0 B16R0.221 C#CC(=O)CCCCCCCCCCCC=C 1458a_100000211873_102130925996 [0,0,0,0,0,0|1,0,3]=4 1 B16R0.221 C#CC(=O)CCCCCCCCCCCCC 1458a_100000211873_100000210684 [0,0,0,0,0,0|1,0,1]=2 2 B16R0.221 C#CC(=O)CCCCCCCCCCCCO 1458a_100000211873_100009813331 [0,0,0,0,0,0|2,0,1]=3 3 B16R0.221 C#CC(=O)CCCCCCOCCCCCO 1458a_100000211873_200132310570 [0,0,0,0,0,0|3,0,1]=4 4 B16R0.221 C#CCCCCCCCCCOCC(=O)CC 7a_100000034437_100000747405 [0,0,0,0,0,0|2,0,2]=4 5 B16R0.221 C#CCCCCCCCCCOCC(=O)NC 34a_100000034437_100000183359 [0,0,0,0,0,0|2,0,2]=4 6 B16R0.221 C#CCCCCCCCCCOCC(=O)NC 7a_100000034437_100000183359 [0,0,0,0,0,0|2,0,2]=4 7 B16R0.221 C#CCCCCCCCCCOCC(=O)OC 34a_100000034437_100000747449 [0,0,0,0,0,0|1,0,2]=3 8 B16R0.221 C#CCCCCCCCCCOCC(=O)OC 7a_100000034437_100000747449 [0,0,0,0,0,0|1,0,2]=3 9 B16R0.221 C#CCCCCCCCCOCCC(=O)NC 34a_100000065265_100012179268 [0,0,0,0,0,0|2,0,2]=4 10 B16R0.221 C#CCCCCCCCCOCCC(=O)NC 7a_100000065265_100000737683 [0,0,0,0,0,0|2,0,2]=4 11 B16R0.221 C#CCCCCCCCCOCCC(=O)OC 34a_100000065265_100000742370 [0,0,0,0,0,0|1,0,2]=3 12 B16R0.221 C#CCCCCCCCCOCCC(=O)OC 7a_100000065265_100000204255 [0,0,0,0,0,0|1,0,2]=3 13 B16R0.221 C#CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100153394163 [0,0,0,0,0,0|2,0,2]=4 14 B16R0.221 C#CCCCCCCCNCCCC(=O)NC 34a_100000740002_100153394163 [0,0,0,0,0,0|2,0,2]=4 15 B16R0.221 C#CCCCCCCCOCCCC(=O)NC 34a_100000054614_100000741757 [0,0,0,0,0,0|2,0,2]=4 16 B16R0.221 C#CCCCCCCCOCCCC(=O)NC 7a_100000054614_100000741757 [0,0,0,0,0,0|2,0,2]=4 17 B16R0.221 C#CCCCCCCCOCCCC(=O)OC 34a_100000054614_100000742333 [0,0,0,0,0,0|1,0,2]=3 18 B16R0.221 C#CCCCCCCCOCCCC(=O)OC 7a_100000054614_100011218270 [0,0,0,0,0,0|1,0,2]=3 19 B16R0.221 C#CCCCCCCCOCCNC(=O)OC 34a_100000757965_100153394163 [0,0,0,0,0,0|2,0,2]=4 20 B16R0.221 C#CCCCCCCCOCCOC(=O)OC 34a_100010262106_100153394163 [0,0,0,0,0,0|2,0,2]=4 21 B16R0.221 C#CCCCCCCCSCCCC(=O)NC 62a_100000741757_100153394163 [0,0,0,0,0,0|2,0,2]=4 22 B16R0.221 C#CCCCCCCCSCCCC(=O)NC 62a_100153394163_100000741757 [0,0,0,0,0,0|2,0,2]=4 23 B16R0.221 C#CCCCCCCCSCCCC(=O)OC 62a_100011218270_100153394163 [0,0,0,0,0,0|1,0,2]=3 24 B16R0.221 C#CCCCCCCCSCCCC(=O)OC 62a_100153394163_100011218270 [0,0,0,0,0,0|1,0,2]=3 25 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 34a_100000059025_100012276617 [0,0,0,0,0,0|1,0,2]=3 26 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 34a_100011217361_100000204269 [0,0,0,0,0,0|1,0,2]=3 27 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 7a_100000059025_100012276617 [0,0,0,0,0,0|1,0,2]=3 28 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 7a_100011217361_100000204269 [0,0,0,0,0,0|1,0,2]=3 29 B16R0.221 C#CCCCCCCOCCOCC(=O)OC 34a_100011217361_100000090808 [0,0,0,0,0,0|2,0,2]=4 30 B16R0.221 C#CCCCCCCOCCOCC(=O)OC 7a_100011217361_100000090808 [0,0,0,0,0,0|2,0,2]=4 31 B16R0.221 C#CCCCCCCSCCCCC(=O)OC 62a_100000204269_100012276617 [0,0,0,0,0,0|1,0,2]=3 32 B16R0.221 C#CCCCCCCSCCCCC(=O)OC 62a_100012276617_100000204269 [0,0,0,0,0,0|1,0,2]=3 33 B16R0.221 C#CCCCCCCSCCOCC(=O)OC 62a_100000090808_100012276617 [0,0,0,0,0,0|2,0,2]=4 34 B16R0.221 C#CCCCCCCSCCOCC(=O)OC 62a_100012276617_100000090808 [0,0,0,0,0,0|2,0,2]=4 35 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 34a_100000074720_100012094781 [0,0,0,0,0,0|1,0,2]=3 36 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 34a_100000766912_100009816466 [0,0,0,0,0,0|1,0,2]=3 37 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 7a_100000074720_100012094781 [0,0,0,0,0,0|1,0,2]=3 38 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 7a_100000766912_100009816466 [0,0,0,0,0,0|1,0,2]=3 39 B16R0.221 C#CCCCCCSCCCCCC(=O)OC 62a_100009816466_100012094781 [0,0,0,0,0,0|1,0,2]=3 40 B16R0.221 C#CCCCCCSCCCCCC(=O)OC 62a_100012094781_100009816466 [0,0,0,0,0,0|1,0,2]=3 41 B16R0.221 C#CCCCCNCCCCCCC(=O)OC 2230a_100000706060_100009815986 [0,0,0,0,0,0|1,0,2]=3 42 B16R0.221 C#CCCCCNCCCCCCC(=O)OC 34a_100000706060_100009815986 [0,0,0,0,0,0|1,0,2]=3 43 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 34a_100000766709_100009815986 [0,0,0,0,0,0|1,0,2]=3 44 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 34a_100009863599_100010269958 [0,0,0,0,0,0|1,0,2]=3 45 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 7a_100000766709_100009815986 [0,0,0,0,0,0|1,0,2]=3 46 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 7a_100009863599_100010269958 [0,0,0,0,0,0|1,0,2]=3 47 B16R0.221 C#CCCCCSCCCCCCC(=O)OC 62a_100009815986_100010269958 [0,0,0,0,0,0|1,0,2]=3 48 B16R0.221 C#CCCCCSCCCCCCC(=O)OC 62a_100010269958_100009815986 [0,0,0,0,0,0|1,0,2]=3 49 B16R0.221 C#CCCCNCCCCCCCC(=O)OC 34a_100000718082_100010004213 [0,0,0,0,0,0|1,0,2]=3 50 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 34a_100000215630_100010004213 [0,0,0,0,0,0|1,0,2]=3 51 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000695029 [0,0,0,0,0,0|1,0,2]=3 52 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 7a_100000215630_100010004213 [0,0,0,0,0,0|1,0,2]=3 53 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 7a_100011022521_100011215417 [0,0,0,0,0,0|1,0,2]=3 54 B16R0.221 C#CCCCSCCCCCCCC(=O)OC 62a_100010004213_100011215417 [0,0,0,0,0,0|1,0,2]=3 55 B16R0.221 C#CCCCSCCCCCCCC(=O)OC 62a_100011215417_100010004213 [0,0,0,0,0,0|1,0,2]=3 56 B16R0.221 C#CCCNCCCCCCCCC(=O)OC 34a_100000755551_100010282707 [0,0,0,0,0,0|1,0,2]=3 57 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000688953 [0,0,0,0,0,0|1,0,2]=3 58 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 34a_100011215631_100010282707 [0,0,0,0,0,0|1,0,2]=3 59 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000688953 [0,0,0,0,0,0|1,0,2]=3 60 B16R0.221 C#CCCSCCCCCCCCC(=O)OC 62a_100000688953_100010282707 [0,0,0,0,0,0|1,0,2]=3 61 B16R0.221 C#CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000688953 [0,0,0,0,0,0|1,0,2]=3 62 B16R0.221 C#CCNCCCCCCCCCC(=O)OC 34a_100000212058_100009813843 [0,0,0,0,0,0|1,0,2]=3 63 B16R0.221 C#CCOCCCCCCCCCC(=O)OC 34a_100000210247_100009813843 [0,0,0,0,0,0|1,0,2]=3 64 B16R0.221 C#CCOCCCCCCOCCC(=O)OC 34a_200011021349_100000742370 [0,0,0,0,0,0|2,0,2]=4 65 B16R0.221 C#CCOCCCCCCOCCC(=O)OC 7a_200011021349_100000204255 [0,0,0,0,0,0|2,0,2]=4 66 B16R0.221 C#CCOCCNCCCCCCC(=O)OC 2230a_100000700922_100009815986 [0,0,0,0,0,0|2,0,2]=4 67 B16R0.221 C#CCOCCNCCCCCCC(=O)OC 34a_100000700922_100009815986 [0,0,0,0,0,0|2,0,2]=4 68 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 34a_100000054580_100009815986 [0,0,0,0,0,0|2,0,2]=4 69 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 34a_100009863599_100010402529 [0,0,0,0,0,0|2,0,2]=4 70 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 7a_100000054580_100009815986 [0,0,0,0,0,0|2,0,2]=4 71 B16R0.221 C#CCOCCOCCCCCCC(=O)OC 7a_100009863599_100010402529 [0,0,0,0,0,0|2,0,2]=4 72 B16R0.221 C#CCOCCSCCCCCCC(=O)OC 62a_100009815986_100010402529 [0,0,0,0,0,0|2,0,2]=4 73 B16R0.221 C#CCOCCSCCCCCCC(=O)OC 62a_100010402529_100009815986 [0,0,0,0,0,0|2,0,2]=4 74 B16R0.221 C#CCSCCCCCCCCCC(=O)OC 62a_100000038162_100009813843 [0,0,0,0,0,0|1,0,2]=3 75 B16R0.221 C/C=C/CCOCCCCCCCC(=O)OC 34a_100016278192_100010004213 [0,0,0,0,0,0|1,0,2]=3 76 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 34a_100000035544_100102629194 [0,0,0,0,0,0|1,0,2]=3 77 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 34a_100016270725_100010282707 [0,0,0,0,0,0|1,0,2]=3 78 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 7a_100000035544_100102629194 [0,0,0,0,0,0|1,0,2]=3 79 B16R0.221 C/C=C/CSCCCCCCCCC(=O)OC 62a_100010282707_100102629194 [0,0,0,0,0,0|1,0,2]=3 80 B16R0.221 C/C=C/CSCCCCCCCCC(=O)OC 62a_100102629194_100010282707 [0,0,0,0,0,0|1,0,2]=3 81 B16R0.221 C=C(C#N)CNCCCCCCCCCCC 2230a_200011215754_100000694840 [0,0,0,0,0,0|4,0,0]=4 82 B16R0.221 C=C(C#N)CNCCCCCCCCCCC 34a_200011215754_100000694840 [0,0,0,0,0,0|4,0,0]=4 83 B16R0.221 C=C(C#N)COCCCCCCCCCCC 34a_100000210809_100000694840 [0,0,0,0,0,0|4,0,0]=4 84 B16R0.221 C=CC(=O)CCCCCCCCCCCCC 1458a_100000185746_100000210684 [0,0,0,0,0,0|1,0,1]=2 85 B16R0.221 C=CC(=O)CCCCCCCCCCCCO 1458a_100000185746_100009813331 [0,0,0,0,0,0|2,0,1]=3 86 B16R0.221 C=CC(=O)CCCCCCOCCCCCO 1458a_100000185746_200132310570 [0,0,0,0,0,0|3,0,1]=4 87 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185746 [0,0,0,0,0,0|2,0,1]=3 88 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_200121576911 [0,0,0,0,0,0|2,0,1]=3 89 B16R0.221 C=CC(=O)NCCCCOCCCCCCC 34a_100014118770_100000210614 [0,0,0,0,0,0|3,0,1]=4 90 B16R0.221 C=CC(=O)NCCNCCCCCCCCC 2230a_114873766552_100011214924 [0,0,0,0,0,0|3,0,1]=4 91 B16R0.221 C=CC(=O)NCCOCCCCCCCCC 34a_100011304386_100011214924 [0,0,0,0,0,0|3,0,1]=4 92 B16R0.221 C=CC(=O)OCCCCCCNCCCCC 2230a_100000209983_100009894100 [0,0,0,0,0,0|3,0,1]=4 93 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 34a_100000210253_100009894100 [0,0,0,0,0,0|3,0,1]=4 94 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 7a_100000210253_100009894100 [0,0,0,0,0,0|3,0,1]=4 95 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100000210326_100009894100 [0,0,0,0,0,0|3,0,1]=4 96 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100009894100_100000210326 [0,0,0,0,0,0|3,0,1]=4 97 B16R0.221 C=CC(=O)OCCCCCOCCCCCC 7a_200011023508_100000210314 [0,0,0,0,0,0|3,0,1]=4 98 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 2230a_100000212291_100009813456 [0,0,0,0,0,0|3,0,1]=4 99 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 34a_100000212291_100009813456 [0,0,0,0,0,0|3,0,1]=4 100 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 34a_100000210712_100009813456 [0,0,0,0,0,0|3,0,1]=4 101 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 7a_100000210712_100009813456 [0,0,0,0,0,0|3,0,1]=4 102 B16R0.221 C=CC(=O)OCCSCCCCCCCCC 62a_100009813456_100000210670 [0,0,0,0,0,0|3,0,1]=4 103 B16R0.221 C=CCCCCCCCCCCCC(=O)C=C 1458a_100000185746_102130925996 [0,0,0,0,0,0|1,0,3]=4 104 B16R0.221 C=CCCCCCCCCCCCC(=O)CC 1458a_100000210414_102130925996 [0,0,0,0,0,0|1,0,2]=3 105 B16R0.221 C=CCCCCCCCCCCCC(=O)CO 1458a_100000210174_102130925996 [0,0,0,0,0,0|2,0,2]=4 106 B16R0.221 C=CCCCCCCCCCNCC(=O)NC 2230a_100000081888_100000183359 [0,0,0,0,0,0|2,0,2]=4 107 B16R0.221 C=CCCCCCCCCCNCC(=O)NC 2230a_100000693194_100009814027 [0,0,0,0,0,0|2,0,2]=4 108 B16R0.221 C=CCCCCCCCCCNCC(=O)NC 34a_100000081888_100000183359 [0,0,0,0,0,0|2,0,2]=4 109 B16R0.221 C=CCCCCCCCCCNCC(=O)OC 2230a_100000081888_100000747449 [0,0,0,0,0,0|1,0,2]=3 110 B16R0.221 C=CCCCCCCCCCNCC(=O)OC 34a_100000081888_100000747449 [0,0,0,0,0,0|1,0,2]=3 111 B16R0.221 C=CCCCCCCCCCOCC(=O)CC 34a_100000725409_100009814027 [0,0,0,0,0,0|2,0,2]=4 112 B16R0.221 C=CCCCCCCCCCOCC(=O)CC 7a_100000038209_100000747405 [0,0,0,0,0,0|2,0,2]=4 113 B16R0.221 C=CCCCCCCCCCOCC(=O)NC 34a_100000038209_100000183359 [0,0,0,0,0,0|2,0,2]=4 114 B16R0.221 C=CCCCCCCCCCOCC(=O)NC 34a_100000750040_100009814027 [0,0,0,0,0,0|2,0,2]=4 115 B16R0.221 C=CCCCCCCCCCOCC(=O)NC 7a_100000038209_100000183359 [0,0,0,0,0,0|2,0,2]=4 116 B16R0.221 C=CCCCCCCCCCOCC(=O)OC 34a_100000038209_100000747449 [0,0,0,0,0,0|1,0,2]=3 117 B16R0.221 C=CCCCCCCCCCOCC(=O)OC 7a_100000038209_100000747449 [0,0,0,0,0,0|1,0,2]=3 118 B16R0.221 C=CCCCCCCCCCSCC(=O)CC 62a_100000747405_100009814027 [0,0,0,0,0,0|2,0,2]=4 119 B16R0.221 C=CCCCCCCCCCSCC(=O)CC 62a_100009814027_100000747405 [0,0,0,0,0,0|2,0,2]=4 120 B16R0.221 C=CCCCCCCCCCSCC(=O)NC 62a_100000183359_100009814027 [0,0,0,0,0,0|2,0,2]=4 121 B16R0.221 C=CCCCCCCCCCSCC(=O)NC 62a_100009814027_100000183359 [0,0,0,0,0,0|2,0,2]=4 122 B16R0.221 C=CCCCCCCCCCSCC(=O)OC 62a_100000747449_100009814027 [0,0,0,0,0,0|1,0,2]=3 123 B16R0.221 C=CCCCCCCCCCSCC(=O)OC 62a_100009814027_100000747449 [0,0,0,0,0,0|1,0,2]=3 124 B16R0.221 C=CCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011933949 [0,0,0,0,0,0|2,0,2]=4 125 B16R0.221 C=CCCCCCCCCNCCC(=O)NC 34a_100000738227_100011933949 [0,0,0,0,0,0|2,0,2]=4 126 B16R0.221 C=CCCCCCCCCOCCC(=O)NC 34a_100000754576_100011933949 [0,0,0,0,0,0|2,0,2]=4 127 B16R0.221 C=CCCCCCCCCOCCC(=O)NC 34a_100011215194_100012179268 [0,0,0,0,0,0|2,0,2]=4 128 B16R0.221 C=CCCCCCCCCOCCC(=O)NC 7a_100011215194_100000737683 [0,0,0,0,0,0|2,0,2]=4 129 B16R0.221 C=CCCCCCCCCOCCC(=O)OC 34a_100011215194_100000742370 [0,0,0,0,0,0|1,0,2]=3 130 B16R0.221 C=CCCCCCCCCOCCC(=O)OC 7a_100011215194_100000204255 [0,0,0,0,0,0|1,0,2]=3 131 B16R0.221 C=CCCCCCCCCSCCC(=O)NC 62a_100000737683_100011933949 [0,0,0,0,0,0|2,0,2]=4 132 B16R0.221 C=CCCCCCCCCSCCC(=O)NC 62a_100011933949_100000737683 [0,0,0,0,0,0|2,0,2]=4 133 B16R0.221 C=CCCCCCCCCSCCC(=O)OC 62a_100000204255_100011933949 [0,0,0,0,0,0|1,0,2]=3 134 B16R0.221 C=CCCCCCCCCSCCC(=O)OC 62a_100011933949_100000204255 [0,0,0,0,0,0|1,0,2]=3 135 B16R0.221 C=CCCCCCCCCSCOC(=O)OC 62a_100011933949_100000139417 [0,0,0,0,0,0|2,0,2]=4 136 B16R0.221 C=CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100012355270 [0,0,0,0,0,0|2,0,2]=4 137 B16R0.221 C=CCCCCCCCNCCCC(=O)NC 34a_100000740002_100012355270 [0,0,0,0,0,0|2,0,2]=4 138 B16R0.221 C=CCCCCCCCOCCCC(=O)NC 34a_100000730831_100000741757 [0,0,0,0,0,0|2,0,2]=4 139 B16R0.221 C=CCCCCCCCOCCCC(=O)NC 7a_100000730831_100000741757 [0,0,0,0,0,0|2,0,2]=4 140 B16R0.221 C=CCCCCCCCOCCCC(=O)OC 34a_100000730831_100000742333 [0,0,0,0,0,0|1,0,2]=3 141 B16R0.221 C=CCCCCCCCOCCCC(=O)OC 7a_100000730831_100011218270 [0,0,0,0,0,0|1,0,2]=3 142 B16R0.221 C=CCCCCCCCOCCNC(=O)OC 34a_100000757965_100012355270 [0,0,0,0,0,0|2,0,2]=4 143 B16R0.221 C=CCCCCCCCOCCOC(=O)OC 34a_100010262106_100012355270 [0,0,0,0,0,0|2,0,2]=4 144 B16R0.221 C=CCCCCCCCSCCCC(=O)NC 62a_100000741757_100012355270 [0,0,0,0,0,0|2,0,2]=4 145 B16R0.221 C=CCCCCCCCSCCCC(=O)NC 62a_100012355270_100000741757 [0,0,0,0,0,0|2,0,2]=4 146 B16R0.221 C=CCCCCCCCSCCCC(=O)OC 62a_100011218270_100012355270 [0,0,0,0,0,0|1,0,2]=3 147 B16R0.221 C=CCCCCCCCSCCCC(=O)OC 62a_100012355270_100011218270 [0,0,0,0,0,0|1,0,2]=3 148 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 34a_100000059025_100011215473 [0,0,0,0,0,0|1,0,2]=3 149 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 34a_200011216477_100000204269 [0,0,0,0,0,0|1,0,2]=3 150 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 7a_100000059025_100011215473 [0,0,0,0,0,0|1,0,2]=3 151 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 7a_200011216477_100000204269 [0,0,0,0,0,0|1,0,2]=3 152 B16R0.221 C=CCCCCCCOCCOCC(=O)OC 34a_200011216477_100000090808 [0,0,0,0,0,0|2,0,2]=4 153 B16R0.221 C=CCCCCCCOCCOCC(=O)OC 7a_200011216477_100000090808 [0,0,0,0,0,0|2,0,2]=4 154 B16R0.221 C=CCCCCCCSCCCCC(=O)OC 62a_100000204269_100011215473 [0,0,0,0,0,0|1,0,2]=3 155 B16R0.221 C=CCCCCCCSCCCCC(=O)OC 62a_100011215473_100000204269 [0,0,0,0,0,0|1,0,2]=3 156 B16R0.221 C=CCCCCCCSCCOCC(=O)OC 62a_100000090808_100011215473 [0,0,0,0,0,0|2,0,2]=4 157 B16R0.221 C=CCCCCCCSCCOCC(=O)OC 62a_100011215473_100000090808 [0,0,0,0,0,0|2,0,2]=4 158 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 34a_100000074720_100000700193 [0,0,0,0,0,0|1,0,2]=3 159 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 34a_100011216702_100009816466 [0,0,0,0,0,0|1,0,2]=3 160 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 7a_100000074720_100000700193 [0,0,0,0,0,0|1,0,2]=3 161 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 7a_100011216702_100009816466 [0,0,0,0,0,0|1,0,2]=3 162 B16R0.221 C=CCCCCCSCCCCCC(=O)OC 62a_100000700193_100009816466 [0,0,0,0,0,0|1,0,2]=3 163 B16R0.221 C=CCCCCCSCCCCCC(=O)OC 62a_100009816466_100000700193 [0,0,0,0,0,0|1,0,2]=3 164 B16R0.221 C=CCCCCNCCCCCCC(=O)OC 2230a_100000703577_100009815986 [0,0,0,0,0,0|1,0,2]=3 165 B16R0.221 C=CCCCCNCCCCCCC(=O)OC 34a_100000703577_100009815986 [0,0,0,0,0,0|1,0,2]=3 166 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 34a_100000766645_100009815986 [0,0,0,0,0,0|1,0,2]=3 167 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 34a_100009863599_100011215482 [0,0,0,0,0,0|1,0,2]=3 168 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 7a_100000766645_100009815986 [0,0,0,0,0,0|1,0,2]=3 169 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 7a_100009863599_100011215482 [0,0,0,0,0,0|1,0,2]=3 170 B16R0.221 C=CCCCCSCCCCCCC(=O)OC 62a_100009815986_100011215482 [0,0,0,0,0,0|1,0,2]=3 171 B16R0.221 C=CCCCCSCCCCCCC(=O)OC 62a_100011215482_100009815986 [0,0,0,0,0,0|1,0,2]=3 172 B16R0.221 C=CCCCNCCCCCCCC(=O)OC 2230a_100000700776_100010004213 [0,0,0,0,0,0|1,0,2]=3 173 B16R0.221 C=CCCCNCCCCCCCC(=O)OC 34a_100000700776_100010004213 [0,0,0,0,0,0|1,0,2]=3 174 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 34a_100000758997_100010004213 [0,0,0,0,0,0|1,0,2]=3 175 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000757094 [0,0,0,0,0,0|1,0,2]=3 176 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 7a_100000758997_100010004213 [0,0,0,0,0,0|1,0,2]=3 177 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 7a_100011022521_100000757094 [0,0,0,0,0,0|1,0,2]=3 178 B16R0.221 C=CCCCSCCCCCCCC(=O)OC 62a_100010004213_100000757094 [0,0,0,0,0,0|1,0,2]=3 179 B16R0.221 C=CCCCSCCCCCCCC(=O)OC 62a_100011713584_100010004213 [0,0,0,0,0,0|1,0,2]=3 180 B16R0.221 C=CCCNCCCCCCCCC(=O)OC 2230a_100015191253_100010282707 [0,0,0,0,0,0|1,0,2]=3 181 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000754431 [0,0,0,0,0,0|1,0,2]=3 182 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 34a_100011205117_100010282707 [0,0,0,0,0,0|1,0,2]=3 183 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000754431 [0,0,0,0,0,0|1,0,2]=3 184 B16R0.221 C=CCCSCCCCCCCCC(=O)OC 62a_100000754431_100010282707 [0,0,0,0,0,0|1,0,2]=3 185 B16R0.221 C=CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000754431 [0,0,0,0,0,0|1,0,2]=3 186 B16R0.221 C=CCNCCCCCCCCCC(=O)OC 2230a_100020586998_100009813843 [0,0,0,0,0,0|1,0,2]=3 187 B16R0.221 C=CCOCCCCCCCCCC(=O)OC 34a_200000210373_100009813843 [0,0,0,0,0,0|1,0,2]=3 188 B16R0.221 C=CCOCCOCCCCCCC(=O)OC 34a_100000037705_100009815986 [0,0,0,0,0,0|2,0,2]=4 189 B16R0.221 C=CCOCCOCCCCCCC(=O)OC 7a_100000037705_100009815986 [0,0,0,0,0,0|2,0,2]=4 190 B16R0.221 C=CCSCCCCCCCCCC(=O)OC 62a_100000210623_100009813843 [0,0,0,0,0,0|1,0,2]=3 191 B16R0.221 C=COCCCCOCCCCCC(=O)OC 34a_100000031558_100009816466 [0,0,0,0,0,0|2,0,2]=4 192 B16R0.221 C=COCCCCOCCCCCC(=O)OC 7a_100000031558_100009816466 [0,0,0,0,0,0|2,0,2]=4 193 B16R0.221 C=COCCCNCCCCCCC(=O)OC 2230a_100000210767_100009815986 [0,0,0,0,0,0|2,0,2]=4 194 B16R0.221 C=COCCCNCCCCCCC(=O)OC 34a_100000210767_100009815986 [0,0,0,0,0,0|2,0,2]=4 195 B16R0.221 C=COCCOCCCCCCCC(=O)OC 34a_100000033082_100010004213 [0,0,0,0,0,0|2,0,2]=4 196 B16R0.221 C=COCCOCCCCCCCC(=O)OC 34a_100011022521_100000039644 [0,0,0,0,0,0|2,0,2]=4 197 B16R0.221 C=COCCOCCCCCCCC(=O)OC 7a_100011022521_100000039644 [0,0,0,0,0,0|2,0,2]=4 198 B16R0.221 C=COCCSCCCCCCCC(=O)OC 62a_100000039644_100010004213 [0,0,0,0,0,0|2,0,2]=4 199 B16R0.221 C=COCCSCCCCCCCC(=O)OC 62a_100010004213_100000039644 [0,0,0,0,0,0|2,0,2]=4 200 B16R0.221 CC#CCCOCCCCCCCC(=O)OC 34a_100000750427_100010004213 [0,0,0,0,0,0|1,0,2]=3 201 B16R0.221 CC#CCNCCCCCCCCC(=O)OC 2230a_100000685387_100010282707 [0,0,0,0,0,0|1,0,2]=3 202 B16R0.221 CC#CCNCCCCCCCCC(=O)OC 34a_100000685387_100010282707 [0,0,0,0,0,0|1,0,2]=3 203 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 34a_100000035544_100000748600 [0,0,0,0,0,0|1,0,2]=3 204 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 34a_100000761923_100010282707 [0,0,0,0,0,0|1,0,2]=3 205 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 7a_100000035544_100000748600 [0,0,0,0,0,0|1,0,2]=3 