(COC1)C 62a_100009817586_100009816466 [0,1,0,1,0,0|2,0,0]=4 22825 B16R1.82594 COC(=O)CCCN1CCCN(CC1C)C 269982a_100011935175_100011218270 [0,1,0,1,0,0|2,0,0]=4 22826 B16R1.63 CCCCCCCCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210759 [0,1,0,1,0,0|1,0,1]=4 22827 B16R1.1343 CNC(=O)CCC(=O)CCC1CCCCC1 1458a_100011309844_100011273959 [0,1,0,1,0,0|1,0,1]=4 22828 B16R1.1343 CNC(=O)CCN(C)CCC1CCCCC1 2230a_100000750875_100012355289 [0,1,0,1,0,0|2,0,0]=4 22829 B16R1.1343 CNC(=O)CCN(C)CCC1CCCCC1 269982a_100000750875_100011273959 [0,1,0,1,0,0|2,0,0]=4 22830 B16R1.1343 CNC(=O)CCN(C)CCC1CCCCC1 270004a_100000750875_100011713444 [0,1,0,1,0,0|2,0,0]=4 22831 B16R1.1343 COC(=O)CCC(=O)CCC1CCCCC1 1458a_100000187943_100011273959 [0,1,0,1,0,0|0,0,1]=3 22832 B16R1.1343 COC(=O)CCC(=O)CCC1CCOCC1 1458a_100000187943_100011934994 [0,1,0,1,0,0|1,0,1]=4 22833 B16R1.1343 COC(=O)CCC(=O)CCN1CCCCC1 1458a_100000187943_100000739454 [0,1,0,1,0,0|1,0,1]=4 22834 B16R1.1343 COC(=O)CCC(=O)CNC1CCCCC1 2230a_100000182618_100000691467 [0,1,0,1,0,0|1,0,1]=4 22835 B16R1.1343 COC(=O)CCC(=O)CNC1CCCCC1 34a_100000182618_100000691467 [0,1,0,1,0,0|1,0,1]=4 22836 B16R1.1343 COC(=O)CCC(=O)COC1CCCCC1 1458a_100000187943_100011935260 [0,1,0,1,0,0|1,0,1]=4 22837 B16R1.1343 COC(=O)CCC(=O)COC1CCCCC1 34a_100000210231_100000691467 [0,1,0,1,0,0|1,0,1]=4 22838 B16R1.1343 COC(=O)CCC(=O)COC1CCCCC1 7a_100000210231_100000691467 [0,1,0,1,0,0|1,0,1]=4 22839 B16R1.1343 COC(=O)CCC(=O)CSC1CCCCC1 62a_100000210327_100000691467 [0,1,0,1,0,0|1,0,1]=4 22840 B16R1.1343 COC(=O)CCC(=O)CSC1CCCCC1 62a_100000691467_100000210327 [0,1,0,1,0,0|1,0,1]=4 22841 B16R1.1343 COC(=O)CCC(=O)NCC1CCCCC1 11a_100000210473_100000187943 [0,1,0,1,0,0|1,0,1]=4 22842 B16R1.1343 COC(=O)CCC(=O)NCC1CCCCC1 1626a_100000210473_100000187943 [0,1,0,1,0,0|1,0,1]=4 22843 B16R1.1343 COC(=O)CCC(=O)NCC1CCCCC1 240690a_100000210473_100000187943 [0,1,0,1,0,0|1,0,1]=4 22844 B16R1.1343 COC(=O)CCC(=O)NCC1CCCCC1 527a_100000210473_100000187943 [0,1,0,1,0,0|1,0,1]=4 22845 B16R1.1343 COC(=O)CCN(C)CCC1CCCCC1 269982a_100025711912_100011273959 [0,1,0,1,0,0|1,0,0]=3 22846 B16R1.1343 COC(=O)CCN(C)CCC1CCCCO1 2230a_100015183322_100000204255 [0,1,0,1,0,0|2,0,0]=4 22847 B16R1.1343 COC(=O)CCN(C)CCC1CCCCO1 269982a_100015183322_100000204255 [0,1,0,1,0,0|2,0,0]=4 22848 B16R1.1343 COC(=O)CCN(C)CCC1CCCCO1 34a_100015183322_100000742370 [0,1,0,1,0,0|2,0,0]=4 22849 B16R1.1343 COC(=O)CCN(C)CCC1CCOCC1 269982a_100025711912_100011934994 [0,1,0,1,0,0|2,0,0]=4 22850 B16R1.1343 COC(=O)CCN(C)CCN1CCCCC1 269982a_100025711912_100000739454 [0,1,0,1,0,0|2,0,0]=4 22851 B16R1.1343 COC(=O)CCN(C)COC1CCCCC1 269982a_100025711912_100011935260 [0,1,0,1,0,0|2,0,0]=4 22852 B16R1.1343 COC(=O)CNC(=O)CCC1CCCCC1 188690a_100000185156_100000211375 [0,1,0,1,0,0|1,0,1]=4 22853 B16R1.1343 COC(=O)COC(C)CNC1CCCCC1 34a_100000202029_100000747449 [0,1,0,1,0,0|2,0,0]=4 22854 B16R1.1343 COC(=O)NCC(=O)CCC1CCCCC1 1458a_100000215747_100011273959 [0,1,0,1,0,0|1,0,1]=4 22855 B16R1.5567 CCC1CCCCC1N(C)CCC(=O)NC 270004a_100000750875_100000757040 [0,1,0,1,0,0|2,0,0]=4 22856 B16R1.5567 CCC1CCCCN1C(=O)CCC(=O)OC 11a_100000210034_100000187943 [0,1,0,1,0,0|1,0,1]=4 22857 B16R1.5567 CCC1CCCCN1C(=O)CCC(=O)OC 1626a_100000210034_100000187943 [0,1,0,1,0,0|1,0,1]=4 22858 B16R1.5567 CCC1CCCCN1C(=O)CCC(=O)OC 240690a_100000210034_100000187943 [0,1,0,1,0,0|1,0,1]=4 22859 B16R1.5567 CCC1CCCCN1C(=O)CCC(=O)OC 527a_100000210034_100000187943 [0,1,0,1,0,0|1,0,1]=4 22860 B16R1.5742 CCC1CCCN1CC(=O)CCC(=O)OC 2230a_100000754278_100000691467 [0,1,0,1,0,0|1,0,1]=4 22861 B16R1.5742 CCC1CCCN1CC(=O)CCC(=O)OC 269982a_100000754278_100000691467 [0,1,0,1,0,0|1,0,1]=4 22862 B16R1.5742 CCC1CCCN1CC(=O)CCC(=O)OC 34a_100000754278_100000691467 [0,1,0,1,0,0|1,0,1]=4 22863 B16R1.7440 COC(=O)CCC(=O)CCC1CCCN1C 1458a_100000187943_100000005710 [0,1,0,1,0,0|1,0,1]=4 22864 B16R1.7440 COC(=O)CCC(=O)COC1CCCC1C 34a_100011216460_100000691467 [0,1,0,1,0,0|1,0,1]=4 22865 B16R1.7440 COC(=O)CCC(=O)COC1CCCC1C 7a_100011216460_100000691467 [0,1,0,1,0,0|1,0,1]=4 22866 B16R1.7440 COC(=O)CCN(C)CCC1CCCN1C 269982a_100025711912_100000005710 [0,1,0,1,0,0|2,0,0]=4 22867 B16R1.7458 COC(=O)CCC(=O)CC1CCCCN1C 1458a_100000187943_100015185383 [0,1,0,1,0,0|1,0,1]=4 22868 B16R1.7458 COC(=O)CCC(=O)CN1CCCCC1C 2230a_100000211376_100000691467 [0,1,0,1,0,0|1,0,1]=4 22869 B16R1.7458 COC(=O)CCC(=O)CN1CCCCC1C 269982a_100000211376_100000691467 [0,1,0,1,0,0|1,0,1]=4 22870 B16R1.7458 COC(=O)CCC(=O)CN1CCCCC1C 34a_100000211376_100000691467 [0,1,0,1,0,0|1,0,1]=4 22871 B16R1.7458 COC(=O)CCC(=O)NC1CCCCC1C 11a_100000211402_100000187943 [0,1,0,1,0,0|1,0,1]=4 22872 B16R1.7458 COC(=O)CCC(=O)NC1CCCCC1C 1626a_100000211402_100000187943 [0,1,0,1,0,0|1,0,1]=4 22873 B16R1.7458 COC(=O)CCC(=O)NC1CCCCC1C 240690a_100000211402_100000187943 [0,1,0,1,0,0|1,0,1]=4 22874 B16R1.7458 COC(=O)CCC(=O)NC1CCCCC1C 527a_100000211402_100000187943 [0,1,0,1,0,0|1,0,1]=4 22875 B16R1.7458 COC(=O)CCN(C)CC1CCCCN1C 2230a_100015185953_100000204255 [0,1,0,1,0,0|2,0,0]=4 22876 B16R1.7458 COC(=O)CCN(C)CC1CCCCN1C 269982a_100015185953_100000204255 [0,1,0,1,0,0|2,0,0]=4 22877 B16R1.7458 COC(=O)CCN(C)CC1CCCCN1C 269982a_100025711912_100015185383 [0,1,0,1,0,0|2,0,0]=4 22878 B16R1.8412 C=C1C[C@H](N(C1)CCCCCC)C(=O)OC 2230a_100025771018_100000210314 [0,1,0,1,0,0|1,0,1]=4 22879 B16R1.8412 CCCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100000210314 [0,1,0,1,0,0|1,0,0]=3 22880 B16R1.8412 CCCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100000210757 [0,1,0,1,0,0|1,0,0]=3 22881 B16R1.8412 CCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100000210314 [0,1,0,1,0,0|1,0,0]=3 22882 B16R1.8412 CCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100000210757 [0,1,0,1,0,0|1,0,0]=3 22883 B16R1.8412 CCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100000210314 [0,1,0,1,0,0|1,0,0]=3 22884 B16R1.8412 CCCCOCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100011995733 [0,1,0,1,0,0|2,0,0]=4 22885 B16R1.8412 CCCCOCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100011995733 [0,1,0,1,0,0|2,0,0]=4 22886 B16R1.8412 CCCCOCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100011995733 [0,1,0,1,0,0|2,0,0]=4 22887 B16R1.8412 CCCCOCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100011995733 [0,1,0,1,0,0|2,0,0]=4 22888 B16R1.8412 CCCCOCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100011995733 [0,1,0,1,0,0|2,0,0]=4 22889 B16R1.8412 CCCOCCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100011215938 [0,1,0,1,0,0|2,0,0]=4 22890 B16R1.8412 CCCOCCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100011215938 [0,1,0,1,0,0|2,0,0]=4 22891 B16R1.8412 CCCOCCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100011215938 [0,1,0,1,0,0|2,0,0]=4 22892 B16R1.8412 CCCOCCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100011215938 [0,1,0,1,0,0|2,0,0]=4 22893 B16R1.8412 CCCOCCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100011215938 [0,1,0,1,0,0|2,0,0]=4 22894 B16R1.8412 CCOCCCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100012232248 [0,1,0,1,0,0|2,0,0]=4 22895 B16R1.8412 CCOCCCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100012232248 [0,1,0,1,0,0|2,0,0]=4 22896 B16R1.8412 CCOCCCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100012232248 [0,1,0,1,0,0|2,0,0]=4 22897 B16R1.8412 CCOCCCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100012232248 [0,1,0,1,0,0|2,0,0]=4 22898 B16R1.8412 CCOCCCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100012232248 [0,1,0,1,0,0|2,0,0]=4 22899 B16R1.8412 COC(=O)[C@@H]1C[C@@H](CN1CCCCCF)F 2230a_100000724535_100000729378 [0,1,0,1,0,0|2,0,0]=4 22900 B16R1.8412 COC(=O)[C@@H]1C[C@@H](CN1CCCCCF)F 269982a_100000724535_100000729378 [0,1,0,1,0,0|2,0,0]=4 22901 B16R1.8412 COC(=O)[C@@H]1C[C@@H](CN1CCCCCF)F 34a_100000724535_100000729378 [0,1,0,1,0,0|2,0,0]=4 22902 B16R1.8412 COC(=O)[C@@H]1C[C@@H](CN1CCCCCO)F 2230a_100000724535_100000746330 [0,1,0,1,0,0|2,0,0]=4 22903 B16R1.8412 COC(=O)[C@@H]1C[C@@H](CN1CCCCCO)F 269982a_100000724535_100000746330 [0,1,0,1,0,0|2,0,0]=4 22904 B16R1.8412 COC(=O)[C@@H]1C[C@@H](CN1CCCCCO)F 34a_100000724535_100000746330 [0,1,0,1,0,0|2,0,0]=4 22905 B16R1.8412 COC(=O)[C@@H]1C[C@H](CN1CCCCCF)O 2230a_100000753705_100000729378 [0,1,0,1,0,0|2,0,0]=4 22906 B16R1.8412 COC(=O)[C@@H]1C[C@H](CN1CCCCCF)O 269982a_100000753705_100000729378 [0,1,0,1,0,0|2,0,0]=4 22907 B16R1.8412 COC(=O)[C@@H]1C[C@H](CN1CCCCCO)O 2230a_100000753705_100000746330 [0,1,0,1,0,0|2,0,0]=4 22908 B16R1.8412 COC(=O)[C@@H]1C[C@H](CN1CCCCCO)O 269982a_100000753705_100000746330 [0,1,0,1,0,0|2,0,0]=4 22909 B16R1.8412 COCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100000730899 [0,1,0,1,0,0|2,0,0]=4 22910 B16R1.8412 COCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100000730899 [0,1,0,1,0,0|2,0,0]=4 22911 B16R1.8412 COCCCCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100000730899 [0,1,0,1,0,0|2,0,0]=4 22912 B16R1.8412 COCCCCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100000730899 [0,1,0,1,0,0|2,0,0]=4 22913 B16R1.8412 COCCCCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100000755781 [0,1,0,1,0,0|2,0,0]=4 22914 B16R1.13014 CCCCCN1CCC(CC1C(=O)OC)O 2230a_100020629045_100000210326 [0,1,0,1,0,0|1,0,0]=3 22915 B16R1.13014 CCCCCN1CCC(CC1C(=O)OC)O 269982a_100020629045_100000210215 [0,1,0,1,0,0|1,0,0]=3 22916 B16R1.13014 CCOCCN1CCC(CC1C(=O)OC)O 2230a_100020629045_100011215890 [0,1,0,1,0,0|2,0,0]=4 22917 B16R1.13014 CCOCCN1CCC(CC1C(=O)OC)O 269982a_100020629045_100011215890 [0,1,0,1,0,0|2,0,0]=4 22918 B16R1.13014 CCSCCN1CCC(CC1C(=O)OC)O 2230a_100020629045_100000757381 [0,1,0,1,0,0|2,0,0]=4 22919 B16R1.13014 CCSCCN1CCC(CC1C(=O)OC)O 269982a_100020629045_100000757381 [0,1,0,1,0,0|2,0,0]=4 22920 B16R1.13014 COC(=O)C1CC(CCN1CCCCF)O 2230a_100020629045_100000729493 [0,1,0,1,0,0|2,0,0]=4 22921 B16R1.13014 COC(=O)C1CC(CCN1CCCCF)O 269982a_100020629045_100000729493 [0,1,0,1,0,0|2,0,0]=4 22922 B16R1.13014 COC(=O)C1CC(CCN1CCCCO)O 2230a_100020629045_100000210776 [0,1,0,1,0,0|2,0,0]=4 22923 B16R1.13014 COC(=O)C1CC(CCN1CCCCO)O 269982a_100020629045_100000210776 [0,1,0,1,0,0|2,0,0]=4 22924 B16R1.13014 COCCCN1CCC(CC1C(=O)OC)O 2230a_100020629045_100000740836 [0,1,0,1,0,0|2,0,0]=4 22925 B16R1.13014 COCCCN1CCC(CC1C(=O)OC)O 269982a_100020629045_100000740836 [0,1,0,1,0,0|2,0,0]=4 22926 B16R1.13568 CCCC1CCCC1N(C)CCC(=O)NC 270004a_100000750875_100000723119 [0,1,0,1,0,0|2,0,0]=4 22927 B16R1.17903 CCCCCCCCC(C)OC1CCC1=O 34a_100000210740_100009892977 [0,1,0,1,0,0|2,0,0]=4 22928 B16R1.17903 CCCCCCCCC(C)OC1CCC1=O 7a_100000210740_100009892977 [0,1,0,1,0,0|2,0,0]=4 22929 B16R1.18481 CNC(=O)CCC(=O)CCCC1CCCC1 1458a_100011309844_100011713738 [0,1,0,1,0,0|1,0,1]=4 22930 B16R1.18481 CNC(=O)CCN(C)CCCC1CCCC1 2230a_100000750875_100011713738 [0,1,0,1,0,0|2,0,0]=4 22931 B16R1.18481 CNC(=O)CCN(C)CCCC1CCCC1 2230a_100015186261_100000737683 [0,1,0,1,0,0|2,0,0]=4 22932 B16R1.18481 CNC(=O)CCN(C)CCCC1CCCC1 269982a_100000750875_100011713738 [0,1,0,1,0,0|2,0,0]=4 22933 B16R1.18481 CNC(=O)CCN(C)CCCC1CCCC1 269982a_100015186261_100000737683 [0,1,0,1,0,0|2,0,0]=4 22934 B16R1.18481 CNC(=O)CCN(C)CCCC1CCCC1 34a_100015186261_100012179268 [0,1,0,1,0,0|2,0,0]=4 22935 B16R1.18481 COC(=O)CCC(=O)CCCC1CCCC1 1458a_100000187943_100011713738 [0,1,0,1,0,0|0,0,1]=3 22936 B16R1.18481 COC(=O)CCC(=O)CCCN1CCCC1 1458a_100000187943_100011445909 [0,1,0,1,0,0|1,0,1]=4 22937 B16R1.18481 COC(=O)CCC(=O)CNCC1CCCC1 2230a_100000737975_100000691467 [0,1,0,1,0,0|1,0,1]=4 22938 B16R1.18481 COC(=O)CCC(=O)CNCC1CCCC1 34a_100000737975_100000691467 [0,1,0,1,0,0|1,0,1]=4 22939 B16R1.18481 COC(=O)CCC(=O)COCC1CCCC1 34a_100000742336_100000691467 [0,1,0,1,0,0|1,0,1]=4 22940 B16R1.18481 COC(=O)CCC(=O)COCC1CCCC1 7a_100000742336_100000691467 [0,1,0,1,0,0|1,0,1]=4 22941 B16R1.18481 COC(=O)CCC(=O)CSCC1CCCC1 62a_100000691467_100000740388 [0,1,0,1,0,0|1,0,1]=4 22942 B16R1.18481 COC(=O)CCC(=O)CSCC1CCCC1 62a_100000740388_100000691467 [0,1,0,1,0,0|1,0,1]=4 22943 B16R1.18481 COC(=O)CCC(=O)NCCC1CCCC1 11a_100000739158_100000187943 [0,1,0,1,0,0|1,0,1]=4 22944 B16R1.18481 COC(=O)CCC(=O)NCCC1CCCC1 1626a_100000739158_100000187943 [0,1,0,1,0,0|1,0,1]=4 22945 B16R1.18481 COC(=O)CCC(=O)NCCC1CCCC1 240690a_100000739158_100000187943 [0,1,0,1,0,0|1,0,1]=4 22946 B16R1.18481 COC(=O)CCC(=O)NCCC1CCCC1 527a_100000739158_100000187943 [0,1,0,1,0,0|1,0,1]=4 22947 B16R1.18481 COC(=O)CCN(C)CCCC1CCCC1 2230a_100015186261_100000204255 [0,1,0,1,0,0|1,0,0]=3 22948 B16R1.18481 COC(=O)CCN(C)CCCC1CCCC1 269982a_100015186261_100000204255 [0,1,0,1,0,0|1,0,0]=3 22949 B16R1.18481 COC(=O)CCN(C)CCCC1CCCC1 269982a_100025711912_100011713738 [0,1,0,1,0,0|1,0,0]=3 22950 B16R1.18481 COC(=O)CCN(C)CCCC1CCCC1 34a_100015186261_100000742370 [0,1,0,1,0,0|1,0,0]=3 22951 B16R1.18481 COC(=O)CCN(C)CCCC1CCCO1 2230a_100011698863_100000204255 [0,1,0,1,0,0|2,0,0]=4 22952 B16R1.18481 COC(=O)CCN(C)CCCC1CCCO1 269982a_100011698863_100000204255 [0,1,0,1,0,0|2,0,0]=4 22953 B16R1.18481 COC(=O)CCN(C)CCCC1CCCO1 34a_100011698863_100000742370 [0,1,0,1,0,0|2,0,0]=4 22954 B16R1.18481 COC(=O)CCN(C)CCCN1CCCC1 269982a_100000233079_100000204255 [0,1,0,1,0,0|2,0,0]=4 22955 B16R1.18481 COC(=O)CCN(C)CCCN1CCCC1 269982a_100025711912_100011445909 [0,1,0,1,0,0|2,0,0]=4 22956 B16R1.18481 COC(=O)NCC(=O)CCCC1CCCC1 1458a_100000215747_100011713738 [0,1,0,1,0,0|1,0,1]=4 22957 B16R1.40120 CNC(=O)CCN(C)C1CCCCCCC1 270004a_100000750875_100000210524 [0,1,0,1,0,0|2,0,0]=4 22958 B16R1.40120 COC(=O)CCC(=O)N1CCCCCCC1 11a_100000211400_100000187943 [0,1,0,1,0,0|1,0,1]=4 22959 B16R1.40120 COC(=O)CCC(=O)N1CCCCCCC1 1626a_100000211400_100000187943 [0,1,0,1,0,0|1,0,1]=4 22960 B16R1.40120 COC(=O)CCC(=O)N1CCCCCCC1 240690a_100000211400_100000187943 [0,1,0,1,0,0|1,0,1]=4 22961 B16R1.40120 COC(=O)CCC(=O)N1CCCCCCC1 527a_100000211400_100000187943 [0,1,0,1,0,0|1,0,1]=4 22962 B16R1.40206 CNC(=O)CCC(=O)CC1CCCCCC1 1458a_100011309844_200000696569 [0,1,0,1,0,0|1,0,1]=4 22963 B16R1.40206 CNC(=O)CCN(C)CC1CCCCCC1 2230a_100000750875_200000696569 [0,1,0,1,0,0|2,0,0]=4 22964 B16R1.40206 CNC(=O)CCN(C)CC1CCCCCC1 269982a_100000750875_200000696569 [0,1,0,1,0,0|2,0,0]=4 22965 B16R1.40206 COC(=O)CCC(=O)CC1CCCCCC1 1458a_100000187943_200000696569 [0,1,0,1,0,0|0,0,1]=3 22966 B16R1.40206 COC(=O)CCC(=O)CN1CCCCCC1 2230a_100000185865_100000691467 [0,1,0,1,0,0|1,0,1]=4 22967 B16R1.40206 COC(=O)CCC(=O)CN1CCCCCC1 269982a_100000185865_100000691467 [0,1,0,1,0,0|1,0,1]=4 22968 B16R1.40206 COC(=O)CCC(=O)CN1CCCCCC1 34a_100000185865_100000691467 [0,1,0,1,0,0|1,0,1]=4 22969 B16R1.40206 COC(=O)CCC(=O)NC1CCCCCC1 11a_100000210984_100000187943 [0,1,0,1,0,0|1,0,1]=4 22970 B16R1.40206 COC(=O)CCC(=O)NC1CCCCCC1 1626a_100000210984_100000187943 [0,1,0,1,0,0|1,0,1]=4 22971 B16R1.40206 COC(=O)CCC(=O)NC1CCCCCC1 240690a_100000210984_100000187943 [0,1,0,1,0,0|1,0,1]=4 22972 B16R1.40206 COC(=O)CCC(=O)NC1CCCCCC1 527a_100000210984_100000187943 [0,1,0,1,0,0|1,0,1]=4 22973 B16R1.40206 COC(=O)CCN(C)CC1CCCCCC1 269982a_100025711912_200000696569 [0,1,0,1,0,0|1,0,0]=3 22974 B16R1.40206 COC(=O)CNC(=O)CC1CCCCCC1 188690a_100000185156_100000685095 [0,1,0,1,0,0|1,0,1]=4 22975 B16R1.40206 COC(=O)NCC(=O)CC1CCCCCC1 1458a_100000215747_200000696569 [0,1,0,1,0,0|1,0,1]=4 22976 B16R1.43502 CCCCCCCOC1(CCC(=O)CC1)C 34a_100012184276_100000210614 [0,1,0,1,0,0|2,0,0]=4 22977 B16R1.43502 CCCCCCCOC1(CCC(=O)CC1)C 7a_100012184276_100000210614 [0,1,0,1,0,0|2,0,0]=4 22978 B16R1.849 CCC(=O)CC(=O)CCCC1CCCCC1 1458a_100000211478_100000747405 [0,1,0,1,0,0|1,0,1]=4 22979 B16R1.849 CNC(=O)CC(=O)CCCC1CCCCC1 1458a_100000211478_100000183359 [0,1,0,1,0,0|1,0,1]=4 22980 B16R1.849 CNC(=O)CN(C)CCCC1CCCCC1 2230a_100000189611_100011713725 [0,1,0,1,0,0|2,0,0]=4 22981 B16R1.849 COC(=O)CC(=O)CCCC1CCCCC1 1458a_100000211351_100011713725 [0,1,0,1,0,0|0,0,1]=3 22982 B16R1.849 COC(=O)CC(=O)CCCC1CCCCC1 1458a_100000211478_100000747449 [0,1,0,1,0,0|0,0,1]=3 22983 B16R1.849 COC(=O)CC(=O)CCCN1CCCCC1 1458a_100000211351_100000690320 [0,1,0,1,0,0|1,0,1]=4 22984 B16R1.849 COC(=O)CC(=O)CCCN1CCCCC1 1458a_100000742516_100000747449 [0,1,0,1,0,0|1,0,1]=4 22985 B16R1.849 COC(=O)CC(=O)CCOC1CCCCC1 1458a_100000211351_100011211530 [0,1,0,1,0,0|1,0,1]=4 22986 B16R1.849 COC(=O)CC(=O)CSCC1CCCCC1 62a_100000210525_100000211423 [0,1,0,1,0,0|1,0,1]=4 22987 B16R1.849 COC(=O)CC(=O)CSCC1CCCCC1 62a_100000211423_100000210525 [0,1,0,1,0,0|1,0,1]=4 22988 B16R1.849 COC(=O)CC(=O)NCCC1CCCCC1 240690a_100000738074_100000211351 [0,1,0,1,0,0|1,0,1]=4 22989 B16R1.849 COC(=O)CC(C)NCCC1CCCCC1 2230a_100000738074_100009817358 [0,1,0,1,0,0|1,0,0]=3 22990 B16R1.849 COC(=O)CC(C)NCCC1CCCCC1 34a_100000738074_100009817358 [0,1,0,1,0,0|1,0,0]=3 22991 B16R1.849 COC(=O)CC(C)NCCC1CCCCO1 2230a_100015183643_100009817358 [0,1,0,1,0,0|2,0,0]=4 22992 B16R1.849 COC(=O)CC(C)NCCC1CCCCO1 34a_100015183643_100009817358 [0,1,0,1,0,0|2,0,0]=4 22993 B16R1.849 COC(=O)CC(C)NCCC1CCOCC1 2230a_100000755988_100009817358 [0,1,0,1,0,0|2,0,0]=4 22994 B16R1.849 COC(=O)CC(C)NCCC1CCOCC1 34a_100000755988_100009817358 [0,1,0,1,0,0|2,0,0]=4 22995 B16R1.849 COC(=O)CC(C)OCCC1CCCCC1 34a_100011217863_100009817358 [0,1,0,1,0,0|1,0,0]=3 22996 B16R1.849 COC(=O)CC(C)OCCC1CCCCC1 7a_100011217863_100009817358 [0,1,0,1,0,0|1,0,0]=3 22997 B16R1.849 COC(=O)CC(C)OCCC1CCCCN1 34a_100000211664_100009817358 [0,1,0,1,0,0|2,0,0]=4 22998 B16R1.849 COC(=O)CC(C)OCCC1CCCNC1 34a_100000752241_100009817358 [0,1,0,1,0,0|2,0,0]=4 22999 B16R1.849 COC(=O)CC(C)OCCC1CCNCC1 34a_100015190746_100009817358 [0,1,0,1,0,0|2,0,0]=4 23000 B16R1.849 COC(=O)CC(C)OCCC1CCOCC1 34a_100011933979_100009817358 [0,1,0,1,0,0|2,0,0]=4 23001 B16R1.849 COC(=O)CC(C)OCCC1CCOCC1 7a_100011933979_100009817358 [0,1,0,1,0,0|2,0,0]=4 23002 B16R1.849 COC(=O)CC(C)SCCC1CCCCC1 62a_100009817358_100012355289 [0,1,0,1,0,0|1,0,0]=3 23003 B16R1.849 COC(=O)CC(C)SCCC1CCCCC1 62a_100012355289_100009817358 [0,1,0,1,0,0|1,0,0]=3 23004 B16R1.849 COC(=O)CC(C)SCCC1CCOCC1 62a_100009817358_100011934994 [0,1,0,1,0,0|2,0,0]=4 23005 B16R1.849 COC(=O)CC(C)SCCC1CCOCC1 62a_100011934994_100009817358 [0,1,0,1,0,0|2,0,0]=4 23006 B16R1.849 COC(=O)CC(C)SCCN1CCCCC1 62a_100000739454_100009817358 [0,1,0,1,0,0|2,0,0]=4 23007 B16R1.849 COC(=O)CC(C)SCCN1CCCCC1 62a_100009817358_100000739454 [0,1,0,1,0,0|2,0,0]=4 23008 B16R1.849 COC(=O)CC(C)SCOC1CCCCC1 62a_100009817358_100011935260 [0,1,0,1,0,0|2,0,0]=4 23009 B16R1.849 COC(=O)CC(C)SCOC1CCCCC1 62a_100011935260_100009817358 [0,1,0,1,0,0|2,0,0]=4 23010 B16R1.849 COC(=O)CN(C)CCCC1CCCCC1 2230a_100000198492_100011713725 [0,1,0,1,0,0|1,0,0]=3 23011 B16R1.849 COC(=O)CN(C)CCCN1CCCCC1 2230a_100000198492_100000690320 [0,1,0,1,0,0|2,0,0]=4 23012 B16R1.849 COC(=O)CN(C)CCOC1CCCCC1 2230a_100000198492_100011211530 [0,1,0,1,0,0|2,0,0]=4 23013 B16R1.849 COC(=O)C[C@@H](O)CNCC1CCCCC1 34a_100000210473_100000754131 [0,1,0,1,0,0|1,0,0]=3 23014 B16R1.849 COC(=O)C[C@@H](O)CNCC1CCCCO1 34a_100000174945_100000754131 [0,1,0,1,0,0|2,0,0]=4 23015 B16R1.849 COC(=O)C[C@@H](O)CNCC1CCCOC1 34a_100000720124_100000754131 [0,1,0,1,0,0|2,0,0]=4 23016 B16R1.849 COC(=O)C[C@@H](O)CNCC1CCOCC1 34a_100000746373_100000754131 [0,1,0,1,0,0|2,0,0]=4 23017 B16R1.849 COC(=O)C[C@@H](O)CNCC1CCSCC1 34a_100015188806_100000754131 [0,1,0,1,0,0|2,0,0]=4 23018 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCCC1 34a_100000212181_100000754131 [0,1,0,1,0,0|1,0,0]=3 23019 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCCC1 7a_100000212181_100000754131 [0,1,0,1,0,0|1,0,0]=3 23020 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCCN1 34a_100000210821_100000754131 [0,1,0,1,0,0|2,0,0]=4 23021 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCCO1 34a_100000211370_100000754131 [0,1,0,1,0,0|2,0,0]=4 23022 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCCO1 7a_100000211370_100000754131 [0,1,0,1,0,0|2,0,0]=4 23023 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCNC1 34a_100000211344_100000754131 [0,1,0,1,0,0|2,0,0]=4 23024 B16R1.849 COC(=O)C[C@@H](O)COCC1CCCOC1 34a_100000741520_100000754131 [0,1,0,1,0,0|2,0,0]=4 23025 B16R1.849 COC(=O)C[C@@H](O)COCC1CCNCC1 34a_100000738675_100000754131 [0,1,0,1,0,0|2,0,0]=4 23026 B16R1.849 COC(=O)C[C@@H](O)COCC1CCOCC1 34a_100000749013_100000754131 [0,1,0,1,0,0|2,0,0]=4 