206 B16R0.221 CC#CCSCCCCCCCCC(=O)OC 62a_100000748600_100010282707 [0,0,0,0,0,0|1,0,2]=3 207 B16R0.221 CC#CCSCCCCCCCCC(=O)OC 62a_100010282707_100000748600 [0,0,0,0,0,0|1,0,2]=3 208 B16R0.221 CC/C=C/CCCOCCCCCC(=O)OC 34a_100016287902_100009816466 [0,0,0,0,0,0|1,0,2]=3 209 B16R0.221 CC/C=C/CCCOCCCCCC(=O)OC 7a_100016287902_100009816466 [0,0,0,0,0,0|1,0,2]=3 210 B16R0.221 CC/C=C\CCCCCCCNCC(=O)NC 269862a_100000693194_200025770492 [0,0,0,0,0,0|2,0,2]=4 211 B16R0.221 CC/C=C\CCCCCNCCCC(=O)NC 269862a_100000740002_100016288537 [0,0,0,0,0,0|2,0,2]=4 212 B16R0.221 CC/C=C\CCCCCOCCCC(=O)NC 34a_100016268722_100000741757 [0,0,0,0,0,0|2,0,2]=4 213 B16R0.221 CC/C=C\CCCCCOCCCC(=O)NC 7a_100016268722_100000741757 [0,0,0,0,0,0|2,0,2]=4 214 B16R0.221 CC/C=C\CCCCCOCCCC(=O)OC 34a_100016268722_100000742333 [0,0,0,0,0,0|1,0,2]=3 215 B16R0.221 CC/C=C\CCCCCOCCCC(=O)OC 7a_100016268722_100011218270 [0,0,0,0,0,0|1,0,2]=3 216 B16R0.221 CC/C=C\CCCCOCCCCC(=O)OC 34a_100016287862_100000204269 [0,0,0,0,0,0|1,0,2]=3 217 B16R0.221 CC/C=C\CCCCOCCCCC(=O)OC 7a_100016287862_100000204269 [0,0,0,0,0,0|1,0,2]=3 218 B16R0.221 CC/C=C\CCCCOCCOCC(=O)OC 34a_100016287862_100000090808 [0,0,0,0,0,0|2,0,2]=4 219 B16R0.221 CC/C=C\CCCCOCCOCC(=O)OC 7a_100016287862_100000090808 [0,0,0,0,0,0|2,0,2]=4 220 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 34a_100009863599_100015370543 [0,0,0,0,0,0|1,0,2]=3 221 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 34a_100016288707_100009815986 [0,0,0,0,0,0|1,0,2]=3 222 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 7a_100009863599_100015370543 [0,0,0,0,0,0|1,0,2]=3 223 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 7a_100016288707_100009815986 [0,0,0,0,0,0|1,0,2]=3 224 B16R0.221 CC/C=C\CCSCCCCCCC(=O)OC 62a_100009815986_100015370543 [0,0,0,0,0,0|1,0,2]=3 225 B16R0.221 CC/C=C\CCSCCCCCCC(=O)OC 62a_100015370543_100009815986 [0,0,0,0,0,0|1,0,2]=3 226 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 34a_100011022521_100103147603 [0,0,0,0,0,0|1,0,2]=3 227 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 34a_100016268518_100010004213 [0,0,0,0,0,0|1,0,2]=3 228 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 7a_100011022521_100103147603 [0,0,0,0,0,0|1,0,2]=3 229 B16R0.221 CC/C=C\CSCCCCCCCC(=O)OC 62a_100010004213_100103147603 [0,0,0,0,0,0|1,0,2]=3 230 B16R0.221 CC/C=C\CSCCCCCCCC(=O)OC 62a_100103147603_100010004213 [0,0,0,0,0,0|1,0,2]=3 231 B16R0.221 CC=C=CCCOCCCCCCC(=O)OC 34a_100011020354_100009815986 [0,0,0,0,0,0|1,0,3]=4 232 B16R0.221 CC=CCCCOCCCCCCC(=O)OC 34a_100020645299_100009815986 [0,0,0,0,0,0|1,0,2]=3 233 B16R0.221 CC=CCOCCCCCCCCC(=O)OC 34a_100000035544_100000070051 [0,0,0,0,0,0|1,0,2]=3 234 B16R0.221 CC=CCOCCCCCCCCC(=O)OC 7a_100000035544_100000070051 [0,0,0,0,0,0|1,0,2]=3 235 B16R0.221 CC=CCSCCCCCCCCC(=O)OC 62a_100000070051_100010282707 [0,0,0,0,0,0|1,0,2]=3 236 B16R0.221 CC=CCSCCCCCCCCC(=O)OC 62a_100010282707_100000070051 [0,0,0,0,0,0|1,0,2]=3 237 B16R0.221 CCC#CCCCCCCNCCC(=O)NC 2230a_100000738227_200000036426 [0,0,0,0,0,0|2,0,2]=4 238 B16R0.221 CCC#CCCCCCCNCCC(=O)NC 34a_100000738227_200000036426 [0,0,0,0,0,0|2,0,2]=4 239 B16R0.221 CCC#CCCCCCCOCCC(=O)NC 34a_100000754576_200000036426 [0,0,0,0,0,0|2,0,2]=4 240 B16R0.221 CCC#CCCCCCCSCCC(=O)NC 62a_100000737683_200000036426 [0,0,0,0,0,0|2,0,2]=4 241 B16R0.221 CCC#CCCCCCCSCCC(=O)NC 62a_200000036426_100000737683 [0,0,0,0,0,0|2,0,2]=4 242 B16R0.221 CCC#CCCCCCCSCCC(=O)OC 62a_100000204255_200000036426 [0,0,0,0,0,0|1,0,2]=3 243 B16R0.221 CCC#CCCCCCCSCCC(=O)OC 62a_200000036426_100000204255 [0,0,0,0,0,0|1,0,2]=3 244 B16R0.221 CCC#CCCCCCCSCOC(=O)OC 62a_200000036426_100000139417 [0,0,0,0,0,0|2,0,2]=4 245 B16R0.221 CCC#CCCOCCCCCCC(=O)OC 34a_100000036655_100009815986 [0,0,0,0,0,0|1,0,2]=3 246 B16R0.221 CCC#CCCOCCCCCCC(=O)OC 7a_100000036655_100009815986 [0,0,0,0,0,0|1,0,2]=3 247 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 34a_100000032950_100010004213 [0,0,0,0,0,0|1,0,2]=3 248 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 34a_100011022521_100009813939 [0,0,0,0,0,0|1,0,2]=3 249 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 7a_100011022521_100009813939 [0,0,0,0,0,0|1,0,2]=3 250 B16R0.221 CCC#CCSCCCCCCCC(=O)OC 62a_100009813939_100010004213 [0,0,0,0,0,0|1,0,2]=3 251 B16R0.221 CCC#CCSCCCCCCCC(=O)OC 62a_100010004213_100009813939 [0,0,0,0,0,0|1,0,2]=3 252 B16R0.221 CCC(=O)CCCCCCCCCCCCO 1458a_100000210414_100009813331 [0,0,0,0,0,0|2,0,0]=2 253 B16R0.221 CCC(=O)CCCCCCOCCCCCO 1458a_100000210414_200132310570 [0,0,0,0,0,0|3,0,0]=3 254 B16R0.221 CCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747405 [0,0,0,0,0,0|3,0,0]=3 255 B16R0.221 CCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747405 [0,0,0,0,0,0|3,0,0]=3 256 B16R0.221 CCC(=O)COCCCCCCCCCCO 34a_100000725409_100009813290 [0,0,0,0,0,0|3,0,0]=3 257 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100000747405_200000033068 [0,0,0,0,0,0|3,0,0]=3 258 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747405 [0,0,0,0,0,0|3,0,0]=3 259 B16R0.221 CCC(=O)NCCNCCCCCCCCO 34a_100132302217_100000033203 [0,0,0,0,0,0|4,0,0]=4 260 B16R0.221 CCC(=O)NCCOCCCCCCCCO 34a_200000158885_100000033203 [0,0,0,0,0,0|4,0,0]=4 261 B16R0.221 CCC(=O)NCCOCCCCCCCCO 7a_200000158885_100000033203 [0,0,0,0,0,0|4,0,0]=4 262 B16R0.221 CCC(=O)OCCOCCCCCCCCO 7a_200000031056_100000033203 [0,0,0,0,0,0|4,0,0]=4 263 B16R0.221 CCC/C=C/COCCCCCCC(=O)OC 34a_100016278788_100009815986 [0,0,0,0,0,0|1,0,2]=3 264 B16R0.221 CCC/C=C/COCCCCCCC(=O)OC 7a_100016278788_100009815986 [0,0,0,0,0,0|1,0,2]=3 265 B16R0.221 CCCC#CCCOCCCCCC(=O)OC 34a_100000042726_100009816466 [0,0,0,0,0,0|1,0,2]=3 266 B16R0.221 CCCC#CCCOCCCCCC(=O)OC 7a_100000042726_100009816466 [0,0,0,0,0,0|1,0,2]=3 267 B16R0.221 CCCC#CCOCCCCCCC(=O)OC 34a_100000034806_100009815986 [0,0,0,0,0,0|1,0,2]=3 268 B16R0.221 CCCC#CCOCCCCCCC(=O)OC 7a_100000034806_100009815986 [0,0,0,0,0,0|1,0,2]=3 269 B16R0.221 CCCC/C=C/CCCCOCCC(=O)NC 34a_200020645093_100012179268 [0,0,0,0,0,0|2,0,2]=4 270 B16R0.221 CCCC/C=C/CCCCOCCC(=O)NC 7a_200020645093_100000737683 [0,0,0,0,0,0|2,0,2]=4 271 B16R0.221 CCCC/C=C/CCCCOCCC(=O)OC 34a_200020645093_100000742370 [0,0,0,0,0,0|1,0,2]=3 272 B16R0.221 CCCC/C=C/CCCCOCCC(=O)OC 7a_200020645093_100000204255 [0,0,0,0,0,0|1,0,2]=3 273 B16R0.221 CCCC/C=C/COCCCCCC(=O)OC 34a_200016272032_100009816466 [0,0,0,0,0,0|1,0,2]=3 274 B16R0.221 CCCC/C=C/COCCCCCC(=O)OC 7a_200016272032_100009816466 [0,0,0,0,0,0|1,0,2]=3 275 B16R0.221 CCCC/C=C\CCOCCCCC(=O)OC 34a_200016286491_100000204269 [0,0,0,0,0,0|1,0,2]=3 276 B16R0.221 CCCC/C=C\CCOCCCCC(=O)OC 7a_200016286491_100000204269 [0,0,0,0,0,0|1,0,2]=3 277 B16R0.221 CCCC/C=C\CCOCCOCC(=O)OC 34a_200016286491_100000090808 [0,0,0,0,0,0|2,0,2]=4 278 B16R0.221 CCCC/C=C\CCOCCOCC(=O)OC 7a_200016286491_100000090808 [0,0,0,0,0,0|2,0,2]=4 279 B16R0.221 CCCCC#CCCCCOCCC(=O)NC 34a_200000066234_100012179268 [0,0,0,0,0,0|2,0,2]=4 280 B16R0.221 CCCCC#CCCCCOCCC(=O)NC 7a_200000066234_100000737683 [0,0,0,0,0,0|2,0,2]=4 281 B16R0.221 CCCCC#CCCCCOCCC(=O)OC 34a_200000066234_100000742370 [0,0,0,0,0,0|1,0,2]=3 282 B16R0.221 CCCCC#CCCCCOCCC(=O)OC 7a_200000066234_100000204255 [0,0,0,0,0,0|1,0,2]=3 283 B16R0.221 CCCCC#CCCCNCCCC(=O)NC 2230a_100000740002_200000047210 [0,0,0,0,0,0|2,0,2]=4 284 B16R0.221 CCCCC#CCCCNCCCC(=O)NC 34a_100000740002_200000047210 [0,0,0,0,0,0|2,0,2]=4 285 B16R0.221 CCCCC#CCCCOCCNC(=O)OC 34a_100000757965_200000047210 [0,0,0,0,0,0|2,0,2]=4 286 B16R0.221 CCCCC#CCCCOCCOC(=O)OC 34a_100010262106_200000047210 [0,0,0,0,0,0|2,0,2]=4 287 B16R0.221 CCCCC#CCCCSCCCC(=O)NC 62a_100000741757_200000047210 [0,0,0,0,0,0|2,0,2]=4 288 B16R0.221 CCCCC#CCCCSCCCC(=O)NC 62a_200000047210_100000741757 [0,0,0,0,0,0|2,0,2]=4 289 B16R0.221 CCCCC#CCCCSCCCC(=O)OC 62a_100011218270_200000047210 [0,0,0,0,0,0|1,0,2]=3 290 B16R0.221 CCCCC#CCCCSCCCC(=O)OC 62a_200000047210_100011218270 [0,0,0,0,0,0|1,0,2]=3 291 B16R0.221 CCCCC#CCCOCCCCC(=O)OC 34a_100000037610_100000204269 [0,0,0,0,0,0|1,0,2]=3 292 B16R0.221 CCCCC#CCCOCCCCC(=O)OC 7a_100000037610_100000204269 [0,0,0,0,0,0|1,0,2]=3 293 B16R0.221 CCCCC#CCCOCCOCC(=O)OC 34a_100000037610_100000090808 [0,0,0,0,0,0|2,0,2]=4 294 B16R0.221 CCCCC#CCCOCCOCC(=O)OC 7a_100000037610_100000090808 [0,0,0,0,0,0|2,0,2]=4 295 B16R0.221 CCCCC#CCOCCCCCC(=O)OC 34a_200000034558_100009816466 [0,0,0,0,0,0|1,0,2]=3 296 B16R0.221 CCCCC#CCOCCCCCC(=O)OC 7a_200000034558_100009816466 [0,0,0,0,0,0|1,0,2]=3 297 B16R0.221 CCCCC/C=C/COCCCCC(=O)OC 34a_100016258190_100000204269 [0,0,0,0,0,0|1,0,2]=3 298 B16R0.221 CCCCC/C=C/COCCCCC(=O)OC 7a_100016258190_100000204269 [0,0,0,0,0,0|1,0,2]=3 299 B16R0.221 CCCCC/C=C/COCCOCC(=O)OC 34a_100016258190_100000090808 [0,0,0,0,0,0|2,0,2]=4 300 B16R0.221 CCCCC/C=C/COCCOCC(=O)OC 7a_100016258190_100000090808 [0,0,0,0,0,0|2,0,2]=4 301 B16R0.221 CCCCC/C=C\CCCOCCC(=O)NC 34a_100020655193_100012179268 [0,0,0,0,0,0|2,0,2]=4 302 B16R0.221 CCCCC/C=C\CCCOCCC(=O)NC 7a_100020655193_100000737683 [0,0,0,0,0,0|2,0,2]=4 303 B16R0.221 CCCCC/C=C\CCCOCCC(=O)OC 34a_100020655193_100000742370 [0,0,0,0,0,0|1,0,2]=3 304 B16R0.221 CCCCC/C=C\CCCOCCC(=O)OC 7a_100020655193_100000204255 [0,0,0,0,0,0|1,0,2]=3 305 B16R0.221 CCCCC/C=C\CCOCCCC(=O)NC 34a_100016277358_100000741757 [0,0,0,0,0,0|2,0,2]=4 306 B16R0.221 CCCCC/C=C\CCOCCCC(=O)NC 7a_100016277358_100000741757 [0,0,0,0,0,0|2,0,2]=4 307 B16R0.221 CCCCC/C=C\CCOCCCC(=O)OC 34a_100016277358_100000742333 [0,0,0,0,0,0|1,0,2]=3 308 B16R0.221 CCCCC/C=C\CCOCCCC(=O)OC 7a_100016277358_100011218270 [0,0,0,0,0,0|1,0,2]=3 309 B16R0.221 CCCCCC#CCCOCCCC(=O)NC 34a_200000042877_100000741757 [0,0,0,0,0,0|2,0,2]=4 310 B16R0.221 CCCCCC#CCCOCCCC(=O)NC 7a_200000042877_100000741757 [0,0,0,0,0,0|2,0,2]=4 311 B16R0.221 CCCCCC#CCCOCCCC(=O)OC 34a_200000042877_100000742333 [0,0,0,0,0,0|1,0,2]=3 312 B16R0.221 CCCCCC#CCCOCCCC(=O)OC 7a_200000042877_100011218270 [0,0,0,0,0,0|1,0,2]=3 313 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 34a_100000059025_100009816472 [0,0,0,0,0,0|1,0,2]=3 314 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 34a_200000033628_100000204269 [0,0,0,0,0,0|1,0,2]=3 315 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 7a_100000059025_100009816472 [0,0,0,0,0,0|1,0,2]=3 316 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 7a_200000033628_100000204269 [0,0,0,0,0,0|1,0,2]=3 317 B16R0.221 CCCCCC#CCOCCOCC(=O)OC 34a_200000033628_100000090808 [0,0,0,0,0,0|2,0,2]=4 318 B16R0.221 CCCCCC#CCOCCOCC(=O)OC 7a_200000033628_100000090808 [0,0,0,0,0,0|2,0,2]=4 319 B16R0.221 CCCCCC#CCSCCCCC(=O)OC 62a_100000204269_100009816472 [0,0,0,0,0,0|1,0,2]=3 320 B16R0.221 CCCCCC#CCSCCCCC(=O)OC 62a_100009816472_100000204269 [0,0,0,0,0,0|1,0,2]=3 321 B16R0.221 CCCCCC#CCSCCOCC(=O)OC 62a_100000090808_100009816472 [0,0,0,0,0,0|2,0,2]=4 322 B16R0.221 CCCCCC#CCSCCOCC(=O)OC 62a_100009816472_100000090808 [0,0,0,0,0,0|2,0,2]=4 323 B16R0.221 CCCCCC/C=C/COCCCC(=O)NC 34a_200016276170_100000741757 [0,0,0,0,0,0|2,0,2]=4 324 B16R0.221 CCCCCC/C=C/COCCCC(=O)NC 7a_200016276170_100000741757 [0,0,0,0,0,0|2,0,2]=4 325 B16R0.221 CCCCCC/C=C/COCCCC(=O)OC 34a_200016276170_100000742333 [0,0,0,0,0,0|1,0,2]=3 326 B16R0.221 CCCCCC/C=C/COCCCC(=O)OC 7a_200016276170_100011218270 [0,0,0,0,0,0|1,0,2]=3 327 B16R0.221 CCCCCCC#CCCOCCC(=O)NC 34a_200000033163_100012179268 [0,0,0,0,0,0|2,0,2]=4 328 B16R0.221 CCCCCCC#CCCOCCC(=O)NC 7a_200000033163_100000737683 [0,0,0,0,0,0|2,0,2]=4 329 B16R0.221 CCCCCCC#CCCOCCC(=O)OC 34a_200000033163_100000742370 [0,0,0,0,0,0|1,0,2]=3 330 B16R0.221 CCCCCCC#CCCOCCC(=O)OC 7a_200000033163_100000204255 [0,0,0,0,0,0|1,0,2]=3 331 B16R0.221 CCCCCCC#CCOCCCC(=O)NC 34a_200000037284_100000741757 [0,0,0,0,0,0|2,0,2]=4 332 B16R0.221 CCCCCCC#CCOCCCC(=O)NC 7a_200000037284_100000741757 [0,0,0,0,0,0|2,0,2]=4 333 B16R0.221 CCCCCCC#CCOCCCC(=O)OC 34a_200000037284_100000742333 [0,0,0,0,0,0|1,0,2]=3 334 B16R0.221 CCCCCCC#CCOCCCC(=O)OC 7a_200000037284_100011218270 [0,0,0,0,0,0|1,0,2]=3 335 B16R0.221 CCCCCCCC#CCOCCC(=O)NC 34a_200000061759_100012179268 [0,0,0,0,0,0|2,0,2]=4 336 B16R0.221 CCCCCCCC#CCOCCC(=O)NC 7a_200000061759_100000737683 [0,0,0,0,0,0|2,0,2]=4 337 B16R0.221 CCCCCCCC#CCOCCC(=O)OC 34a_200000061759_100000742370 [0,0,0,0,0,0|1,0,2]=3 338 B16R0.221 CCCCCCCC#CCOCCC(=O)OC 7a_200000061759_100000204255 [0,0,0,0,0,0|1,0,2]=3 339 B16R0.221 CCCCCCCC/C=C/COCC(=O)CC 7a_200020667288_100000747405 [0,0,0,0,0,0|2,0,2]=4 340 B16R0.221 CCCCCCCC/C=C/COCC(=O)NC 34a_200020667288_100000183359 [0,0,0,0,0,0|2,0,2]=4 341 B16R0.221 CCCCCCCC/C=C/COCC(=O)NC 7a_200020667288_100000183359 [0,0,0,0,0,0|2,0,2]=4 342 B16R0.221 CCCCCCCC/C=C/COCC(=O)OC 34a_200020667288_100000747449 [0,0,0,0,0,0|1,0,2]=3 343 B16R0.221 CCCCCCCC/C=C/COCC(=O)OC 7a_200020667288_100000747449 [0,0,0,0,0,0|1,0,2]=3 344 B16R0.221 CCCCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218819 [0,0,0,0,0,0|3,0,1]=4 345 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000210684 [0,0,0,0,0,0|1,0,0]=1 346 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000756256_100000210202 [0,0,0,0,0,0|1,0,0]=1 347 B16R0.221 CCCCCCCCCCCCCC(=O)CF 1458a_100000756256_100015361967 [0,0,0,0,0,0|2,0,0]=2 348 B16R0.221 CCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000210684 [0,0,0,0,0,0|2,0,0]=2 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CCCCCCCCCCCCNC(=O)CO 527a_100000210451_100000210174 [0,0,0,0,0,0|3,0,0]=3 361 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100000210451_106832991635 [0,0,0,0,0,0|2,0,0]=2 362 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100000210451 [0,0,0,0,0,0|2,0,0]=2 363 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100000210451_100102657272 [0,0,0,0,0,0|2,0,0]=2 364 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100000210451 [0,0,0,0,0,0|2,0,0]=2 365 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_100000210451_100102657272 [0,0,0,0,0,0|2,0,0]=2 366 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_106832991638_100000210451 [0,0,0,0,0,0|2,0,0]=2 367 B16R0.221 CCCCCCCCCCCCNC(C)CC 2230a_100000209981_100011215052 [0,0,0,0,0,0|3,0,1]=4 368 B16R0.221 CCCCCCCCCCCCNC(C)CC 2230a_100000210451_100000758301 [0,0,0,0,0,0|3,0,1]=4 369 B16R0.221 CCCCCCCCCCCCNC(C)CC 270004a_100000209981_100011218549 [0,0,0,0,0,0|3,0,1]=4 370 B16R0.221 CCCCCCCCCCCCNC(C)CC 34a_100000210451_100011215416 [0,0,0,0,0,0|3,0,1]=4 371 B16R0.221 CCCCCCCCCCCCOC(C)CC 34a_100000210810_100011215416 [0,0,0,0,0,0|3,0,1]=4 372 B16R0.221 CCCCCCCCCCCCOC(C)CC 7a_100000210228_100000759014 [0,0,0,0,0,0|3,0,1]=4 373 B16R0.221 CCCCCCCCCCCCOC(C)CC 7a_100000210810_100000758301 [0,0,0,0,0,0|3,0,1]=4 374 B16R0.221 CCCCCCCCCCCCSC(C)OC 62a_100009879195_100000759014 [0,0,0,0,0,0|2,0,1]=3 375 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215454 [0,0,0,0,0,0|2,0,0]=2 376 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_200011215754_100000183359 [0,0,0,0,0,0|2,0,0]=2 377 B16R0.221 CCCCCCCCCCCNCC(=O)NC 34a_200011215754_100000183359 [0,0,0,0,0,0|2,0,0]=2 378 B16R0.221 CCCCCCCCCCCNCC(=O)OC 2230a_200011215754_100000747449 [0,0,0,0,0,0|1,0,0]=1 379 B16R0.221 CCCCCCCCCCCNCC(=O)OC 34a_200011215754_100000747449 [0,0,0,0,0,0|1,0,0]=1 380 B16R0.221 CCCCCCCCCCCNCC(C)CC 2230a_100020588543_100011215454 [0,0,0,0,0,0|3,0,1]=4 381 B16R0.221 CCCCCCCCCCCNCC(C)CC 2230a_200011215754_100000748023 [0,0,0,0,0,0|3,0,1]=4 382 B16R0.221 CCCCCCCCCCCNCC(C)CC 270004a_200011215754_100000243153 [0,0,0,0,0,0|3,0,1]=4 383 B16R0.221 CCCCCCCCCCCNCC(C)CC 34a_200011215754_100000748023 [0,0,0,0,0,0|3,0,1]=4 384 B16R0.221 CCCCCCCCCCCNCC(O)CC 2230a_100011218483_100011215454 [0,0,0,0,0,0|2,0,2]=4 385 B16R0.221 CCCCCCCCCCCNCC(O)CC 2230a_200011215754_100011218378 [0,0,0,0,0,0|2,0,2]=4 386 B16R0.221 CCCCCCCCCCCNCC(O)CC 34a_200011215754_100011218378 [0,0,0,0,0,0|2,0,2]=4 387 B16R0.221 CCCCCCCCCCCNC[C@@H](C)CC 2230a_200011215754_100009816398 [0,0,0,0,0,0|3,0,1]=4 388 B16R0.221 CCCCCCCCCCCNC[C@@H](C)CC 34a_200011215754_100009816398 [0,0,0,0,0,0|3,0,1]=4 389 B16R0.221 CCCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011215454 [0,0,0,0,0,0|2,0,1]=3 390 B16R0.221 CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011215454 [0,0,0,0,0,0|2,0,0]=2 391 B16R0.221 CCCCCCCCCCCOCC(=O)CC 7a_100000210809_100000747405 [0,0,0,0,0,0|2,0,0]=2 392 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000210809_100000183359 [0,0,0,0,0,0|2,0,0]=2 393 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011215454 [0,0,0,0,0,0|2,0,0]=2 394 B16R0.221 CCCCCCCCCCCOCC(=O)NC 7a_100000210809_100000183359 [0,0,0,0,0,0|2,0,0]=2 395 B16R0.221 CCCCCCCCCCCOCC(=O)OC 34a_100000210809_100000747449 [0,0,0,0,0,0|1,0,0]=1 396 B16R0.221 CCCCCCCCCCCOCC(=O)OC 7a_100000210809_100000747449 [0,0,0,0,0,0|1,0,0]=1 397 B16R0.221 CCCCCCCCCCCOCC(C)CC 34a_100000210809_100000748023 [0,0,0,0,0,0|3,0,1]=4 398 B16R0.221 CCCCCCCCCCCOCC(C)CC 7a_100000210809_100000748023 [0,0,0,0,0,0|3,0,1]=4 399 B16R0.221 CCCCCCCCCCCOCC(C)OC 34a_100000690652_100011215454 [0,0,0,0,0,0|2,0,1]=3 400 B16R0.221 CCCCCCCCCCCOCC(O)CC 34a_100000210809_100011218378 [0,0,0,0,0,0|2,0,2]=4 401 B16R0.221 CCCCCCCCCCCOCC(O)CC 7a_100000210809_100011218378 [0,0,0,0,0,0|2,0,2]=4 402 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CC 34a_100000210809_100009816398 [0,0,0,0,0,0|3,0,1]=4 403 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CC 7a_100000210809_100009816398 [0,0,0,0,0,0|3,0,1]=4 404 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100011215454 [0,0,0,0,0,0|3,0,1]=4 405 B16R0.221 CCCCCCCCCCCSCC(=O)CC 62a_100000747405_100011215454 [0,0,0,0,0,0|2,0,0]=2 406 B16R0.221 CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011215454 [0,0,0,0,0,0|2,0,0]=2 407 B16R0.221 CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011215454 [0,0,0,0,0,0|1,0,0]=1 408 B16R0.221 CCCCCCCCCCCSCC(O)CC 62a_100011218378_100011215454 [0,0,0,0,0,0|2,0,2]=4 409 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000684558_100000737683 [0,0,0,0,0,0|2,0,0]=2 410 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210320 [0,0,0,0,0,0|2,0,0]=2 411 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000684558_100012179268 [0,0,0,0,0,0|2,0,0]=2 412 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000210320 [0,0,0,0,0,0|2,0,0]=2 413 B16R0.221 CCCCCCCCCCNCCC(=O)OC 2230a_100000684558_100000204255 [0,0,0,0,0,0|1,0,0]=1 414 B16R0.221 CCCCCCCCCCNCCC(=O)OC 34a_100000684558_100000742370 [0,0,0,0,0,0|1,0,0]=1 415 B16R0.221 CCCCCCCCCCNCCC(C)CC 2230a_100020591266_100000210320 [0,0,0,0,0,0|3,0,1]=4 416 B16R0.221 CCCCCCCCCCOCCC(=NO)N 34a_100000749954_100000210320 [0,0,0,0,0,0|4,0,0]=4 417 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000210711_100012179268 [0,0,0,0,0,0|2,0,0]=2 418 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000210320 [0,0,0,0,0,0|2,0,0]=2 419 B16R0.221 CCCCCCCCCCOCCC(=O)NC 7a_100000210711_100000737683 [0,0,0,0,0,0|2,0,0]=2 420 B16R0.221 CCCCCCCCCCOCCC(=O)OC 34a_100000210711_100000742370 [0,0,0,0,0,0|1,0,0]=1 421 B16R0.221 CCCCCCCCCCOCCC(=O)OC 7a_100000210711_100000204255 [0,0,0,0,0,0|1,0,0]=1 422 B16R0.221 CCCCCCCCCCOCCC(C)CC 7a_100011215188_100000210320 [0,0,0,0,0,0|3,0,1]=4 423 B16R0.221 CCCCCCCCCCOCCC(C)OC 7a_100000764861_100000210320 [0,0,0,0,0,0|2,0,1]=3 424 B16R0.221 CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210320 [0,0,0,0,0,0|2,0,0]=2 425 B16R0.221 CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210320 [0,0,0,0,0,0|1,0,0]=1 426 B16R0.221 CCCCCCCCCNC/C=C/C(=O)OC 2230a_100000212291_100000742655 [0,0,0,0,0,0|1,0,2]=3 427 B16R0.221 CCCCCCCCCNC/C=C/C(=O)OC 34a_100000212291_100000742655 [0,0,0,0,0,0|1,0,2]=3 428 B16R0.221 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7a_100000210712_100000742655 [0,0,0,0,0,0|1,0,2]=3 440 B16R0.221 CCCCCCCCCOCCCC(=O)NC 34a_100000210712_100000741757 [0,0,0,0,0,0|2,0,0]=2 441 B16R0.221 CCCCCCCCCOCCCC(=O)NC 7a_100000210712_100000741757 [0,0,0,0,0,0|2,0,0]=2 442 B16R0.221 CCCCCCCCCOCCCC(=O)NN 34a_100000211488_100011214924 [0,0,0,0,0,0|3,0,0]=3 443 B16R0.221 CCCCCCCCCOCCCC(=O)OC 34a_100000210712_100000742333 [0,0,0,0,0,0|1,0,0]=1 444 B16R0.221 CCCCCCCCCOCCCC(=O)OC 7a_100000210712_100011218270 [0,0,0,0,0,0|1,0,0]=1 445 B16R0.221 CCCCCCCCCOCCCC(C)CC 7a_100011216074_100000210328 [0,0,0,0,0,0|3,0,1]=4 446 B16R0.221 CCCCCCCCCOCCCN(C)CC 7a_100000210712_100015186262 [0,0,0,0,0,0|4,0,0]=4 447 B16R0.221 CCCCCCCCCOCCNC(=O)CC 34a_200000158885_100011214924 [0,0,0,0,0,0|3,0,0]=3 448 B16R0.221 CCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210328 [0,0,0,0,0,0|3,0,0]=3 449 B16R0.221 CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011214924 [0,0,0,0,0,0|2,0,0]=2 450 B16R0.221 CCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210328 [0,0,0,0,0,0|3,0,0]=3 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[0,0,0,0,0,0|1,0,0]=1 474 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000210272_100009816466 [0,0,0,0,0,0|1,0,0]=1 475 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210614 [0,0,0,0,0,0|1,0,0]=1 476 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000210272_100009816466 [0,0,0,0,0,0|1,0,0]=1 477 B16R0.221 CCCCCCCOCCCCCC(C)CC 7a_200000035636_100000210614 [0,0,0,0,0,0|3,0,1]=4 478 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100000210614_100009816466 [0,0,0,0,0,0|1,0,0]=1 479 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210316 [0,0,0,0,0,0|1,0,0]=1 480 B16R0.221 CCCCCCNCCCCCCC(=O)OC 2230a_100000210581_100009815986 [0,0,0,0,0,0|1,0,0]=1 481 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100000210259_100009815986 [0,0,0,0,0,0|1,0,0]=1 482 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210314 [0,0,0,0,0,0|1,0,0]=1 483 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100000210259_100009815986 [0,0,0,0,0,0|1,0,0]=1 484 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210314 [0,0,0,0,0,0|1,0,0]=1 485 B16R0.221 CCCCCCOCCOC/C=C/C(=O)OC 34a_100000691444_100000742655 [0,0,0,0,0,0|2,0,2]=4 486 B16R0.221 CCCCCCOCCOC/C=C/C(=O)OC 7a_100000691444_100000742655 [0,0,0,0,0,0|2,0,2]=4 487 B16R0.221 CCCCCCOCCOCCCC(=O)NC 34a_100000691444_100000741757 [0,0,0,0,0,0|3,0,0]=3 488 B16R0.221 CCCCCCOCCOCCCC(=O)NC 7a_100000691444_100000741757 [0,0,0,0,0,0|3,0,0]=3 489 B16R0.221 CCCCCCOCCOCCCC(=O)OC 34a_100000691444_100000742333 [0,0,0,0,0,0|2,0,0]=2 490 B16R0.221 CCCCCCOCCOCCCC(=O)OC 7a_100000691444_100011218270 [0,0,0,0,0,0|2,0,0]=2 491 B16R0.221 CCCCCCOCCOCCOC(=O)NC 34a_100000691444_200011997002 [0,0,0,0,0,0|4,0,0]=4 492 B16R0.221 CCCCCCOCCOCCOC(=O)NC 7a_100000691444_200011997002 [0,0,0,0,0,0|4,0,0]=4 493 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100000210314_100009815986 [0,0,0,0,0,0|1,0,0]=1 494 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210757 [0,0,0,0,0,0|1,0,0]=1 495 B16R0.221 CCCCCNCCCCCCCC(=O)OC 2230a_100000209983_100010004213 [0,0,0,0,0,0|1,0,0]=1 496 B16R0.221 CCCCCNCCOCCCCC(=O)OC 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[0,0,0,0,0,0|3,0,0]=3 508 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100000210326_100010004213 [0,0,0,0,0,0|1,0,0]=1 509 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210326 [0,0,0,0,0,0|1,0,0]=1 510 B16R0.221 CCCCNCCCCCCCCC(=O)OC 2230a_100000102301_100010282707 [0,0,0,0,0,0|1,0,0]=1 511 B16R0.221 CCCCNCCCCCCCCC(=O)OC 7a_106832991798_100010282707 [0,0,0,0,0,0|1,0,0]=1 512 B16R0.221 CCCCNCCCCOC/C=C/C(=O)OC 34a_200011216965_100000742655 [0,0,0,0,0,0|2,0,2]=4 513 B16R0.221 CCCCNCCCCOCCCC(=O)NC 34a_200011216965_100000741757 [0,0,0,0,0,0|3,0,0]=3 514 B16R0.221 CCCCNCCCCOCCCC(=O)OC 34a_200011216965_100000742333 [0,0,0,0,0,0|2,0,0]=2 515 B16R0.221 CCCCNCCCCOCCOC(=O)NC 34a_200011216965_200011997002 [0,0,0,0,0,0|4,0,0]=4 516 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210210 [0,0,0,0,0,0|1,0,0]=1 517 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000210227_100010282707 [0,0,0,0,0,0|1,0,0]=1 518 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210211 [0,0,0,0,0,0|1,0,0]=1 519 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000210227_100010282707 [0,0,0,0,0,0|1,0,0]=1 520 B16R0.221 CCCCOCCCCOC/C=C/C(=O)OC 34a_200000760531_100000742655 [0,0,0,0,0,0|2,0,2]=4 521 B16R0.221 CCCCOCCCCOC/C=C/C(=O)OC 7a_200000760531_100000742655 [0,0,0,0,0,0|2,0,2]=4 522 B16R0.221 CCCCOCCCCOCCCC(=O)NC 34a_200000760531_100000741757 [0,0,0,0,0,0|3,0,0]=3 523 B16R0.221 CCCCOCCCCOCCCC(=O)NC 7a_200000760531_100000741757 [0,0,0,0,0,0|3,0,0]=3 524 B16R0.221 CCCCOCCCCOCCCC(=O)OC 34a_200000760531_100000742333 [0,0,0,0,0,0|2,0,0]=2 525 B16R0.221 CCCCOCCCCOCCCC(=O)OC 7a_200000760531_100011218270 [0,0,0,0,0,0|2,0,0]=2 526 B16R0.221 CCCCOCCCCOCCOC(=O)NC 34a_200000760531_200011997002 [0,0,0,0,0,0|4,0,0]=4 527 B16R0.221 CCCCOCCCCOCCOC(=O)NC 7a_200000760531_200011997002 [0,0,0,0,0,0|4,0,0]=4 528 B16R0.221 CCCCOCCCNCCCCC(=O)OC 2230a_200000211371_100000204269 [0,0,0,0,0,0|2,0,0]=2 529 B16R0.221 CCCCOCCCNCCCCC(=O)OC 34a_200000211371_100000204269 [0,0,0,0,0,0|2,0,0]=2 530 B16R0.221 CCCCOCCCNCCOCC(=O)OC 2230a_200000211371_100000090808 [0,0,0,0,0,0|3,0,0]=3 531 B16R0.221 CCCCOCCCNCCOCC(=O)OC 34a_200000211371_100000090808 [0,0,0,0,0,0|3,0,0]=3 532 B16R0.221 CCCCOCCCOCCCCC(=O)OC 34a_200011215613_100000204269 [0,0,0,0,0,0|2,0,0]=2 533 B16R0.221 CCCCOCCCOCCCCC(=O)OC 7a_200011215613_100000204269 [0,0,0,0,0,0|2,0,0]=2 534 B16R0.221 CCCCOCCCOCCOCC(=O)OC 34a_200011215613_100000090808 [0,0,0,0,0,0|3,0,0]=3 535 B16R0.221 CCCCOCCCOCCOCC(=O)OC 7a_200011215613_100000090808 [0,0,0,0,0,0|3,0,0]=3 536 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [0,0,0,0,0,0|2,0,0]=2 537 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [0,0,0,0,0,0|2,0,0]=2 538 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [0,0,0,0,0,0|2,0,0]=2 539 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [0,0,0,0,0,0|2,0,0]=2 540 B16R0.221 CCCCOCCOCCOCCC(=O)NC 34a_100011215186_100012179268 [0,0,0,0,0,0|4,0,0]=4 541 B16R0.221 CCCCOCCOCCOCCC(=O)NC 7a_100011215186_100000737683 [0,0,0,0,0,0|4,0,0]=4 542 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210210 [0,0,0,0,0,0|3,0,0]=3 543 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100011215186_100000742370 [0,0,0,0,0,0|3,0,0]=3 544 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210211 [0,0,0,0,0,0|3,0,0]=3 545 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100011215186_100000204255 [0,0,0,0,0,0|3,0,0]=3 546 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100000743108_100009816466 [0,0,0,0,0,0|2,0,0]=2 547 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100009816466_100000743108 [0,0,0,0,0,0|2,0,0]=2 548 B16R0.221 CCCCOCOCCCCCCC(=O)OC 34a_100009863599_100011995733 [0,0,0,0,0,0|2,0,0]=2 549 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100009815986_100011995733 [0,0,0,0,0,0|2,0,0]=2 550 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100011995733_100009815986 [0,0,0,0,0,0|2,0,0]=2 551 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100000210211_100010282707 [0,0,0,0,0,0|1,0,0]=1 552 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210210 [0,0,0,0,0,0|1,0,0]=1 553 B16R0.221 CCCCSCCNCCCCCC(=O)OC 2230a_100025743550_100009816466 [0,0,0,0,0,0|2,0,0]=2 554 B16R0.221 CCCCSCCOCCCCCC(=O)OC 34a_200000230436_100009816466 [0,0,0,0,0,0|2,0,0]=2 555 B16R0.221 CCCCSCCOCCCCCC(=O)OC 7a_200000230436_100009816466 [0,0,0,0,0,0|2,0,0]=2 556 B16R0.221 CCCOCCCCCCCCCC(=O)OC 34a_100000210258_100009813843 [0,0,0,0,0,0|1,0,0]=1 557 B16R0.221 CCCOCCCNCCCCCC(=O)OC 2230a_100011217757_100009816466 [0,0,0,0,0,0|2,0,0]=2 558 B16R0.221 CCCOCCCNCCCCCC(=O)OC 34a_100011217757_100009816466 [0,0,0,0,0,0|2,0,0]=2 559 B16R0.221 CCCOCCNCCCCCCC(=O)OC 2230a_100161115042_100009815986 [0,0,0,0,0,0|2,0,0]=2 560 B16R0.221 CCCOCCNCCCCCCC(=O)OC 34a_100161115042_100009815986 [0,0,0,0,0,0|2,0,0]=2 561 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100000752267_100009815986 [0,0,0,0,0,0|2,0,0]=2 562 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011215938 [0,0,0,0,0,0|2,0,0]=2 563 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100000752267_100009815986 [0,0,0,0,0,0|2,0,0]=2 564 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215938 [0,0,0,0,0,0|2,0,0]=2 565 B16R0.221 CCCOCCOCCNCCCC(=O)NC 2230a_200011904461_100000741757 [0,0,0,0,0,0|4,0,0]=4 566 B16R0.221 CCCOCCOCCNCCCC(=O)NC 34a_200011904461_100000741757 [0,0,0,0,0,0|4,0,0]=4 567 B16R0.221 CCCOCCOCCNCCCC(=O)OC 2230a_200011904461_100011218270 [0,0,0,0,0,0|3,0,0]=3 568 B16R0.221 CCCOCCOCCNCCCC(=O)OC 34a_200011904461_100000742333 [0,0,0,0,0,0|3,0,0]=3 569 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215938 [0,0,0,0,0,0|2,0,0]=2 570 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100011215938_100009815986 [0,0,0,0,0,0|2,0,0]=2 571 B16R0.221 CCCSCCCCCCCCCC(=O)OC 62a_100000210303_100009813843 [0,0,0,0,0,0|1,0,0]=1 572 B16R0.221 CCCSCCNCCCCCCC(=O)OC 2230a_100020603323_100009815986 [0,0,0,0,0,0|2,0,0]=2 573 B16R0.221 CCCSCCOCCCCCCC(=O)OC 34a_200000230433_100009815986 [0,0,0,0,0,0|2,0,0]=2 574 B16R0.221 CCCSCCOCCCCCCC(=O)OC 7a_200000230433_100009815986 [0,0,0,0,0,0|2,0,0]=2 575 B16R0.221 CCN(C)CCCCCCCCCCCCO 2230a_100000225621_100009813331 [0,0,0,0,0,0|4,0,0]=4 576 B16R0.221 CCN(C)CCCCCCCCCCCCO 269982a_100000225621_100009813331 [0,0,0,0,0,0|4,0,0]=4 577 B16R0.221 CCNCCCCCCCCCCC(=O)OC 2230a_100015525214_100009812566 [0,0,0,0,0,0|1,0,0]=1 578 B16R0.221 CCNN=CCCCCCCCCC(=O)OC 4a_100000756455_200010166605 [0,0,0,0,0,0|2,0,1]=3 579 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210202 [0,0,0,0,0,0|1,0,0]=1 580 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100121572206_100009812566 [0,0,0,0,0,0|1,0,0]=1 581 B16R0.221 CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210202 [0,0,0,0,0,0|1,0,0]=1 582 B16R0.221 CCOCCCNCCCCCCC(=O)OC 2230a_100000210961_100009815986 [0,0,0,0,0,0|2,0,0]=2 583 B16R0.221 CCOCCCNCCCCCCC(=O)OC 34a_100000210961_100009815986 [0,0,0,0,0,0|2,0,0]=2 584 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100000757476_100009815986 [0,0,0,0,0,0|2,0,0]=2 585 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100009863599_100012232248 [0,0,0,0,0,0|2,0,0]=2 586 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100000757476_100009815986 [0,0,0,0,0,0|2,0,0]=2 587 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100009863599_100012232248 [0,0,0,0,0,0|2,0,0]=2 588 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100009815986_100012232248 [0,0,0,0,0,0|2,0,0]=2 589 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100012232248_100009815986 [0,0,0,0,0,0|2,0,0]=2 590 B16R0.221 CCOCCNCCCCCCCC(=O)OC 2230a_102516460346_100010004213 [0,0,0,0,0,0|2,0,0]=2 591 B16R0.221 CCOCCNCCCCCCCC(=O)OC 34a_102516460346_100010004213 [0,0,0,0,0,0|2,0,0]=2 592 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100000210136_100010004213 [0,0,0,0,0,0|2,0,0]=2 593 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000210147 [0,0,0,0,0,0|2,0,0]=2 594 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100000210136_100010004213 [0,0,0,0,0,0|2,0,0]=2 595 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215890 [0,0,0,0,0,0|2,0,0]=2 596 B16R0.221 CCOCCOCCNCCCCC(=O)OC 2230a_100102712874_100000204269 [0,0,0,0,0,0|3,0,0]=3 597 B16R0.221 CCOCCOCCNCCCCC(=O)OC 34a_100102712874_100000204269 [0,0,0,0,0,0|3,0,0]=3 598 B16R0.221 CCOCCOCCNCCOCC(=O)OC 2230a_100102712874_100000090808 [0,0,0,0,0,0|4,0,0]=4 599 B16R0.221 CCOCCOCCNCCOCC(=O)OC 34a_100102712874_100000090808 [0,0,0,0,0,0|4,0,0]=4 600 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000059025_100011211534 [0,0,0,0,0,0|3,0,0]=3 601 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000210240_100000204269 [0,0,0,0,0,0|3,0,0]=3 602 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000059025_100011211534 [0,0,0,0,0,0|3,0,0]=3 603 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000210240_100000204269 [0,0,0,0,0,0|3,0,0]=3 604 B16R0.221 CCOCCOCCOCCNCC(=O)OC 2230a_100012282185_100000747449 [0,0,0,0,0,0|4,0,0]=4 605 B16R0.221 CCOCCOCCOCCNCC(=O)OC 34a_100012282185_100000747449 [0,0,0,0,0,0|4,0,0]=4 606 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100000033264_100000747449 [0,0,0,0,0,0|4,0,0]=4 607 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100000210240_100000090808 [0,0,0,0,0,0|4,0,0]=4 608 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100011023656_100000210147 [0,0,0,0,0,0|4,0,0]=4 609 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100000033264_100000747449 [0,0,0,0,0,0|4,0,0]=4 610 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100000210240_100000090808 [0,0,0,0,0,0|4,0,0]=4 611 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100011023656_100011215890 [0,0,0,0,0,0|4,0,0]=4 612 B16R0.221 CCOCCOCCSCCCCC(=O)OC 62a_100000204269_100011211534 [0,0,0,0,0,0|3,0,0]=3 613 B16R0.221 CCOCCOCCSCCCCC(=O)OC 62a_100011211534_100000204269 [0,0,0,0,0,0|3,0,0]=3 614 B16R0.221 CCOCCOCCSCCOCC(=O)OC 62a_100000090808_100011211534 [0,0,0,0,0,0|4,0,0]=4 615 B16R0.221 CCOCCOCCSCCOCC(=O)OC 62a_100011211534_100000090808 [0,0,0,0,0,0|4,0,0]=4 616 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100000210147_100010004213 [0,0,0,0,0,0|2,0,0]=2 617 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215890 [0,0,0,0,0,0|2,0,0]=2 618 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100000739092_100010282707 [0,0,0,0,0,0|2,0,0]=2 619 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000739092 [0,0,0,0,0,0|2,0,0]=2 620 B16R0.221 CCSCCCCCCCCCCC(=O)OC 62a_100000210202_100009812566 [0,0,0,0,0,0|1,0,0]=1 621 B16R0.221 CCSCCCOCCCCCCC(=O)OC 34a_100011216438_100009815986 [0,0,0,0,0,0|2,0,0]=2 622 B16R0.221 CCSCCCOCCCCCCC(=O)OC 7a_100011216438_100009815986 [0,0,0,0,0,0|2,0,0]=2 623 B16R0.221 CCSCCNCCCCCCCC(=O)OC 2230a_100000106463_100010004213 [0,0,0,0,0,0|2,0,0]=2 624 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100000212035_100010004213 [0,0,0,0,0,0|2,0,0]=2 625 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100011022521_100000757381 [0,0,0,0,0,0|2,0,0]=2 626 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100000212035_100010004213 [0,0,0,0,0,0|2,0,0]=2 627 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100011022521_100000757381 [0,0,0,0,0,0|2,0,0]=2 628 B16R0.221 CCSCCOCCOCCOCC(=O)OC 34a_100011023656_100000757381 [0,0,0,0,0,0|4,0,0]=4 629 B16R0.221 CCSCCOCCOCCOCC(=O)OC 7a_100011023656_100000757381 [0,0,0,0,0,0|4,0,0]=4 630 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100000757381_100010004213 [0,0,0,0,0,0|2,0,0]=2 631 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100010004213_100000757381 [0,0,0,0,0,0|2,0,0]=2 632 B16R0.221 CNC(=O)CCCCCCCCCCCCO 240690a_100102657272_100102582631 [0,0,0,0,0,0|2,0,0]=2 633 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_100000740002_100000033203 [0,0,0,0,0,0|3,0,0]=3 634 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_102515433106_100000741757 [0,0,0,0,0,0|3,0,0]=3 635 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_100000740002_100000033203 [0,0,0,0,0,0|3,0,0]=3 636 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_102515433106_100000741757 [0,0,0,0,0,0|3,0,0]=3 637 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000741757 [0,0,0,0,0,0|3,0,0]=3 638 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 7a_100009813846_100000741757 [0,0,0,0,0,0|3,0,0]=3 639 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000741757 [0,0,0,0,0,0|3,0,0]=3 640 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 7a_100000033203_100000741757 [0,0,0,0,0,0|3,0,0]=3 641 B16R0.221 CNC(=O)CCCOCCCCCCCCN 34a_102515433106_100000741757 [0,0,0,0,0,0|3,0,0]=3 642 B16R0.221 CNC(=O)CCCOCCCCCNCCN 34a_103619048469_100000741757 [0,0,0,0,0,0|4,0,0]=4 643 B16R0.221 CNC(=O)CCCOCCCOCCCOC 34a_200011215475_100000741757 [0,0,0,0,0,0|4,0,0]=4 644 B16R0.221 CNC(=O)CCCOCCCOCCCOC 7a_200011215475_100000741757 [0,0,0,0,0,0|4,0,0]=4 645 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000033203_100000741757 [0,0,0,0,0,0|3,0,0]=3 646 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000741757_100000033203 [0,0,0,0,0,0|3,0,0]=3 647 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737683 [0,0,0,0,0,0|3,0,0]=3 648 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000738227_100009813782 [0,0,0,0,0,0|3,0,0]=3 649 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000078944_100012179268 [0,0,0,0,0,0|3,0,0]=3 650 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000738227_100009813782 [0,0,0,0,0,0|3,0,0]=3 651 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 34a_100009813782_100012179268 [0,0,0,0,0,0|3,0,0]=3 652 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737683 [0,0,0,0,0,0|3,0,0]=3 653 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 34a_100009868337_100012179268 [0,0,0,0,0,0|3,0,0]=3 654 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737683 [0,0,0,0,0,0|3,0,0]=3 655 B16R0.221 CNC(=O)CCOCCCCCCCCCN 34a_100000078944_100012179268 [0,0,0,0,0,0|3,0,0]=3 656 B16R0.221 CNC(=O)CCOCCCCCCCCCO 34a_100000754576_100009813782 [0,0,0,0,0,0|3,0,0]=3 657 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100000737683_100009813782 [0,0,0,0,0,0|3,0,0]=3 658 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737683 [0,0,0,0,0,0|3,0,0]=3 659 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183359 [0,0,0,0,0,0|3,0,0]=3 660 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000693194_100009813290 [0,0,0,0,0,0|3,0,0]=3 661 B16R0.221 CNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183359 [0,0,0,0,0,0|3,0,0]=3 662 B16R0.221 CNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183359 [0,0,0,0,0,0|3,0,0]=3 663 B16R0.221 CNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183359 [0,0,0,0,0,0|3,0,0]=3 664 B16R0.221 CNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183359 [0,0,0,0,0,0|3,0,0]=3 665 B16R0.221 CNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183359 [0,0,0,0,0,0|3,0,0]=3 666 B16R0.221 CNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183359 [0,0,0,0,0,0|3,0,0]=3 667 B16R0.221 CNC(=O)COCCCCCCCCCCO 34a_100000750040_100009813290 [0,0,0,0,0,0|3,0,0]=3 668 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100000183359_200000033068 [0,0,0,0,0,0|3,0,0]=3 669 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183359 [0,0,0,0,0,0|3,0,0]=3 670 B16R0.221 CNC(=O)NCCNCCCCCCCCO 34a_100015205895_100000033203 [0,0,0,0,0,0|4,0,0]=4 671 B16R0.221 CNC(=O)OCCNCCCCCCCCO 34a_102515433106_200011997002 [0,0,0,0,0,0|4,0,0]=4 672 B16R0.221 CNC(=O)OCCOCCCCCCCCBr 34a_100009813846_200011997002 [0,0,0,0,0,0|4,0,0]=4 673 B16R0.221 CNC(=O)OCCOCCCCCCCCBr 7a_100009813846_200011997002 [0,0,0,0,0,0|4,0,0]=4 674 B16R0.221 CNC(=O)OCCOCCCCCCCCCl 34a_100000033203_200011997002 [0,0,0,0,0,0|4,0,0]=4 675 B16R0.221 CNC(=O)OCCOCCCCCCCCCl 7a_100000033203_200011997002 [0,0,0,0,0,0|4,0,0]=4 676 B16R0.221 CNC(=O)OCCOCCCCCCCCN 34a_102515433106_200011997002 [0,0,0,0,0,0|4,0,0]=4 677 