23027 B16R1.849 COC(=O)C[C@@H](O)COCC1CCSCC1 34a_100000070558_100000754131 [0,1,0,1,0,0|2,0,0]=4 23028 B16R1.849 COC(=O)C[C@@H](O)COCC1CCSCC1 7a_100000070558_100000754131 [0,1,0,1,0,0|2,0,0]=4 23029 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCCCC1 62a_100000211423_100000754131 [0,1,0,1,0,0|1,0,0]=3 23030 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCCCC1 62a_100000754131_100000211423 [0,1,0,1,0,0|1,0,0]=3 23031 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCCCO1 62a_100000211543_100000754131 [0,1,0,1,0,0|2,0,0]=4 23032 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCCCO1 62a_100000754131_100000211543 [0,1,0,1,0,0|2,0,0]=4 23033 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCCOC1 62a_100000741521_100000754131 [0,1,0,1,0,0|2,0,0]=4 23034 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCCOC1 62a_100000754131_100000741521 [0,1,0,1,0,0|2,0,0]=4 23035 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCOCC1 62a_100000754131_100000749018 [0,1,0,1,0,0|2,0,0]=4 23036 B16R1.849 COC(=O)C[C@@H](O)CSCC1CCOCC1 62a_100000754603_100000754131 [0,1,0,1,0,0|2,0,0]=4 23037 B16R1.853 COC(=O)CC(=O)CCC1CCCCN1C 1458a_100000211351_100000211948 [0,1,0,1,0,0|1,0,1]=4 23038 B16R1.853 COC(=O)CC(=O)CCC1CCCCN1C 1458a_100000718493_100000747449 [0,1,0,1,0,0|1,0,1]=4 23039 B16R1.853 COC(=O)CC(=O)COC1CCCCC1C 1458a_100011223357_100000747449 [0,1,0,1,0,0|1,0,1]=4 23040 B16R1.853 COC(=O)CC(C)NCC1CCCCC1O 34a_100011216029_100009817358 [0,1,0,1,0,0|2,0,0]=4 23041 B16R1.853 COC(=O)CC(C)NCC1CCCCN1C 34a_100011228421_100009817358 [0,1,0,1,0,0|2,0,0]=4 23042 B16R1.853 COC(=O)CC(C)OCC1CCCCN1C 34a_100000225079_100009817358 [0,1,0,1,0,0|2,0,0]=4 23043 B16R1.853 COC(=O)CC(C)SCC1CCCCN1C 62a_100009817358_100015185383 [0,1,0,1,0,0|2,0,0]=4 23044 B16R1.853 COC(=O)CC(C)SCC1CCCCN1C 62a_100015185383_100009817358 [0,1,0,1,0,0|2,0,0]=4 23045 B16R1.853 COC(=O)CN(C)CCC1CCCCN1C 2230a_100000198492_100000211948 [0,1,0,1,0,0|2,0,0]=4 23046 B16R1.853 COC(=O)CN(C)CCN1CCCCC1C 2230a_200011233311_100000747449 [0,1,0,1,0,0|2,0,0]=4 23047 B16R1.853 COC(=O)CN(C)CCN1CCCCC1C 269982a_200011233311_100000747449 [0,1,0,1,0,0|2,0,0]=4 23048 B16R1.853 COC(=O)C[C@@H](O)CNC1CCCCC1C 34a_100000211402_100000754131 [0,1,0,1,0,0|1,0,0]=3 23049 B16R1.853 COC(=O)C[C@@H](O)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000754131 [0,1,0,1,0,0|2,0,0]=4 23050 B16R1.853 COC(=O)C[C@@H](O)COC1CCCCC1C 34a_100000211207_100000754131 [0,1,0,1,0,0|1,0,0]=3 23051 B16R1.853 COC(=O)C[C@@H](O)COC1CCCCC1C 7a_100000211207_100000754131 [0,1,0,1,0,0|1,0,0]=3 23052 B16R1.853 COC(=O)C[C@@H](O)COC1CCCCC1Cl 34a_100000038908_100000754131 [0,1,0,1,0,0|2,0,0]=4 23053 B16R1.853 COC(=O)C[C@@H](O)COC1CCCCC1Cl 7a_100000038908_100000754131 [0,1,0,1,0,0|2,0,0]=4 23054 B16R1.853 COC(=O)C[C@@H](O)COC1CCNCC1C 34a_100011998114_100000754131 [0,1,0,1,0,0|2,0,0]=4 23055 B16R1.853 COC(=O)C[C@@H](O)COC1CNCCC1C 34a_100000696640_100000754131 [0,1,0,1,0,0|2,0,0]=4 23056 B16R1.853 COC(=O)C[C@@H](O)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000754131 [0,1,0,1,0,0|2,0,0]=4 23057 B16R1.853 COC(=O)C[C@@H](O)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000754131 [0,1,0,1,0,0|2,0,0]=4 23058 B16R1.853 COC(=O)C[C@@H](O)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100000754131 [0,1,0,1,0,0|2,0,0]=4 23059 B16R1.853 COC(=O)C[C@@H](O)CSC1CCCCC1F 62a_100000754131_100015423560 [0,1,0,1,0,0|2,0,0]=4 23060 B16R1.853 COC(=O)C[C@@H](O)CSC1CCCCC1F 62a_100015423560_100000754131 [0,1,0,1,0,0|2,0,0]=4 23061 B16R1.853 COC(=O)C[C@@H](O)CSC1CCCCC1O 62a_100000038908_100000754131 [0,1,0,1,0,0|2,0,0]=4 23062 B16R1.853 COC(=O)C[C@@H](O)CSC1CCCCC1O 62a_100000754131_100000038908 [0,1,0,1,0,0|2,0,0]=4 23063 B16R1.863 COC(=O)CC(=O)CSCCC1CCCC1 62a_100000210525_100000760354 [0,1,0,1,0,0|1,0,1]=4 23064 B16R1.863 COC(=O)CC(=O)CSCCC1CCCC1 62a_100000760354_100000210525 [0,1,0,1,0,0|1,0,1]=4 23065 B16R1.863 COC(=O)CC(=O)NCCCC1CCCC1 240690a_100000736752_100000211351 [0,1,0,1,0,0|1,0,1]=4 23066 B16R1.863 COC(=O)CC(C)NCCCC1CCCC1 2230a_100000736752_100009817358 [0,1,0,1,0,0|1,0,0]=3 23067 B16R1.863 COC(=O)CC(C)NCCCC1CCCC1 34a_100000736752_100009817358 [0,1,0,1,0,0|1,0,0]=3 23068 B16R1.863 COC(=O)CC(C)NCCOC1CCCC1 34a_100000741755_100009817358 [0,1,0,1,0,0|2,0,0]=4 23069 B16R1.863 COC(=O)CC(C)OCCCC1CCCC1 34a_100011215328_100009817358 [0,1,0,1,0,0|1,0,0]=3 23070 B16R1.863 COC(=O)CC(C)OCCCC1CCCC1 7a_100011215328_100009817358 [0,1,0,1,0,0|1,0,0]=3 23071 B16R1.863 COC(=O)CC(C)OCCNC1CCCC1 34a_200000200444_100009817358 [0,1,0,1,0,0|2,0,0]=4 23072 B16R1.863 COC(=O)CC(C)OCCOC1CCCC1 34a_100000738311_100009817358 [0,1,0,1,0,0|2,0,0]=4 23073 B16R1.863 COC(=O)CC(C)OCCOC1CCCC1 7a_100000738311_100009817358 [0,1,0,1,0,0|2,0,0]=4 23074 B16R1.863 COC(=O)CC(C)SCCCC1CCCC1 62a_100009817358_100011713738 [0,1,0,1,0,0|1,0,0]=3 23075 B16R1.863 COC(=O)CC(C)SCCCC1CCCC1 62a_100011713738_100009817358 [0,1,0,1,0,0|1,0,0]=3 23076 B16R1.863 COC(=O)CC(C)SCCCN1CCCC1 62a_100009817358_100011445909 [0,1,0,1,0,0|2,0,0]=4 23077 B16R1.863 COC(=O)CC(C)SCCCN1CCCC1 62a_100016991639_100009817358 [0,1,0,1,0,0|2,0,0]=4 23078 B16R1.863 COC(=O)C[C@@H](O)CNCCC1CCCC1 34a_100000739158_100000754131 [0,1,0,1,0,0|1,0,0]=3 23079 B16R1.863 COC(=O)C[C@@H](O)COCCC1CCCC1 34a_100000749090_100000754131 [0,1,0,1,0,0|1,0,0]=3 23080 B16R1.863 COC(=O)C[C@@H](O)COCCC1CCCC1 7a_100000749090_100000754131 [0,1,0,1,0,0|1,0,0]=3 23081 B16R1.863 COC(=O)C[C@@H](O)COCCC1CCNC1 34a_100016987287_100000754131 [0,1,0,1,0,0|2,0,0]=4 23082 B16R1.863 COC(=O)C[C@@H](O)COCCC1CCOC1 34a_100011879284_100000754131 [0,1,0,1,0,0|2,0,0]=4 23083 B16R1.863 COC(=O)C[C@@H](O)CSCCC1CCCC1 62a_100000754131_100000760354 [0,1,0,1,0,0|1,0,0]=3 23084 B16R1.863 COC(=O)C[C@@H](O)CSCCC1CCCC1 62a_100000760354_100000754131 [0,1,0,1,0,0|1,0,0]=3 23085 B16R1.863 COC(=O)C[C@@H](O)CSCCN1CCCC1 62a_100000700749_100000754131 [0,1,0,1,0,0|2,0,0]=4 23086 B16R1.863 COC(=O)C[C@@H](O)CSCCN1CCCC1 62a_100000754131_100000004467 [0,1,0,1,0,0|2,0,0]=4 23087 B16R1.5594 CCC1CCCCC1OC(C)CC(=O)OC 34a_100000210738_100009817358 [0,1,0,1,0,0|1,0,0]=3 23088 B16R1.5594 CCC1CCCCC1OC(C)CC(=O)OC 7a_100000210738_100009817358 [0,1,0,1,0,0|1,0,0]=3 23089 B16R1.5594 CCC1CCCCN1C[C@H](O)CC(=O)OC 34a_100000210034_100000754131 [0,1,0,1,0,0|1,0,0]=3 23090 B16R1.5594 CC[C@H]1COCCN1C[C@H](O)CC(=O)OC 34a_100016988097_100000754131 [0,1,0,1,0,0|2,0,0]=4 23091 B16R1.5594 CN[C@@H]1CCCC[C@H]1OC(C)CC(=O)OC 34a_100000708425_100009817358 [0,1,0,1,0,0|2,0,0]=4 23092 B16R1.5594 COC(=O)CC(C)NC1CCCCC1OC 34a_100011208099_100009817358 [0,1,0,1,0,0|2,0,0]=4 23093 B16R1.5594 COC(=O)CC(C)OC1CCCCC1CN 34a_100011216029_100009817358 [0,1,0,1,0,0|2,0,0]=4 23094 B16R1.5594 COC(=O)CC(C)O[C@H]1CCCC[C@@H]1OC 34a_200009815850_100009817358 [0,1,0,1,0,0|2,0,0]=4 23095 B16R1.5594 COC(=O)CC(C)O[C@H]1CCCC[C@@H]1OC 7a_200009815850_100009817358 [0,1,0,1,0,0|2,0,0]=4 23096 B16R1.5594 COC(=O)C[C@@H](O)CN1CCCCC1CO 34a_100000210821_100000754131 [0,1,0,1,0,0|2,0,0]=4 23097 B16R1.5766 CCN1CCCC1CNC(C)CC(=O)OC 2230a_100000211693_100009817358 [0,1,0,1,0,0|2,0,0]=4 23098 B16R1.5766 CCN1CCC[C@@H]1COC(C)CC(=O)OC 34a_100011739246_100009817358 [0,1,0,1,0,0|2,0,0]=4 23099 B16R1.5766 CCN1CCC[C@@H]1COC(C)CC(=O)OC 7a_100011739246_100009817358 [0,1,0,1,0,0|2,0,0]=4 23100 B16R1.13411 CCCC1CCCCC1N(C)CC(=O)NC 270004a_100000189611_100011218038 [0,1,0,1,0,0|2,0,0]=4 23101 B16R1.13411 CCCC1CCCCC1N(C)CC(=O)OC 270004a_100000198492_100011218038 [0,1,0,1,0,0|1,0,0]=3 23102 B16R1.13411 CCCC1CCCCN1C(=O)CC(=O)OC 240690a_100000701414_100000211351 [0,1,0,1,0,0|1,0,1]=4 23103 B16R1.13411 CCCC1CCCCN1C(C)CC(=O)OC 2230a_100000701414_100009817358 [0,1,0,1,0,0|1,0,0]=3 23104 B16R1.13411 CCCC1CCCCN1C(C)CC(=O)OC 269982a_100000701414_100009817358 [0,1,0,1,0,0|1,0,0]=3 23105 B16R1.13411 CCCC1CCCCN1C(C)CC(=O)OC 34a_100000701414_100009817358 [0,1,0,1,0,0|1,0,0]=3 23106 B16R1.13411 CCCC1COCCN1C(C)CC(=O)OC 2230a_102495339903_100009817358 [0,1,0,1,0,0|2,0,0]=4 23107 B16R1.13411 CCCC1COCCN1C(C)CC(=O)OC 269982a_102495339903_100009817358 [0,1,0,1,0,0|2,0,0]=4 23108 B16R1.13411 CCCC1COCCN1C(C)CC(=O)OC 34a_102495339903_100009817358 [0,1,0,1,0,0|2,0,0]=4 23109 B16R1.13411 CCCN1CCCCC1C(=O)CC(=O)OC 1458a_100000743559_100000747449 [0,1,0,1,0,0|1,0,1]=4 23110 B16R1.13411 CCOC1CCCCC1N(C)CC(=O)OC 270004a_100000198492_200000031474 [0,1,0,1,0,0|2,0,0]=4 23111 B16R1.13411 COC(=O)CC(C)N1CCCCC1CCO 2230a_100000211664_100009817358 [0,1,0,1,0,0|2,0,0]=4 23112 B16R1.13411 COC(=O)CC(C)N1CCCCC1CCO 269982a_100000211664_100009817358 [0,1,0,1,0,0|2,0,0]=4 23113 B16R1.13411 COC(=O)CC(C)N1CCCCC1CCO 34a_100000211664_100009817358 [0,1,0,1,0,0|2,0,0]=4 23114 B16R1.13411 COCC1CCCCN1C(C)CC(=O)OC 2230a_100015184032_100009817358 [0,1,0,1,0,0|2,0,0]=4 23115 B16R1.13411 COCC1CCCCN1C(C)CC(=O)OC 269982a_100015184032_100009817358 [0,1,0,1,0,0|2,0,0]=4 23116 B16R1.13411 COCC1CCCCN1C(C)CC(=O)OC 34a_100015184032_100009817358 [0,1,0,1,0,0|2,0,0]=4 23117 B16R1.13597 COC[C@@H]1CCCN1C[C@H](O)CC(=O)OC 34a_100020646714_100000754131 [0,1,0,1,0,0|2,0,0]=4 23118 B16R1.13660 CCCCCCCCCC(=O)C1CCC1=O 1458a_100000210558_100009892977 [0,1,0,1,0,0|1,0,1]=4 23119 B16R1.13660 CCCCCCCCCN(C)C1CCC1=O 269982a_100000232482_100009892977 [0,1,0,1,0,0|2,0,0]=4 23120 B16R1.14725 CNC(=O)CN(C)C1CCCCCCCC1 270004a_100000189611_100000038600 [0,1,0,1,0,0|2,0,0]=4 23121 B16R1.14725 COC(=O)CC(=O)N1CCCCCCCC1 240690a_100000039187_100000211351 [0,1,0,1,0,0|1,0,1]=4 23122 B16R1.14725 COC(=O)CC(C)N1CCCCCCCC1 2230a_100000039187_100009817358 [0,1,0,1,0,0|1,0,0]=3 23123 B16R1.14725 COC(=O)CC(C)N1CCCCCCCC1 269982a_100000039187_100009817358 [0,1,0,1,0,0|1,0,0]=3 23124 B16R1.14725 COC(=O)CC(C)N1CCCCCCCC1 34a_100000039187_100009817358 [0,1,0,1,0,0|1,0,0]=3 23125 B16R1.14725 COC(=O)CN(C)C1CCCCCCCC1 270004a_100000198492_100000038600 [0,1,0,1,0,0|1,0,0]=3 23126 B16R1.14752 COC(=O)CC(=O)CCN1CCCCCC1 1458a_100000211351_100000722644 [0,1,0,1,0,0|1,0,1]=4 23127 B16R1.14752 COC(=O)CC(=O)CCN1CCCCCC1 1458a_100000740320_100000747449 [0,1,0,1,0,0|1,0,1]=4 23128 B16R1.14752 COC(=O)CC(=O)CSC1CCCCCC1 