B16R0.221 CNC(=O)OCCSCCCCCCCCO 62a_100000033203_200011997002 [0,0,0,0,0,0|4,0,0]=4 678 B16R0.221 CNC(=O)OCCSCCCCCCCCO 62a_200011997002_100000033203 [0,0,0,0,0,0|4,0,0]=4 679 B16R0.221 CNCCCCCCCCCCCC(=O)OC 2230a_106832991635_100010983606 [0,0,0,0,0,0|1,0,0]=1 680 B16R0.221 CNCCCCCCCCCCCC(=O)OC 34a_100102657272_100010983606 [0,0,0,0,0,0|1,0,0]=1 681 B16R0.221 CNCCCCCCCCCCCC(=O)OC 7a_106832991635_100010983606 [0,0,0,0,0,0|1,0,0]=1 682 B16R0.221 CNCCCCCOCCCCCC(=O)OC 34a_100000722520_100009816466 [0,0,0,0,0,0|2,0,0]=2 683 B16R0.221 CNCCCOCCCCCCCC(=O)OC 34a_100000213112_100010004213 [0,0,0,0,0,0|2,0,0]=2 684 B16R0.221 CNCCOCCOCCCCCC(=O)OC 34a_100000228057_100009816466 [0,0,0,0,0,0|3,0,0]=3 685 B16R0.221 CNCCOCCOCCOCCC(=O)OC 34a_200014138305_100000742370 [0,0,0,0,0,0|4,0,0]=4 686 B16R0.221 COC(=O)/C=C/CNCCCCCCCCO 2230a_102515433106_100000742655 [0,0,0,0,0,0|2,0,2]=4 687 B16R0.221 COC(=O)/C=C/CNCCCCCCCCO 34a_102515433106_100000742655 [0,0,0,0,0,0|2,0,2]=4 688 B16R0.221 COC(=O)/C=C/COCCCCCCCCBr 34a_100009813846_100000742655 [0,0,0,0,0,0|2,0,2]=4 689 B16R0.221 COC(=O)/C=C/COCCCCCCCCBr 7a_100009813846_100000742655 [0,0,0,0,0,0|2,0,2]=4 690 B16R0.221 COC(=O)/C=C/COCCCCCCCCCl 34a_100000033203_100000742655 [0,0,0,0,0,0|2,0,2]=4 691 B16R0.221 COC(=O)/C=C/COCCCCCCCCCl 7a_100000033203_100000742655 [0,0,0,0,0,0|2,0,2]=4 692 B16R0.221 COC(=O)/C=C/COCCCCCCCCN 34a_102515433106_100000742655 [0,0,0,0,0,0|2,0,2]=4 693 B16R0.221 COC(=O)/C=C/CSCCCCCCCCO 62a_100000033203_100000742655 [0,0,0,0,0,0|2,0,2]=4 694 B16R0.221 COC(=O)/C=C/CSCCCCCCCCO 62a_100000742655_100000033203 [0,0,0,0,0,0|2,0,2]=4 695 B16R0.221 COC(=O)CCCCCCCCCCCSC 62a_200000210301_100010983606 [0,0,0,0,0,0|1,0,0]=1 696 B16R0.221 COC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100010983606 [0,0,0,0,0,0|1,0,0]=1 697 B16R0.221 COC(=O)CCCCCCCCCCOCF 34a_100011003013_100015361967 [0,0,0,0,0,0|2,0,0]=2 698 B16R0.221 COC(=O)CCCCCCCCCCOCF 7a_100011003013_100015361967 [0,0,0,0,0,0|2,0,0]=2 699 B16R0.221 COC(=O)CCCCCCCCCCSCF 62a_100015361967_100009812566 [0,0,0,0,0,0|2,0,0]=2 700 B16R0.221 COC(=O)CCCCCCCCCNCCF 34a_100000724931_100009813843 [0,0,0,0,0,0|2,0,0]=2 701 B16R0.221 COC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009813843 [0,0,0,0,0,0|2,0,0]=2 702 B16R0.221 COC(=O)CCCCCCCCCNCCO 34a_100016990907_100009813843 [0,0,0,0,0,0|2,0,0]=2 703 B16R0.221 COC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009813843 [0,0,0,0,0,0|2,0,0]=2 704 B16R0.221 COC(=O)CCCCCCCCCOCCN 34a_100000210304_100009813843 [0,0,0,0,0,0|2,0,0]=2 705 B16R0.221 COC(=O)CCCCCCCCCSCC#N 62a_100011215382_100009813843 [0,0,0,0,0,0|2,0,1]=3 706 B16R0.221 COC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009813843 [0,0,0,0,0,0|2,0,1]=3 707 B16R0.221 COC(=O)CCCCCCCCCSCCF 62a_100011217306_100009813843 [0,0,0,0,0,0|2,0,0]=2 708 B16R0.221 COC(=O)CCCCCCCCCSCCO 62a_100000211926_100009813843 [0,0,0,0,0,0|2,0,0]=2 709 B16R0.221 COC(=O)CCCCCCCCCSCSC 62a_100011218213_100009813843 [0,0,0,0,0,0|2,0,0]=2 710 B16R0.221 COC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010282707 [0,0,0,0,0,0|2,0,0]=2 711 B16R0.221 COC(=O)CCCCCCCCNCCCF 34a_100015189416_100010282707 [0,0,0,0,0,0|2,0,0]=2 712 B16R0.221 COC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010282707 [0,0,0,0,0,0|2,0,0]=2 713 B16R0.221 COC(=O)CCCCCCCCOCCC#N 7a_100000035544_100000184422 [0,0,0,0,0,0|2,0,1]=3 714 B16R0.221 COC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010282707 [0,0,0,0,0,0|2,0,0]=2 715 B16R0.221 COC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010282707 [0,0,0,0,0,0|2,0,0]=2 716 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000035544_100011934791 [0,0,0,0,0,0|2,0,0]=2 717 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000759539_100010282707 [0,0,0,0,0,0|2,0,0]=2 718 B16R0.221 COC(=O)CCCCCCCCOCCCF 7a_100000035544_100011934791 [0,0,0,0,0,0|2,0,0]=2 719 B16R0.221 COC(=O)CCCCCCCCOCCCN 34a_100000182051_100010282707 [0,0,0,0,0,0|2,0,0]=2 720 B16R0.221 COC(=O)CCCCCCCCOCCCO 34a_100000035544_100000230001 [0,0,0,0,0,0|2,0,0]=2 721 B16R0.221 COC(=O)CCCCCCCCOCCCO 7a_100000035544_100011215043 [0,0,0,0,0,0|2,0,0]=2 722 B16R0.221 COC(=O)CCCCCCCCOCCON 34a_100000700252_100010282707 [0,0,0,0,0,0|3,0,0]=3 723 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000035544_100000212216 [0,0,0,0,0,0|2,0,0]=2 724 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000230434_100010282707 [0,0,0,0,0,0|2,0,0]=2 725 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000035544_100000212216 [0,0,0,0,0,0|2,0,0]=2 726 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000230434_100010282707 [0,0,0,0,0,0|2,0,0]=2 727 B16R0.221 COC(=O)CCCCCCCCSCCC#N 62a_100010282707_100011215226 [0,0,0,0,0,0|2,0,1]=3 728 B16R0.221 COC(=O)CCCCCCCCSCCC#N 62a_100011215226_100010282707 [0,0,0,0,0,0|2,0,1]=3 729 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100010282707_100011934791 [0,0,0,0,0,0|2,0,0]=2 730 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100011934791_100010282707 [0,0,0,0,0,0|2,0,0]=2 731 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100010282707_100011215043 [0,0,0,0,0,0|2,0,0]=2 732 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100011215043_100010282707 [0,0,0,0,0,0|2,0,0]=2 733 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100000212216_100010282707 [0,0,0,0,0,0|2,0,0]=2 734 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100010282707_100000751147 [0,0,0,0,0,0|2,0,0]=2 735 B16R0.221 COC(=O)CCCCCCCCSCSC#N 62a_100000211825_100010282707 [0,0,0,0,0,0|3,0,1]=4 736 B16R0.221 COC(=O)CCCCCCCCSCSC#N 62a_100010282707_100000211825 [0,0,0,0,0,0|3,0,1]=4 737 B16R0.221 COC(=O)CCCCCCCNCCCCO 2230a_100000750430_100010004213 [0,0,0,0,0,0|2,0,0]=2 738 B16R0.221 COC(=O)CCCCCCCNCCCCO 34a_100000750430_100010004213 [0,0,0,0,0,0|2,0,0]=2 739 B16R0.221 COC(=O)CCCCCCCNCCCSC 2230a_100000749238_100010004213 [0,0,0,0,0,0|2,0,0]=2 740 B16R0.221 COC(=O)CCCCCCCOCC#CCCl 34a_200000047223_100010004213 [0,0,0,0,0,0|2,0,2]=4 741 B16R0.221 COC(=O)CCCCCCCOCC#CCO 34a_100011022521_200000047223 [0,0,0,0,0,0|2,0,2]=4 742 B16R0.221 COC(=O)CCCCCCCOCC#CCO 7a_100011022521_200000047223 [0,0,0,0,0,0|2,0,2]=4 743 B16R0.221 COC(=O)CCCCCCCOCCCC#N 7a_100011022521_100000687738 [0,0,0,0,0,0|2,0,1]=3 744 B16R0.221 COC(=O)CCCCCCCOCCCC=O 7a_100011022521_200011292268 [0,0,0,0,0,0|2,0,1]=3 745 B16R0.221 COC(=O)CCCCCCCOCCCCBr 34a_100011216708_100010004213 [0,0,0,0,0,0|2,0,0]=2 746 B16R0.221 COC(=O)CCCCCCCOCCCCCl 34a_100000210776_100010004213 [0,0,0,0,0,0|2,0,0]=2 747 B16R0.221 COC(=O)CCCCCCCOCCCCCl 7a_100000210776_100010004213 [0,0,0,0,0,0|2,0,0]=2 748 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011022521_100000729493 [0,0,0,0,0,0|2,0,0]=2 749 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011995726_100010004213 [0,0,0,0,0,0|2,0,0]=2 750 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011022521_100000729493 [0,0,0,0,0,0|2,0,0]=2 751 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011995726_100010004213 [0,0,0,0,0,0|2,0,0]=2 752 B16R0.221 COC(=O)CCCCCCCOCCCCI 34a_200012148704_100010004213 [0,0,0,0,0,0|2,0,0]=2 753 B16R0.221 COC(=O)CCCCCCCOCCCCN 34a_100000750430_100010004213 [0,0,0,0,0,0|2,0,0]=2 754 B16R0.221 COC(=O)CCCCCCCOCCCCO 34a_100011022521_100011216708 [0,0,0,0,0,0|2,0,0]=2 755 B16R0.221 COC(=O)CCCCCCCOCCCCO 7a_100011022521_100000210776 [0,0,0,0,0,0|2,0,0]=2 756 B16R0.221 COC(=O)CCCCCCCOCCCSC 34a_100000690336_100010004213 [0,0,0,0,0,0|2,0,0]=2 757 B16R0.221 COC(=O)CCCCCCCOCCCSC 7a_100000690336_100010004213 [0,0,0,0,0,0|2,0,0]=2 758 B16R0.221 COC(=O)CCCCCCCSCC#CCO 62a_100010004213_200000047223 [0,0,0,0,0,0|2,0,2]=4 759 B16R0.221 COC(=O)CCCCCCCSCC#CCO 62a_200000047223_100010004213 [0,0,0,0,0,0|2,0,2]=4 760 B16R0.221 COC(=O)CCCCCCCSCCCC#N 62a_100000687738_100010004213 [0,0,0,0,0,0|2,0,1]=3 761 B16R0.221 COC(=O)CCCCCCCSCCCC#N 62a_100010004213_100000687738 [0,0,0,0,0,0|2,0,1]=3 762 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_100010004213_200011292268 [0,0,0,0,0,0|2,0,1]=3 763 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_200011292268_100010004213 [0,0,0,0,0,0|2,0,1]=3 764 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100000729493_100010004213 [0,0,0,0,0,0|2,0,0]=2 765 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100010004213_100000729493 [0,0,0,0,0,0|2,0,0]=2 766 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100000210776_100010004213 [0,0,0,0,0,0|2,0,0]=2 767 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100010004213_100000210776 [0,0,0,0,0,0|2,0,0]=2 768 B16R0.221 COC(=O)CCCCCCCSCCSC#N 62a_100000034367_100010004213 [0,0,0,0,0,0|3,0,1]=4 769 B16R0.221 COC(=O)CCCCCCCSCCSC#N 62a_100010004213_100000034367 [0,0,0,0,0,0|3,0,1]=4 770 B16R0.221 COC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009815986 [0,0,0,0,0,0|2,0,0]=2 771 B16R0.221 COC(=O)CCCCCCNCCCCCO 34a_100000762737_100009815986 [0,0,0,0,0,0|2,0,0]=2 772 B16R0.221 COC(=O)CCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100009815986 [0,0,0,0,0,0|4,0,0]=4 773 B16R0.221 COC(=O)CCCCCCNCCOCCO 2230a_100000211614_100009815986 [0,0,0,0,0,0|3,0,0]=3 774 B16R0.221 COC(=O)CCCCCCNCCOCCO 34a_100000211614_100009815986 [0,0,0,0,0,0|3,0,0]=3 775 B16R0.221 COC(=O)CCCCCCNCCSCCO 2230a_100011219999_100009815986 [0,0,0,0,0,0|3,0,0]=3 776 B16R0.221 COC(=O)CCCCCCOCCCCC#N 7a_100009863599_100000211819 [0,0,0,0,0,0|2,0,1]=3 777 B16R0.221 COC(=O)CCCCCCOCCCCC=O 7a_100009863599_100000139335 [0,0,0,0,0,0|2,0,1]=3 778 B16R0.221 COC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009815986 [0,0,0,0,0,0|2,0,0]=2 779 B16R0.221 COC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009815986 [0,0,0,0,0,0|2,0,0]=2 780 B16R0.221 COC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009815986 [0,0,0,0,0,0|2,0,0]=2 781 B16R0.221 COC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009815986 [0,0,0,0,0,0|2,0,0]=2 782 B16R0.221 COC(=O)CCCCCCOCCCCCF 34a_100009863599_100000729378 [0,0,0,0,0,0|2,0,0]=2 783 B16R0.221 COC(=O)CCCCCCOCCCCCF 7a_100009863599_100000729378 [0,0,0,0,0,0|2,0,0]=2 784 B16R0.221 COC(=O)CCCCCCOCCCCCI 34a_200012148887_100009815986 [0,0,0,0,0,0|2,0,0]=2 785 B16R0.221 COC(=O)CCCCCCOCCCCCI 7a_200012148887_100009815986 [0,0,0,0,0,0|2,0,0]=2 786 B16R0.221 COC(=O)CCCCCCOCCCCCN 34a_100000762737_100009815986 [0,0,0,0,0,0|2,0,0]=2 787 B16R0.221 COC(=O)CCCCCCOCCCCCO 34a_100009863599_100000746330 [0,0,0,0,0,0|2,0,0]=2 788 B16R0.221 COC(=O)CCCCCCOCCCCCO 7a_100009863599_100000746330 [0,0,0,0,0,0|2,0,0]=2 789 B16R0.221 COC(=O)CCCCCCOCCCCSC 34a_100011217163_100009815986 [0,0,0,0,0,0|2,0,0]=2 790 B16R0.221 COC(=O)CCCCCCOCCCCSC 7a_100011217163_100009815986 [0,0,0,0,0,0|2,0,0]=2 791 B16R0.221 COC(=O)CCCCCCOCCOCC#N 7a_100009863599_200000047693 [0,0,0,0,0,0|3,0,1]=4 792 B16R0.221 COC(=O)CCCCCCOCCOCCBr 34a_100000692535_100009815986 [0,0,0,0,0,0|3,0,0]=3 793 B16R0.221 COC(=O)CCCCCCOCCOCCBr 7a_100000692535_100009815986 [0,0,0,0,0,0|3,0,0]=3 794 B16R0.221 COC(=O)CCCCCCOCCOCCCl 34a_100011215305_100009815986 [0,0,0,0,0,0|3,0,0]=3 795 B16R0.221 COC(=O)CCCCCCOCCOCCCl 7a_100011215305_100009815986 [0,0,0,0,0,0|3,0,0]=3 796 B16R0.221 COC(=O)CCCCCCOCCOCCF 34a_200015357709_100009815986 [0,0,0,0,0,0|3,0,0]=3 797 B16R0.221 COC(=O)CCCCCCOCCOCCF 7a_200015357709_100009815986 [0,0,0,0,0,0|3,0,0]=3 798 B16R0.221 COC(=O)CCCCCCOCCOCCI 34a_100012149058_100009815986 [0,0,0,0,0,0|3,0,0]=3 799 B16R0.221 COC(=O)CCCCCCOCCOCCI 7a_100012149058_100009815986 [0,0,0,0,0,0|3,0,0]=3 800 B16R0.221 COC(=O)CCCCCCOCCOCCN 34a_100000211614_100009815986 [0,0,0,0,0,0|3,0,0]=3 801 B16R0.221 COC(=O)CCCCCCOCCOCCO 34a_100009863599_100000692535 [0,0,0,0,0,0|3,0,0]=3 802 B16R0.221 COC(=O)CCCCCCOCCOCCO 7a_100009863599_100011215305 [0,0,0,0,0,0|3,0,0]=3 803 B16R0.221 COC(=O)CCCCCCSCCCCC#N 62a_100009815986_100000211819 [0,0,0,0,0,0|2,0,1]=3 804 B16R0.221 COC(=O)CCCCCCSCCCCC#N 62a_100011219923_100009815986 [0,0,0,0,0,0|2,0,1]=3 805 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009815986 [0,0,0,0,0,0|2,0,1]=3 806 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100009815986_100000139335 [0,0,0,0,0,0|2,0,1]=3 807 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100000729378_100009815986 [0,0,0,0,0,0|2,0,0]=2 808 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100009815986_100000729378 [0,0,0,0,0,0|2,0,0]=2 809 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100000746330_100009815986 [0,0,0,0,0,0|2,0,0]=2 810 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100009815986_100000746330 [0,0,0,0,0,0|2,0,0]=2 811 B16R0.221 COC(=O)CCCCCCSCCOCC#N 62a_100009815986_200000047693 [0,0,0,0,0,0|3,0,1]=4 812 B16R0.221 COC(=O)CCCCCCSCCOCC#N 62a_200000047693_100009815986 [0,0,0,0,0,0|3,0,1]=4 813 B16R0.221 COC(=O)CCCCCCSCCOCCO 62a_100009815986_100011215305 [0,0,0,0,0,0|3,0,0]=3 814 B16R0.221 COC(=O)CCCCCCSCCOCCO 62a_100011215305_100009815986 [0,0,0,0,0,0|3,0,0]=3 815 B16R0.221 COC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009816466 [0,0,0,0,0,0|2,0,0]=2 816 B16R0.221 COC(=O)CCCCCNCCCCCCO 34a_100000686447_100009816466 [0,0,0,0,0,0|2,0,0]=2 817 B16R0.221 COC(=O)CCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100009816466 [0,0,0,0,0,0|4,0,0]=4 818 B16R0.221 COC(=O)CCCCCOCCCCCC#N 7a_100000074720_100009813376 [0,0,0,0,0,0|2,0,1]=3 819 B16R0.221 COC(=O)CCCCCOCCCCCC=O 7a_100000074720_100000139337 [0,0,0,0,0,0|2,0,1]=3 820 B16R0.221 COC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009816466 [0,0,0,0,0,0|2,0,0]=2 821 B16R0.221 COC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009816466 [0,0,0,0,0,0|2,0,0]=2 822 B16R0.221 COC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009816466 [0,0,0,0,0,0|2,0,0]=2 823 B16R0.221 COC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009816466 [0,0,0,0,0,0|2,0,0]=2 824 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000074720_100015922095 [0,0,0,0,0,0|2,0,0]=2 825 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000732779_100009816466 [0,0,0,0,0,0|2,0,0]=2 826 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000074720_100015922095 [0,0,0,0,0,0|2,0,0]=2 827 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000732779_100009816466 [0,0,0,0,0,0|2,0,0]=2 828 B16R0.221 COC(=O)CCCCCOCCCCCCN 34a_100000686447_100009816466 [0,0,0,0,0,0|2,0,0]=2 829 B16R0.221 COC(=O)CCCCCOCCCCCCO 34a_100000074720_100000766143 [0,0,0,0,0,0|2,0,0]=2 830 B16R0.221 COC(=O)CCCCCOCCCCCCO 7a_100000074720_100000766143 [0,0,0,0,0,0|2,0,0]=2 831 B16R0.221 COC(=O)CCCCCSCCCCCC#N 62a_100009813376_100009816466 [0,0,0,0,0,0|2,0,1]=3 832 B16R0.221 COC(=O)CCCCCSCCCCCC#N 62a_100009816466_100009813376 [0,0,0,0,0,0|2,0,1]=3 833 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100000139337_100009816466 [0,0,0,0,0,0|2,0,1]=3 834 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100009816466_100000139337 [0,0,0,0,0,0|2,0,1]=3 835 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100009816466_100015922095 [0,0,0,0,0,0|2,0,0]=2 836 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100015922095_100009816466 [0,0,0,0,0,0|2,0,0]=2 837 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100000766143_100009816466 [0,0,0,0,0,0|2,0,0]=2 838 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100009816466_100000766143 [0,0,0,0,0,0|2,0,0]=2 839 B16R0.221 COC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000204269 [0,0,0,0,0,0|2,0,0]=2 840 B16R0.221 COC(=O)CCCCNCCCCCCCO 34a_100011996573_100000204269 [0,0,0,0,0,0|2,0,0]=2 841 B16R0.221 COC(=O)CCCCNCCCOCCCO 2230a_100011310245_100000204269 [0,0,0,0,0,0|3,0,0]=3 842 B16R0.221 COC(=O)CCCCNCCCOCCCO 34a_100011310245_100000204269 [0,0,0,0,0,0|3,0,0]=3 843 B16R0.221 COC(=O)CCCCOCCCCCCC#N 7a_100000059025_100009813337 [0,0,0,0,0,0|2,0,1]=3 844 B16R0.221 COC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000204269 [0,0,0,0,0,0|2,0,0]=2 845 B16R0.221 COC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000204269 [0,0,0,0,0,0|2,0,0]=2 846 B16R0.221 COC(=O)CCCCOCCCCCCCN 34a_100011996573_100000204269 [0,0,0,0,0,0|2,0,0]=2 847 B16R0.221 COC(=O)CCCCOCCCCCCCO 34a_100000059025_100000760002 [0,0,0,0,0,0|2,0,0]=2 848 B16R0.221 COC(=O)CCCCOCCCCCCCO 7a_100000059025_100000760002 [0,0,0,0,0,0|2,0,0]=2 849 B16R0.221 COC(=O)CCCCOCCCOCCCN 34a_100011310245_100000204269 [0,0,0,0,0,0|3,0,0]=3 850 B16R0.221 COC(=O)CCCCSCCCCCCC#N 62a_100000204269_100009813337 [0,0,0,0,0,0|2,0,1]=3 851 B16R0.221 COC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000204269 [0,0,0,0,0,0|2,0,1]=3 852 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000204269_100000760002 [0,0,0,0,0,0|2,0,0]=2 853 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000760002_100000204269 [0,0,0,0,0,0|2,0,0]=2 854 B16R0.221 COC(=O)CCCNCCCCCCCCO 2230a_102515433106_100011218270 [0,0,0,0,0,0|2,0,0]=2 855 B16R0.221 COC(=O)CCCNCCCCCCCCO 34a_102515433106_100000742333 [0,0,0,0,0,0|2,0,0]=2 856 B16R0.221 COC(=O)CCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100011218270 [0,0,0,0,0,0|4,0,0]=4 857 B16R0.221 COC(=O)CCCNCCOCCOCCO 2230a_100011998139_100011218270 [0,0,0,0,0,0|4,0,0]=4 858 B16R0.221 COC(=O)CCCNCCOCCOCCO 34a_100011998139_100000742333 [0,0,0,0,0,0|4,0,0]=4 859 B16R0.221 COC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000742333 [0,0,0,0,0,0|2,0,0]=2 860 B16R0.221 COC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011218270 [0,0,0,0,0,0|2,0,0]=2 861 B16R0.221 COC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000742333 [0,0,0,0,0,0|2,0,0]=2 862 B16R0.221 COC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011218270 [0,0,0,0,0,0|2,0,0]=2 863 B16R0.221 COC(=O)CCCOCCCCCCCCN 34a_102515433106_100000742333 [0,0,0,0,0,0|2,0,0]=2 864 B16R0.221 COC(=O)CCCOCCCCCNCCN 34a_103619048469_100000742333 [0,0,0,0,0,0|3,0,0]=3 865 B16R0.221 COC(=O)CCCOCCOCCOCCBr 34a_100010132937_100000742333 [0,0,0,0,0,0|4,0,0]=4 866 B16R0.221 COC(=O)CCCOCCOCCOCCBr 7a_100010132937_100011218270 [0,0,0,0,0,0|4,0,0]=4 867 B16R0.221 COC(=O)CCCOCCOCCOCCCl 34a_100000032323_100000742333 [0,0,0,0,0,0|4,0,0]=4 868 B16R0.221 COC(=O)CCCOCCOCCOCCCl 7a_100000032323_100011218270 [0,0,0,0,0,0|4,0,0]=4 869 B16R0.221 COC(=O)CCCOCCOCCOCCN 34a_100011998139_100000742333 [0,0,0,0,0,0|4,0,0]=4 870 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100000033203_100011218270 [0,0,0,0,0,0|2,0,0]=2 871 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100011218270_100000033203 [0,0,0,0,0,0|2,0,0]=2 872 B16R0.221 COC(=O)CCCSCCOCCOCCO 62a_100000032323_100011218270 [0,0,0,0,0,0|4,0,0]=4 873 B16R0.221 COC(=O)CCCSCCOCCOCCO 62a_100011218270_100000032323 [0,0,0,0,0,0|4,0,0]=4 874 B16R0.221 COC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000204255 [0,0,0,0,0,0|2,0,0]=2 875 B16R0.221 COC(=O)CCNCCCCCCCCCO 34a_100000078944_100000742370 [0,0,0,0,0,0|2,0,0]=2 876 B16R0.221 COC(=O)CCNCCCOCCOCCO 2230a_100011996194_100000204255 [0,0,0,0,0,0|4,0,0]=4 877 B16R0.221 COC(=O)CCNCCCOCCOCCO 34a_100011996194_100000742370 [0,0,0,0,0,0|4,0,0]=4 878 B16R0.221 COC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000742370 [0,0,0,0,0,0|2,0,0]=2 879 B16R0.221 COC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000204255 [0,0,0,0,0,0|2,0,0]=2 880 B16R0.221 COC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000742370 [0,0,0,0,0,0|2,0,0]=2 881 B16R0.221 COC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000204255 [0,0,0,0,0,0|2,0,0]=2 882 B16R0.221 COC(=O)CCOCCCCCCCCCN 34a_100000078944_100000742370 [0,0,0,0,0,0|2,0,0]=2 883 B16R0.221 COC(=O)CCOCCOCCOCCCF 34a_100010982084_100011934791 [0,0,0,0,0,0|4,0,0]=4 884 B16R0.221 COC(=O)CCOCCOCCOCCCF 7a_100010982084_100011934791 [0,0,0,0,0,0|4,0,0]=4 885 B16R0.221 COC(=O)CCOCCOCCOCCCN 34a_100011996194_100000742370 [0,0,0,0,0,0|4,0,0]=4 886 B16R0.221 COC(=O)CCOCCOCCOCCCO 34a_100010982084_100000230001 [0,0,0,0,0,0|4,0,0]=4 887 B16R0.221 COC(=O)CCOCCOCCOCCCO 7a_100010982084_100011215043 [0,0,0,0,0,0|4,0,0]=4 888 B16R0.221 COC(=O)CCOCCOCCOCCSC 34a_100010982084_100000212216 [0,0,0,0,0,0|4,0,0]=4 889 B16R0.221 COC(=O)CCOCCOCCOCCSC 7a_100010982084_100000212216 [0,0,0,0,0,0|4,0,0]=4 890 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100000204255_100009813782 [0,0,0,0,0,0|2,0,0]=2 891 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100009813782_100000204255 [0,0,0,0,0,0|2,0,0]=2 892 B16R0.221 COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747449 [0,0,0,0,0,0|2,0,0]=2 893 B16R0.221 COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000747449 [0,0,0,0,0,0|2,0,0]=2 894 B16R0.221 COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000747449 [0,0,0,0,0,0|2,0,0]=2 895 B16R0.221 COC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747449 [0,0,0,0,0,0|2,0,0]=2 896 B16R0.221 COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000747449 [0,0,0,0,0,0|2,0,0]=2 897 B16R0.221 COC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747449 [0,0,0,0,0,0|2,0,0]=2 898 B16R0.221 COC(=O)COCCCCCCCCCCN 34a_100000066964_100000747449 [0,0,0,0,0,0|2,0,0]=2 899 B16R0.221 COC(=O)COCCNCCCCCCCO 2230a_100011996573_100000090808 [0,0,0,0,0,0|3,0,0]=3 900 B16R0.221 COC(=O)COCCNCCCCCCCO 34a_100011996573_100000090808 [0,0,0,0,0,0|3,0,0]=3 901 B16R0.221 COC(=O)COCCNCCCOCCCO 2230a_100011310245_100000090808 [0,0,0,0,0,0|4,0,0]=4 902 B16R0.221 COC(=O)COCCNCCCOCCCO 34a_100011310245_100000090808 [0,0,0,0,0,0|4,0,0]=4 903 B16R0.221 COC(=O)COCCOCCCCCCCBr 34a_100000760002_100000090808 [0,0,0,0,0,0|3,0,0]=3 904 B16R0.221 COC(=O)COCCOCCCCCCCBr 7a_100000760002_100000090808 [0,0,0,0,0,0|3,0,0]=3 905 B16R0.221 COC(=O)COCCOCCCCCCCN 34a_100011996573_100000090808 [0,0,0,0,0,0|3,0,0]=3 906 B16R0.221 COC(=O)COCCOCCCOCCCN 34a_100011310245_100000090808 [0,0,0,0,0,0|4,0,0]=4 907 B16R0.221 COC(=O)COCCOCCOCCCCF 34a_100011023656_100000729493 [0,0,0,0,0,0|4,0,0]=4 908 B16R0.221 COC(=O)COCCOCCOCCCCF 7a_100011023656_100000729493 [0,0,0,0,0,0|4,0,0]=4 909 B16R0.221 COC(=O)COCCOCCOCCCCO 34a_100011023656_100011216708 [0,0,0,0,0,0|4,0,0]=4 910 B16R0.221 COC(=O)COCCOCCOCCCCO 7a_100011023656_100000210776 [0,0,0,0,0,0|4,0,0]=4 911 B16R0.221 COC(=O)COCCSCCCCCCC#N 62a_100000090808_100009813337 [0,0,0,0,0,0|3,0,1]=4 912 B16R0.221 COC(=O)COCCSCCCCCCC#N 62a_100009813337_100000090808 [0,0,0,0,0,0|3,0,1]=4 913 B16R0.221 COC(=O)COCCSCCCCCCCO 62a_100000090808_100000760002 [0,0,0,0,0,0|3,0,0]=3 914 B16R0.221 COC(=O)COCCSCCCCCCCO 62a_100000760002_100000090808 [0,0,0,0,0,0|3,0,0]=3 915 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100000747449_200000033068 [0,0,0,0,0,0|2,0,0]=2 916 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747449 [0,0,0,0,0,0|2,0,0]=2 917 B16R0.221 COC(=O)NCCOCCCCCCCCO 34a_100000757965_100000033203 [0,0,0,0,0,0|3,0,0]=3 918 B16R0.221 COC(=O)OCCOCCCCCCCCO 34a_100010262106_100000033203 [0,0,0,0,0,0|3,0,0]=3 919 B16R0.221 COC(=O)OCSCCCCCCCCCO 62a_100009813782_100000139417 [0,0,0,0,0,0|3,0,0]=3 920 B16R0.221 COC(C)CCOCCCCCCCCCO 7a_100000764861_100009813782 [0,0,0,0,0,0|3,0,1]=4 921 B16R0.221 COC(C)COCCCCCCCCCCO 34a_100000690652_100009813290 [0,0,0,0,0,0|3,0,1]=4 922 B16R0.221 COC(C)SCCCCCCCCCCCO 62a_100009812471_100009879195 [0,0,0,0,0,0|3,0,1]=4 923 B16R0.221 COCCCCCCCCCCCC(=O)OC 34a_100138415774_100010983606 [0,0,0,0,0,0|1,0,0]=1 924 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_100000059025_100011998445 [0,0,0,0,0,0|2,0,0]=2 925 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_200012092642_100000204269 [0,0,0,0,0,0|2,0,0]=2 926 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_100000059025_100011998445 [0,0,0,0,0,0|2,0,0]=2 927 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_200012092642_100000204269 [0,0,0,0,0,0|2,0,0]=2 928 B16R0.221 COCCCCCCOCCOCC(=O)OC 34a_200012092642_100000090808 [0,0,0,0,0,0|3,0,0]=3 929 B16R0.221 COCCCCCCOCCOCC(=O)OC 7a_200012092642_100000090808 [0,0,0,0,0,0|3,0,0]=3 930 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100000204269_100011998445 [0,0,0,0,0,0|2,0,0]=2 931 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100011998445_100000204269 [0,0,0,0,0,0|2,0,0]=2 932 B16R0.221 COCCCCCCSCCOCC(=O)OC 62a_100000090808_100011998445 [0,0,0,0,0,0|3,0,0]=3 933 B16R0.221 COCCCCCCSCCOCC(=O)OC 62a_100011998445_100000090808 [0,0,0,0,0,0|3,0,0]=3 934 B16R0.221 COCCCCCNCCCCCC(=O)OC 2230a_100000747528_100009816466 [0,0,0,0,0,0|2,0,0]=2 935 B16R0.221 COCCCCCNCCCCCC(=O)OC 34a_100000747528_100009816466 [0,0,0,0,0,0|2,0,0]=2 936 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100000740925_100009815986 [0,0,0,0,0,0|2,0,0]=2 937 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100009863599_100000755781 [0,0,0,0,0,0|2,0,0]=2 938 B16R0.221 COCCCCOCCCCCCC(=O)OC 7a_100009863599_100000730899 [0,0,0,0,0,0|2,0,0]=2 939 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100000730899_100009815986 [0,0,0,0,0,0|2,0,0]=2 940 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100009815986_100000730899 [0,0,0,0,0,0|2,0,0]=2 941 B16R0.221 COCCCNCCCCCCCC(=O)OC 34a_100150723488_100010004213 [0,0,0,0,0,0|2,0,0]=2 942 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100000740835_100010004213 [0,0,0,0,0,0|2,0,0]=2 943 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100011022521_100000740836 [0,0,0,0,0,0|2,0,0]=2 944 B16R0.221 COCCCOCCCCCCCC(=O)OC 7a_100011022521_100000740836 [0,0,0,0,0,0|2,0,0]=2 945 B16R0.221 COCCCOCCCOCCCC(=O)OC 34a_200011215475_100000742333 [0,0,0,0,0,0|3,0,0]=3 946 B16R0.221 COCCCOCCCOCCCC(=O)OC 7a_200011215475_100011218270 [0,0,0,0,0,0|3,0,0]=3 947 B16R0.221 COCCCOCCOCCOCC(=O)OC 34a_100011023656_100000740836 [0,0,0,0,0,0|4,0,0]=4 948 B16R0.221 COCCCOCCOCCOCC(=O)OC 7a_100011023656_100000740836 [0,0,0,0,0,0|4,0,0]=4 949 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100000709357_100010004213 [0,0,0,0,0,0|2,0,0]=2 950 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100010004213_100000709357 [0,0,0,0,0,0|2,0,0]=2 951 B16R0.221 COCCNCCCCCCCCC(=O)OC 2230a_100000209980_100010282707 [0,0,0,0,0,0|2,0,0]=2 952 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [0,0,0,0,0,0|2,0,0]=2 953 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [0,0,0,0,0,0|2,0,0]=2 954 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [0,0,0,0,0,0|2,0,0]=2 955 B16R0.221 COCCOCCCNCCCCC(=O)OC 2230a_100000206027_100000204269 [0,0,0,0,0,0|3,0,0]=3 956 B16R0.221 COCCOCCCNCCCCC(=O)OC 34a_100000206027_100000204269 [0,0,0,0,0,0|3,0,0]=3 957 B16R0.221 COCCOCCCNCCOCC(=O)OC 2230a_100000206027_100000090808 [0,0,0,0,0,0|4,0,0]=4 958 B16R0.221 COCCOCCCNCCOCC(=O)OC 34a_100000206027_100000090808 [0,0,0,0,0,0|4,0,0]=4 959 B16R0.221 COCCOCCCOCCCCC(=O)OC 34a_100000059025_100011216529 [0,0,0,0,0,0|3,0,0]=3 960 B16R0.221 COCCOCCCOCCCCC(=O)OC 7a_100000059025_100011216529 [0,0,0,0,0,0|3,0,0]=3 961 B16R0.221 COCCOCCCSCCCCC(=O)OC 62a_100000204269_100011216529 [0,0,0,0,0,0|3,0,0]=3 962 B16R0.221 COCCOCCCSCCCCC(=O)OC 62a_100011216529_100000204269 [0,0,0,0,0,0|3,0,0]=3 963 B16R0.221 COCCOCCCSCCOCC(=O)OC 62a_100000090808_100011216529 [0,0,0,0,0,0|4,0,0]=4 964 B16R0.221 COCCOCCCSCCOCC(=O)OC 62a_100011216529_100000090808 [0,0,0,0,0,0|4,0,0]=4 965 B16R0.221 COCCOCCNCCCCCC(=O)OC 2230a_100000745349_100009816466 [0,0,0,0,0,0|3,0,0]=3 966 B16R0.221 COCCOCCNCCCCCC(=O)OC 34a_100000745349_100009816466 [0,0,0,0,0,0|3,0,0]=3 967 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100000074720_100000695917 [0,0,0,0,0,0|3,0,0]=3 968 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100011215163_100009816466 [0,0,0,0,0,0|3,0,0]=3 969 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100000074720_100000695917 [0,0,0,0,0,0|3,0,0]=3 970 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100011215163_100009816466 [0,0,0,0,0,0|3,0,0]=3 971 B16R0.221 COCCOCCOCCNCCC(=O)OC 2230a_100012028300_100000204255 [0,0,0,0,0,0|4,0,0]=4 972 B16R0.221 COCCOCCOCCNCCC(=O)OC 34a_100012028300_100000742370 [0,0,0,0,0,0|4,0,0]=4 973 B16R0.221 COCCOCCOCCOCCC(=O)OC 34a_100000688194_100000742370 [0,0,0,0,0,0|4,0,0]=4 974 B16R0.221 COCCOCCOCCOCCC(=O)OC 34a_100010982084_100011201679 [0,0,0,0,0,0|4,0,0]=4 975 B16R0.221 COCCOCCOCCOCCC(=O)OC 7a_100000688194_100000204255 [0,0,0,0,0,0|4,0,0]=4 976 B16R0.221 COCCOCCOCCOCCC(=O)OC 7a_100010982084_100000233755 [0,0,0,0,0,0|4,0,0]=4 977 B16R0.221 COCCOCCOCCSCCC(=O)OC 62a_100000204255_100013367474 [0,0,0,0,0,0|4,0,0]=4 978 B16R0.221 COCCOCCOCCSCCC(=O)OC 62a_100013367474_100000204255 [0,0,0,0,0,0|4,0,0]=4 979 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100000695917_100009816466 [0,0,0,0,0,0|3,0,0]=3 980 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100009816466_100000695917 [0,0,0,0,0,0|3,0,0]=3 981 B16R0.221 COCCOCSCCCCCCC(=O)OC 62a_100000231047_100009815986 [0,0,0,0,0,0|3,0,0]=3 982 B16R0.221 COCCOCSCCCCCCC(=O)OC 62a_100009815986_100000231047 [0,0,0,0,0,0|3,0,0]=3 983 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100000233755_100010282707 [0,0,0,0,0,0|2,0,0]=2 984 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000233755 [0,0,0,0,0,0|2,0,0]=2 985 B16R0.221 COCSCCCCCCCCCC(=O)OC 62a_100000766300_100009813843 [0,0,0,0,0,0|2,0,0]=2 986 B16R0.221 CO[C@H](C)CNCCCCCCCCCCO 2230a_100020591295_100009813290 [0,0,0,0,0,0|3,0,1]=4 987 B16R0.221 NNC(=O)CCCOCCCCCCCCO 34a_100000211488_100000033203 [0,0,0,0,0,0|4,0,0]=4 988 B16R0.221 O=C(CO)CCCCCCCCCCCCO 1458a_100000210174_100009813331 [0,0,0,0,0,0|3,0,0]=3 989 B16R0.221 O=C(CO)CCCCCCOCCCCCO 1458a_100000210174_200132310570 [0,0,0,0,0,0|4,0,0]=4 990 B15R0.70 C/C=C/CCOCCCCCCCCCC 34a_100016278192_100000210320 [1,0,0,0,0,0|2,0,0]=3 991 B15R0.70 C/C=C/CCOCCCCCCCCCO 34a_100016278192_100009813782 [1,0,0,0,0,0|3,0,0]=4 992 B15R0.70 C/C=C/CNCCCCCCCCCCC 34a_200011215754_100102629194 [1,0,0,0,0,0|2,0,0]=3 993 B15R0.70 C/C=C/CNCCCCCCCCCCO 34a_100000066964_100102629194 [1,0,0,0,0,0|3,0,0]=4 994 B15R0.70 C/C=C/COCCCCCCCCCCBr 34a_100009813290_100102629194 [1,0,0,0,0,0|3,0,0]=4 995 B15R0.70 C/C=C/COCCCCCCCCCCBr 7a_100009813290_100102629194 [1,0,0,0,0,0|3,0,0]=4 996 B15R0.70 C/C=C/COCCCCCCCCCCC 34a_100000210809_100102629194 [1,0,0,0,0,0|2,0,0]=3 997 B15R0.70 C/C=C/COCCCCCCCCCCC 34a_100016270725_100011215454 [1,0,0,0,0,0|2,0,0]=3 998 B15R0.70 C/C=C/COCCCCCCCCCCC 7a_100000210809_100102629194 [1,0,0,0,0,0|2,0,0]=3 999 B15R0.70 C/C=C/COCCCCCCCCCCCl 34a_200000033068_100102629194 [1,0,0,0,0,0|3,0,0]=4 1000 B15R0.70 C/C=C/COCCCCCCCCCCCl 7a_200000033068_100102629194 [1,0,0,0,0,0|3,0,0]=4 1001 B15R0.70 C/C=C/COCCCCCCCCCCN 34a_100000066964_100102629194 [1,0,0,0,0,0|3,0,0]=4 1002 B15R0.70 C/C=C/COCCCCCCCCCCO 34a_100016270725_100009813290 [1,0,0,0,0,0|3,0,0]=4 1003 B15R0.70 C/C=C/CSCCCCCCCCCCC 62a_100102629194_100011215454 [1,0,0,0,0,0|2,0,0]=3 1004 B15R0.70 C/C=C/CSCCCCCCCCCCO 62a_100009813290_100102629194 [1,0,0,0,0,0|3,0,0]=4 1005 B15R0.70 C/C=C/CSCCCCCCCCCCO 62a_100102629194_200000033068 [1,0,0,0,0,0|3,0,0]=4 1006 B15R0.70 CC#CCCOCCCCCCCCCC 34a_100000750427_100000210320 [1,0,0,0,0,0|2,0,1]=4 1007 B15R0.70 CC#CCNCCCCCCCCCCC 2230a_100000685387_100011215454 [1,0,0,0,0,0|2,0,1]=4 1008 B15R0.70 CC#CCNCCCCCCCCCCC 2230a_200011215754_100000748600 [1,0,0,0,0,0|2,0,1]=4 1009 B15R0.70 CC#CCNCCCCCCCCCCC 34a_100000685387_100011215454 [1,0,0,0,0,0|2,0,1]=4 1010 B15R0.70 CC#CCNCCCCCCCCCCC 34a_200011215754_100000748600 [1,0,0,0,0,0|2,0,1]=4 1011 B15R0.70 CC#CCOCCCCCCCCCCC 34a_100000210809_100000748600 [1,0,0,0,0,0|2,0,1]=4 1012 B15R0.70 CC#CCOCCCCCCCCCCC 34a_100000761923_100011215454 [1,0,0,0,0,0|2,0,1]=4 1013 B15R0.70 CC#CCOCCCCCCCCCCC 7a_100000210809_100000748600 [1,0,0,0,0,0|2,0,1]=4 1014 B15R0.70 CC#CCSCCCCCCCCCCC 62a_100000748600_100011215454 [1,0,0,0,0,0|2,0,1]=4 1015 B15R0.70 CC/C=C/CCCCCCCCCCOC 34a_200025759790_200000210301 [1,0,0,0,0,0|0,0,3]=4 1016 B15R0.70 CC/C=C/CCCCCCCCCCOC 7a_200025759790_200000210301 [1,0,0,0,0,0|0,0,3]=4 1017 B15R0.70 CC/C=C/CCCCCCCCCCO[13CH3] 34a_200025759790_200025704644 [1,0,0,0,0,0|0,0,3]=4 1018 B15R0.70 CC/C=C/CCCCCCCCCCO[13CH3] 7a_200025759790_200025704644 [1,0,0,0,0,0|0,0,3]=4 1019 B15R0.70 CC/C=C/CCCOCCCCCCCC 34a_100016287902_100000210759 [1,0,0,0,0,0|2,0,1]=4 1020 B15R0.70 CC/C=C/CCCOCCCCCCCC 7a_100016287902_100000210759 [1,0,0,0,0,0|2,0,1]=4 1021 B15R0.70 CC/C=C\CCCCCCCNCCCC 269862a_100000102301_200025770492 [1,0,0,0,0,0|2,0,1]=4 1022 B15R0.70 CC/C=C\CCCCCNCCCCCC 269862a_100000210581_100016288537 [1,0,0,0,0,0|2,0,1]=4 1023 B15R0.70 CC/C=C\CCCCCOCCCCCC 34a_100016268722_100000210314 [1,0,0,0,0,0|2,0,1]=4 1024 B15R0.70 CC/C=C\CCCCCOCCCCCC 7a_100016268722_100000210314 [1,0,0,0,0,0|2,0,1]=4 1025 B15R0.70 CC/C=C\CCCCOCCCCCCC 34a_100016287862_100000210614 [1,0,0,0,0,0|2,0,1]=4 1026 B15R0.70 CC/C=C\CCCCOCCCCCCC 7a_100016287862_100000210614 [1,0,0,0,0,0|2,0,1]=4 1027 B15R0.70 CC/C=C\CCNCCCCCCCCC 2230a_100000212291_100015370543 [1,0,0,0,0,0|2,0,1]=4 1028 B15R0.70 CC/C=C\CCNCCCCCCCCC 34a_100000212291_100015370543 [1,0,0,0,0,0|2,0,1]=4 1029 B15R0.70 CC/C=C\CCOCCCCCCCCC 34a_100000210712_100015370543 [1,0,0,0,0,0|2,0,1]=4 1030 B15R0.70 CC/C=C\CCOCCCCCCCCC 34a_100016288707_100011214924 [1,0,0,0,0,0|2,0,1]=4 1031 B15R0.70 CC/C=C\CCOCCCCCCCCC 7a_100000210712_100015370543 [1,0,0,0,0,0|2,0,1]=4 1032 B15R0.70 CC/C=C\CCOCCCCCCCCC 7a_100016288707_100000210328 [1,0,0,0,0,0|2,0,1]=4 1033 B15R0.70 CC/C=C\CCSCCCCCCCCC 62a_100015370543_100000210670 [1,0,0,0,0,0|2,0,1]=4 1034 B15R0.70 CC/C=C\CNCCCCCCCCCC 2230a_100000684558_100103147603 [1,0,0,0,0,0|2,0,1]=4 1035 B15R0.70 CC/C=C\CNCCCCCCCCCC 34a_100000684558_100103147603 [1,0,0,0,0,0|2,0,1]=4 1036 B15R0.70 CC/C=C\COCCCCCCCCCC 34a_100000210711_100103147603 [1,0,0,0,0,0|2,0,1]=4 1037 B15R0.70 CC/C=C\COCCCCCCCCCC 34a_100016268518_100000210320 [1,0,0,0,0,0|2,0,1]=4 1038 B15R0.70 CC/C=C\COCCCCCCCCCC 7a_100000210711_100103147603 [1,0,0,0,0,0|2,0,1]=4 1039 B15R0.70 CC/C=C\CSCCCCCCCCCC 62a_100103147603_100000210320 [1,0,0,0,0,0|2,0,1]=4 1040 B15R0.70 CC=CCCCOCCCCCCCCC 34a_100020645299_100011214924 [1,0,0,0,0,0|2,0,0]=3 1041 B15R0.70 CC=CCCCOCCCCCCCCO 34a_100020645299_100000033203 [1,0,0,0,0,0|3,0,0]=4 1042 B15R0.70 CC=CCNCCCCCCCCCCC 2230a_200011215754_100000070051 [1,0,0,0,0,0|2,0,0]=3 1043 B15R0.70 CC=CCNCCCCCCCCCCC 34a_200011215754_100000070051 [1,0,0,0,0,0|2,0,0]=3 1044 B15R0.70 CC=CCNCCCCCCCCCCO 2230a_100000066964_100000070051 [1,0,0,0,0,0|3,0,0]=4 1045 B15R0.70 CC=CCNCCCCCCCCCCO 34a_100000066964_100000070051 [1,0,0,0,0,0|3,0,0]=4 1046 B15R0.70 CC=CCOCCCCCCCCCCBr 34a_100009813290_100000070051 [1,0,0,0,0,0|3,0,0]=4 1047 B15R0.70 CC=CCOCCCCCCCCCCBr 7a_100009813290_100000070051 [1,0,0,0,0,0|3,0,0]=4 1048 B15R0.70 CC=CCOCCCCCCCCCCC 34a_100000210809_100000070051 [1,0,0,0,0,0|2,0,0]=3 1049 B15R0.70 CC=CCOCCCCCCCCCCC 7a_100000210809_100000070051 [1,0,0,0,0,0|2,0,0]=3 1050 B15R0.70 CC=CCOCCCCCCCCCCCl 34a_200000033068_100000070051 [1,0,0,0,0,0|3,0,0]=4 1051 B15R0.70 CC=CCOCCCCCCCCCCCl 7a_200000033068_100000070051 [1,0,0,0,0,0|3,0,0]=4 1052 B15R0.70 CC=CCOCCCCCCCCCCN 34a_100000066964_100000070051 [1,0,0,0,0,0|3,0,0]=4 1053 B15R0.70 CC=CCSCCCCCCCCCCC 62a_100000070051_100011215454 [1,0,0,0,0,0|2,0,0]=3 1054 B15R0.70 CC=CCSCCCCCCCCCCO 62a_100000070051_200000033068 [1,0,0,0,0,0|3,0,0]=4 1055 B15R0.70 CC=CCSCCCCCCCCCCO 62a_100009813290_100000070051 [1,0,0,0,0,0|3,0,0]=4 1056 B15R0.70 CCCC/C=C\CCCCCCCCOC 34a_100020587526_200000210301 [1,0,0,0,0,0|0,0,3]=4 1057 B15R0.70 CCCC/C=C\CCCCCCCCOC 7a_100020587526_200000210301 [1,0,0,0,0,0|0,0,3]=4 1058 B15R0.70 CCCC/C=C\CCCCCCCCO[13CH3] 34a_100020587526_200025704644 [1,0,0,0,0,0|0,0,3]=4 1059 B15R0.70 CCCC/C=C\CCCCCCCCO[13CH3] 7a_100020587526_200025704644 [1,0,0,0,0,0|0,0,3]=4 1060 B15R0.70 CCCCCCCCCCCCCCNC 2230a_100011217771_200000210301 [1,0,0,0,0,0|1,0,1]=3 1061 B15R0.70 CCCCCCCCCCCCCCNC 2230a_106832991635_100011215471 [1,0,0,0,0,0|1,0,1]=3 1062 B15R0.70 CCCCCCCCCCCCCCNC 270004a_106832991635_200011216147 [1,0,0,0,0,0|1,0,1]=3 1063 B15R0.70 CCCCCCCCCCCCCCNC 34a_100011217771_200000210301 [1,0,0,0,0,0|1,0,1]=3 1064 B15R0.70 CCCCCCCCCCCCCCNC 34a_100102657272_100011215471 [1,0,0,0,0,0|1,0,1]=3 1065 B15R0.70 CCCCCCCCCCCCCCNC 7a_106832991635_100011215471 [1,0,0,0,0,0|1,0,1]=3 1066 B15R0.70 CCCCCCCCCCCCCCN[13CH3] 2230a_100011217771_200025704644 [1,0,0,0,0,0|1,0,1]=3 1067 B15R0.70 CCCCCCCCCCCCCCN[13CH3] 34a_100011217771_200025704644 [1,0,0,0,0,0|1,0,1]=3 1068 B15R0.70 CCCCCCCCCCCCCCOC 34a_100000210739_200000210301 [1,0,0,0,0,0|0,0,1]=2 1069 B15R0.70 CCCCCCCCCCCCCCOC 34a_100138415774_100011215471 [1,0,0,0,0,0|0,0,1]=2 1070 B15R0.70 CCCCCCCCCCCCCCOC 7a_100000210739_200000210301 [1,0,0,0,0,0|0,0,1]=2 1071 B15R0.70 CCCCCCCCCCCCCCO[13CH3] 34a_100000210739_200025704644 [1,0,0,0,0,0|0,0,1]=2 1072 B15R0.70 CCCCCCCCCCCCCCO[13CH3] 7a_100000210739_200025704644 [1,0,0,0,0,0|0,0,1]=2 1073 B15R0.70 CCCCCCCCCCCCCNCC 2230a_100011215765_100000210202 [1,0,0,0,0,0|2,0,0]=3 1074 B15R0.70 CCCCCCCCCCCCCNCC 2230a_100015525214_100000210684 [1,0,0,0,0,0|2,0,0]=3 1075 B15R0.70 CCCCCCCCCCCCCNCC 270004a_100015525214_200011215488 [1,0,0,0,0,0|2,0,0]=3 1076 B15R0.70 CCCCCCCCCCCCCNCC 34a_100011215765_100000210202 [1,0,0,0,0,0|2,0,0]=3 1077 B15R0.70 CCCCCCCCCCCCCNCF 34a_100011215765_100015361967 [1,0,0,0,0,0|3,0,0]=4 1078 B15R0.70 CCCCCCCCCCCCCOCC 34a_100000185773_100000210202 [1,0,0,0,0,0|2,0,0]=3 1079 B15R0.70 CCCCCCCCCCCCCOCC 34a_100121572206_100000210684 [1,0,0,0,0,0|2,0,0]=3 1080 B15R0.70 CCCCCCCCCCCCCOCC 7a_100000185773_100000210202 [1,0,0,0,0,0|2,0,0]=3 1081 B15R0.70 CCCCCCCCCCCCCOCF 34a_100000185773_100015361967 [1,0,0,0,0,0|3,0,0]=4 1082 B15R0.70 CCCCCCCCCCCCCOCF 7a_100000185773_100015361967 [1,0,0,0,0,0|3,0,0]=4 1083 B15R0.70 CCCCCCCCCCCCCSCF 62a_100015361967_100011934334 [1,0,0,0,0,0|3,0,0]=4 1084 B15R0.70 CCCCCCCCCCCCNCCC 2230a_100000210451_100000210303 [1,0,0,0,0,0|2,0,1]=4 1085 B15R0.70 CCCCCCCCCCCCNCCC 270004a_100020643023_100011218549 [1,0,0,0,0,0|2,0,1]=4 1086 B15R0.70 CCCCCCCCCCCCNCCC 34a_100000210451_100000210303 [1,0,0,0,0,0|2,0,1]=4 1087 B15R0.70 CCCCCCCCCCCCNCOC 2230a_100000210451_100000766300 [1,0,0,0,0,0|1,0,1]=3 1088 B15R0.70 CCCCCCCCCCCCNCSC 2230a_100000210451_100011218213 [1,0,0,0,0,0|1,1,1]=4 1089 B15R0.70 CCCCCCCCCCCCNCSC 34a_100000210451_100011218213 [1,0,0,0,0,0|1,1,1]=4 1090 B15R0.70 CCCCCCCCCCCCOCCC 34a_100000210258_100000759014 [1,0,0,0,0,0|2,0,1]=4 1091 B15R0.70 CCCCCCCCCCCCOCCC 34a_100000210810_100000210303 [1,0,0,0,0,0|2,0,1]=4 1092 B15R0.70 CCCCCCCCCCCCOCCC 7a_100000210810_100000210303 [1,0,0,0,0,0|2,0,1]=4 1093 B15R0.70 CCCCCCCCCCCCOCSC 34a_100000210810_100011218213 [1,0,0,0,0,0|1,1,1]=4 1094 B15R0.70 CCCCCCCCCCCCSCOC 62a_100000766300_100000759014 [1,0,0,0,0,0|1,0,1]=3 1095 B15R0.70 CCCCCCCCCCCCSCSC 62a_100011218213_100000759014 [1,0,0,0,0,0|1,1,1]=4 1096 B15R0.70 CCCCCCCCCCCNCCCC 2230a_100000102301_100011215454 [1,0,0,0,0,0|2,0,1]=4 1097 B15R0.70 CCCCCCCCCCCNCCCC 2230a_200011215754_100000210211 [1,0,0,0,0,0|2,0,1]=4 1098 B15R0.70 CCCCCCCCCCCNCCCC 34a_200011215754_100000210210 [1,0,0,0,0,0|2,0,1]=4 1099 B15R0.70 CCCCCCCCCCCNCCCC 7a_106832991798_100011215454 [1,0,0,0,0,0|2,0,1]=4 1100 B15R0.70 CCCCCCCCCCCNCCOC 2230a_100000209980_100011215454 [1,0,0,0,0,0|1,0,1]=3 1101 B15R0.70 CCCCCCCCCCCNCCOC 2230a_200011215754_100011201679 [1,0,0,0,0,0|1,0,1]=3 1102 B15R0.70 CCCCCCCCCCCNCCOC 34a_200011215754_100011201679 [1,0,0,0,0,0|1,0,1]=3 1103 B15R0.70 CCCCCCCCCCCNCCSC 2230a_100020590264_100011215454 [1,0,0,0,0,0|1,1,1]=4 1104 B15R0.70 CCCCCCCCCCCNCCSC 2230a_200011215754_100000751147 [1,0,0,0,0,0|1,1,1]=4 1105 B15R0.70 CCCCCCCCCCCNCCSC 34a_200011215754_100000212216 [1,0,0,0,0,0|1,1,1]=4 1106 B15R0.70 CCCCCCCCCCCOCCCC 34a_100000210227_100011215454 [1,0,0,0,0,0|2,0,1]=4 1107 B15R0.70 CCCCCCCCCCCOCCCC 34a_100000210809_100000210210 [1,0,0,0,0,0|2,0,1]=4 1108 B15R0.70 CCCCCCCCCCCOCCCC 7a_100000210227_100011215454 [1,0,0,0,0,0|2,0,1]=4 1109 B15R0.70 CCCCCCCCCCCOCCCC 7a_100000210809_100000210211 [1,0,0,0,0,0|2,0,1]=4 1110 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210237_100011215454 [1,0,0,0,0,0|1,0,1]=3 1111 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210809_100011201679 [1,0,0,0,0,0|1,0,1]=3 1112 B15R0.70 CCCCCCCCCCCOCCOC 34a_100010166600_200000210301 [1,0,0,0,0,0|1,0,1]=3 1113 B15R0.70 CCCCCCCCCCCOCCOC 7a_100000210809_100000233755 [1,0,0,0,0,0|1,0,1]=3 1114 B15R0.70 CCCCCCCCCCCOCCOC 7a_100010166600_200000210301 [1,0,0,0,0,0|1,0,1]=3 1115 B15R0.70 CCCCCCCCCCCOCCON 34a_100000700252_100011215454 [1,0,0,0,0,0|2,0,1]=4 1116 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 34a_100010166600_200025704644 [1,0,0,0,0,0|1,0,1]=3 1117 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 7a_100010166600_200025704644 [1,0,0,0,0,0|1,0,1]=3 1118 B15R0.70 CCCCCCCCCCCOCCSC 34a_100000210809_100000212216 [1,0,0,0,0,0|1,1,1]=4 1119 B15R0.70 CCCCCCCCCCCOCCSC 34a_100000230434_100011215454 [1,0,0,0,0,0|1,1,1]=4 1120 B15R0.70 CCCCCCCCCCCOCCSC 7a_100000210809_100000212216 [1,0,0,0,0,0|1,1,1]=4 1121 B15R0.70 CCCCCCCCCCCOCCSC 7a_100000230434_100011215454 [1,0,0,0,0,0|1,1,1]=4 1122 B15R0.70 CCCCCCCCCCCSCCOC 62a_100000233755_100011215454 [1,0,0,0,0,0|1,0,1]=3 1123 B15R0.70 CCCCCCCCCCCSCCSC 62a_100000212216_100011215454 [1,0,0,0,0,0|1,1,1]=4 1124 B15R0.70 CCCCCCCCCCCSCOCC 62a_100000739092_100011215454 [1,0,0,0,0,0|3,0,0]=4 1125 B15R0.70 CCCCCCCCCCNCCCCC 2230a_100000209983_100000210320 [1,0,0,0,0,0|2,0,1]=4 1126 B15R0.70 CCCCCCCCCCNCCCCC 2230a_100000684558_100000210326 [1,0,0,0,0,0|2,0,1]=4 1127 B15R0.70 CCCCCCCCCCNCCCCC 34a_100000684558_100000718602 [1,0,0,0,0,0|2,0,1]=4 1128 B15R0.70 CCCCCCCCCCNCCCOC 2230a_100000684558_100000740836 [1,0,0,0,0,0|1,0,1]=3 1129 B15R0.70 CCCCCCCCCCNCCCOC 34a_100000684558_100000740836 [1,0,0,0,0,0|1,0,1]=3 1130 B15R0.70 CCCCCCCCCCNCCCOC 34a_100150723488_100000210320 [1,0,0,0,0,0|1,0,1]=3 1131 B15R0.70 CCCCCCCCCCNCCCSC 2230a_100000749238_100000210320 [1,0,0,0,0,0|1,1,1]=4 1132 B15R0.70 CCCCCCCCCCNCCOCC 2230a_100000684558_100011215890 [1,0,0,0,0,0|3,0,0]=4 1133 B15R0.70 CCCCCCCCCCNCCOCC 2230a_102516460346_100000210320 [1,0,0,0,0,0|3,0,0]=4 1134 B15R0.70 CCCCCCCCCCNCCOCC 34a_100000684558_100000210147 [1,0,0,0,0,0|3,0,0]=4 1135 B15R0.70 CCCCCCCCCCNCCOCC 34a_102516460346_100000210320 [1,0,0,0,0,0|3,0,0]=4 1136 B15R0.70 CCCCCCCCCCNCCSCC 2230a_100000106463_100000210320 [1,0,0,0,0,0|3,0,0]=4 1137 B15R0.70 CCCCCCCCCCNCCSCC 2230a_100000684558_100000757381 [1,0,0,0,0,0|3,0,0]=4 1138 B15R0.70 CCCCCCCCCCNCCSCC 34a_100000684558_100000757381 [1,0,0,0,0,0|3,0,0]=4 1139 B15R0.70 CCCCCCCCCCOCCCCC 34a_100000210253_100000210320 [1,0,0,0,0,0|2,0,1]=4 1140 B15R0.70 CCCCCCCCCCOCCCCC 34a_100000210711_100000718602 [1,0,0,0,0,0|2,0,1]=4 1141 B15R0.70 CCCCCCCCCCOCCCCC 7a_100000210253_100000210320 [1,0,0,0,0,0|2,0,1]=4 1142 B15R0.70 CCCCCCCCCCOCCCCC 7a_100000210711_100000210326 [1,0,0,0,0,0|2,0,1]=4 1143 B15R0.70 CCCCCCCCCCOCCCNC 34a_100000213112_100000210320 [1,0,0,0,0,0|2,0,1]=4 1144 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000210711_100000740836 [1,0,0,0,0,0|1,0,1]=3 1145 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000740835_100000210320 [1,0,0,0,0,0|1,0,1]=3 1146 B15R0.70 CCCCCCCCCCOCCCOC 7a_100000210711_100000740836 [1,0,0,0,0,0|1,0,1]=3 1147 B15R0.70 CCCCCCCCCCOCCCSC 34a_100000690336_100000210320 [1,0,0,0,0,0|1,1,1]=4 1148 B15R0.70 CCCCCCCCCCOCCCSC 7a_100000690336_100000210320 [1,0,0,0,0,0|1,1,1]=4 1149 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210136_100000210320 [1,0,0,0,0,0|3,0,0]=4 1150 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210711_100000210147 [1,0,0,0,0,0|3,0,0]=4 1151 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210136_100000210320 [1,0,0,0,0,0|3,0,0]=4 1152 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210711_100011215890 [1,0,0,0,0,0|3,0,0]=4 1153 B15R0.70 CCCCCCCCCCOCCSCC 34a_100000210711_100000757381 [1,0,0,0,0,0|3,0,0]=4 1154 B15R0.70 CCCCCCCCCCOCCSCC 34a_100000212035_100000210320 [1,0,0,0,0,0|3,0,0]=4 1155 B15R0.70 CCCCCCCCCCOCCSCC 7a_100000210711_100000757381 [1,0,0,0,0,0|3,0,0]=4 1156 B15R0.70 CCCCCCCCCCOCCSCC 7a_100000212035_100000210320 [1,0,0,0,0,0|3,0,0]=4 1157 B15R0.70 CCCCCCCCCCSCCCOC 62a_100000709357_100000210320 [1,0,0,0,0,0|1,0,1]=3 1158 B15R0.70 CCCCCCCCCCSCCOCC 34a_100011628728_100000210202 [1,0,0,0,0,0|3,0,0]=4 1159 B15R0.70 CCCCCCCCCCSCCOCC 62a_100000210147_100000210320 [1,0,0,0,0,0|3,0,0]=4 1160 B15R0.70 CCCCCCCCCCSCCOCC 7a_100011628728_100000210202 [1,0,0,0,0,0|3,0,0]=4 1161 B15R0.70 CCCCCCCCCCSCCSCC 62a_100000757381_100000210320 [1,0,0,0,0,0|3,0,0]=4 1162 B15R0.70 CCCCCCCCCNCCCCCC 2230a_100000210581_100011214924 [1,0,0,0,0,0|2,0,1]=4 1163 B15R0.70 CCCCCCCCCNCCCCCC 2230a_100000212291_100000210314 [1,0,0,0,0,0|2,0,1]=4 1164 B15R0.70 CCCCCCCCCNCCCCCC 34a_100000212291_100000210314 [1,0,0,0,0,0|2,0,1]=4 1165 B15R0.70 CCCCCCCCCNCCCCOC 2230a_100000212291_100000730899 [1,0,0,0,0,0|1,0,1]=3 1166 B15R0.70 CCCCCCCCCNCCCCOC 34a_100000212291_100000755781 [1,0,0,0,0,0|1,0,1]=3 1167 B15R0.70 CCCCCCCCCNCCCOCC 2230a_100000210961_100011214924 [1,0,0,0,0,0|3,0,0]=4 1168 B15R0.70 CCCCCCCCCNCCCOCC 2230a_100000212291_100012232248 [1,0,0,0,0,0|3,0,0]=4 1169 B15R0.70 CCCCCCCCCNCCCOCC 34a_100000210961_100011214924 [1,0,0,0,0,0|3,0,0]=4 1170 B15R0.70 CCCCCCCCCNCCCOCC 34a_100000212291_100012232248 [1,0,0,0,0,0|3,0,0]=4 1171 B15R0.70 CCCCCCCCCNCOCCOC 2230a_100000212291_100000231047 [1,0,0,0,0,0|2,0,1]=4 1172 B15R0.70 CCCCCCCCCOCCCCCC 34a_100000210259_100011214924 [1,0,0,0,0,0|2,0,1]=4 1173 B15R0.70 CCCCCCCCCOCCCCCC 34a_100000210712_100000210314 [1,0,0,0,0,0|2,0,1]=4 1174 B15R0.70 CCCCCCCCCOCCCCCC 7a_100000210259_100000210328 [1,0,0,0,0,0|2,0,1]=4 1175 B15R0.70 CCCCCCCCCOCCCCCC 7a_100000210712_100000210314 [1,0,0,0,0,0|2,0,1]=4 1176 B15R0.70 CCCCCCCCCOCCCCOC 34a_100000210712_100000755781 [1,0,0,0,0,0|1,0,1]=3 1177 B15R0.70 CCCCCCCCCOCCCCOC 34a_100000740925_100011214924 [1,0,0,0,0,0|1,0,1]=3 1178 B15R0.70 CCCCCCCCCOCCCCOC 7a_100000210712_100000730899 [1,0,0,0,0,0|1,0,1]=3 1179 B15R0.70 CCCCCCCCCOCCCCSC 34a_100011217163_100011214924 [1,0,0,0,0,0|1,1,1]=4 1180 B15R0.70 CCCCCCCCCOCCCCSC 7a_100011217163_100000210328 [1,0,0,0,0,0|1,1,1]=4 1181 B15R0.70 CCCCCCCCCOCCCOCC 34a_100000210712_100012232248 [1,0,0,0,0,0|3,0,0]=4 1182 B15R0.70 CCCCCCCCCOCCCOCC 34a_100000757476_100011214924 [1,0,0,0,0,0|3,0,0]=4 1183 B15R0.70 CCCCCCCCCOCCCOCC 7a_100000210712_100012232248 [1,0,0,0,0,0|3,0,0]=4 1184 B15R0.70 CCCCCCCCCOCCCOCC 7a_100000757476_100000210328 [1,0,0,0,0,0|3,0,0]=4 1185 B15R0.70 CCCCCCCCCOCCCSCC 34a_100011216438_100011214924 [1,0,0,0,0,0|3,0,0]=4 1186 B15R0.70 CCCCCCCCCOCCCSCC 7a_100011216438_100000210328 [1,0,0,0,0,0|3,0,0]=4 1187 B15R0.70 CCCCCCCCCSCCCCOC 62a_100000730899_100000210670 [1,0,0,0,0,0|1,0,1]=3 1188 B15R0.70 CCCCCCCCCSCCCOCC 62a_100012232248_100000210670 [1,0,0,0,0,0|3,0,0]=4 1189 B15R0.70 CCCCCCCCCSCOCCOC 62a_100000231047_100000210670 [1,0,0,0,0,0|2,0,1]=4 1190 B15R0.70 CCCCCCCCNCCCCCCC 2230a_100000229938_100000210759 [1,0,0,0,0,0|2,0,1]=4 1191 B15R0.70 CCCCCCCCNCCCCCCC 2230a_100000229939_100000210681 [1,0,0,0,0,0|2,0,1]=4 1192 B15R0.70 CCCCCCCCNCCCCCCC 34a_100000229939_100000210614 [1,0,0,0,0,0|2,0,1]=4 1193 B15R0.70 CCCCCCCCNCCCCCOC 2230a_100000747528_100000210759 [1,0,0,0,0,0|1,0,1]=3 1194 B15R0.70 CCCCCCCCNCCCCCOC 34a_100000747528_100000210759 [1,0,0,0,0,0|1,0,1]=3 1195 B15R0.70 CCCCCCCCNCCOCCOC 2230a_100000229939_100000695917 [1,0,0,0,0,0|2,0,1]=4 1196 B15R0.70 CCCCCCCCNCCOCCOC 2230a_100000745349_100000210759 [1,0,0,0,0,0|2,0,1]=4 1197 B15R0.70 CCCCCCCCNCCOCCOC 34a_100000229939_100000695917 [1,0,0,0,0,0|2,0,1]=4 1198 B15R0.70 CCCCCCCCNCCOCCOC 34a_100000745349_100000210759 [1,0,0,0,0,0|2,0,1]=4 1199 B15R0.70 CCCCCCCCOCCCCCCC 34a_100000210232_100000210614 [1,0,0,0,0,0|2,0,1]=4 1200 B15R0.70 CCCCCCCCOCCCCCCC 34a_100000210272_100000210759 [1,0,0,0,0,0|2,0,1]=4 1201 B15R0.70 CCCCCCCCOCCCCCCC 7a_100000210232_100000210614 [1,0,0,0,0,0|2,0,1]=4 1202 B15R0.70 CCCCCCCCOCCCCCCC 7a_100000210272_100000210759 [1,0,0,0,0,0|2,0,1]=4 1203 B15R0.70 CCCCCCCCOCCCCCNC 34a_100000722520_100000210759 [1,0,0,0,0,0|2,0,1]=4 1204 B15R0.70 CCCCCCCCOCCOCCOC 34a_100000210232_100000695917 [1,0,0,0,0,0|2,0,1]=4 1205 B15R0.70 CCCCCCCCOCCOCCOC 34a_100011215163_100000210759 [1,0,0,0,0,0|2,0,1]=4 1206 B15R0.70 CCCCCCCCOCCOCCOC 7a_100000210232_100000695917 [1,0,0,0,0,0|2,0,1]=4 1207 B15R0.70 CCCCCCCCOCCOCCOC 7a_100011215163_100000210759 [1,0,0,0,0,0|2,0,1]=4 1208 B15R0.70 CCCCCCCCSCCOCCOC 62a_100000210759_100000695917 [1,0,0,0,0,0|2,0,1]=4 1209 B15R0.70 CCCCCCCCSCCOCCOC 62a_100000695917_100000210317 [1,0,0,0,0,0|2,0,1]=4 1210 B15R0.70 CCCCCCCNCCCCCCOC 2230a_100000229938_100011998445 [1,0,0,0,0,0|1,0,1]=3 1211 B15R0.70 CCCCCCCNCCCOCCOC 2230a_100000206027_100000210681 [1,0,0,0,0,0|2,0,1]=4 1212 B15R0.70 CCCCCCCNCCCOCCOC 2230a_100000229938_100011216529 [1,0,0,0,0,0|2,0,1]=4 1213 B15R0.70 CCCCCCCNCCCOCCOC 34a_100000206027_100000210614 [1,0,0,0,0,0|2,0,1]=4 1214 B15R0.70 CCCCCCCOCCCCCCOC 34a_100000210272_100011998445 [1,0,0,0,0,0|1,0,1]=3 1215 B15R0.70 CCCCCCCOCCCCCCOC 34a_200012092642_100000210614 [1,0,0,0,0,0|1,0,1]=3 1216 B15R0.70 CCCCCCCOCCCCCCOC 7a_100000210272_100011998445 [1,0,0,0,0,0|1,0,1]=3 1217 B15R0.70 CCCCCCCOCCCCCCOC 7a_200012092642_100000210614 [1,0,0,0,0,0|1,0,1]=3 1218 B15R0.70 CCCCCCCOCCCOCCOC 34a_100000210272_100011216529 [1,0,0,0,0,0|2,0,1]=4 1219 B15R0.70 CCCCCCCOCCCOCCOC 7a_100000210272_100011216529 [1,0,0,0,0,0|2,0,1]=4 1220 B15R0.70 CCCCCCCSCCCCCCOC 62a_100000210614_100011998445 [1,0,0,0,0,0|1,0,1]=3 1221 B15R0.70 CCCCCCCSCCCCCCOC 62a_100011998445_100000210316 [1,0,0,0,0,0|1,0,1]=3 1222 B15R0.70 CCCCCCCSCCCOCCOC 62a_100000210614_100011216529 [1,0,0,0,0,0|2,0,1]=4 1223 B15R0.70 CCCCCCCSCCCOCCOC 62a_100011216529_100000210316 [1,0,0,0,0,0|2,0,1]=4 1224 B15R0.70 CCCCCCOCCCOCCCOC 34a_200011215475_100000210314 [1,0,0,0,0,0|2,0,1]=4 1225 B15R0.70 CCCCCCOCCCOCCCOC 7a_200011215475_100000210314 [1,0,0,0,0,0|2,0,1]=4 1226 B15R0.70 CCCCCCOCCOCCCCOC 34a_100000691444_100000755781 [1,0,0,0,0,0|2,0,1]=4 1227 B15R0.70 CCCCCCOCCOCCCCOC 7a_100000691444_100000730899 [1,0,0,0,0,0|2,0,1]=4 1228 B15R0.70 CCCCNCCCCOCCCCOC 34a_200011216965_100000755781 [1,0,0,0,0,0|2,0,1]=4 1229 B15R0.70 CCCCOCCCCOCCCCOC 34a_200000760531_100000755781 [1,0,0,0,0,0|2,0,1]=4 1230 B15R0.70 CCCCOCCCCOCCCCOC 7a_200000760531_100000730899 [1,0,0,0,0,0|2,0,1]=4 1231 B15R0.70 CCCCOCCOCCCCCCOC 34a_100000210238_100011998445 [1,0,0,0,0,0|2,0,1]=4 1232 B15R0.70 CCCCOCCOCCCCCCOC 34a_200012092642_100000743108 [1,0,0,0,0,0|2,0,1]=4 1233 B15R0.70 CCCCOCCOCCCCCCOC 7a_100000210238_100011998445 [1,0,0,0,0,0|2,0,1]=4 1234 B15R0.70 CCCCOCCOCCCCCCOC 7a_200012092642_100000743108 [1,0,0,0,0,0|2,0,1]=4 1235 B15R0.70 CCCCOCCSCCCCCCOC 62a_100000743108_100011998445 [1,0,0,0,0,0|2,0,1]=4 1236 B15R0.70 CCCCOCCSCCCCCCOC 62a_100011998445_100000743108 [1,0,0,0,0,0|2,0,1]=4 1237 B15R0.70 CCCCSCCNCCCCCCOC 2230a_100025743550_100011998445 [1,0,0,0,0,0|2,0,1]=4 1238 B15R0.70 CCCCSCCOCCCCCCOC 34a_200000230436_100011998445 [1,0,0,0,0,0|2,0,1]=4 1239 B15R0.70 CCCCSCCOCCCCCCOC 7a_200000230436_100011998445 [1,0,0,0,0,0|2,0,1]=4 1240 B15R0.70 CCCOCCCCCCCCCOCC 34a_100009875440_100000210303 [1,0,0,0,0,0|3,0,0]=4 1241 B15R0.70 CCCOCCCCCCCCCOCC 7a_100009875440_100000210303 [1,0,0,0,0,0|3,0,0]=4 1242 B15R0.70 CCCOCCCNCCCCCCOC 2230a_100011217757_100011998445 [1,0,0,0,0,0|2,0,1]=4 1243 B15R0.70 CCCOCCCNCCCCCCOC 34a_100011217757_100011998445 [1,0,0,0,0,0|2,0,1]=4 1244 B15R0.70 CCNCCCCCCCCCCCCO 2230a_100000066677_100000210202 [1,0,0,0,0,0|3,0,0]=4 1245 B15R0.70 CCNCCCCCCCCCCCCO 2230a_100015525214_100009813331 [1,0,0,0,0,0|3,0,0]=4 1246 B15R0.70 CCNCCCCCCCCCCCCO 34a_100000066677_100000210202 [1,0,0,0,0,0|3,0,0]=4 1247 B15R0.70 CCOCCCCCCCCCCCCBr 34a_100009813331_100000210202 [1,0,0,0,0,0|3,0,0]=4 1248 B15R0.70 CCOCCCCCCCCCCCCBr 7a_100009813331_100000210202 [1,0,0,0,0,0|3,0,0]=4 1249 B15R0.70 CCOCCCCCCCCCCCCN 34a_100000066677_100000210202 [1,0,0,0,0,0|3,0,0]=4 1250 B15R0.70 CCOCCCCCCCCCCCCO 34a_100121572206_100009813331 [1,0,0,0,0,0|3,0,0]=4 1251 B15R0.70 CCSCCCCCCCCCCCCO 62a_100009813331_100000210202 [1,0,0,0,0,0|3,0,0]=4 1252 B15R0.70 CNCCCCCCCCCCCCCO 2230a_106832991635_100009812470 [1,0,0,0,0,0|2,0,1]=4 1253 B15R0.70 CNCCCCCCCCCCCCCO 34a_100102657272_100009812470 [1,0,0,0,0,0|2,0,1]=4 1254 B15R0.70 CNCCCCCCCCCCCCCO 7a_106832991635_100009812470 [1,0,0,0,0,0|2,0,1]=4 1255 B15R0.70 CNCCCCCOCCCCCCOC 34a_100000722520_100011998445 [1,0,0,0,0,0|2,0,1]=4 1256 B15R0.70 COCCCCCCCCCCCCCBr 34a_100009812470_200000210301 [1,0,0,0,0,0|1,0,1]=3 1257 B15R0.70 COCCCCCCCCCCCCCBr 7a_100009812470_200000210301 [1,0,0,0,0,0|1,0,1]=3 1258 B15R0.70 COCCCCCCCCCCCCCO 34a_100138415774_100009812470 [1,0,0,0,0,0|1,0,1]=3 1259 B15R0.70 COCCCCCCNCCCCCCO 2230a_100000686447_100011998445 [1,0,0,0,0,0|2,0,1]=4 1260 B15R0.70 COCCCCCCNCCCCCCO 34a_100000686447_100011998445 [1,0,0,0,0,0|2,0,1]=4 1261 B15R0.70 COCCCCCCNCCCCCOC 2230a_100000747528_100011998445 [1,0,0,0,0,0|2,0,1]=4 1262 B15R0.70 COCCCCCCNCCCCCOC 34a_100000747528_100011998445 [1,0,0,0,0,0|2,0,1]=4 1263 B15R0.70 COCCCCCCOCCCCCCBr 34a_100011215345_100011998445 [1,0,0,0,0,0|2,0,1]=4 1264 B15R0.70 COCCCCCCOCCCCCCBr 7a_100011215345_100011998445 [1,0,0,0,0,0|2,0,1]=4 1265 B15R0.70 COCCCCCCOCCCCCCCl 34a_100000766143_100011998445 [1,0,0,0,0,0|2,0,1]=4 1266 B15R0.70 COCCCCCCOCCCCCCCl 7a_100000766143_100011998445 [1,0,0,0,0,0|2,0,1]=4 1267 B15R0.70 COCCCCCCOCCCCCCF 34a_100000732779_100011998445 [1,0,0,0,0,0|2,0,1]=4 1268 B15R0.70 COCCCCCCOCCCCCCF 34a_200012092642_100015922095 [1,0,0,0,0,0|2,0,1]=4 1269 B15R0.70 COCCCCCCOCCCCCCF 7a_100000732779_100011998445 [1,0,0,0,0,0|2,0,1]=4 1270 B15R0.70 COCCCCCCOCCCCCCF 7a_200012092642_100015922095 [1,0,0,0,0,0|2,0,1]=4 1271 B15R0.70 COCCCCCCOCCCCCCN 34a_100000686447_100011998445 [1,0,0,0,0,0|2,0,1]=4 1272 B15R0.70 COCCCCCCOCCCCCCO 34a_200012092642_100000766143 [1,0,0,0,0,0|2,0,1]=4 1273 B15R0.70 COCCCCCCOCCCCCCO 7a_200012092642_100000766143 [1,0,0,0,0,0|2,0,1]=4 1274 B15R0.70 COCCCCCCSCCCCCCF 62a_100011998445_100015922095 [1,0,0,0,0,0|2,0,1]=4 1275 B15R0.70 COCCCCCCSCCCCCCF 62a_100015922095_100011998445 [1,0,0,0,0,0|2,0,1]=4 1276 B15R0.70 COCCCCCCSCCCCCCO 62a_100000766143_100011998445 [1,0,0,0,0,0|2,0,1]=4 1277 B15R0.70 COCCCCCCSCCCCCCO 62a_100011998445_100000766143 [1,0,0,0,0,0|2,0,1]=4 1278 B15R0.70 COCCCCCNCCCCCCCO 2230a_100000747528_100000760002 [1,0,0,0,0,0|2,0,1]=4 1279 B15R0.70 COCCCCCNCCCCCCCO 34a_100000747528_100000760002 [1,0,0,0,0,0|2,0,1]=4 1280 B15R0.70 COCCCCNCCCCCCCCO 2230a_102515433106_100000730899 [1,0,0,0,0,0|2,0,1]=4 1281 B15R0.70 COCCCCNCCCCCCCCO 34a_102515433106_100000755781 [1,0,0,0,0,0|2,0,1]=4 1282 B15R0.70 COCCCCOCCCCCCCCBr 34a_100009813846_100000755781 [1,0,0,0,0,0|2,0,1]=4 1283 B15R0.70 COCCCCOCCCCCCCCBr 7a_100009813846_100000730899 [1,0,0,0,0,0|2,0,1]=4 1284 B15R0.70 COCCCCOCCCCCCCCCl 34a_100000033203_100000755781 [1,0,0,0,0,0|2,0,1]=4 1285 B15R0.70 COCCCCOCCCCCCCCCl 7a_100000033203_100000730899 [1,0,0,0,0,0|2,0,1]=4 1286 B15R0.70 COCCCCOCCCCCCCCN 34a_102515433106_100000755781 [1,0,0,0,0,0|2,0,1]=4 1287 B15R0.70 COCCCCOCCCCCCCCO 34a_100000740925_100000033203 [1,0,0,0,0,0|2,0,1]=4 1288 B15R0.70 COCCCCSCCCCCCCCO 62a_100000033203_100000730899 [1,0,0,0,0,0|2,0,1]=4 1289 B15R0.70 COCCCCSCCCCCCCCO 62a_100000730899_100000033203 [1,0,0,0,0,0|2,0,1]=4 1290 B15R0.70 COCCCNCCCCCCCCCO 2230a_100000078944_100000740836 [1,0,0,0,0,0|2,0,1]=4 1291 B15R0.70 COCCCNCCCCCCCCCO 34a_100000078944_100000740836 [1,0,0,0,0,0|2,0,1]=4 1292 B15R0.70 COCCCNCCCCCCCCCO 34a_100150723488_100009813782 [1,0,0,0,0,0|2,0,1]=4 1293 B15R0.70 COCCCOCCCCCCCCCBr 34a_100009813782_100000740836 [1,0,0,0,0,0|2,0,1]=4 1294 B15R0.70 COCCCOCCCCCCCCCBr 7a_100009813782_100000740836 [1,0,0,0,0,0|2,0,1]=4 1295 B15R0.70 COCCCOCCCCCCCCCCl 34a_100009868337_100000740836 [1,0,0,0,0,0|2,0,1]=4 1296 B15R0.70 COCCCOCCCCCCCCCCl 7a_100009868337_100000740836 [1,0,0,0,0,0|2,0,1]=4 1297 B15R0.70 COCCCOCCCCCCCCCN 34a_100000078944_100000740836 [1,0,0,0,0,0|2,0,1]=4 1298 B15R0.70 COCCCOCCCCCCCCCO 34a_100000740835_100009813782 [1,0,0,0,0,0|2,0,1]=4 1299 B15R0.70 COCCCSCCCCCCCCCO 62a_100000709357_100009813782 [1,0,0,0,0,0|2,0,1]=4 1300 B15R0.70 COCCCSCCCCCCCCCO 62a_100009813782_100000709357 [1,0,0,0,0,0|2,0,1]=4 1301 B15R0.70 COCCNCCCCCCCCCCO 2230a_100000066964_100011201679 [1,0,0,0,0,0|2,0,1]=4 1302 B15R0.70 COCCNCCCCCCCCCCO 2230a_100000209980_100009813290 [1,0,0,0,0,0|2,0,1]=4 1303 B15R0.70 COCCNCCCCCCCCCCO 34a_100000066964_100011201679 [1,0,0,0,0,0|2,0,1]=4 1304 B15R0.70 COCCOCCCCCCCCCCBr 34a_100009813290_100011201679 [1,0,0,0,0,0|2,0,1]=4 1305 B15R0.70 COCCOCCCCCCCCCCBr 7a_100009813290_100000233755 [1,0,0,0,0,0|2,0,1]=4 1306 B15R0.70 COCCOCCCCCCCCCCCl 34a_200000033068_100011201679 [1,0,0,0,0,0|2,0,1]=4 1307 B15R0.70 COCCOCCCCCCCCCCCl 7a_200000033068_100000233755 [1,0,0,0,0,0|2,0,1]=4 1308 B15R0.70 COCCOCCCCCCCCCCN 34a_100000066964_100011201679 [1,0,0,0,0,0|2,0,1]=4 1309 B15R0.70 COCCOCCCCCCCCCCO 34a_100000210237_100009813290 [1,0,0,0,0,0|2,0,1]=4 1310 B15R0.70 COCCSCCCCCCCCCCO 62a_100000233755_200000033068 [1,0,0,0,0,0|2,0,1]=4 1311 B15R0.70 COCCSCCCCCCCCCCO 62a_100009813290_100000233755 [1,0,0,0,0,0|2,0,1]=4 1312 B15R0.70 COCSCCCCCCCCCCCO 62a_100009812471_100000766300 [1,0,0,0,0,0|2,0,1]=4 1313 B15R0.70 CSCCCCCCCCCCCCCO 62a_100009812470_200000210301 [1,0,0,0,0,0|1,1,1]=4 1314 B15R0.70 [13CH3]OCCCCCCCCCCCCCBr 34a_100009812470_200025704644 [1,0,0,0,0,0|1,0,1]=3 1315 B15R0.70 [13CH3]OCCCCCCCCCCCCCBr 7a_100009812470_200025704644 [1,0,0,0,0,0|1,0,1]=3 1316 B15R0.70 [13CH3]SCCCCCCCCCCCCCO 62a_100009812470_200025704644 [1,0,0,0,0,0|1,1,1]=4 1317 B15R0.81 C#CC(=O)CCCCCCCCCCCC 1458a_100000211873_100000759014 [1,0,0,0,0,0|1,0,1]=3 1318 B15R0.81 C#CC(=O)CCCCCCCCCCCO 1458a_100000211873_100009812471 [1,0,0,0,0,0|2,0,1]=4 1319 B15R0.81 C#CCCCCCCCCOCC(=O)OC 34a_100000065265_100000747449 [1,0,0,0,0,0|1,0,2]=4 1320 B15R0.81 C#CCCCCCCCCOCC(=O)OC 7a_100000065265_100000747449 [1,0,0,0,0,0|1,0,2]=4 1321 B15R0.81 C#CCCCCCCCOCCC(=O)OC 34a_100000054614_100000742370 [1,0,0,0,0,0|1,0,2]=4 1322 B15R0.81 C#CCCCCCCCOCCC(=O)OC 7a_100000054614_100000204255 [1,0,0,0,0,0|1,0,2]=4 1323 B15R0.81 C#CCCCCCCCSCCC(=O)OC 62a_100000204255_100153394163 [1,0,0,0,0,0|1,0,2]=4 1324 B15R0.81 C#CCCCCCCCSCCC(=O)OC 62a_100153394163_100000204255 [1,0,0,0,0,0|1,0,2]=4 1325 B15R0.81 C#CCCCCCCOCCCC(=O)OC 34a_100011217361_100000742333 [1,0,0,0,0,0|1,0,2]=4 1326 B15R0.81 C#CCCCCCCOCCCC(=O)OC 7a_100011217361_100011218270 [1,0,0,0,0,0|1,0,2]=4 1327 B15R0.81 C#CCCCCCCSCCCC(=O)OC 