62a_100000210525_100011217769 [0,1,0,1,0,0|1,0,1]=4 23129 B16R1.14752 COC(=O)CC(=O)CSC1CCCCCC1 62a_100011217769_100000210525 [0,1,0,1,0,0|1,0,1]=4 23130 B16R1.14752 COC(=O)CC(=O)NCC1CCCCCC1 240690a_100015204231_100000211351 [0,1,0,1,0,0|1,0,1]=4 23131 B16R1.14752 COC(=O)CC(C)NCC1CCCCCC1 2230a_100015204231_100009817358 [0,1,0,1,0,0|1,0,0]=3 23132 B16R1.14752 COC(=O)CC(C)NCC1CCCCCC1 34a_100015204231_100009817358 [0,1,0,1,0,0|1,0,0]=3 23133 B16R1.14752 COC(=O)CC(C)OCC1CCCCCC1 34a_100000699130_100009817358 [0,1,0,1,0,0|1,0,0]=3 23134 B16R1.14752 COC(=O)CC(C)OCC1CCCCCC1 7a_100000699130_100009817358 [0,1,0,1,0,0|1,0,0]=3 23135 B16R1.14752 COC(=O)CC(C)SCC1CCCCCC1 62a_100009817358_200000696569 [0,1,0,1,0,0|1,0,0]=3 23136 B16R1.14752 COC(=O)CC(C)SCC1CCCCCC1 62a_200000696569_100009817358 [0,1,0,1,0,0|1,0,0]=3 23137 B16R1.14752 COC(=O)CN(C)CCN1CCCCCC1 269982a_106744473495_100000747449 [0,1,0,1,0,0|2,0,0]=4 23138 B16R1.14752 COC(=O)C[C@@H](O)CNC1CCCCCC1 34a_100000210984_100000754131 [0,1,0,1,0,0|1,0,0]=3 23139 B16R1.14752 COC(=O)C[C@@H](O)COC1CCCCCC1 34a_100000210887_100000754131 [0,1,0,1,0,0|1,0,0]=3 23140 B16R1.14752 COC(=O)C[C@@H](O)COC1CCCCCC1 7a_100000210887_100000754131 [0,1,0,1,0,0|1,0,0]=3 23141 B16R1.14752 COC(=O)C[C@@H](O)CSC1CCCCCC1 62a_100000754131_100011217769 [0,1,0,1,0,0|1,0,0]=3 23142 B16R1.14752 COC(=O)C[C@@H](O)CSC1CCCCCC1 62a_100011217769_100000754131 [0,1,0,1,0,0|1,0,0]=3 23143 B16R1.14929 COC(=O)CC(=O)NC1CCCCCCC1 240690a_100000211152_100000211351 [0,1,0,1,0,0|1,0,1]=4 23144 B16R1.14929 COC(=O)CC(C)NC1CCCCCCC1 2230a_100000211152_100009817358 [0,1,0,1,0,0|1,0,0]=3 23145 B16R1.14929 COC(=O)CC(C)NC1CCCCCCC1 34a_100000211152_100009817358 [0,1,0,1,0,0|1,0,0]=3 23146 B16R1.14929 COC(=O)CC(C)OC1CCCCCCC1 34a_100000210054_100009817358 [0,1,0,1,0,0|1,0,0]=3 23147 B16R1.14929 COC(=O)CC(C)OC1CCCCCCC1 7a_100000210054_100009817358 [0,1,0,1,0,0|1,0,0]=3 23148 B16R1.14929 COC(=O)C[C@@H](O)CN1CCCCCCC1 34a_100000211400_100000754131 [0,1,0,1,0,0|1,0,0]=3 23149 B16R1.15621 CCCCC1CCCC1N(C)CC(=O)NC 270004a_100000189611_100000750825 [0,1,0,1,0,0|2,0,0]=4 23150 B16R1.15621 CCCCC1CCCC1N(C)CC(=O)OC 270004a_100000198492_100000750825 [0,1,0,1,0,0|1,0,0]=3 23151 B16R1.17220 COC(=O)CC(C)OCCC1CCCN1C 34a_100011215177_100009817358 [0,1,0,1,0,0|2,0,0]=4 23152 B16R1.17220 COC(=O)CC(C)OCCC1CCCN1C 7a_100011215177_100009817358 [0,1,0,1,0,0|2,0,0]=4 23153 B16R1.17220 COC(=O)CC(C)SCCC1CCCN1C 62a_100000005710_100009817358 [0,1,0,1,0,0|2,0,0]=4 23154 B16R1.17220 COC(=O)CC(C)SCCC1CCCN1C 62a_100009817358_100000005710 [0,1,0,1,0,0|2,0,0]=4 23155 B16R1.17220 COC(=O)C[C@@H](O)COCC1CCCN1C 34a_100000743107_100000754131 [0,1,0,1,0,0|2,0,0]=4 23156 B16R2.132 O=C1CCC(CC1)COC2CCCCC2 34a_100000062911_100000210327 [0,0,0,2,0,0|2,0,0]=4 23157 B16R2.132 O=C1CCC(CC1)OCC2CCCCC2 34a_100000764474_100000211423 [0,0,0,2,0,0|2,0,0]=4 23158 B16R2.132 O=C1CCC(CC1)OCC2CCCCC2 7a_100000764474_100000211423 [0,0,0,2,0,0|2,0,0]=4 23159 B16R2.132 O=C1CCC(CN1)NCC2CCCCC2 2230a_100000748762_100000211423 [0,0,0,2,0,0|2,0,0]=4 23160 B16R2.132 O=C1CCC(CN1)NCC2CCCCC2 269862a_100000748762_100000211278 [0,0,0,2,0,0|2,0,0]=4 23161 B16R2.132 O=C1CCC(CN1)NCC2CCCCC2 34a_100000748762_100000211423 [0,0,0,2,0,0|2,0,0]=4 23162 B16R2.132 O=C1CCC(CN1)OCC2CCCCC2 34a_100000079199_100000211423 [0,0,0,2,0,0|2,0,0]=4 23163 B16R2.135 O=C1CCC(CC1)COCC2CCCC2 34a_100000062911_100000740388 [0,0,0,2,0,0|2,0,0]=4 23164 B16R2.135 O=C1CCC(CC1)OCCC2CCCC2 34a_100000764474_100000760354 [0,0,0,2,0,0|2,0,0]=4 23165 B16R2.135 O=C1CCC(CC1)OCCC2CCCC2 7a_100000764474_100000760354 [0,0,0,2,0,0|2,0,0]=4 23166 B16R2.135 O=C1CCC(CN1)NCCC2CCCC2 2230a_100000748762_100000760354 [0,0,0,2,0,0|2,0,0]=4 23167 B16R2.135 O=C1CCC(CN1)NCCC2CCCC2 34a_100000748762_100000760354 [0,0,0,2,0,0|2,0,0]=4 23168 B16R2.135 O=C1CCC(CN1)OCCC2CCCC2 34a_100000079199_100000760354 [0,0,0,2,0,0|2,0,0]=4 23169 B16R2.1129 CC1CCCCC1NC2CCC(=O)NC2 269862a_100000748762_100000210921 [0,0,0,2,0,0|2,0,0]=4 23170 B16R2.1129 CC1CCCCC1NC2CCC(=O)NC2 270004a_100000748762_100000210921 [0,0,0,2,0,0|2,0,0]=4 23171 B16R2.2244 CCC1CCCC1NC2CCC(=O)NC2 269862a_100000748762_100000749056 [0,0,0,2,0,0|2,0,0]=4 23172 B16R2.2244 CCC1CCCC1NC2CCC(=O)NC2 270004a_100000748762_100000749056 [0,0,0,2,0,0|2,0,0]=4 23173 B16R2.33330 O=C1CCC(CC1)OC2CCCCCC2 34a_100000764474_100011217769 [0,0,0,2,0,0|2,0,0]=4 23174 B16R2.33330 O=C1CCC(CN1)NC2CCCCCC2 270004a_100000748762_100000210131 [0,0,0,2,0,0|2,0,0]=4 23175 B16R2.33330 O=C1CCC(CN1)NC2CCCCCC2 34a_100000748762_100011217769 [0,0,0,2,0,0|2,0,0]=4 23176 B16R2.33330 O=C1CCC(CN1)OC2CCCCCC2 34a_100000079199_100011217769 [0,0,0,2,0,0|2,0,0]=4 23177 B16R2.2925 CN1C(=O)CCCC1CNC2CCCC2 2230a_200010383782_100000179811 [0,0,0,2,0,0|2,0,0]=4 23178 B16R2.2925 CN1C(=O)CCCC1CNC2CCCC2 270004a_200010383782_100000210133 [0,0,0,2,0,0|2,0,0]=4 23179 B16R2.2925 CN1C(=O)CCCC1CNC2CCCC2 34a_200010383782_100000179811 [0,0,0,2,0,0|2,0,0]=4 23180 B16R2.11948 CN1C(=O)CCCC1CNCCC2CC2 2230a_200010383782_100000694398 [0,0,0,2,0,0|2,0,0]=4 23181 B16R2.11948 CN1C(=O)CCCC1CNCCC2CC2 34a_200010383782_100000694398 [0,0,0,2,0,0|2,0,0]=4 23182 B16R2.11961 CN1C(=O)CCCC1CNCC2CCC2 2230a_200010383782_100000763275 [0,0,0,2,0,0|2,0,0]=4 23183 B16R2.11961 CN1C(=O)CCCC1CNCC2CCC2 269862a_200010383782_100000753134 [0,0,0,2,0,0|2,0,0]=4 23184 B16R2.11961 CN1C(=O)CCCC1CNCC2CCC2 34a_200010383782_100000763275 [0,0,0,2,0,0|2,0,0]=4 23185 B16R2.55 CCCC1CCCCN1C2COC(=O)O2 34a_100000701414_100000032252 [0,0,0,2,0,0|2,0,0]=4 23186 B16R2.60 CCCC1CCCC1NC2CNC(=O)C2 269862a_100000697751_100000723119 [0,0,0,2,0,0|2,0,0]=4 23187 B16R2.173 CCC1CCCCC1NC2CNC(=O)C2 269862a_100000697751_100000757040 [0,0,0,2,0,0|2,0,0]=4 23188 B16R2.173 CCC1CCCCC1OC2COC(=O)O2 34a_100000210738_100000032252 [0,0,0,2,0,0|2,0,0]=4 23189 B16R2.173 CCC1CCCCN1CC2COC(=O)O2 269982a_100000210034_100000073702 [0,0,0,2,0,0|2,0,0]=4 23190 B16R2.173 CCC1CCCCN1CC2COC(=O)O2 34a_100000210034_100000073702 [0,0,0,2,0,0|2,0,0]=4 23191 B16R2.173 CCC1CCCCN1C[C@H]2COC(=O)N2 2230a_100000210034_100015307671 [0,0,0,2,0,0|2,0,0]=4 23192 B16R2.173 CCC1CCCCN1C[C@H]2COC(=O)N2 269982a_100000210034_100015307671 [0,0,0,2,0,0|2,0,0]=4 23193 B16R2.173 CCC1CCCCN1C[C@H]2COC(=O)N2 34a_100000210034_100015307671 [0,0,0,2,0,0|2,0,0]=4 23194 B16R2.1513 CCC1CCCC1NCC2CNC(=O)C2 269862a_100016993742_100000749056 [0,0,0,2,0,0|2,0,0]=4 23195 B16R2.2832 O=C1CC(CN1)CNCC2CCCCC2 2230a_100016993742_100000211423 [0,0,0,2,0,0|2,0,0]=4 23196 B16R2.2832 O=C1CC(CN1)CNCC2CCCCC2 269862a_100016993742_100000211278 [0,0,0,2,0,0|2,0,0]=4 23197 B16R2.2832 O=C1CC(CN1)CNCC2CCCCC2 34a_100016993742_100000211423 [0,0,0,2,0,0|2,0,0]=4 23198 B16R2.2832 O=C1CC(CN1)COCC2CCCCC2 34a_100016041077_100000211423 [0,0,0,2,0,0|2,0,0]=4 23199 B16R2.2832 O=C1CC(CN1)NCCC2CCCCC2 2230a_100000697751_100012355289 [0,0,0,2,0,0|2,0,0]=4 23200 B16R2.2832 O=C1CC(CN1)OCCC2CCCCC2 34a_100000690082_100011209188 [0,0,0,2,0,0|2,0,0]=4 23201 B16R2.2832 O=C1CCC(C1)OCCC2CCCCC2 34a_100012614533_100011209188 [0,0,0,2,0,0|2,0,0]=4 23202 B16R2.2832 O=C1CN(CN1)CCCC2CCCCC2 2230a_200000708111_100011713725 [0,0,0,2,0,0|2,0,0]=4 23203 B16R2.2832 O=C1N[C@H](CO1)CNCC2CCCCC2 2230a_100000210473_100015307671 [0,0,0,2,0,0|2,0,0]=4 23204 B16R2.2832 O=C1N[C@H](CO1)CNCC2CCCCC2 34a_100000210473_100015307671 [0,0,0,2,0,0|2,0,0]=4 23205 B16R2.2832 O=C1N[C@H](CO1)COCC2CCCCC2 34a_100000212181_100015307671 [0,0,0,2,0,0|2,0,0]=4 23206 B16R2.2832 O=C1N[C@H](CO1)COCC2CCCCC2 7a_100000212181_100015307671 [0,0,0,2,0,0|2,0,0]=4 23207 B16R2.2832 O=C1N[C@H](CO1)CSCC2CCCCC2 62a_100000211423_100015307671 [0,0,0,2,0,0|2,0,0]=4 23208 B16R2.2832 O=C1N[C@H](CO1)CSCC2CCCCC2 62a_100015307671_100000211423 [0,0,0,2,0,0|2,0,0]=4 23209 B16R2.2832 O=C1OCC(O1)CNCC2CCCCC2 34a_100000210473_100000073702 [0,0,0,2,0,0|2,0,0]=4 23210 B16R2.2832 O=C1OCC(O1)COCC2CCCCC2 34a_100000212181_100000073702 [0,0,0,2,0,0|2,0,0]=4 23211 B16R2.2832 O=C1OCC(O1)CSCC2CCCCC2 62a_100000073702_100000211423 [0,0,0,2,0,0|2,0,0]=4 23212 B16R2.2832 O=C1OCC(O1)CSCC2CCCCC2 62a_100000211423_100000073702 [0,0,0,2,0,0|2,0,0]=4 23213 B16R2.2832 O=C1OCC(O1)NCCC2CCCCC2 34a_100000738074_100000032252 [0,0,0,2,0,0|2,0,0]=4 23214 B16R2.2832 O=C1OCC(O1)OCCC2CCCCC2 34a_100011217863_100000032252 [0,0,0,2,0,0|2,0,0]=4 23215 B16R2.2832 O=C1OCC(O1)SCCC2CCCCC2 62a_100012355289_100000032252 [0,0,0,2,0,0|2,0,0]=4 23216 B16R2.2842 O=C1CC(CN1)CNCCC2CCCC2 2230a_100016993742_100000760354 [0,0,0,2,0,0|2,0,0]=4 23217 B16R2.2842 O=C1CC(CN1)CNCCC2CCCC2 34a_100016993742_100000760354 [0,0,0,2,0,0|2,0,0]=4 23218 B16R2.2842 O=C1CC(CN1)COCCC2CCCC2 34a_100016041077_100000760354 [0,0,0,2,0,0|2,0,0]=4 23219 B16R2.2842 O=C1CC(CN1)NCCCC2CCCC2 2230a_100000697751_100011713738 [0,0,0,2,0,0|2,0,0]=4 23220 B16R2.2842 O=C1CC(CN1)OCCCC2CCCC2 34a_100000690082_100011713738 [0,0,0,2,0,0|2,0,0]=4 23221 B16R2.2842 O=C1CCC(C1)OCCCC2CCCC2 34a_100012614533_100011713738 [0,0,0,2,0,0|2,0,0]=4 23222 B16R2.2842 O=C1N[C@H](CO1)CNCCC2CCCC2 2230a_100000739158_100015307671 [0,0,0,2,0,0|2,0,0]=4 23223 B16R2.2842 O=C1N[C@H](CO1)CNCCC2CCCC2 34a_100000739158_100015307671 [0,0,0,2,0,0|2,0,0]=4 23224 B16R2.2842 O=C1N[C@H](CO1)COCCC2CCCC2 34a_100000749090_100015307671 [0,0,0,2,0,0|2,0,0]=4 23225 B16R2.2842 O=C1N[C@H](CO1)COCCC2CCCC2 7a_100000749090_100015307671 [0,0,0,2,0,0|2,0,0]=4 23226 B16R2.2842 O=C1N[C@H](CO1)CSCCC2CCCC2 62a_100000760354_100015307671 [0,0,0,2,0,0|2,0,0]=4 23227 B16R2.2842 O=C1N[C@H](CO1)CSCCC2CCCC2 62a_100015307671_100000760354 [0,0,0,2,0,0|2,0,0]=4 23228 B16R2.2842 O=C1OCC(O1)CNCCC2CCCC2 34a_100000739158_100000073702 [0,0,0,2,0,0|2,0,0]=4 23229 B16R2.2842 O=C1OCC(O1)COCCC2CCCC2 34a_100000749090_100000073702 [0,0,0,2,0,0|2,0,0]=4 23230 B16R2.2842 O=C1OCC(O1)CSCCC2CCCC2 62a_100000073702_100000760354 [0,0,0,2,0,0|2,0,0]=4 23231 B16R2.2842 O=C1OCC(O1)CSCCC2CCCC2 62a_100000760354_100000073702 [0,0,0,2,0,0|2,0,0]=4 23232 B16R2.2842 O=C1OCC(O1)NCCCC2CCCC2 34a_100000736752_100000032252 [0,0,0,2,0,0|2,0,0]=4 23233 B16R2.2842 O=C1OCC(O1)OCCCC2CCCC2 34a_100011215328_100000032252 [0,0,0,2,0,0|2,0,0]=4 23234 B16R2.2842 O=C1OCC(O1)SCCCC2CCCC2 62a_100011713738_100000032252 [0,0,0,2,0,0|2,0,0]=4 23235 B16R2.11407 O=C1CC(CN1)CNC2CCCCCC2 34a_100016993742_100011217769 [0,0,0,2,0,0|2,0,0]=4 23236 B16R2.11407 O=C1CC(CN1)COC2CCCCCC2 34a_100016041077_100011217769 [0,0,0,2,0,0|2,0,0]=4 23237 B16R2.11407 O=C1CC(CN1)NCC2CCCCCC2 2230a_100000697751_200000696569 [0,0,0,2,0,0|2,0,0]=4 23238 B16R2.11407 O=C1CC(CN1)NCC2CCCCCC2 269862a_100000697751_200000763224 [0,0,0,2,0,0|2,0,0]=4 23239 B16R2.11407 O=C1CC(CN1)OCC2CCCCCC2 34a_100000690082_200000696569 [0,0,0,2,0,0|2,0,0]=4 23240 B16R2.11407 O=C1CCC(C1)OCC2CCCCCC2 34a_100012614533_200000696569 [0,0,0,2,0,0|2,0,0]=4 23241 B16R2.11407 O=C1N[C@H](CO1)CNC2CCCCCC2 2230a_100000210984_100015307671 [0,0,0,2,0,0|2,0,0]=4 23242 B16R2.11407 O=C1N[C@H](CO1)CNC2CCCCCC2 34a_100000210984_100015307671 [0,0,0,2,0,0|2,0,0]=4 23243 B16R2.11407 O=C1N[C@H](CO1)COC2CCCCCC2 34a_100000210887_100015307671 [0,0,0,2,0,0|2,0,0]=4 23244 B16R2.11407 O=C1N[C@H](CO1)COC2CCCCCC2 7a_100000210887_100015307671 [0,0,0,2,0,0|2,0,0]=4 23245 B16R2.11407 O=C1N[C@H](CO1)CSC2CCCCCC2 62a_100011217769_100015307671 [0,0,0,2,0,0|2,0,0]=4 23246 B16R2.11407 O=C1N[C@H](CO1)CSC2CCCCCC2 62a_100015307671_100011217769 [0,0,0,2,0,0|2,0,0]=4 23247 B16R2.11407 O=C1OCC(O1)CNC2CCCCCC2 34a_100000210984_100000073702 [0,0,0,2,0,0|2,0,0]=4 23248 B16R2.11407 O=C1OCC(O1)COC2CCCCCC2 34a_100000210887_100000073702 [0,0,0,2,0,0|2,0,0]=4 23249 B16R2.11407 O=C1OCC(O1)CSC2CCCCCC2 62a_100000073702_100011217769 [0,0,0,2,0,0|2,0,0]=4 23250 B16R2.11407 O=C1OCC(O1)CSC2CCCCCC2 62a_100011217769_100000073702 [0,0,0,2,0,0|2,0,0]=4 23251 B16R2.11407 O=C1OCC(O1)NCC2CCCCCC2 34a_100015204231_100000032252 [0,0,0,2,0,0|2,0,0]=4 23252 B16R2.11407 O=C1OCC(O1)OCC2CCCCCC2 34a_100000699130_100000032252 [0,0,0,2,0,0|2,0,0]=4 23253 B16R2.11407 O=C1OCC(O1)SCC2CCCCCC2 62a_200000696569_100000032252 [0,0,0,2,0,0|2,0,0]=4 23254 B16R2.11414 CC1CCCCC1NCC2CNC(=O)C2 269862a_100016993742_100000210921 [0,0,0,2,0,0|2,0,0]=4 23255 B16R2.11414 CC1CCCCC1NCC2COC(=O)O2 34a_100000211402_100000073702 [0,0,0,2,0,0|2,0,0]=4 23256 B16R2.11414 CC1CCCCC1NC[C@H]2COC(=O)N2 2230a_100000211402_100015307671 [0,0,0,2,0,0|2,0,0]=4 23257 B16R2.11414 CC1CCCCC1NC[C@H]2COC(=O)N2 34a_100000211402_100015307671 [0,0,0,2,0,0|2,0,0]=4 23258 B16R2.11414 CC1CCCCC1OCC2COC(=O)O2 34a_100000211207_100000073702 [0,0,0,2,0,0|2,0,0]=4 23259 B16R2.11414 CC1CCCCC1OC[C@H]2COC(=O)N2 34a_100000211207_100015307671 [0,0,0,2,0,0|2,0,0]=4 23260 B16R2.11414 CC1CCCCC1OC[C@H]2COC(=O)N2 7a_100000211207_100015307671 [0,0,0,2,0,0|2,0,0]=4 23261 B16R2.11458 O=C1OCC(O1)N2CCCCCCCC2 34a_100000039187_100000032252 [0,0,0,2,0,0|2,0,0]=4 23262 B16R2.11527 O=C1N[C@H](CO1)CN2CCCCCCC2 2230a_100000211400_100015307671 [0,0,0,2,0,0|2,0,0]=4 23263 B16R2.11527 O=C1N[C@H](CO1)CN2CCCCCCC2 269982a_100000211400_100015307671 [0,0,0,2,0,0|2,0,0]=4 23264 B16R2.11527 O=C1N[C@H](CO1)CN2CCCCCCC2 34a_100000211400_100015307671 [0,0,0,2,0,0|2,0,0]=4 23265 B16R2.11527 O=C1OCC(O1)CN2CCCCCCC2 269982a_100000211400_100000073702 [0,0,0,2,0,0|2,0,0]=4 23266 B16R2.11527 O=C1OCC(O1)CN2CCCCCCC2 34a_100000211400_100000073702 [0,0,0,2,0,0|2,0,0]=4 23267 B16R2.11527 O=C1OCC(O1)NC2CCCCCCC2 34a_100000211152_100000032252 [0,0,0,2,0,0|2,0,0]=4 23268 B16R2.11527 O=C1OCC(O1)OC2CCCCCCC2 34a_100000210054_100000032252 [0,0,0,2,0,0|2,0,0]=4 23269 B16R2.2468 CCC1CCCCN1CCC2CCC2=O 2230a_100000210034_200016118888 [0,0,0,2,0,0|2,0,0]=4 23270 B16R2.2468 CCC1CCCCN1CCC2CCC2=O 269982a_100000210034_200016118888 [0,0,0,2,0,0|2,0,0]=4 23271 B16R2.5347 CCC(=O)CN1CCC2CCCCC2C1 269982a_100000211783_100000747405 [0,0,0,2,0,0|2,0,0]=4 23272 B16R2.5347 CNC(=O)CN1CCC2CCCCC2C1 2230a_100000211783_100000183359 [0,0,0,2,0,0|2,0,0]=4 23273 B16R2.5347 CNC(=O)CN1CCC2CCCCC2C1 269982a_100000211783_100000183359 [0,0,0,2,0,0|2,0,0]=4 23274 B16R2.5347 CNC(=O)CN1CCC2CCCCC2C1 34a_100000211783_100000183359 [0,0,0,2,0,0|2,0,0]=4 23275 B16R2.5347 COC(=O)CN1CCC2CCCCC2C1 2230a_100000211783_100000747449 [0,0,0,2,0,0|1,0,0]=3 23276 B16R2.5347 COC(=O)CN1CCC2CCCCC2C1 269982a_100000211783_100000747449 [0,0,0,2,0,0|1,0,0]=3 23277 B16R2.5347 COC(=O)CN1CCC2CCCCC2C1 34a_100000211783_100000747449 [0,0,0,2,0,0|1,0,0]=3 23278 B16R2.5347 COC(=O)CN1CCN2CCCCC2C1 2230a_100000746566_100000747449 [0,0,0,2,0,0|2,0,0]=4 23279 B16R2.5347 COC(=O)CN1CCN2CCCCC2C1 269982a_100000746566_100000747449 [0,0,0,2,0,0|2,0,0]=4 23280 B16R2.5347 COC(=O)CN1CCN2CCCCC2C1 34a_100000746566_100000747449 [0,0,0,2,0,0|2,0,0]=4 23281 B16R2.7893 CCC1CCCCC1N2CC2C(=O)OC 270004a_200009830135_100000757040 [0,0,0,2,0,0|1,0,0]=3 23282 B16R2.7893 COC(=O)C1CN1C2CCCCC2CO 270004a_200009830135_100009861125 [0,0,0,2,0,0|2,0,0]=4 23283 B16R2.7893 COC(=O)C1CN1C2CCCCC2OC 270004a_200009830135_100000740605 [0,0,0,2,0,0|2,0,0]=4 23284 B16R2.33851 CNC(=O)CCCN1CC2CCC1CC2 2230a_100000750499_100000741757 [0,0,0,2,0,0|2,0,0]=4 23285 B16R2.33851 CNC(=O)CCCN1CC2CCC1CC2 269982a_100000750499_100000741757 [0,0,0,2,0,0|2,0,0]=4 23286 B16R2.33851 CNC(=O)CCCN1CC2CCC1CC2 34a_100000750499_100000741757 [0,0,0,2,0,0|2,0,0]=4 23287 B16R2.33851 COC(=O)CCCN1CC2CCC1CC2 2230a_100000750499_100011218270 [0,0,0,2,0,0|1,0,0]=3 23288 B16R2.33851 COC(=O)CCCN1CC2CCC1CC2 269982a_100000750499_100011218270 [0,0,0,2,0,0|1,0,0]=3 23289 B16R2.33851 COC(=O)CCCN1CC2CCC1CC2 34a_100000750499_100000742333 [0,0,0,2,0,0|1,0,0]=3 23290 B16R2.33851 COC(=O)CCN[C@H]1CN2CCC1CC2 2230a_100016987387_100000204255 [0,0,0,2,0,0|2,0,0]=4 23291 B16R2.35322 COC(=O)CCCN1C2CCC1COC2 2230a_100015205251_100011218270 [0,0,0,2,0,0|2,0,0]=4 23292 B16R2.35322 COC(=O)CCCN1C2CCC1COC2 269982a_100015205251_100011218270 [0,0,0,2,0,0|2,0,0]=4 23293 B16R2.35322 COC(=O)CCCN1C2CCC1COC2 34a_100015205251_100000742333 [0,0,0,2,0,0|2,0,0]=4 23294 B16R2.148 CCC(=O)N1CCCC1C2CCCCC2 11a_100011206067_100000210414 [0,0,0,2,0,0|2,0,0]=4 23295 B16R2.148 CCC(=O)N1CCCC1C2CCCCC2 1626a_100011206067_100000210414 [0,0,0,2,0,0|2,0,0]=4 23296 B16R2.148 CCC(=O)N1CCCC1C2CCCCC2 240690a_100011206067_100000210414 [0,0,0,2,0,0|2,0,0]=4 23297 B16R2.148 CCC(=O)N1CCCC1C2CCCCC2 527a_100011206067_100000210414 [0,0,0,2,0,0|2,0,0]=4 23298 B16R2.148 CNC(=O)N1CCCC1C2CCCCC2 2708a_100102657272_100011206067 [0,0,0,2,0,0|2,0,0]=4 23299 B16R2.148 CNC(=O)N1CCCC1C2CCCCC2 273464a_100102657272_100011206067 [0,0,0,2,0,0|2,0,0]=4 23300 B16R2.148 CNC(=O)[C@@H]1CCCN1C2CCCCC2 269982a_100015185040_100000210327 [0,0,0,2,0,0|2,0,0]=4 23301 B16R2.148 CNC(=O)[C@@H]1CCCN1C2CCCCC2 270004a_100015185040_100000210434 [0,0,0,2,0,0|2,0,0]=4 23302 B16R2.148 CNC(=O)[C@@H]1CCCN1C2CCCCC2 34a_100015185040_100000210327 [0,0,0,2,0,0|2,0,0]=4 23303 B16R2.148 COC(=O)C1CSCN1C2CCCCC2 269982a_200000724679_100000210327 [0,0,0,2,0,0|2,0,0]=4 23304 B16R2.148 COC(=O)C1CSCN1C2CCCCC2 270004a_200000724679_100000210434 [0,0,0,2,0,0|2,0,0]=4 23305 B16R2.148 COC(=O)C1SCCN1C2CCCCC2 269982a_100015296106_100000210327 [0,0,0,2,0,0|2,0,0]=4 23306 B16R2.148 COC(=O)C1SCCN1C2CCCCC2 270004a_100015296106_100000210434 [0,0,0,2,0,0|2,0,0]=4 23307 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCCCC2 269982a_100000752040_100000210327 [0,0,0,2,0,0|1,0,0]=3 23308 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCCCC2 270004a_100000752040_100000210434 [0,0,0,2,0,0|1,0,0]=3 23309 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCCOC2 269982a_100000752040_100000693364 [0,0,0,2,0,0|2,0,0]=4 23310 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCCOC2 270004a_100000752040_100000753404 [0,0,0,2,0,0|2,0,0]=4 23311 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCCSC2 270004a_100000752040_100000057913 [0,0,0,2,0,0|2,0,0]=4 23312 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCNCC2 270004a_100000752040_100015192401 [0,0,0,2,0,0|2,0,0]=4 23313 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCOCC2 269982a_100000752040_100011324220 [0,0,0,2,0,0|2,0,0]=4 23314 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCOCC2 270004a_100000752040_100011217826 [0,0,0,2,0,0|2,0,0]=4 23315 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCSCC2 269982a_100000752040_100000069128 [0,0,0,2,0,0|2,0,0]=4 23316 B16R2.148 COC(=O)[C@@H]1CCCN1C2CCSCC2 270004a_100000752040_100000203788 [0,0,0,2,0,0|2,0,0]=4 23317 B16R2.1222 CNC(=O)[C@@H]1CCCN1CC2CCCC2 2230a_100015185040_100000740388 [0,0,0,2,0,0|2,0,0]=4 23318 B16R2.1222 CNC(=O)[C@@H]1CCCN1CC2CCCC2 269982a_100015185040_100000740388 [0,0,0,2,0,0|2,0,0]=4 23319 B16R2.1222 CNC(=O)[C@@H]1CCCN1CC2CCCC2 34a_100015185040_100000740388 [0,0,0,2,0,0|2,0,0]=4 23320 B16R2.1222 COC(=O)C1CCCC1OC2CCCC2 34a_200000081814_100000179811 [0,0,0,2,0,0|1,0,0]=3 23321 B16R2.1222 COC(=O)C1CCCC1OC2CCCC2 7a_200000081814_100000179811 [0,0,0,2,0,0|1,0,0]=3 23322 B16R2.1222 COC(=O)C1CCCC1OC2CCOC2 34a_200000081814_100000690089 [0,0,0,2,0,0|2,0,0]=4 23323 B16R2.1222 COC(=O)C1CCCC1OC2CCOC2 7a_200000081814_100000731011 [0,0,0,2,0,0|2,0,0]=4 23324 B16R2.1222 COC(=O)C1CSCN1CC2CCCC2 269982a_200000724679_100000740388 [0,0,0,2,0,0|2,0,0]=4 23325 B16R2.1222 COC(=O)C1SCCN1CC2CCCC2 2230a_100015296106_100000740388 [0,0,0,2,0,0|2,0,0]=4 23326 B16R2.1222 COC(=O)C1SCCN1CC2CCCC2 269982a_100015296106_100000740388 [0,0,0,2,0,0|2,0,0]=4 23327 B16R2.1222 COC(=O)[C@@H]1CCCN1CC2CCCC2 2230a_100000752040_100000740388 [0,0,0,2,0,0|1,0,0]=3 23328 B16R2.1222 COC(=O)[C@@H]1CCCN1CC2CCCC2 269982a_100000752040_100000740388 [0,0,0,2,0,0|1,0,0]=3 23329 B16R2.1222 COC(=O)[C@@H]1CCCN1CC2CCCO2 2230a_100000752040_100000203698 [0,0,0,2,0,0|2,0,0]=4 23330 B16R2.1222 COC(=O)[C@@H]1CCCN1CC2CCCO2 269982a_100000752040_100000183445 [0,0,0,2,0,0|2,0,0]=4 23331 B16R2.1222 COC(=O)[C@@H]1CCCN1CC2CCOC2 2230a_100000752040_100000702531 [0,0,0,2,0,0|2,0,0]=4 23332 B16R2.1222 COC(=O)[C@@H]1CCCN1CC2CCOC2 269982a_100000752040_100000702531 [0,0,0,2,0,0|2,0,0]=4 23333 B16R2.1258 COC(=O)[C@@H]1CCCN1C2CCOC2C 270004a_100000752040_100000691750 [0,0,0,2,0,0|2,0,0]=4 23334 B16R2.1258 COC(=O)[C@@H]1CCCN1[C@@H]2CCC[C@H]2O 269982a_100000752040_200016002552 [0,0,0,2,0,0|2,0,0]=4 23335 B16R2.34273 COC(=O)C1CCCC1OCCC2CC2 34a_200000081814_100000694398 [0,0,0,2,0,0|1,0,0]=3 23336 B16R2.34273 COC(=O)C1CCCC1OCCC2CC2 