62a_100011218270_100012276617 [1,0,0,0,0,0|1,0,2]=4 1328 B15R0.81 C#CCCCCCCSCCCC(=O)OC 62a_100012276617_100011218270 [1,0,0,0,0,0|1,0,2]=4 1329 B15R0.81 C#CCCCCCOCCCCC(=O)OC 34a_100000059025_100012094781 [1,0,0,0,0,0|1,0,2]=4 1330 B15R0.81 C#CCCCCCOCCCCC(=O)OC 34a_100000766912_100000204269 [1,0,0,0,0,0|1,0,2]=4 1331 B15R0.81 C#CCCCCCOCCCCC(=O)OC 7a_100000059025_100012094781 [1,0,0,0,0,0|1,0,2]=4 1332 B15R0.81 C#CCCCCCOCCCCC(=O)OC 7a_100000766912_100000204269 [1,0,0,0,0,0|1,0,2]=4 1333 B15R0.81 C#CCCCCCSCCCCC(=O)OC 62a_100000204269_100012094781 [1,0,0,0,0,0|1,0,2]=4 1334 B15R0.81 C#CCCCCCSCCCCC(=O)OC 62a_100012094781_100000204269 [1,0,0,0,0,0|1,0,2]=4 1335 B15R0.81 C#CCCCCNCCCCCC(=O)OC 2230a_100000706060_100009816466 [1,0,0,0,0,0|1,0,2]=4 1336 B15R0.81 C#CCCCCNCCCCCC(=O)OC 34a_100000706060_100009816466 [1,0,0,0,0,0|1,0,2]=4 1337 B15R0.81 C#CCCCCOCCCCCC(=O)OC 34a_100000074720_100010269958 [1,0,0,0,0,0|1,0,2]=4 1338 B15R0.81 C#CCCCCOCCCCCC(=O)OC 34a_100000766709_100009816466 [1,0,0,0,0,0|1,0,2]=4 1339 B15R0.81 C#CCCCCOCCCCCC(=O)OC 7a_100000074720_100010269958 [1,0,0,0,0,0|1,0,2]=4 1340 B15R0.81 C#CCCCCOCCCCCC(=O)OC 7a_100000766709_100009816466 [1,0,0,0,0,0|1,0,2]=4 1341 B15R0.81 C#CCCCCSCCCCCC(=O)OC 62a_100009816466_100010269958 [1,0,0,0,0,0|1,0,2]=4 1342 B15R0.81 C#CCCCCSCCCCCC(=O)OC 62a_100010269958_100009816466 [1,0,0,0,0,0|1,0,2]=4 1343 B15R0.81 C#CCCCNCCCCCCC(=O)OC 34a_100000718082_100009815986 [1,0,0,0,0,0|1,0,2]=4 1344 B15R0.81 C#CCCCOCCCCCCC(=O)OC 34a_100000215630_100009815986 [1,0,0,0,0,0|1,0,2]=4 1345 B15R0.81 C#CCCCOCCCCCCC(=O)OC 34a_100009863599_100000695029 [1,0,0,0,0,0|1,0,2]=4 1346 B15R0.81 C#CCCCOCCCCCCC(=O)OC 7a_100000215630_100009815986 [1,0,0,0,0,0|1,0,2]=4 1347 B15R0.81 C#CCCCOCCCCCCC(=O)OC 7a_100009863599_100011215417 [1,0,0,0,0,0|1,0,2]=4 1348 B15R0.81 C#CCCCSCCCCCCC(=O)OC 62a_100009815986_100011215417 [1,0,0,0,0,0|1,0,2]=4 1349 B15R0.81 C#CCCCSCCCCCCC(=O)OC 62a_100011215417_100009815986 [1,0,0,0,0,0|1,0,2]=4 1350 B15R0.81 C#CCCNCCCCCCCC(=O)OC 34a_100000755551_100010004213 [1,0,0,0,0,0|1,0,2]=4 1351 B15R0.81 C#CCCOCCCCCCCC(=O)OC 34a_100011022521_100000688953 [1,0,0,0,0,0|1,0,2]=4 1352 B15R0.81 C#CCCOCCCCCCCC(=O)OC 34a_100011215631_100010004213 [1,0,0,0,0,0|1,0,2]=4 1353 B15R0.81 C#CCCOCCCCCCCC(=O)OC 7a_100011022521_100000688953 [1,0,0,0,0,0|1,0,2]=4 1354 B15R0.81 C#CCCSCCCCCCCC(=O)OC 62a_100000688953_100010004213 [1,0,0,0,0,0|1,0,2]=4 1355 B15R0.81 C#CCCSCCCCCCCC(=O)OC 62a_100010004213_100000688953 [1,0,0,0,0,0|1,0,2]=4 1356 B15R0.81 C#CCNCCCCCCCCC(=O)OC 34a_100000212058_100010282707 [1,0,0,0,0,0|1,0,2]=4 1357 B15R0.81 C#CCOCCCCCCCCC(=O)OC 34a_100000035544_100000184674 [1,0,0,0,0,0|1,0,2]=4 1358 B15R0.81 C#CCOCCCCCCCCC(=O)OC 34a_100000210247_100010282707 [1,0,0,0,0,0|1,0,2]=4 1359 B15R0.81 C#CCOCCCCCCCCC(=O)OC 7a_100000035544_100000038162 [1,0,0,0,0,0|1,0,2]=4 1360 B15R0.81 C#CCSCCCCCCCCC(=O)OC 62a_100000038162_100010282707 [1,0,0,0,0,0|1,0,2]=4 1361 B15R0.81 C/C=C/CCOCCCCCCC(=O)OC 34a_100016278192_100009815986 [1,0,0,0,0,0|1,0,2]=4 1362 B15R0.81 C/C=C/COCCCCCCCC(=O)OC 34a_100011022521_100102629194 [1,0,0,0,0,0|1,0,2]=4 1363 B15R0.81 C/C=C/COCCCCCCCC(=O)OC 34a_100016270725_100010004213 [1,0,0,0,0,0|1,0,2]=4 1364 B15R0.81 C/C=C/COCCCCCCCC(=O)OC 7a_100011022521_100102629194 [1,0,0,0,0,0|1,0,2]=4 1365 B15R0.81 C/C=C/CSCCCCCCCC(=O)OC 62a_100010004213_100102629194 [1,0,0,0,0,0|1,0,2]=4 1366 B15R0.81 C/C=C/CSCCCCCCCC(=O)OC 62a_100102629194_100010004213 [1,0,0,0,0,0|1,0,2]=4 1367 B15R0.81 C=CC(=O)CCCCCCCCCCCC 1458a_100000185746_100000759014 [1,0,0,0,0,0|1,0,1]=3 1368 B15R0.81 C=CC(=O)CCCCCCCCCCCO 1458a_100000185746_100009812471 [1,0,0,0,0,0|2,0,1]=4 1369 B15R0.81 C=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000185746 [1,0,0,0,0,0|2,0,1]=4 1370 B15R0.81 C=CC(=O)NCCCCCCCCCCC 240690a_200011215754_200121576911 [1,0,0,0,0,0|2,0,1]=4 1371 B15R0.81 C=CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011093070 [1,0,0,0,0,0|1,0,2]=4 1372 B15R0.81 C=CCCCCCCCCOCC(=O)OC 34a_100011215194_100000747449 [1,0,0,0,0,0|1,0,2]=4 1373 B15R0.81 C=CCCCCCCCCOCC(=O)OC 7a_100011215194_100000747449 [1,0,0,0,0,0|1,0,2]=4 1374 B15R0.81 C=CCCCCCCCCSCC(=O)OC 62a_100000747449_100011933949 [1,0,0,0,0,0|1,0,2]=4 1375 B15R0.81 C=CCCCCCCCCSCC(=O)OC 62a_100011933949_100000747449 [1,0,0,0,0,0|1,0,2]=4 1376 B15R0.81 C=CCCCCCCCOCCC(=O)OC 34a_100000730831_100000742370 [1,0,0,0,0,0|1,0,2]=4 1377 B15R0.81 C=CCCCCCCCOCCC(=O)OC 7a_100000730831_100000204255 [1,0,0,0,0,0|1,0,2]=4 1378 B15R0.81 C=CCCCCCCCSCCC(=O)OC 62a_100000204255_100012355270 [1,0,0,0,0,0|1,0,2]=4 1379 B15R0.81 C=CCCCCCCCSCCC(=O)OC 62a_100012355270_100000204255 [1,0,0,0,0,0|1,0,2]=4 1380 B15R0.81 C=CCCCCCCOCCCC(=O)OC 34a_200011216477_100000742333 [1,0,0,0,0,0|1,0,2]=4 1381 B15R0.81 C=CCCCCCCOCCCC(=O)OC 7a_200011216477_100011218270 [1,0,0,0,0,0|1,0,2]=4 1382 B15R0.81 C=CCCCCCCSCCCC(=O)OC 62a_100011215473_100011218270 [1,0,0,0,0,0|1,0,2]=4 1383 B15R0.81 C=CCCCCCCSCCCC(=O)OC 62a_100011218270_100011215473 [1,0,0,0,0,0|1,0,2]=4 1384 B15R0.81 C=CCCCCCOCCCCC(=O)OC 34a_100000059025_100000700193 [1,0,0,0,0,0|1,0,2]=4 1385 B15R0.81 C=CCCCCCOCCCCC(=O)OC 34a_100011216702_100000204269 [1,0,0,0,0,0|1,0,2]=4 1386 B15R0.81 C=CCCCCCOCCCCC(=O)OC 7a_100000059025_100000700193 [1,0,0,0,0,0|1,0,2]=4 1387 B15R0.81 C=CCCCCCOCCCCC(=O)OC 7a_100011216702_100000204269 [1,0,0,0,0,0|1,0,2]=4 1388 B15R0.81 C=CCCCCCSCCCCC(=O)OC 62a_100000204269_100000700193 [1,0,0,0,0,0|1,0,2]=4 1389 B15R0.81 C=CCCCCCSCCCCC(=O)OC 62a_100000700193_100000204269 [1,0,0,0,0,0|1,0,2]=4 1390 B15R0.81 C=CCCCCNCCCCCC(=O)OC 2230a_100000703577_100009816466 [1,0,0,0,0,0|1,0,2]=4 1391 B15R0.81 C=CCCCCNCCCCCC(=O)OC 34a_100000703577_100009816466 [1,0,0,0,0,0|1,0,2]=4 1392 B15R0.81 C=CCCCCOCCCCCC(=O)OC 34a_100000074720_100011215482 [1,0,0,0,0,0|1,0,2]=4 1393 B15R0.81 C=CCCCCOCCCCCC(=O)OC 34a_100000766645_100009816466 [1,0,0,0,0,0|1,0,2]=4 1394 B15R0.81 C=CCCCCOCCCCCC(=O)OC 7a_100000074720_100011215482 [1,0,0,0,0,0|1,0,2]=4 1395 B15R0.81 C=CCCCCOCCCCCC(=O)OC 7a_100000766645_100009816466 [1,0,0,0,0,0|1,0,2]=4 1396 B15R0.81 C=CCCCCSCCCCCC(=O)OC 62a_100009816466_100011215482 [1,0,0,0,0,0|1,0,2]=4 1397 B15R0.81 C=CCCCCSCCCCCC(=O)OC 62a_100011215482_100009816466 [1,0,0,0,0,0|1,0,2]=4 1398 B15R0.81 C=CCCCNCCCCCCC(=O)OC 2230a_100000700776_100009815986 [1,0,0,0,0,0|1,0,2]=4 1399 B15R0.81 C=CCCCNCCCCCCC(=O)OC 34a_100000700776_100009815986 [1,0,0,0,0,0|1,0,2]=4 1400 B15R0.81 C=CCCCOCCCCCCC(=O)OC 34a_100000758997_100009815986 [1,0,0,0,0,0|1,0,2]=4 1401 B15R0.81 C=CCCCOCCCCCCC(=O)OC 34a_100009863599_100000757094 [1,0,0,0,0,0|1,0,2]=4 1402 B15R0.81 C=CCCCOCCCCCCC(=O)OC 7a_100000758997_100009815986 [1,0,0,0,0,0|1,0,2]=4 1403 B15R0.81 C=CCCCOCCCCCCC(=O)OC 7a_100009863599_100000757094 [1,0,0,0,0,0|1,0,2]=4 1404 B15R0.81 C=CCCCSCCCCCCC(=O)OC 62a_100009815986_100000757094 [1,0,0,0,0,0|1,0,2]=4 1405 B15R0.81 C=CCCCSCCCCCCC(=O)OC 62a_100011713584_100009815986 [1,0,0,0,0,0|1,0,2]=4 1406 B15R0.81 C=CCCNCCCCCCCC(=O)OC 2230a_100015191253_100010004213 [1,0,0,0,0,0|1,0,2]=4 1407 B15R0.81 C=CCCOCCCCCCCC(=O)OC 34a_100011022521_100000754431 [1,0,0,0,0,0|1,0,2]=4 1408 B15R0.81 C=CCCOCCCCCCCC(=O)OC 34a_100011205117_100010004213 [1,0,0,0,0,0|1,0,2]=4 1409 B15R0.81 C=CCCOCCCCCCCC(=O)OC 7a_100011022521_100000754431 [1,0,0,0,0,0|1,0,2]=4 1410 B15R0.81 C=CCCSCCCCCCCC(=O)OC 62a_100000754431_100010004213 [1,0,0,0,0,0|1,0,2]=4 1411 B15R0.81 C=CCCSCCCCCCCC(=O)OC 62a_100010004213_100000754431 [1,0,0,0,0,0|1,0,2]=4 1412 B15R0.81 C=CCNCCCCCCCCC(=O)OC 2230a_100020586998_100010282707 [1,0,0,0,0,0|1,0,2]=4 1413 B15R0.81 C=CCOCCCCCCCCC(=O)OC 34a_100000035544_100015514636 [1,0,0,0,0,0|1,0,2]=4 1414 B15R0.81 C=CCOCCCCCCCCC(=O)OC 34a_200000210373_100010282707 [1,0,0,0,0,0|1,0,2]=4 1415 B15R0.81 C=CCOCCCCCCCCC(=O)OC 7a_100000035544_100015514636 [1,0,0,0,0,0|1,0,2]=4 1416 B15R0.81 C=CCSCCCCCCCCC(=O)OC 62a_100000210623_100010282707 [1,0,0,0,0,0|1,0,2]=4 1417 B15R0.81 C=CCSCCCCCCCCC(=O)OC 62a_100010282707_100000210623 [1,0,0,0,0,0|1,0,2]=4 1418 B15R0.81 CC#CCCOCCCCCCC(=O)OC 34a_100000750427_100009815986 [1,0,0,0,0,0|1,0,2]=4 1419 B15R0.81 CC#CCNCCCCCCCC(=O)OC 2230a_100000685387_100010004213 [1,0,0,0,0,0|1,0,2]=4 1420 B15R0.81 CC#CCNCCCCCCCC(=O)OC 34a_100000685387_100010004213 [1,0,0,0,0,0|1,0,2]=4 1421 B15R0.81 CC#CCOCCCCCCCC(=O)OC 34a_100000761923_100010004213 [1,0,0,0,0,0|1,0,2]=4 1422 B15R0.81 CC#CCOCCCCCCCC(=O)OC 34a_100011022521_100000748600 [1,0,0,0,0,0|1,0,2]=4 1423 B15R0.81 CC#CCOCCCCCCCC(=O)OC 7a_100011022521_100000748600 [1,0,0,0,0,0|1,0,2]=4 1424 B15R0.81 CC#CCSCCCCCCCC(=O)OC 62a_100000748600_100010004213 [1,0,0,0,0,0|1,0,2]=4 1425 B15R0.81 CC#CCSCCCCCCCC(=O)OC 62a_100010004213_100000748600 [1,0,0,0,0,0|1,0,2]=4 1426 B15R0.81 CC/C=C/CCCOCCCCC(=O)OC 34a_100016287902_100000204269 [1,0,0,0,0,0|1,0,2]=4 1427 B15R0.81 CC/C=C/CCCOCCCCC(=O)OC 7a_100016287902_100000204269 [1,0,0,0,0,0|1,0,2]=4 1428 B15R0.81 CC/C=C\CCCCCOCCC(=O)OC 34a_100016268722_100000742370 [1,0,0,0,0,0|1,0,2]=4 1429 B15R0.81 CC/C=C\CCCCCOCCC(=O)OC 7a_100016268722_100000204255 [1,0,0,0,0,0|1,0,2]=4 1430 B15R0.81 CC/C=C\CCCCOCCCC(=O)OC 34a_100016287862_100000742333 [1,0,0,0,0,0|1,0,2]=4 1431 B15R0.81 CC/C=C\CCCCOCCCC(=O)OC 7a_100016287862_100011218270 [1,0,0,0,0,0|1,0,2]=4 1432 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 34a_100000074720_100015370543 [1,0,0,0,0,0|1,0,2]=4 1433 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 34a_100016288707_100009816466 [1,0,0,0,0,0|1,0,2]=4 1434 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 7a_100000074720_100015370543 [1,0,0,0,0,0|1,0,2]=4 1435 B15R0.81 CC/C=C\CCOCCCCCC(=O)OC 7a_100016288707_100009816466 [1,0,0,0,0,0|1,0,2]=4 1436 B15R0.81 CC/C=C\CCSCCCCCC(=O)OC 62a_100009816466_100015370543 [1,0,0,0,0,0|1,0,2]=4 1437 B15R0.81 CC/C=C\CCSCCCCCC(=O)OC 62a_100015370543_100009816466 [1,0,0,0,0,0|1,0,2]=4 1438 B15R0.81 CC/C=C\COCCCCCCC(=O)OC 34a_100009863599_100103147603 [1,0,0,0,0,0|1,0,2]=4 1439 B15R0.81 CC/C=C\COCCCCCCC(=O)OC 34a_100016268518_100009815986 [1,0,0,0,0,0|1,0,2]=4 1440 B15R0.81 CC/C=C\COCCCCCCC(=O)OC 7a_100009863599_100103147603 [1,0,0,0,0,0|1,0,2]=4 1441 B15R0.81 CC/C=C\CSCCCCCCC(=O)OC 62a_100009815986_100103147603 [1,0,0,0,0,0|1,0,2]=4 1442 B15R0.81 CC/C=C\CSCCCCCCC(=O)OC 62a_100103147603_100009815986 [1,0,0,0,0,0|1,0,2]=4 1443 B15R0.81 CC=CCCCOCCCCCC(=O)OC 34a_100020645299_100009816466 [1,0,0,0,0,0|1,0,2]=4 1444 B15R0.81 CC=CCOCCCCCCCC(=O)OC 34a_100011022521_100000070051 [1,0,0,0,0,0|1,0,2]=4 1445 B15R0.81 CC=CCOCCCCCCCC(=O)OC 7a_100011022521_100000070051 [1,0,0,0,0,0|1,0,2]=4 1446 B15R0.81 CC=CCSCCCCCCCC(=O)OC 62a_100000070051_100010004213 [1,0,0,0,0,0|1,0,2]=4 1447 B15R0.81 CC=CCSCCCCCCCC(=O)OC 62a_100010004213_100000070051 [1,0,0,0,0,0|1,0,2]=4 1448 B15R0.81 CCC#CCCCCCCSCC(=O)OC 62a_100000747449_200000036426 [1,0,0,0,0,0|1,0,2]=4 1449 B15R0.81 CCC#CCCCCCCSCC(=O)OC 62a_200000036426_100000747449 [1,0,0,0,0,0|1,0,2]=4 1450 B15R0.81 CCC#CCCOCCCCCC(=O)OC 34a_100000036655_100009816466 [1,0,0,0,0,0|1,0,2]=4 1451 B15R0.81 CCC#CCCOCCCCCC(=O)OC 7a_100000036655_100009816466 [1,0,0,0,0,0|1,0,2]=4 1452 B15R0.81 CCC#CCOCCCCCCC(=O)OC 34a_100000032950_100009815986 [1,0,0,0,0,0|1,0,2]=4 1453 B15R0.81 CCC#CCOCCCCCCC(=O)OC 34a_100009863599_100009813939 [1,0,0,0,0,0|1,0,2]=4 1454 B15R0.81 CCC#CCOCCCCCCC(=O)OC 7a_100009863599_100009813939 [1,0,0,0,0,0|1,0,2]=4 1455 B15R0.81 CCC#CCSCCCCCCC(=O)OC 62a_100009813939_100009815986 [1,0,0,0,0,0|1,0,2]=4 1456 B15R0.81 CCC#CCSCCCCCCC(=O)OC 62a_100009815986_100009813939 [1,0,0,0,0,0|1,0,2]=4 1457 B15R0.81 CCC(=O)CCCCCCCCCCCO 1458a_100000210414_100009812471 [1,0,0,0,0,0|2,0,0]=3 1458 B15R0.81 CCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747405 [1,0,0,0,0,0|3,0,0]=4 1459 B15R0.81 CCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747405 [1,0,0,0,0,0|3,0,0]=4 1460 B15R0.81 CCC(=O)COCCCCCCCCCO 34a_100000725409_100009813782 [1,0,0,0,0,0|3,0,0]=4 1461 B15R0.81 CCC(=O)CSCCCCCCCCCO 62a_100000747405_100009813782 [1,0,0,0,0,0|3,0,0]=4 1462 B15R0.81 CCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747405 [1,0,0,0,0,0|3,0,0]=4 1463 B15R0.81 CCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210414 [1,0,0,0,0,0|3,0,0]=4 1464 B15R0.81 CCC/C=C/COCCCCCC(=O)OC 34a_100016278788_100009816466 [1,0,0,0,0,0|1,0,2]=4 1465 B15R0.81 CCC/C=C/COCCCCCC(=O)OC 7a_100016278788_100009816466 [1,0,0,0,0,0|1,0,2]=4 1466 B15R0.81 CCCC#CCCOCCCCC(=O)OC 34a_100000042726_100000204269 [1,0,0,0,0,0|1,0,2]=4 1467 B15R0.81 CCCC#CCCOCCCCC(=O)OC 7a_100000042726_100000204269 [1,0,0,0,0,0|1,0,2]=4 1468 B15R0.81 CCCC#CCOCCCCCC(=O)OC 34a_100000034806_100009816466 [1,0,0,0,0,0|1,0,2]=4 1469 B15R0.81 CCCC#CCOCCCCCC(=O)OC 7a_100000034806_100009816466 [1,0,0,0,0,0|1,0,2]=4 1470 B15R0.81 CCCC/C=C/CCCCOCC(=O)OC 34a_200020645093_100000747449 [1,0,0,0,0,0|1,0,2]=4 1471 B15R0.81 CCCC/C=C/CCCCOCC(=O)OC 7a_200020645093_100000747449 [1,0,0,0,0,0|1,0,2]=4 1472 B15R0.81 CCCC/C=C/COCCCCC(=O)OC 34a_200016272032_100000204269 [1,0,0,0,0,0|1,0,2]=4 1473 B15R0.81 CCCC/C=C/COCCCCC(=O)OC 7a_200016272032_100000204269 [1,0,0,0,0,0|1,0,2]=4 1474 B15R0.81 CCCC/C=C\CCOCCCC(=O)OC 34a_200016286491_100000742333 [1,0,0,0,0,0|1,0,2]=4 1475 B15R0.81 CCCC/C=C\CCOCCCC(=O)OC 7a_200016286491_100011218270 [1,0,0,0,0,0|1,0,2]=4 1476 B15R0.81 CCCCC#CCCCCCCC(=O)CC 1458a_100000210414_200000043322 [1,0,0,0,0,0|1,0,2]=4 1477 B15R0.81 CCCCC#CCCCCOCC(=O)OC 34a_200000066234_100000747449 [1,0,0,0,0,0|1,0,2]=4 1478 B15R0.81 CCCCC#CCCCCOCC(=O)OC 7a_200000066234_100000747449 [1,0,0,0,0,0|1,0,2]=4 1479 B15R0.81 CCCCC#CCCCSCCC(=O)OC 62a_100000204255_200000047210 [1,0,0,0,0,0|1,0,2]=4 1480 B15R0.81 CCCCC#CCCCSCCC(=O)OC 62a_200000047210_100000204255 [1,0,0,0,0,0|1,0,2]=4 1481 B15R0.81 CCCCC#CCCOCCCC(=O)OC 34a_100000037610_100000742333 [1,0,0,0,0,0|1,0,2]=4 1482 B15R0.81 CCCCC#CCCOCCCC(=O)OC 7a_100000037610_100011218270 [1,0,0,0,0,0|1,0,2]=4 1483 B15R0.81 CCCCC#CCOCCCCC(=O)OC 34a_200000034558_100000204269 [1,0,0,0,0,0|1,0,2]=4 1484 B15R0.81 CCCCC#CCOCCCCC(=O)OC 7a_200000034558_100000204269 [1,0,0,0,0,0|1,0,2]=4 1485 B15R0.81 CCCCC/C=C/COCCCC(=O)OC 34a_100016258190_100000742333 [1,0,0,0,0,0|1,0,2]=4 1486 B15R0.81 CCCCC/C=C/COCCCC(=O)OC 7a_100016258190_100011218270 [1,0,0,0,0,0|1,0,2]=4 1487 B15R0.81 CCCCC/C=C\CCCOCC(=O)OC 34a_100020655193_100000747449 [1,0,0,0,0,0|1,0,2]=4 1488 B15R0.81 CCCCC/C=C\CCCOCC(=O)OC 7a_100020655193_100000747449 [1,0,0,0,0,0|1,0,2]=4 1489 B15R0.81 CCCCC/C=C\CCOCCC(=O)OC 34a_100016277358_100000742370 [1,0,0,0,0,0|1,0,2]=4 1490 B15R0.81 CCCCC/C=C\CCOCCC(=O)OC 7a_100016277358_100000204255 [1,0,0,0,0,0|1,0,2]=4 1491 B15R0.81 CCCCCC#CCCOCCC(=O)OC 34a_200000042877_100000742370 [1,0,0,0,0,0|1,0,2]=4 1492 B15R0.81 CCCCCC#CCCOCCC(=O)OC 7a_200000042877_100000204255 [1,0,0,0,0,0|1,0,2]=4 1493 B15R0.81 CCCCCC#CCOCCCC(=O)OC 34a_200000033628_100000742333 [1,0,0,0,0,0|1,0,2]=4 1494 B15R0.81 CCCCCC#CCOCCCC(=O)OC 7a_200000033628_100011218270 [1,0,0,0,0,0|1,0,2]=4 1495 B15R0.81 CCCCCC#CCSCCCC(=O)OC 62a_100009816472_100011218270 [1,0,0,0,0,0|1,0,2]=4 1496 B15R0.81 CCCCCC#CCSCCCC(=O)OC 62a_100011218270_100009816472 [1,0,0,0,0,0|1,0,2]=4 1497 B15R0.81 CCCCCC/C=C/COCCC(=O)OC 34a_200016276170_100000742370 [1,0,0,0,0,0|1,0,2]=4 1498 B15R0.81 CCCCCC/C=C/COCCC(=O)OC 7a_200016276170_100000204255 [1,0,0,0,0,0|1,0,2]=4 1499 B15R0.81 CCCCCCC#CCCOCC(=O)OC 34a_200000033163_100000747449 [1,0,0,0,0,0|1,0,2]=4 1500 B15R0.81 CCCCCCC#CCCOCC(=O)OC 7a_200000033163_100000747449 [1,0,0,0,0,0|1,0,2]=4 1501 B15R0.81 CCCCCCC#CCOCCC(=O)OC 34a_200000037284_100000742370 [1,0,0,0,0,0|1,0,2]=4 1502 B15R0.81 CCCCCCC#CCOCCC(=O)OC 7a_200000037284_100000204255 [1,0,0,0,0,0|1,0,2]=4 1503 B15R0.81 CCCCCCCC#CCOCC(=O)OC 34a_200000061759_100000747449 [1,0,0,0,0,0|1,0,2]=4 1504 B15R0.81 CCCCCCCC#CCOCC(=O)OC 7a_200000061759_100000747449 [1,0,0,0,0,0|1,0,2]=4 1505 B15R0.81 CCCCCCCCCCC=CC(=O)NC 11a_106832991635_100015291182 [1,0,0,0,0,0|1,0,2]=4 1506 B15R0.81 CCCCCCCCCCC=CC(=O)NC 1626a_100102657272_100015291182 [1,0,0,0,0,0|1,0,2]=4 1507 B15R0.81 CCCCCCCCCCC=CC(=O)NC 240690a_100102657272_100015291182 [1,0,0,0,0,0|1,0,2]=4 1508 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000759014 [1,0,0,0,0,0|1,0,0]=2 1509 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100011215791_100000210202 [1,0,0,0,0,0|1,0,0]=2 1510 B15R0.81 CCCCCCCCCCCCC(=O)CF 1458a_100011215791_100015361967 [1,0,0,0,0,0|2,0,0]=3 1511 B15R0.81 CCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000759014 [1,0,0,0,0,0|2,0,0]=3 1512 B15R0.81 CCCCCCCCCCCCC(=O)NC 11a_106832991635_100011215791 [1,0,0,0,0,0|1,0,0]=2 1513 B15R0.81 CCCCCCCCCCCCC(=O)NC 1626a_100102657272_100011215791 [1,0,0,0,0,0|1,0,0]=2 1514 B15R0.81 CCCCCCCCCCCCC(=O)NC 240690a_100102657272_100011215791 [1,0,0,0,0,0|1,0,0]=2 1515 B15R0.81 CCCCCCCCCCCCC(C)NC 2230a_106832991635_200011217028 [1,0,0,0,0,0|2,0,1]=4 1516 B15R0.81 CCCCCCCCCCCCC(C)NC 270004a_106832991635_100011219199 [1,0,0,0,0,0|2,0,1]=4 1517 B15R0.81 CCCCCCCCCCCCC(C)NC 34a_100102657272_200011217028 [1,0,0,0,0,0|2,0,1]=4 1518 B15R0.81 CCCCCCCCCCCCC(C)NC 7a_106832991635_200011217028 [1,0,0,0,0,0|2,0,1]=4 1519 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_100138415774_200011217028 [1,0,0,0,0,0|1,0,1]=3 1520 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_200011215752_200000210301 [1,0,0,0,0,0|1,0,1]=3 1521 B15R0.81 CCCCCCCCCCCCC(C)OC 7a_200011215752_200000210301 [1,0,0,0,0,0|1,0,1]=3 1522 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 34a_200011215752_200025704644 [1,0,0,0,0,0|1,0,1]=3 1523 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 7a_200011215752_200025704644 [1,0,0,0,0,0|1,0,1]=3 1524 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000225621_100011215052 [1,0,0,0,0,0|3,0,0]=4 1525 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000227908_100000210202 [1,0,0,0,0,0|3,0,0]=4 1526 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000225621_100000759014 [1,0,0,0,0,0|3,0,0]=4 1527 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000227908_100000204670 [1,0,0,0,0,0|3,0,0]=4 1528 B15R0.81 CCCCCCCCCCCNC(=O)CC 11a_200011215754_100000210414 [1,0,0,0,0,0|2,0,0]=3 1529 B15R0.81 CCCCCCCCCCCNC(=O)CC 1626a_200011215754_100000210414 [1,0,0,0,0,0|2,0,0]=3 1530 B15R0.81 CCCCCCCCCCCNC(=O)CC 240690a_200011215754_100000210414 [1,0,0,0,0,0|2,0,0]=3 1531 B15R0.81 CCCCCCCCCCCNC(=O)CC 527a_200011215754_100000210414 [1,0,0,0,0,0|2,0,0]=3 1532 B15R0.81 CCCCCCCCCCCNC(=O)CO 240690a_200011215754_100000210174 [1,0,0,0,0,0|3,0,0]=4 1533 B15R0.81 CCCCCCCCCCCNC(=O)CO 527a_200011215754_100000210174 [1,0,0,0,0,0|3,0,0]=4 1534 B15R0.81 CCCCCCCCCCCNC(=O)NC 2708a_100102657272_200011215754 [1,0,0,0,0,0|2,0,0]=3 1535 B15R0.81 CCCCCCCCCCCNC(=O)NC 2708a_200011215754_106832991635 [1,0,0,0,0,0|2,0,0]=3 1536 B15R0.81 CCCCCCCCCCCNC(=O)NC 273464a_100102657272_200011215754 [1,0,0,0,0,0|2,0,0]=3 1537 B15R0.81 CCCCCCCCCCCNC(=O)NC 273464a_200011215754_100102657272 [1,0,0,0,0,0|2,0,0]=3 1538 B15R0.81 CCCCCCCCCCCNC(=O)NC 512a_106832991638_200011215754 [1,0,0,0,0,0|2,0,0]=3 1539 B15R0.81 CCCCCCCCCCCNC(=O)NC 512a_200011215754_100102657272 [1,0,0,0,0,0|2,0,0]=3 1540 B15R0.81 CCCCCCCCCCCSC(C)OC 62a_100009879195_100011215454 [1,0,0,0,0,0|2,0,1]=4 1541 B15R0.81 CCCCCCCCCCNCC(=O)NC 2230a_100000684558_100000183359 [1,0,0,0,0,0|2,0,0]=3 1542 B15R0.81 CCCCCCCCCCNCC(=O)NC 2230a_100000693194_100000210320 [1,0,0,0,0,0|2,0,0]=3 1543 B15R0.81 CCCCCCCCCCNCC(=O)NC 