7a_200000081814_100000764125 [0,0,0,2,0,0|1,0,0]=3 23337 B16R2.34273 COC(=O)C1CCCC1OCCC2CO2 34a_200000081814_100000732470 [0,0,0,2,0,0|2,0,0]=4 23338 B16R2.34273 COC(=O)C1CCCC1OCCC2CO2 7a_200000081814_100000732470 [0,0,0,2,0,0|2,0,0]=4 23339 B16R2.34273 COC(=O)[C@@H]1CCCN1CCCC2CO2 2230a_100000752040_100000733510 [0,0,0,2,0,0|2,0,0]=4 23340 B16R2.34273 COC(=O)[C@@H]1CCCN1CCCC2CO2 269982a_100000752040_100000733510 [0,0,0,2,0,0|2,0,0]=4 23341 B16R2.34292 COC(=O)C1CCCC1OCC2CCC2 34a_200000081814_100000763275 [0,0,0,2,0,0|1,0,0]=3 23342 B16R2.34292 COC(=O)C1CCCC1OCC2CCC2 7a_200000081814_100000763275 [0,0,0,2,0,0|1,0,0]=3 23343 B16R2.34292 COC(=O)C1CCCC1OCC2CCO2 34a_200000081814_100000103362 [0,0,0,2,0,0|2,0,0]=4 23344 B16R2.34292 COC(=O)C1CCCC1OCC2CCO2 7a_200000081814_100000103362 [0,0,0,2,0,0|2,0,0]=4 23345 B16R2.34292 COC(=O)C1CCCC1OCC2COC2 34a_200000081814_100010264016 [0,0,0,2,0,0|2,0,0]=4 23346 B16R2.34292 COC(=O)C1CCCC1OCC2COC2 7a_200000081814_100010264016 [0,0,0,2,0,0|2,0,0]=4 23347 B16R2.602 CCCC1CCCCC1OC2CCC2=O 34a_100011217265_100009892977 [0,0,0,2,0,0|2,0,0]=4 23348 B16R2.602 CCCC1CCCCC1OC2CCC2=O 7a_100011217265_100009892977 [0,0,0,2,0,0|2,0,0]=4 23349 B16R2.6152 CCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 2230a_100102885509_100000210202 [0,0,0,2,0,0|1,0,0]=3 23350 B16R2.6152 CCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 269982a_100102885509_100000204670 [0,0,0,2,0,0|1,0,0]=3 23351 B16R2.6152 CCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 34a_100102885509_100000210202 [0,0,0,2,0,0|1,0,0]=3 23352 B16R2.6152 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CF 269982a_100102885509_100015361967 [0,0,0,2,0,0|2,0,0]=4 23353 B16R2.6152 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CF 34a_100102885509_100015361967 [0,0,0,2,0,0|2,0,0]=4 23354 B16R2.170412 CCC(=O)CN1CCCC2C1CCCC2 269982a_100000211887_100000747405 [0,0,0,2,0,0|2,0,0]=4 23355 B16R2.170412 CNC(=O)CN1CCCC2C1CCCC2 2230a_100000211887_100000183359 [0,0,0,2,0,0|2,0,0]=4 23356 B16R2.170412 CNC(=O)CN1CCCC2C1CCCC2 269982a_100000211887_100000183359 [0,0,0,2,0,0|2,0,0]=4 23357 B16R2.170412 CNC(=O)CN1CCCC2C1CCCC2 34a_100000211887_100000183359 [0,0,0,2,0,0|2,0,0]=4 23358 B16R2.170412 COC(=O)CN1CCCC2C1CCCC2 2230a_100000211887_100000747449 [0,0,0,2,0,0|1,0,0]=3 23359 B16R2.170412 COC(=O)CN1CCCC2C1CCCC2 269982a_100000211887_100000747449 [0,0,0,2,0,0|1,0,0]=3 23360 B16R2.170412 COC(=O)CN1CCCC2C1CCCC2 34a_100000211887_100000747449 [0,0,0,2,0,0|1,0,0]=3 23361 B16R2.170412 COC(=O)CN1CCOC2C1CCCC2 2230a_200000741227_100000747449 [0,0,0,2,0,0|2,0,0]=4 23362 B16R2.170412 COC(=O)CN1CCOC2C1CCCC2 269982a_200000741227_100000747449 [0,0,0,2,0,0|2,0,0]=4 23363 B16R2.170412 COC(=O)CN1CCOC2C1CCCC2 34a_200000741227_100000747449 [0,0,0,2,0,0|2,0,0]=4 23364 B16R2.28942 CCCC1CCCC1N2CC2C(=O)OC 270004a_200009830135_100000723119 [0,0,0,2,0,0|1,0,0]=3 23365 B16R2.33849 COC(=O)CCCN1C[C@@H]2C[C@H]1CN2C 2230a_100025763010_100011218270 [0,0,0,2,0,0|2,0,0]=4 23366 B16R2.33849 COC(=O)CCCN1C[C@@H]2C[C@H]1CN2C 269982a_100025763010_100011218270 [0,0,0,2,0,0|2,0,0]=4 23367 B16R2.34310 COC(=O)CN1CC2CCCN2CC1C 2230a_200159271516_100000747449 [0,0,0,2,0,0|2,0,0]=4 23368 B16R2.34310 COC(=O)CN1CC2CCCN2CC1C 269982a_200159271516_100000747449 [0,0,0,2,0,0|2,0,0]=4 23369 B16R2.34310 COC(=O)CN1CC2CCCN2CC1C 34a_200159271516_100000747449 [0,0,0,2,0,0|2,0,0]=4 23370 B16R2.35297 CNC(=O)CCCN1CCCC1C2CC2 2230a_200000757794_100000741757 [0,0,0,2,0,0|2,0,0]=4 23371 B16R2.35297 CNC(=O)CCCN1CCCC1C2CC2 269982a_200000757794_100000741757 [0,0,0,2,0,0|2,0,0]=4 23372 B16R2.35297 CNC(=O)CCCN1CCCC1C2CC2 34a_200000757794_100000741757 [0,0,0,2,0,0|2,0,0]=4 23373 B16R2.35297 COC(=O)CCCN1CCCC1C2CC2 2230a_200000757794_100011218270 [0,0,0,2,0,0|1,0,0]=3 23374 B16R2.35297 COC(=O)CCCN1CCCC1C2CC2 269982a_200000757794_100011218270 [0,0,0,2,0,0|1,0,0]=3 23375 B16R2.35297 COC(=O)CCCN1CCCC1C2CC2 34a_200000757794_100000742333 [0,0,0,2,0,0|1,0,0]=3 23376 B16R2.181944 CNC(=O)CNCC12CCCC1CCC2 2230a_100159271432_100000183359 [0,0,0,2,0,0|2,0,0]=4 23377 B16R2.181944 CNC(=O)CNCC12CCCC1CCC2 34a_100159271432_100000183359 [0,0,0,2,0,0|2,0,0]=4 23378 B16R2.181944 COC(=O)CNCC12CCCC1CCC2 2230a_100159271432_100000747449 [0,0,0,2,0,0|1,0,0]=3 23379 B16R2.181944 COC(=O)CNCC12CCCC1CCC2 34a_100159271432_100000747449 [0,0,0,2,0,0|1,0,0]=3 23380 B16R2.181944 COC(=O)COCC12CCCN1CCC2 34a_100000722608_100000747449 [0,0,0,2,0,0|2,0,0]=4 23381 B16R2.181944 COC(=O)COCC12CCCN1CCC2 7a_100000722608_100000747449 [0,0,0,2,0,0|2,0,0]=4 23382 B16R2.36024 CCN1C[C@H]2C[C@@H]1CN2CCC(=O)OC 2230a_200016994038_100000204255 [0,0,0,2,0,0|2,0,0]=4 23383 B16R2.36024 CCN1C[C@H]2C[C@@H]1CN2CCC(=O)OC 269982a_200016994038_100000204255 [0,0,0,2,0,0|2,0,0]=4 23384 B16R2.279 O=C1CCC1CCNCC2CCCCC2 2230a_100000210473_200016118888 [0,0,0,2,0,0|2,0,0]=4 23385 B16R2.279 O=C1CCC1CCOCC2CCCCC2 7a_100000212181_200016118888 [0,0,0,2,0,0|2,0,0]=4 23386 B16R2.279 O=C1CCC1CCSCC2CCCCC2 62a_100000211423_200016118888 [0,0,0,2,0,0|2,0,0]=4 23387 B16R2.279 O=C1CCC1CCSCC2CCCCC2 62a_200016118888_100000211423 [0,0,0,2,0,0|2,0,0]=4 23388 B16R2.279 O=C1CCC1NCCCC2CCCCC2 34a_100011211642_100009892977 [0,0,0,2,0,0|2,0,0]=4 23389 B16R2.279 O=C1CCC1OCCCC2CCCCC2 34a_100000198086_100009892977 [0,0,0,2,0,0|2,0,0]=4 23390 B16R2.279 O=C1CCC1OCCCC2CCCCC2 7a_100000198086_100009892977 [0,0,0,2,0,0|2,0,0]=4 23391 B16R2.279 O=C1CCC1SCCCC2CCCCC2 62a_100009892977_100011713725 [0,0,0,2,0,0|2,0,0]=4 23392 B16R2.279 O=C1CCC1SCCCC2CCCCC2 62a_100011713725_100009892977 [0,0,0,2,0,0|2,0,0]=4 23393 B16R2.1159 COC(=O)C1CN1CCC2CCCCC2 2230a_200009830135_100012355289 [0,0,0,2,0,0|1,0,0]=3 23394 B16R2.1159 COC(=O)C1CN1CCC2CCCCC2 270004a_200009830135_100011713444 [0,0,0,2,0,0|1,0,0]=3 23395 B16R2.1159 COC(=O)C1CN1CCC2CCOCC2 2230a_200009830135_100011934994 [0,0,0,2,0,0|2,0,0]=4 23396 B16R2.1159 COC(=O)C1CN1CCN2CCCCC2 2230a_200009830135_100000739454 [0,0,0,2,0,0|2,0,0]=4 23397 B16R2.1159 COC(=O)C1CN1COC2CCCCC2 2230a_200009830135_100011935260 [0,0,0,2,0,0|2,0,0]=4 23398 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCCCC2 2230a_102516456887_100000211423 [0,0,0,2,0,0|1,0,0]=3 23399 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCCCC2 269982a_102516456887_100000211423 [0,0,0,2,0,0|1,0,0]=3 23400 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCCCO2 2230a_102516456887_100000211543 [0,0,0,2,0,0|2,0,0]=4 23401 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCCCO2 269982a_102516456887_100000211543 [0,0,0,2,0,0|2,0,0]=4 23402 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCCOC2 2230a_102516456887_100000741521 [0,0,0,2,0,0|2,0,0]=4 23403 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCCOC2 269982a_102516456887_100000741521 [0,0,0,2,0,0|2,0,0]=4 23404 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCOCC2 2230a_102516456887_100000754603 [0,0,0,2,0,0|2,0,0]=4 23405 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCOCC2 269982a_102516456887_100000754603 [0,0,0,2,0,0|2,0,0]=4 23406 B16R2.1219 COC(=O)[C@@H]1CCN1CC2CCSCC2 270004a_102516456887_100000067145 [0,0,0,2,0,0|2,0,0]=4 23407 B16R2.1369 CNC(=O)CNCC1CC12CCCCC2 2230a_100015185624_100000183359 [0,0,0,2,0,0|2,0,0]=4 23408 B16R2.1369 CNC(=O)CNCC1CC12CCCCC2 34a_100015185624_100000183359 [0,0,0,2,0,0|2,0,0]=4 23409 B16R2.1369 COC(=O)CNCC1CC12CCCCC2 2230a_100015185624_100000747449 [0,0,0,2,0,0|1,0,0]=3 23410 B16R2.1369 COC(=O)CNCC1CC12CCCCC2 34a_100015185624_100000747449 [0,0,0,2,0,0|1,0,0]=3 23411 B16R2.2293 COC(=O)CN1CCOC12CCCCC2 269982a_200015422347_100000747449 [0,0,0,2,0,0|2,0,0]=4 23412 B16R2.2293 COC(=O)CN1CCOC12CCCCC2 34a_200015422347_100000747449 [0,0,0,2,0,0|2,0,0]=4 23413 B16R2.33633 CNC(=O)CCCNC1C2CCC1CC2 34a_100000740002_100009813300 [0,0,0,2,0,0|2,0,0]=4 23414 B16R2.33633 CNC(=O)CCCSC1C2CCC1CC2 62a_100000741757_100009813300 [0,0,0,2,0,0|2,0,0]=4 23415 B16R2.33633 CNC(=O)CCCSC1C2CCC1CC2 62a_100009813300_100000741757 [0,0,0,2,0,0|2,0,0]=4 23416 B16R2.33633 COC(=O)CCCCN1C2CCC1CC2 2230a_100000735658_100000204269 [0,0,0,2,0,0|1,0,0]=3 23417 B16R2.33633 COC(=O)CCCCN1C2CCC1CC2 269982a_100000735658_100000204269 [0,0,0,2,0,0|1,0,0]=3 23418 B16R2.33633 COC(=O)CCCCN1C2CCC1CC2 34a_100000735658_100000204269 [0,0,0,2,0,0|1,0,0]=3 23419 B16R2.33633 COC(=O)CCCSC1C2CCC1CC2 62a_100009813300_100011218270 [0,0,0,2,0,0|1,0,0]=3 23420 B16R2.33633 COC(=O)CCCSC1C2CCC1CC2 62a_100011218270_100009813300 [0,0,0,2,0,0|1,0,0]=3 23421 B16R2.33633 COC(=O)COCCN1C2CCC1CC2 2230a_100000735658_100000090808 [0,0,0,2,0,0|2,0,0]=4 23422 B16R2.33633 COC(=O)COCCN1C2CCC1CC2 34a_100000735658_100000090808 [0,0,0,2,0,0|2,0,0]=4 23423 B16R2.33633 COC(=O)NCCOC1C2CCC1CC2 34a_100000757965_100009813300 [0,0,0,2,0,0|2,0,0]=4 23424 B16R2.33633 COC(=O)OCCOC1C2CCC1CC2 34a_100010262106_100009813300 [0,0,0,2,0,0|2,0,0]=4 23425 B16R2.35223 COC(=O)CCN1CCN2CCC1CC2 269982a_100000027273_100000204255 [0,0,0,2,0,0|2,0,0]=4 23426 B16R2.35238 COC(=O)CCCCCN1CC2CC2C1 2230a_100000741873_100009816466 [0,0,0,2,0,0|1,0,0]=3 23427 B16R2.35238 COC(=O)CCCCCN1CC2CC2C1 269982a_100000741873_100009816466 [0,0,0,2,0,0|1,0,0]=3 23428 B16R2.35238 COC(=O)CCCCCN1CC2CC2C1 34a_100000741873_100009816466 [0,0,0,2,0,0|1,0,0]=3 23429 B16R2.171541 COC(=O)CCCCOC1CCC2C1C2 34a_200012295571_100000204269 [0,0,0,2,0,0|1,0,0]=3 23430 B16R2.171541 COC(=O)COCCOC1CCC2C1C2 34a_200012295571_100000090808 [0,0,0,2,0,0|2,0,0]=4 23431 B16R2.213210 COC(=O)CCCCNC1C2C1COC2 2230a_100000702821_100000204269 [0,0,0,2,0,0|2,0,0]=4 23432 B16R2.213210 COC(=O)CCCCNC1C2C1COC2 34a_100000702821_100000204269 [0,0,0,2,0,0|2,0,0]=4 23433 B16R2.213210 COC(=O)CCCOCC1C2C1CNC2 34a_100000045132_100000742333 [0,0,0,2,0,0|2,0,0]=4 23434 B16R2.290 O=C1CCC1CCNCCC2CCCC2 2230a_100000739158_200016118888 [0,0,0,2,0,0|2,0,0]=4 23435 B16R2.290 O=C1CCC1CCOCCC2CCCC2 7a_100000749090_200016118888 [0,0,0,2,0,0|2,0,0]=4 23436 B16R2.290 O=C1CCC1CCSCCC2CCCC2 62a_100000760354_200016118888 [0,0,0,2,0,0|2,0,0]=4 23437 B16R2.290 O=C1CCC1CCSCCC2CCCC2 62a_200016118888_100000760354 [0,0,0,2,0,0|2,0,0]=4 23438 B16R2.1160 CNC(=O)C1CCCCN1C2CCCC2 2230a_100011209383_100000179811 [0,0,0,2,0,0|2,0,0]=4 23439 B16R2.1160 CNC(=O)C1CCCCN1C2CCCC2 269982a_100011209383_100000179811 [0,0,0,2,0,0|2,0,0]=4 23440 B16R2.1160 CNC(=O)C1CCCCN1C2CCCC2 270004a_100011209383_100000210133 [0,0,0,2,0,0|2,0,0]=4 23441 B16R2.1160 CNC(=O)C1CCCCN1C2CCCC2 34a_100011209383_100000179811 [0,0,0,2,0,0|2,0,0]=4 23442 B16R2.1160 COC(=O)C1CCCCN1C2CCCC2 2230a_100000734855_100000179811 [0,0,0,2,0,0|1,0,0]=3 23443 B16R2.1160 COC(=O)C1CCCCN1C2CCCC2 269982a_100000734855_100000179811 [0,0,0,2,0,0|1,0,0]=3 23444 B16R2.1160 COC(=O)C1CCCCN1C2CCCC2 270004a_100000734855_100000210133 [0,0,0,2,0,0|1,0,0]=3 23445 B16R2.1160 COC(=O)C1CCCCN1C2CCCC2 34a_100000734855_100000179811 [0,0,0,2,0,0|1,0,0]=3 23446 B16R2.1160 COC(=O)C1CCCCN1C2CCOC2 2230a_100000734855_100000731011 [0,0,0,2,0,0|2,0,0]=4 23447 B16R2.1160 COC(=O)C1CCCCN1C2CCOC2 269982a_100000734855_100000731011 [0,0,0,2,0,0|2,0,0]=4 23448 B16R2.1160 COC(=O)C1CCCCN1C2CCOC2 270004a_100000734855_100000752484 [0,0,0,2,0,0|2,0,0]=4 23449 B16R2.1160 COC(=O)C1CCCCN1C2CCOC2 34a_100000734855_100000690089 [0,0,0,2,0,0|2,0,0]=4 23450 B16R2.1160 COC(=O)C1CCCCN1C2CCSC2 270004a_100000734855_100000212027 [0,0,0,2,0,0|2,0,0]=4 23451 B16R2.1160 COC(=O)C1COCCN1C2CCCC2 2230a_100000765174_100000179811 [0,0,0,2,0,0|2,0,0]=4 23452 B16R2.1160 COC(=O)C1COCCN1C2CCCC2 270004a_100000765174_100000210133 [0,0,0,2,0,0|2,0,0]=4 23453 B16R2.1160 COC(=O)C1COCCN1C2CCCC2 34a_100000765174_100000179811 [0,0,0,2,0,0|2,0,0]=4 23454 B16R2.1208 COC(=O)[C@@H]1CCN1CCC2CCCC2 2230a_102516456887_100000760354 [0,0,0,2,0,0|1,0,0]=3 23455 B16R2.1208 COC(=O)[C@@H]1CCN1CCC2CCCC2 269982a_102516456887_100000760354 [0,0,0,2,0,0|1,0,0]=3 23456 B16R2.1208 COC(=O)[C@@H]1CCN1CCN2CCCC2 269982a_102516456887_100000004467 [0,0,0,2,0,0|2,0,0]=4 23457 B16R2.1260 CCC(=O)CN1CCCC1C2CCCC2 269982a_100000743374_100000747405 [0,0,0,2,0,0|2,0,0]=4 23458 B16R2.1260 CNC(=O)CN1CCCC1C2CCCC2 2230a_100000743374_100000183359 [0,0,0,2,0,0|2,0,0]=4 23459 B16R2.1260 CNC(=O)CN1CCCC1C2CCCC2 269982a_100000743374_100000183359 [0,0,0,2,0,0|2,0,0]=4 23460 B16R2.1260 CNC(=O)CN1CCCC1C2CCCC2 34a_100000743374_100000183359 [0,0,0,2,0,0|2,0,0]=4 23461 B16R2.1260 COC(=O)CN1CCCC1C2CCCC2 2230a_100000743374_100000747449 [0,0,0,2,0,0|1,0,0]=3 23462 B16R2.1260 COC(=O)CN1CCCC1C2CCCC2 269982a_100000743374_100000747449 [0,0,0,2,0,0|1,0,0]=3 23463 B16R2.1260 COC(=O)CN1CCCC1C2CCCC2 34a_100000743374_100000747449 [0,0,0,2,0,0|1,0,0]=3 23464 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCCC2 2230a_100025726698_100000179811 [0,0,0,2,0,0|1,0,0]=3 23465 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCCC2 269982a_100025726698_100000179811 [0,0,0,2,0,0|1,0,0]=3 23466 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCCC2 270004a_100025726698_100000210133 [0,0,0,2,0,0|1,0,0]=3 23467 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCCC2 34a_100025726698_100000179811 [0,0,0,2,0,0|1,0,0]=3 23468 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCOC2 2230a_100025726698_100000731011 [0,0,0,2,0,0|2,0,0]=4 23469 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCOC2 269982a_100025726698_100000731011 [0,0,0,2,0,0|2,0,0]=4 23470 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCOC2 270004a_100025726698_100000752484 [0,0,0,2,0,0|2,0,0]=4 23471 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCOC2 34a_100025726698_100000690089 [0,0,0,2,0,0|2,0,0]=4 23472 B16R2.1260 COC(=O)C[C@H]1CCCN1C2CCSC2 270004a_100025726698_100000212027 [0,0,0,2,0,0|2,0,0]=4 23473 B16R2.33443 COC(=O)C1CN1CCCC2CCCC2 2230a_200009830135_100011713738 [0,0,0,2,0,0|1,0,0]=3 23474 B16R2.33443 COC(=O)C1CN1CCCN2CCCC2 2230a_200009830135_100011445909 [0,0,0,2,0,0|2,0,0]=4 23475 B16R2.35206 CNC(=O)CCCNC1CC2CCC1C2 2230a_100000758229_100000741757 [0,0,0,2,0,0|2,0,0]=4 23476 B16R2.35206 CNC(=O)CCCNC1CC2CCC1C2 269862a_100000740002_100000223372 [0,0,0,2,0,0|2,0,0]=4 23477 B16R2.35206 CNC(=O)CCCNC1CC2CCC1C2 270004a_100000740002_100000223372 [0,0,0,2,0,0|2,0,0]=4 23478 B16R2.35206 CNC(=O)CCCNC1CC2CCC1C2 34a_100000740002_100000727232 [0,0,0,2,0,0|2,0,0]=4 23479 B16R2.35206 CNC(=O)CCCNC1CC2CCC1C2 34a_100000758229_100000741757 [0,0,0,2,0,0|2,0,0]=4 23480 B16R2.35206 CNC(=O)CCCOC1CC2CCC1C2 34a_100000211339_100000741757 [0,0,0,2,0,0|2,0,0]=4 23481 B16R2.35206 CNC(=O)CCCSC1CC2CCC1C2 62a_100000727232_100000741757 [0,0,0,2,0,0|2,0,0]=4 23482 B16R2.35206 CNC(=O)CCCSC1CC2CCC1C2 62a_100000741757_100000727232 [0,0,0,2,0,0|2,0,0]=4 23483 B16R2.35206 CNC(=O)CCNCC1CC2CCC1C2 269862a_100000738227_100000697602 [0,0,0,2,0,0|2,0,0]=4 23484 B16R2.35206 CNC(=O)CCNCC1CC2CCC1C2 270004a_100000738227_100000697602 [0,0,0,2,0,0|2,0,0]=4 23485 B16R2.35206 CNC(=O)CCOCC1CC2CCC1C2 34a_100000229996_100012179268 [0,0,0,2,0,0|2,0,0]=4 23486 B16R2.35206 COC(=O)CCCCN1CC2CCC1C2 2230a_100000743476_100000204269 [0,0,0,2,0,0|1,0,0]=3 23487 B16R2.35206 COC(=O)CCCCN1CC2CCC1C2 269982a_100000743476_100000204269 [0,0,0,2,0,0|1,0,0]=3 23488 B16R2.35206 COC(=O)CCCCN1CC2CCC1C2 34a_100000743476_100000204269 [0,0,0,2,0,0|1,0,0]=3 23489 B16R2.35206 COC(=O)CCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000204269 [0,0,0,2,0,0|2,0,0]=4 23490 B16R2.35206 COC(=O)CCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000204269 [0,0,0,2,0,0|2,0,0]=4 23491 B16R2.35206 COC(=O)CCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000204269 [0,0,0,2,0,0|2,0,0]=4 23492 B16R2.35206 COC(=O)CCCNC1CC2CCC1C2 2230a_100000758229_100011218270 [0,0,0,2,0,0|1,0,0]=3 23493 B16R2.35206 COC(=O)CCCNC1CC2CCC1C2 34a_100000758229_100000742333 [0,0,0,2,0,0|1,0,0]=3 23494 B16R2.35206 COC(=O)CCCOC1CC2CCC1C2 34a_100000211339_100000742333 [0,0,0,2,0,0|1,0,0]=3 23495 B16R2.35206 COC(=O)CCCSC1CC2CCC1C2 62a_100000727232_100011218270 [0,0,0,2,0,0|1,0,0]=3 23496 B16R2.35206 COC(=O)CCCSC1CC2CCC1C2 62a_100011218270_100000727232 [0,0,0,2,0,0|1,0,0]=3 23497 B16R2.35206 COC(=O)CCOCC1CC2CCC1C2 34a_100000229996_100000742370 [0,0,0,2,0,0|1,0,0]=3 23498 B16R2.35206 COC(=O)COCCN1CC2CCC1C2 2230a_100000743476_100000090808 [0,0,0,2,0,0|2,0,0]=4 23499 B16R2.35206 COC(=O)COCCN1CC2CCC1C2 34a_100000743476_100000090808 [0,0,0,2,0,0|2,0,0]=4 23500 B16R2.35206 COC(=O)COCCN1CC2CCC1C2 34a_200011499663_100000747449 [0,0,0,2,0,0|2,0,0]=4 23501 B16R2.35206 COC(=O)NCCOC1CC2CCC1C2 34a_100000757965_100000727232 [0,0,0,2,0,0|2,0,0]=4 23502 B16R2.35206 COC(=O)OCCOC1CC2CCC1C2 34a_100010262106_100000727232 [0,0,0,2,0,0|2,0,0]=4 23503 B16R2.34040 CCC(=O)N1C(CCC2C1CCCC2)C 11a_100132302184_100000210414 [0,0,0,2,0,0|2,0,0]=4 23504 B16R2.34040 CCC(=O)N1C(CCC2C1CCCC2)C 240690a_100132302184_100000210414 [0,0,0,2,0,0|2,0,0]=4 23505 B16R2.34040 CCC(=O)N1C(CCC2C1CCCC2)C 527a_100132302184_100000210414 [0,0,0,2,0,0|2,0,0]=4 23506 B16R2.34040 CNC(=O)N1C(CCC2C1CCCC2)C 273464a_100102657272_100132302184 [0,0,0,2,0,0|2,0,0]=4 23507 B16R2.176128 COC(=O)CC1COCCN1C2CCC2 270004a_100000731486_100000241760 [0,0,0,2,0,0|2,0,0]=4 23508 B16R2.176128 COC(=O)CC1COCCN1C2CCC2 34a_100000731486_100000749161 [0,0,0,2,0,0|2,0,0]=4 23509 B16R2.211814 COC(=O)CC1COCCN1CC2CC2 2230a_100000731486_100000742324 [0,0,0,2,0,0|2,0,0]=4 23510 B16R2.211814 COC(=O)CC1COCCN1CC2CC2 34a_100000731486_100000742324 [0,0,0,2,0,0|2,0,0]=4 23511 B16R2.1181 CNC(=O)CCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000737683 [0,0,0,2,0,0|2,0,0]=4 23512 B16R2.1181 CNC(=O)CCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000737683 [0,0,0,2,0,0|2,0,0]=4 23513 B16R2.1181 CNC(=O)CCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100012179268 [0,0,0,2,0,0|2,0,0]=4 23514 B16R2.1181 COC(=O)CCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000204255 [0,0,0,2,0,0|1,0,0]=3 23515 B16R2.1181 COC(=O)CCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000204255 [0,0,0,2,0,0|1,0,0]=3 23516 B16R2.1181 COC(=O)CCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000742370 [0,0,0,2,0,0|1,0,0]=3 23517 B16R2.3271 CC1CCCCC1NCCC2CCC2=O 2230a_100000211402_200016118888 [0,0,0,2,0,0|2,0,0]=4 23518 B16R2.3271 CC1CCCCC1OCCC2CCC2=O 7a_100000211207_200016118888 [0,0,0,2,0,0|2,0,0]=4 23519 B16R2.33912 COC(=O)[C@@H]1CCN1C2CCCCC2C 270004a_102516456887_100000210921 [0,0,0,2,0,0|1,0,0]=3 23520 B16R2.33912 COC(=O)[C@@H]1CCN1C2CCCCC2F 269982a_102516456887_100015423560 [0,0,0,2,0,0|2,0,0]=4 23521 B16R2.33912 COC(=O)[C@@H]1CCN1C2CCCCC2O 269982a_102516456887_100000038908 [0,0,0,2,0,0|2,0,0]=4 23522 B16R2.33912 COC(=O)[C@@H]1CCN1C2CCNCC2C 270004a_102516456887_100000703950 [0,0,0,2,0,0|2,0,0]=4 23523 B16R2.33912 COC(=O)[C@@H]1CCN1C2CCOCC2C 270004a_102516456887_100000755695 [0,0,0,2,0,0|2,0,0]=4 23524 B16R2.181385 CNC(=O)CCCNC1CCCC2C1C2 269862a_100000740002_100000697651 [0,0,0,2,0,0|2,0,0]=4 23525 B16R2.34082 CNC(=O)C1CCCCN1CC2CCC2 2230a_100011209383_100000763275 [0,0,0,2,0,0|2,0,0]=4 23526 B16R2.34082 CNC(=O)C1CCCCN1CC2CCC2 269982a_100011209383_100000763275 [0,0,0,2,0,0|2,0,0]=4 23527 B16R2.34082 CNC(=O)C1CCCCN1CC2CCC2 34a_100011209383_100000763275 [0,0,0,2,0,0|2,0,0]=4 23528 B16R2.34082 COC(=O)C1CCCCN1CC2CCC2 2230a_100000734855_100000763275 [0,0,0,2,0,0|1,0,0]=3 23529 B16R2.34082 COC(=O)C1CCCCN1CC2CCC2 269982a_100000734855_100000763275 [0,0,0,2,0,0|1,0,0]=3 23530 B16R2.34082 COC(=O)C1CCCCN1CC2CCC2 34a_100000734855_100000763275 [0,0,0,2,0,0|1,0,0]=3 23531 B16R2.34082 COC(=O)C1CCCCN1CC2CCO2 2230a_100000734855_100000103362 [0,0,0,2,0,0|2,0,0]=4 23532 B16R2.34082 COC(=O)C1CCCCN1CC2CCO2 269982a_100000734855_100000103362 [0,0,0,2,0,0|2,0,0]=4 23533 B16R2.34082 COC(=O)C1CCCCN1CC2CCO2 34a_100000734855_100000103362 [0,0,0,2,0,0|2,0,0]=4 23534 B16R2.34082 COC(=O)C1CCCCN1CC2COC2 2230a_100000734855_100010264016 [0,0,0,2,0,0|2,0,0]=4 23535 B16R2.34082 COC(=O)C1CCCCN1CC2COC2 269982a_100000734855_100010264016 [0,0,0,2,0,0|2,0,0]=4 23536 B16R2.34082 COC(=O)C1CCCCN1CC2COC2 34a_100000734855_100010264016 [0,0,0,2,0,0|2,0,0]=4 23537 B16R2.34082 COC(=O)C1CNCCC1OC2CCC2 34a_200103168510_100000749161 [0,0,0,2,0,0|2,0,0]=4 23538 B16R2.34082 COC(=O)C1COCCN1CC2CCC2 2230a_100000765174_100000763275 [0,0,0,2,0,0|2,0,0]=4 23539 B16R2.34082 COC(=O)C1COCCN1CC2CCC2 34a_100000765174_100000763275 [0,0,0,2,0,0|2,0,0]=4 23540 B16R2.34082 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCC2 34a_100015709673_100000749161 [0,0,0,2,0,0|1,0,0]=3 23541 B16R2.34082 COC(=O)[C@@H]1CCCC[C@@H]1OC2COC2 34a_100015709673_100009818527 [0,0,0,2,0,0|2,0,0]=4 23542 B16R2.34082 COC(=O)[C@@H]1CCCC[C@@H]1OC2COC2 7a_100015709673_100009818527 [0,0,0,2,0,0|2,0,0]=4 23543 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2CCC2 2230a_100025726698_100000763275 [0,0,0,2,0,0|1,0,0]=3 23544 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2CCC2 269982a_100025726698_100000763275 [0,0,0,2,0,0|1,0,0]=3 23545 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2CCC2 34a_100025726698_100000763275 [0,0,0,2,0,0|1,0,0]=3 23546 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2CCO2 2230a_100025726698_100000103362 [0,0,0,2,0,0|2,0,0]=4 23547 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2CCO2 269982a_100025726698_100000103362 [0,0,0,2,0,0|2,0,0]=4 23548 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2CCO2 34a_100025726698_100000103362 [0,0,0,2,0,0|2,0,0]=4 23549 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2COC2 2230a_100025726698_100010264016 [0,0,0,2,0,0|2,0,0]=4 23550 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2COC2 269982a_100025726698_100010264016 [0,0,0,2,0,0|2,0,0]=4 23551 B16R2.170365 COC(=O)C[C@H]1CCCN1CC2COC2 34a_100025726698_100010264016 [0,0,0,2,0,0|2,0,0]=4 23552 B16R2.171030 COC(=O)CCCCN1CCC12COC2 2230a_100015204706_100000204269 [0,0,0,2,0,0|2,0,0]=4 23553 B16R2.171030 COC(=O)CCCCN1CCC12COC2 269982a_100015204706_100000204269 [0,0,0,2,0,0|2,0,0]=4 23554 B16R2.34081 CNC(=O)C1CCCCN1CCC2CC2 2230a_100011209383_100000694398 [0,0,0,2,0,0|2,0,0]=4 23555 B16R2.34081 CNC(=O)C1CCCCN1CCC2CC2 269982a_100011209383_100000694398 [0,0,0,2,0,0|2,0,0]=4 23556 B16R2.34081 CNC(=O)C1CCCCN1CCC2CC2 34a_100011209383_100000694398 [0,0,0,2,0,0|2,0,0]=4 23557 B16R2.34081 COC(=O)C1CCCCN1CCC2CC2 2230a_100000734855_100000694398 [0,0,0,2,0,0|1,0,0]=3 23558 B16R2.34081 COC(=O)C1CCCCN1CCC2CC2 269982a_100000734855_100000694398 [0,0,0,2,0,0|1,0,0]=3 23559 B16R2.34081 COC(=O)C1CCCCN1CCC2CC2 34a_100000734855_100000694398 [0,0,0,2,0,0|1,0,0]=3 23560 B16R2.34081 COC(=O)C1CCCCN1CCC2CO2 2230a_100000734855_100000732470 [0,0,0,2,0,0|2,0,0]=4 23561 B16R2.34081 COC(=O)C1CCCCN1CCC2CO2 269982a_100000734855_100000732470 [0,0,0,2,0,0|2,0,0]=4 23562 B16R2.34081 COC(=O)C1CCCCN1CCC2CO2 34a_100000734855_100000732470 [0,0,0,2,0,0|2,0,0]=4 23563 B16R2.34081 COC(=O)C1CNCCC1OCC2CC2 34a_200103168510_100000742324 [0,0,0,2,0,0|2,0,0]=4 23564 B16R2.34081 COC(=O)C1COCCN1CCC2CC2 2230a_100000765174_100000694398 [0,0,0,2,0,0|2,0,0]=4 23565 B16R2.34081 COC(=O)C1COCCN1CCC2CC2 34a_100000765174_100000694398 [0,0,0,2,0,0|2,0,0]=4 23566 B16R2.34081 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CC2 34a_100015709673_100000742324 [0,0,0,2,0,0|1,0,0]=3 23567 B16R2.34081 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CC2 7a_100015709673_100000742324 [0,0,0,2,0,0|1,0,0]=3 23568 B16R2.34081 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CO2 34a_100015709673_102125554688 [0,0,0,2,0,0|2,0,0]=4 23569 B16R2.34081 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CO2 7a_100015709673_102125554688 [0,0,0,2,0,0|2,0,0]=4 23570 B16R2.34081 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CS2 7a_100015709673_100000031435 [0,0,0,2,0,0|2,0,0]=4 23571 B16R2.34081 COC(=O)[C@@H]1CCCC[C@@H]1OC[C@@H]2CO2 7a_100015709673_100000745022 [0,0,0,2,0,0|2,0,0]=4 23572 B16R2.147904 CCCCCN1CC2CC1C2C(=O)OC 2230a_200010453038_100000210326 [0,0,0,2,0,0|1,0,0]=3 23573 B16R2.147904 CCCCCN1CC2CC1C2C(=O)OC 269982a_200010453038_100000210215 [0,0,0,2,0,0|1,0,0]=3 23574 B16R2.147904 CCCCCN1CC2CC1C2C(=O)OC 34a_200010453038_100000718602 [0,0,0,2,0,0|1,0,0]=3 23575 B16R2.147904 CCOCCN1CC2CC1C2C(=O)OC 2230a_200010453038_100011215890 [0,0,0,2,0,0|2,0,0]=4 23576 B16R2.147904 CCOCCN1CC2CC1C2C(=O)OC 269982a_200010453038_100011215890 [0,0,0,2,0,0|2,0,0]=4 23577 B16R2.147904 CCOCCN1CC2CC1C2C(=O)OC 34a_200010453038_100000210147 [0,0,0,2,0,0|2,0,0]=4 23578 B16R2.147904 CCSCCN1CC2CC1C2C(=O)OC 2230a_200010453038_100000757381 [0,0,0,2,0,0|2,0,0]=4 23579 B16R2.147904 CCSCCN1CC2CC1C2C(=O)OC 269982a_200010453038_100000757381 [0,0,0,2,0,0|2,0,0]=4 23580 B16R2.147904 CCSCCN1CC2CC1C2C(=O)OC 34a_200010453038_100000757381 [0,0,0,2,0,0|2,0,0]=4 23581 B16R2.147904 COC(=O)C1C2CC1N(C2)CCCCF 2230a_200010453038_100000729493 [0,0,0,2,0,0|2,0,0]=4 23582 B16R2.147904 COC(=O)C1C2CC1N(C2)CCCCF 269982a_200010453038_100000729493 [0,0,0,2,0,0|2,0,0]=4 23583 B16R2.147904 COC(=O)C1C2CC1N(C2)CCCCF 34a_200010453038_100000729493 [0,0,0,2,0,0|2,0,0]=4 23584 B16R2.147904 COC(=O)C1C2CC1N(C2)CCCCO 2230a_200010453038_100000210776 [0,0,0,2,0,0|2,0,0]=4 23585 B16R2.147904 COC(=O)C1C2CC1N(C2)CCCCO 269982a_200010453038_100000210776 [0,0,0,2,0,0|2,0,0]=4 23586 B16R2.147904 COC(=O)C1C2CC1N(C2)CCCCO 34a_200010453038_100011216708 [0,0,0,2,0,0|2,0,0]=4 23587 B16R2.147904 COCCCN1CC2CC1C2C(=O)OC 2230a_200010453038_100000740836 [0,0,0,2,0,0|2,0,0]=4 23588 B16R2.147904 COCCCN1CC2CC1C2C(=O)OC 269982a_200010453038_100000740836 [0,0,0,2,0,0|2,0,0]=4 23589 B16R2.147904 COCCCN1CC2CC1C2C(=O)OC 34a_200010453038_100000740836 [0,0,0,2,0,0|2,0,0]=4 23590 B16R2.175892 COC(=O)C[C@H]1CCCN1CCC2CC2 2230a_100025726698_100000694398 [0,0,0,2,0,0|1,0,0]=3 23591 B16R2.175892 COC(=O)C[C@H]1CCCN1CCC2CC2 269982a_100025726698_100000694398 [0,0,0,2,0,0|1,0,0]=3 23592 B16R2.175892 COC(=O)C[C@H]1CCCN1CCC2CC2 34a_100025726698_100000694398 [0,0,0,2,0,0|1,0,0]=3 23593 B16R2.175892 COC(=O)C[C@H]1CCCN1CCC2CO2 2230a_100025726698_100000732470 [0,0,0,2,0,0|2,0,0]=4 23594 B16R2.175892 COC(=O)C[C@H]1CCCN1CCC2CO2 269982a_100025726698_100000732470 [0,0,0,2,0,0|2,0,0]=4 23595 B16R2.175892 COC(=O)C[C@H]1CCCN1CCC2CO2 34a_100025726698_100000732470 [0,0,0,2,0,0|2,0,0]=4 23596 B16R2.1214 CNC(=O)CCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000741757 [0,0,0,2,0,0|2,0,0]=4 23597 B16R2.1214 CNC(=O)CCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000741757 [0,0,0,2,0,0|2,0,0]=4 23598 B16R2.1214 CNC(=O)CCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000741757 [0,0,0,2,0,0|2,0,0]=4 23599 B16R2.1214 COC(=O)CCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100011218270 [0,0,0,2,0,0|1,0,0]=3 23600 B16R2.1214 COC(=O)CCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100011218270 [0,0,0,2,0,0|1,0,0]=3 23601 B16R2.1214 COC(=O)CCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000742333 [0,0,0,2,0,0|1,0,0]=3 23602 B16R2.1214 COC(=O)CCCN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100011218270 [0,0,0,2,0,0|2,0,0]=4 23603 B16R2.1214 COC(=O)CCCN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100011218270 [0,0,0,2,0,0|2,0,0]=4 23604 B16R2.1214 COC(=O)CCCN1C[C@H]2COC[C@H]2C1 34a_100000700037_100000742333 [0,0,0,2,0,0|2,0,0]=4 23605 B16R2.1357 CCC(=O)COC1CCC2CCCC2C1 7a_100000073670_100000747405 [0,0,0,2,0,0|2,0,0]=4 23606 B16R2.1357 CNC(=O)COC1CCC2CCCC2C1 34a_100000073670_100000183359 [0,0,0,2,0,0|2,0,0]=4 23607 B16R2.1357 CNC(=O)COC1CCC2CCCC2C1 7a_100000073670_100000183359 [0,0,0,2,0,0|2,0,0]=4 23608 B16R2.1357 COC(=O)CCN1CCN2CCC[C@@H]2C1 2230a_100000008389_100000204255 [0,0,0,2,0,0|2,0,0]=4 23609 B16R2.1357 COC(=O)CCN1CCN2CCC[C@@H]2C1 269982a_100000008389_100000204255 [0,0,0,2,0,0|2,0,0]=4 23610 B16R2.1357 COC(=O)CCN1CCN2CCC[C@@H]2C1 34a_100000008389_100000742370 [0,0,0,2,0,0|2,0,0]=4 23611 B16R2.1357 COC(=O)COC1CCC2CCCC2C1 34a_100000073670_100000747449 [0,0,0,2,0,0|1,0,0]=3 23612 B16R2.1357 COC(=O)COC1CCC2CCCC2C1 7a_100000073670_100000747449 [0,0,0,2,0,0|1,0,0]=3 23613 B16R2.33452 COC(=O)C1CN1CCC2CCCN2C 2230a_200009830135_100000005710 [0,0,0,2,0,0|2,0,0]=4 23614 B16R2.23155 O=C1CCC1CCNC2CCCCCC2 2230a_100000210984_200016118888 [0,0,0,2,0,0|2,0,0]=4 23615 B16R2.23155 O=C1CCC1CCOC2CCCCCC2 7a_100000210887_200016118888 [0,0,0,2,0,0|2,0,0]=4 23616 B16R2.23155 O=C1CCC1CCSC2CCCCCC2 62a_100011217769_200016118888 [0,0,0,2,0,0|2,0,0]=4 23617 B16R2.23155 O=C1CCC1CCSC2CCCCCC2 62a_200016118888_100011217769 [0,0,0,2,0,0|2,0,0]=4 23618 B16R2.23155 O=C1CCC1NCCC2CCCCCC2 34a_100011532351_100009892977 [0,0,0,2,0,0|2,0,0]=4 23619 B16R2.26039 O=C1CCC1CCN2CCCCCCC2 2230a_100000211400_200016118888 [0,0,0,2,0,0|2,0,0]=4 23620 B16R2.26039 O=C1CCC1CCN2CCCCCCC2 269982a_100000211400_200016118888 [0,0,0,2,0,0|2,0,0]=4 23621 B16R2.26039 O=C1CCC1OCC2CCCCCCC2 34a_100011216312_100009892977 [0,0,0,2,0,0|2,0,0]=4 23622 B16R2.26039 O=C1CCC1OCC2CCCCCCC2 7a_100011216312_100009892977 [0,0,0,2,0,0|2,0,0]=4 23623 B16R2.6479 COC(=O)CN1CCN2CCCC2C1C 2230a_200000066283_100000747449 [0,0,0,2,0,0|2,0,0]=4 23624 B16R2.6479 COC(=O)CN1CCN2CCCC2C1C 269982a_200000066283_100000747449 [0,0,0,2,0,0|2,0,0]=4 23625 B16R2.6479 COC(=O)CN1CCN2CCCC2C1C 34a_200000066283_100000747449 [0,0,0,2,0,0|2,0,0]=4 23626 B16R2.8583 CCC1CCCC1N2CC[C@H]2C(=O)OC 270004a_102516456887_100000749056 [0,0,0,2,0,0|1,0,0]=3 23627 B16R2.33720 CNC(=O)CCCNC1CCCC12CC2 269862a_100000740002_100009881796 [0,0,0,2,0,0|2,0,0]=4 23628 B16R2.33720 COC(=O)CCCCN1CCCC12CC2 2230a_100020620911_100000204269 [0,0,0,2,0,0|1,0,0]=3 23629 B16R2.33720 COC(=O)CCCCN1CCCC12CC2 269982a_100020620911_100000204269 [0,0,0,2,0,0|1,0,0]=3 23630 B16R2.33720 COC(=O)CCCCN1CCCC12CC2 34a_100020620911_100000204269 [0,0,0,2,0,0|1,0,0]=3 23631 B16R2.33720 COC(=O)COCCN1CCCC12CC2 2230a_100020620911_100000090808 [0,0,0,2,0,0|2,0,0]=4 23632 B16R2.33720 COC(=O)COCCN1CCCC12CC2 34a_100020620911_100000090808 [0,0,0,2,0,0|2,0,0]=4 23633 B16R2.172789 COC(=O)[C@@H]1CCN1C2CCCCCC2 269982a_102516456887_100011217769 [0,0,0,2,0,0|1,0,0]=3 23634 B16R2.172789 COC(=O)[C@@H]1CCN1C2CCCCCC2 270004a_102516456887_100000210131 [0,0,0,2,0,0|1,0,0]=3 23635 B16R2.172789 COC(=O)[C@@H]1CCN1C2CCCNCC2 270004a_102516456887_100015187895 [0,0,0,2,0,0|2,0,0]=4 23636 B16R2.168441 COC(=O)C1CN1C2CCCCCCC2 270004a_200009830135_100000210524 [0,0,0,2,0,0|1,0,0]=3 23637 B16R2.168511 COC(=O)C1CN1CC2CCCCCC2 2230a_200009830135_200000696569 [0,0,0,2,0,0|1,0,0]=3