34a_100000684558_100000183359 [1,0,0,0,0,0|2,0,0]=3 1544 B15R0.81 CCCCCCCCCCNCC(=O)OC 2230a_100000684558_100000747449 [1,0,0,0,0,0|1,0,0]=2 1545 B15R0.81 CCCCCCCCCCNCC(=O)OC 34a_100000684558_100000747449 [1,0,0,0,0,0|1,0,0]=2 1546 B15R0.81 CCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210320 [1,0,0,0,0,0|2,0,1]=4 1547 B15R0.81 CCCCCCCCCCOCC(=O)CC 34a_100000725409_100000210320 [1,0,0,0,0,0|2,0,0]=3 1548 B15R0.81 CCCCCCCCCCOCC(=O)CC 7a_100000210711_100000747405 [1,0,0,0,0,0|2,0,0]=3 1549 B15R0.81 CCCCCCCCCCOCC(=O)NC 34a_100000210711_100000183359 [1,0,0,0,0,0|2,0,0]=3 1550 B15R0.81 CCCCCCCCCCOCC(=O)NC 34a_100000750040_100000210320 [1,0,0,0,0,0|2,0,0]=3 1551 B15R0.81 CCCCCCCCCCOCC(=O)NC 7a_100000210711_100000183359 [1,0,0,0,0,0|2,0,0]=3 1552 B15R0.81 CCCCCCCCCCOCC(=O)OC 34a_100000210711_100000747449 [1,0,0,0,0,0|1,0,0]=2 1553 B15R0.81 CCCCCCCCCCOCC(=O)OC 7a_100000210711_100000747449 [1,0,0,0,0,0|1,0,0]=2 1554 B15R0.81 CCCCCCCCCCOCC(C)OC 34a_100000690652_100000210320 [1,0,0,0,0,0|2,0,1]=4 1555 B15R0.81 CCCCCCCCCCSCC(=O)CC 62a_100000747405_100000210320 [1,0,0,0,0,0|2,0,0]=3 1556 B15R0.81 CCCCCCCCCCSCC(=O)NC 62a_100000183359_100000210320 [1,0,0,0,0,0|2,0,0]=3 1557 B15R0.81 CCCCCCCCCCSCC(=O)OC 62a_100000747449_100000210320 [1,0,0,0,0,0|1,0,0]=2 1558 B15R0.81 CCCCCCCCCNCCC(=O)NC 2230a_100000212291_100000737683 [1,0,0,0,0,0|2,0,0]=3 1559 B15R0.81 CCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011214924 [1,0,0,0,0,0|2,0,0]=3 1560 B15R0.81 CCCCCCCCCNCCC(=O)NC 34a_100000212291_100012179268 [1,0,0,0,0,0|2,0,0]=3 1561 B15R0.81 CCCCCCCCCNCCC(=O)NC 34a_100000738227_100011214924 [1,0,0,0,0,0|2,0,0]=3 1562 B15R0.81 CCCCCCCCCNCCC(=O)OC 2230a_100000212291_100000204255 [1,0,0,0,0,0|1,0,0]=2 1563 B15R0.81 CCCCCCCCCNCCC(=O)OC 34a_100000212291_100000742370 [1,0,0,0,0,0|1,0,0]=2 1564 B15R0.81 CCCCCCCCCOCCC(=O)NC 34a_100000210712_100012179268 [1,0,0,0,0,0|2,0,0]=3 1565 B15R0.81 CCCCCCCCCOCCC(=O)NC 34a_100000754576_100011214924 [1,0,0,0,0,0|2,0,0]=3 1566 B15R0.81 CCCCCCCCCOCCC(=O)NC 7a_100000210712_100000737683 [1,0,0,0,0,0|2,0,0]=3 1567 B15R0.81 CCCCCCCCCOCCC(=O)OC 34a_100000210712_100000742370 [1,0,0,0,0,0|1,0,0]=2 1568 B15R0.81 CCCCCCCCCOCCC(=O)OC 7a_100000210712_100000204255 [1,0,0,0,0,0|1,0,0]=2 1569 B15R0.81 CCCCCCCCCOCCC(C)OC 7a_100000764861_100000210328 [1,0,0,0,0,0|2,0,1]=4 1570 B15R0.81 CCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210670 [1,0,0,0,0,0|2,0,0]=3 1571 B15R0.81 CCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210670 [1,0,0,0,0,0|1,0,0]=2 1572 B15R0.81 CCCCCCCCNC/C=C/C(=O)OC 2230a_100000229939_100000742655 [1,0,0,0,0,0|1,0,2]=4 1573 B15R0.81 CCCCCCCCNC/C=C/C(=O)OC 34a_100000229939_100000742655 [1,0,0,0,0,0|1,0,2]=4 1574 B15R0.81 CCCCCCCCNCCCC(=O)NC 2230a_100000229939_100000741757 [1,0,0,0,0,0|2,0,0]=3 1575 B15R0.81 CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210759 [1,0,0,0,0,0|2,0,0]=3 1576 B15R0.81 CCCCCCCCNCCCC(=O)NC 34a_100000229939_100000741757 [1,0,0,0,0,0|2,0,0]=3 1577 B15R0.81 CCCCCCCCNCCCC(=O)NC 34a_100000740002_100000210759 [1,0,0,0,0,0|2,0,0]=3 1578 B15R0.81 CCCCCCCCNCCCC(=O)OC 2230a_100000229939_100011218270 [1,0,0,0,0,0|1,0,0]=2 1579 B15R0.81 CCCCCCCCNCCCC(=O)OC 34a_100000229939_100000742333 [1,0,0,0,0,0|1,0,0]=2 1580 B15R0.81 CCCCCCCCNCCNC(=O)CC 34a_100132302217_100000210759 [1,0,0,0,0,0|3,0,0]=4 1581 B15R0.81 CCCCCCCCNCCNC(=O)NC 34a_100015205895_100000210759 [1,0,0,0,0,0|3,0,0]=4 1582 B15R0.81 CCCCCCCCNCCOC(=O)NC 34a_100000229939_200011997002 [1,0,0,0,0,0|3,0,0]=4 1583 B15R0.81 CCCCCCCCOC/C=C/C(=O)OC 34a_100000210232_100000742655 [1,0,0,0,0,0|1,0,2]=4 1584 B15R0.81 CCCCCCCCOC/C=C/C(=O)OC 7a_100000210232_100000742655 [1,0,0,0,0,0|1,0,2]=4 1585 B15R0.81 CCCCCCCCOCCCC(=O)NC 34a_100000210232_100000741757 [1,0,0,0,0,0|2,0,0]=3 1586 B15R0.81 CCCCCCCCOCCCC(=O)NC 7a_100000210232_100000741757 [1,0,0,0,0,0|2,0,0]=3 1587 B15R0.81 CCCCCCCCOCCCC(=O)NN 34a_100000211488_100000210759 [1,0,0,0,0,0|3,0,0]=4 1588 B15R0.81 CCCCCCCCOCCCC(=O)OC 34a_100000210232_100000742333 [1,0,0,0,0,0|1,0,0]=2 1589 B15R0.81 CCCCCCCCOCCCC(=O)OC 7a_100000210232_100011218270 [1,0,0,0,0,0|1,0,0]=2 1590 B15R0.81 CCCCCCCCOCCNC(=O)CC 34a_200000158885_100000210759 [1,0,0,0,0,0|3,0,0]=4 1591 B15R0.81 CCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210759 [1,0,0,0,0,0|3,0,0]=4 1592 B15R0.81 CCCCCCCCOCCNC(=O)OC 34a_100000757965_100000210759 [1,0,0,0,0,0|2,0,0]=3 1593 B15R0.81 CCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210759 [1,0,0,0,0,0|3,0,0]=4 1594 B15R0.81 CCCCCCCCOCCOC(=O)NC 34a_100000210232_200011997002 [1,0,0,0,0,0|3,0,0]=4 1595 B15R0.81 CCCCCCCCOCCOC(=O)NC 7a_100000210232_200011997002 [1,0,0,0,0,0|3,0,0]=4 1596 B15R0.81 CCCCCCCCOCCOC(=O)OC 34a_100010262106_100000210759 [1,0,0,0,0,0|2,0,0]=3 1597 B15R0.81 CCCCCCCCSC/C=C/C(=O)OC 62a_100000210759_100000742655 [1,0,0,0,0,0|1,0,2]=4 1598 B15R0.81 CCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210317 [1,0,0,0,0,0|1,0,2]=4 1599 B15R0.81 CCCCCCCCSCCCC(=O)NC 62a_100000210759_100000741757 [1,0,0,0,0,0|2,0,0]=3 1600 B15R0.81 CCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210317 [1,0,0,0,0,0|2,0,0]=3 1601 B15R0.81 CCCCCCCCSCCCC(=O)OC 62a_100000210759_100011218270 [1,0,0,0,0,0|1,0,0]=2 1602 B15R0.81 CCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210317 [1,0,0,0,0,0|1,0,0]=2 1603 B15R0.81 CCCCCCCCSCCOC(=O)NC 62a_100000210759_200011997002 [1,0,0,0,0,0|3,0,0]=4 1604 B15R0.81 CCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210317 [1,0,0,0,0,0|3,0,0]=4 1605 B15R0.81 CCCCCCCNCCCCC(=O)OC 2230a_100000229938_100000204269 [1,0,0,0,0,0|1,0,0]=2 1606 B15R0.81 CCCCCCCNCCOCC(=O)OC 2230a_100000229938_100000090808 [1,0,0,0,0,0|2,0,0]=3 1607 B15R0.81 CCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210614 [1,0,0,0,0,0|1,0,0]=2 1608 B15R0.81 CCCCCCCOCCCCC(=O)OC 34a_100000210272_100000204269 [1,0,0,0,0,0|1,0,0]=2 1609 B15R0.81 CCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210614 [1,0,0,0,0,0|1,0,0]=2 1610 B15R0.81 CCCCCCCOCCCCC(=O)OC 7a_100000210272_100000204269 [1,0,0,0,0,0|1,0,0]=2 1611 B15R0.81 CCCCCCCOCCOCC(=O)OC 34a_100000210272_100000090808 [1,0,0,0,0,0|2,0,0]=3 1612 B15R0.81 CCCCCCCOCCOCC(=O)OC 7a_100000210272_100000090808 [1,0,0,0,0,0|2,0,0]=3 1613 B15R0.81 CCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210316 [1,0,0,0,0,0|1,0,0]=2 1614 B15R0.81 CCCCCCCSCCCCC(=O)OC 62a_100000210614_100000204269 [1,0,0,0,0,0|1,0,0]=2 1615 B15R0.81 CCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210316 [1,0,0,0,0,0|2,0,0]=3 1616 B15R0.81 CCCCCCCSCCOCC(=O)OC 62a_100000210614_100000090808 [1,0,0,0,0,0|2,0,0]=3 1617 B15R0.81 CCCCCCNCCCCCC(=O)OC 2230a_100000210581_100009816466 [1,0,0,0,0,0|1,0,0]=2 1618 B15R0.81 CCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210314 [1,0,0,0,0,0|1,0,0]=2 1619 B15R0.81 CCCCCCOCCCCCC(=O)OC 34a_100000210259_100009816466 [1,0,0,0,0,0|1,0,0]=2 1620 B15R0.81 CCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210314 [1,0,0,0,0,0|1,0,0]=2 1621 B15R0.81 CCCCCCOCCCCCC(=O)OC 7a_100000210259_100009816466 [1,0,0,0,0,0|1,0,0]=2 1622 B15R0.81 CCCCCCOCCOCCC(=O)NC 34a_100000691444_100012179268 [1,0,0,0,0,0|3,0,0]=4 1623 B15R0.81 CCCCCCOCCOCCC(=O)NC 7a_100000691444_100000737683 [1,0,0,0,0,0|3,0,0]=4 1624 B15R0.81 CCCCCCOCCOCCC(=O)OC 34a_100000691444_100000742370 [1,0,0,0,0,0|2,0,0]=3 1625 B15R0.81 CCCCCCOCCOCCC(=O)OC 7a_100000691444_100000204255 [1,0,0,0,0,0|2,0,0]=3 1626 B15R0.81 CCCCCCSCCCCCC(=O)OC 62a_100000210314_100009816466 [1,0,0,0,0,0|1,0,0]=2 1627 B15R0.81 CCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210757 [1,0,0,0,0,0|1,0,0]=2 1628 B15R0.81 CCCCCNCCCCCCC(=O)OC 2230a_100000209983_100009815986 [1,0,0,0,0,0|1,0,0]=2 1629 B15R0.81 CCCCCNCCOCCCC(=O)NC 34a_100000224656_100000741757 [1,0,0,0,0,0|3,0,0]=4 1630 B15R0.81 CCCCCNCCOCCCC(=O)OC 34a_100000224656_100000742333 [1,0,0,0,0,0|2,0,0]=3 1631 B15R0.81 CCCCCNN=CCCCCC(=O)OC 4a_100000694160_100000052768 [1,0,0,0,0,0|2,0,1]=4 1632 B15R0.81 CCCCCOCCCCCCC(=O)OC 34a_100000210253_100009815986 [1,0,0,0,0,0|1,0,0]=2 1633 B15R0.81 CCCCCOCCCCCCC(=O)OC 34a_100009863599_100000718602 [1,0,0,0,0,0|1,0,0]=2 1634 B15R0.81 CCCCCOCCCCCCC(=O)OC 7a_100000210253_100009815986 [1,0,0,0,0,0|1,0,0]=2 1635 B15R0.81 CCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210326 [1,0,0,0,0,0|1,0,0]=2 1636 B15R0.81 CCCCCOCCOCCCC(=O)NC 34a_100011215259_100000741757 [1,0,0,0,0,0|3,0,0]=4 1637 B15R0.81 CCCCCOCCOCCCC(=O)NC 7a_100011215259_100000741757 [1,0,0,0,0,0|3,0,0]=4 1638 B15R0.81 CCCCCOCCOCCCC(=O)OC 34a_100011215259_100000742333 [1,0,0,0,0,0|2,0,0]=3 1639 B15R0.81 CCCCCOCCOCCCC(=O)OC 7a_100011215259_100011218270 [1,0,0,0,0,0|2,0,0]=3 1640 B15R0.81 CCCCCSCCCCCCC(=O)OC 62a_100000210326_100009815986 [1,0,0,0,0,0|1,0,0]=2 1641 B15R0.81 CCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210326 [1,0,0,0,0,0|1,0,0]=2 1642 B15R0.81 CCCCNCCCCCCCC(=O)OC 2230a_100000102301_100010004213 [1,0,0,0,0,0|1,0,0]=2 1643 B15R0.81 CCCCNCCCCCCCC(=O)OC 7a_106832991798_100010004213 [1,0,0,0,0,0|1,0,0]=2 1644 B15R0.81 CCCCNCCCCOCCC(=O)NC 34a_200011216965_100012179268 [1,0,0,0,0,0|3,0,0]=4 1645 B15R0.81 CCCCNCCCCOCCC(=O)OC 34a_200011216965_100000742370 [1,0,0,0,0,0|2,0,0]=3 1646 B15R0.81 CCCCOCCCCCCCC(=O)OC 34a_100000210227_100010004213 [1,0,0,0,0,0|1,0,0]=2 1647 B15R0.81 CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000210210 [1,0,0,0,0,0|1,0,0]=2 1648 B15R0.81 CCCCOCCCCCCCC(=O)OC 7a_100000210227_100010004213 [1,0,0,0,0,0|1,0,0]=2 1649 B15R0.81 CCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210211 [1,0,0,0,0,0|1,0,0]=2 1650 B15R0.81 CCCCOCCCCOCCC(=O)NC 34a_200000760531_100012179268 [1,0,0,0,0,0|3,0,0]=4 1651 B15R0.81 CCCCOCCCCOCCC(=O)NC 7a_200000760531_100000737683 [1,0,0,0,0,0|3,0,0]=4 1652 B15R0.81 CCCCOCCCCOCCC(=O)OC 34a_200000760531_100000742370 [1,0,0,0,0,0|2,0,0]=3 1653 B15R0.81 CCCCOCCCCOCCC(=O)OC 7a_200000760531_100000204255 [1,0,0,0,0,0|2,0,0]=3 1654 B15R0.81 CCCCOCCCNCCCC(=O)NC 2230a_200000211371_100000741757 [1,0,0,0,0,0|3,0,0]=4 1655 B15R0.81 CCCCOCCCNCCCC(=O)NC 34a_200000211371_100000741757 [1,0,0,0,0,0|3,0,0]=4 1656 B15R0.81 CCCCOCCCNCCCC(=O)OC 2230a_200000211371_100011218270 [1,0,0,0,0,0|2,0,0]=3 1657 B15R0.81 CCCCOCCCNCCCC(=O)OC 34a_200000211371_100000742333 [1,0,0,0,0,0|2,0,0]=3 1658 B15R0.81 CCCCOCCCOCCCC(=O)NC 34a_200011215613_100000741757 [1,0,0,0,0,0|3,0,0]=4 1659 B15R0.81 CCCCOCCCOCCCC(=O)NC 7a_200011215613_100000741757 [1,0,0,0,0,0|3,0,0]=4 1660 B15R0.81 CCCCOCCCOCCCC(=O)OC 34a_200011215613_100000742333 [1,0,0,0,0,0|2,0,0]=3 1661 B15R0.81 CCCCOCCCOCCCC(=O)OC 7a_200011215613_100011218270 [1,0,0,0,0,0|2,0,0]=3 1662 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000059025_100000743108 [1,0,0,0,0,0|2,0,0]=3 1663 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000210238_100000204269 [1,0,0,0,0,0|2,0,0]=3 1664 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000059025_100000743108 [1,0,0,0,0,0|2,0,0]=3 1665 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000210238_100000204269 [1,0,0,0,0,0|2,0,0]=3 1666 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100000210238_100000090808 [1,0,0,0,0,0|3,0,0]=4 1667 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100011023656_100000210210 [1,0,0,0,0,0|3,0,0]=4 1668 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100011215186_100000747449 [1,0,0,0,0,0|3,0,0]=4 1669 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100000210238_100000090808 [1,0,0,0,0,0|3,0,0]=4 1670 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210211 [1,0,0,0,0,0|3,0,0]=4 1671 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100011215186_100000747449 [1,0,0,0,0,0|3,0,0]=4 1672 B15R0.81 CCCCOCCSCCCCC(=O)OC 62a_100000204269_100000743108 [1,0,0,0,0,0|2,0,0]=3 1673 B15R0.81 CCCCOCCSCCCCC(=O)OC 62a_100000743108_100000204269 [1,0,0,0,0,0|2,0,0]=3 1674 B15R0.81 CCCCOCCSCCOCC(=O)OC 62a_100000090808_100000743108 [1,0,0,0,0,0|3,0,0]=4 1675 B15R0.81 CCCCOCCSCCOCC(=O)OC 62a_100000743108_100000090808 [1,0,0,0,0,0|3,0,0]=4 1676 B15R0.81 CCCCOCOCCCCCC(=O)OC 34a_100000074720_100011995733 [1,0,0,0,0,0|2,0,0]=3 1677 B15R0.81 CCCCOCSCCCCCC(=O)OC 62a_100009816466_100011995733 [1,0,0,0,0,0|2,0,0]=3 1678 B15R0.81 CCCCOCSCCCCCC(=O)OC 62a_100011995733_100009816466 [1,0,0,0,0,0|2,0,0]=3 1679 B15R0.81 CCCCSCCCCCCCC(=O)OC 62a_100000210211_100010004213 [1,0,0,0,0,0|1,0,0]=2 1680 B15R0.81 CCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210210 [1,0,0,0,0,0|1,0,0]=2 1681 B15R0.81 CCCCSCCNCCCCC(=O)OC 2230a_100025743550_100000204269 [1,0,0,0,0,0|2,0,0]=3 1682 B15R0.81 CCCCSCCNCCOCC(=O)OC 2230a_100025743550_100000090808 [1,0,0,0,0,0|3,0,0]=4 1683 B15R0.81 CCCCSCCOCCCCC(=O)OC 34a_200000230436_100000204269 [1,0,0,0,0,0|2,0,0]=3 1684 B15R0.81 CCCCSCCOCCCCC(=O)OC 7a_200000230436_100000204269 [1,0,0,0,0,0|2,0,0]=3 1685 B15R0.81 CCCCSCCOCCOCC(=O)OC 34a_200000230436_100000090808 [1,0,0,0,0,0|3,0,0]=4 1686 B15R0.81 CCCCSCCOCCOCC(=O)OC 7a_200000230436_100000090808 [1,0,0,0,0,0|3,0,0]=4 1687 B15R0.81 CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210303 [1,0,0,0,0,0|1,0,0]=2 1688 B15R0.81 CCCOCCCCCCCCC(=O)OC 34a_100000210258_100010282707 [1,0,0,0,0,0|1,0,0]=2 1689 B15R0.81 CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210303 [1,0,0,0,0,0|1,0,0]=2 1690 B15R0.81 CCCOCCCNCCCCC(=O)OC 2230a_100011217757_100000204269 [1,0,0,0,0,0|2,0,0]=3 1691 B15R0.81 CCCOCCCNCCCCC(=O)OC 34a_100011217757_100000204269 [1,0,0,0,0,0|2,0,0]=3 1692 B15R0.81 CCCOCCCNCCOCC(=O)OC 2230a_100011217757_100000090808 [1,0,0,0,0,0|3,0,0]=4 1693 B15R0.81 CCCOCCCNCCOCC(=O)OC 34a_100011217757_100000090808 [1,0,0,0,0,0|3,0,0]=4 1694 B15R0.81 CCCOCCNCCCCCC(=O)OC 2230a_100161115042_100009816466 [1,0,0,0,0,0|2,0,0]=3 1695 B15R0.81 CCCOCCNCCCCCC(=O)OC 34a_100161115042_100009816466 [1,0,0,0,0,0|2,0,0]=3 1696 B15R0.81 CCCOCCOCCCCCC(=O)OC 34a_100000074720_100011215938 [1,0,0,0,0,0|2,0,0]=3 1697 B15R0.81 CCCOCCOCCCCCC(=O)OC 34a_100000752267_100009816466 [1,0,0,0,0,0|2,0,0]=3 1698 B15R0.81 CCCOCCOCCCCCC(=O)OC 7a_100000074720_100011215938 [1,0,0,0,0,0|2,0,0]=3 1699 B15R0.81 CCCOCCOCCCCCC(=O)OC 7a_100000752267_100009816466 [1,0,0,0,0,0|2,0,0]=3 1700 B15R0.81 CCCOCCOCCNCCC(=O)OC 2230a_200011904461_100000204255 [1,0,0,0,0,0|3,0,0]=4 1701 B15R0.81 CCCOCCOCCNCCC(=O)OC 34a_200011904461_100000742370 [1,0,0,0,0,0|3,0,0]=4 1702 B15R0.81 CCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210303 [1,0,0,0,0,0|3,0,0]=4 1703 B15R0.81 CCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210303 [1,0,0,0,0,0|3,0,0]=4 1704 B15R0.81 CCCOCCSCCCCCC(=O)OC 62a_100009816466_100011215938 [1,0,0,0,0,0|2,0,0]=3 1705 B15R0.81 CCCOCCSCCCCCC(=O)OC 62a_100011215938_100009816466 [1,0,0,0,0,0|2,0,0]=3 1706 B15R0.81 CCCSCCCCCCCCC(=O)OC 62a_100000210303_100010282707 [1,0,0,0,0,0|1,0,0]=2 1707 B15R0.81 CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210303 [1,0,0,0,0,0|1,0,0]=2 1708 B15R0.81 CCCSCCNCCCCCC(=O)OC 2230a_100020603323_100009816466 [1,0,0,0,0,0|2,0,0]=3 1709 B15R0.81 CCCSCCOCCCCCC(=O)OC 34a_200000230433_100009816466 [1,0,0,0,0,0|2,0,0]=3 1710 B15R0.81 CCCSCCOCCCCCC(=O)OC 7a_200000230433_100009816466 [1,0,0,0,0,0|2,0,0]=3 1711 B15R0.81 CCNCCCCCCCCCC(=O)OC 2230a_100015525214_100009813843 [1,0,0,0,0,0|1,0,0]=2 1712 B15R0.81 CCOCCCCCCCCCC(=O)OC 34a_100121572206_100009813843 [1,0,0,0,0,0|1,0,0]=2 1713 B15R0.81 CCOCCCNCCCCCC(=O)OC 2230a_100000210961_100009816466 [1,0,0,0,0,0|2,0,0]=3 1714 B15R0.81 CCOCCCNCCCCCC(=O)OC 34a_100000210961_100009816466 [1,0,0,0,0,0|2,0,0]=3 1715 B15R0.81 CCOCCCOCCCCCC(=O)OC 34a_100000074720_100012232248 [1,0,0,0,0,0|2,0,0]=3 1716 B15R0.81 CCOCCCOCCCCCC(=O)OC 34a_100000757476_100009816466 [1,0,0,0,0,0|2,0,0]=3 1717 B15R0.81 CCOCCCOCCCCCC(=O)OC 7a_100000074720_100012232248 [1,0,0,0,0,0|2,0,0]=3 1718 B15R0.81 CCOCCCOCCCCCC(=O)OC 7a_100000757476_100009816466 [1,0,0,0,0,0|2,0,0]=3 1719 B15R0.81 CCOCCCSCCCCCC(=O)OC 62a_100009816466_100012232248 [1,0,0,0,0,0|2,0,0]=3 1720 B15R0.81 CCOCCCSCCCCCC(=O)OC 62a_100012232248_100009816466 [1,0,0,0,0,0|2,0,0]=3 1721 B15R0.81 CCOCCNCCCCCCC(=O)OC 2230a_102516460346_100009815986 [1,0,0,0,0,0|2,0,0]=3 1722 B15R0.81 CCOCCNCCCCCCC(=O)OC 34a_102516460346_100009815986 [1,0,0,0,0,0|2,0,0]=3 1723 B15R0.81 CCOCCOCCCCCCC(=O)OC 34a_100000210136_100009815986 [1,0,0,0,0,0|2,0,0]=3 1724 B15R0.81 CCOCCOCCCCCCC(=O)OC 34a_100009863599_100000210147 [1,0,0,0,0,0|2,0,0]=3 1725 B15R0.81 CCOCCOCCCCCCC(=O)OC 7a_100000210136_100009815986 [1,0,0,0,0,0|2,0,0]=3 1726 B15R0.81 CCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215890 [1,0,0,0,0,0|2,0,0]=3 1727 B15R0.81 CCOCCOCCNCCCC(=O)OC 2230a_100102712874_100011218270 [1,0,0,0,0,0|3,0,0]=4 1728 B15R0.81 CCOCCOCCNCCCC(=O)OC 34a_100102712874_100000742333 [1,0,0,0,0,0|3,0,0]=4 1729 B15R0.81 CCOCCOCCOCCCC(=O)OC 34a_100000210240_100000742333 [1,0,0,0,0,0|3,0,0]=4 1730 B15R0.81 CCOCCOCCOCCCC(=O)OC 7a_100000210240_100011218270 [1,0,0,0,0,0|3,0,0]=4 1731 B15R0.81 CCOCCOCCSCCCC(=O)OC 62a_100011211534_100011218270 [1,0,0,0,0,0|3,0,0]=4 1732 B15R0.81 CCOCCOCCSCCCC(=O)OC 62a_100011218270_100011211534 [1,0,0,0,0,0|3,0,0]=4 1733 B15R0.81 CCOCCSCCCCCCC(=O)OC 62a_100000210147_100009815986 [1,0,0,0,0,0|2,0,0]=3 1734 B15R0.81 CCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215890 [1,0,0,0,0,0|2,0,0]=3 1735 B15R0.81 CCOCSCCCCCCCC(=O)OC 62a_100000739092_100010004213 [1,0,0,0,0,0|2,0,0]=3 1736 B15R0.81 CCOCSCCCCCCCC(=O)OC 62a_100010004213_100000739092 [1,0,0,0,0,0|2,0,0]=3 1737 B15R0.81 CCSCCCCCCCCCC(=O)OC 62a_100000210202_100009813843 [1,0,0,0,0,0|1,0,0]=2 1738 B15R0.81 CCSCCCOCCCCCC(=O)OC 34a_100011216438_100009816466 [1,0,0,0,0,0|2,0,0]=3 1739 B15R0.81 CCSCCCOCCCCCC(=O)OC 7a_100011216438_100009816466 [1,0,0,0,0,0|2,0,0]=3 1740 B15R0.81 CCSCCNCCCCCCC(=O)OC 2230a_100000106463_100009815986 [1,0,0,0,0,0|2,0,0]=3 1741 B15R0.81 CCSCCOCCCCCCC(=O)OC 34a_100000212035_100009815986 [1,0,0,0,0,0|2,0,0]=3 1742 B15R0.81 CCSCCOCCCCCCC(=O)OC 34a_100009863599_100000757381 [1,0,0,0,0,0|2,0,0]=3 1743 B15R0.81 CCSCCOCCCCCCC(=O)OC 7a_100000212035_100009815986 [1,0,0,0,0,0|2,0,0]=3 1744 B15R0.81 CCSCCOCCCCCCC(=O)OC 7a_100009863599_100000757381 [1,0,0,0,0,0|2,0,0]=3 1745 B15R0.81 CCSCCSCCCCCCC(=O)OC 62a_100000757381_100009815986 [1,0,0,0,0,0|2,0,0]=3 1746 B15R0.81 CCSCCSCCCCCCC(=O)OC 62a_100009815986_100000757381 [1,0,0,0,0,0|2,0,0]=3 1747 B15R0.81 CNC(=O)CCCCCCCCCCCO 240690a_100102657272_100000037981 [1,0,0,0,0,0|2,0,0]=3 1748 B15R0.81 CNC(=O)CCCNCCCCCCCO 2230a_100000740002_100000760002 [1,0,0,0,0,0|3,0,0]=4 1749 B15R0.81 CNC(=O)CCCNCCCCCCCO 2230a_100011996573_100000741757 [1,0,0,0,0,0|3,0,0]=4 1750 B15R0.81 CNC(=O)CCCNCCCCCCCO 34a_100000740002_100000760002 [1,0,0,0,0,0|3,0,0]=4 1751 B15R0.81 CNC(=O)CCCNCCCCCCCO 34a_100011996573_100000741757 [1,0,0,0,0,0|3,0,0]=4 1752 B15R0.81 CNC(=O)CCCNCCCCCCOC 2230a_100000740002_100011998445 [1,0,0,0,0,0|3,0,0]=4 1753 B15R0.81 CNC(=O)CCCNCCCCCCOC 34a_100000740002_100011998445 [1,0,0,0,0,0|3,0,0]=4 1754 B15R0.81 CNC(=O)CCCOCCCCCCCBr 34a_100000760002_100000741757 [1,0,0,0,0,0|3,0,0]=4 1755 B15R0.81 CNC(=O)CCCOCCCCCCCBr 7a_100000760002_100000741757 [1,0,0,0,0,0|3,0,0]=4 1756 B15R0.81 CNC(=O)CCCOCCCCCCCN 34a_100011996573_100000741757 [1,0,0,0,0,0|3,0,0]=4 1757 B15R0.81 CNC(=O)CCCOCCCCCCOC 34a_200012092642_100000741757 [1,0,0,0,0,0|3,0,0]=4 1758 B15R0.81 CNC(=O)CCCOCCCCCCOC 7a_200012092642_100000741757 [1,0,0,0,0,0|3,0,0]=4 1759 B15R0.81 CNC(=O)CCCSCCCCCCCO 62a_100000741757_100000760002 [1,0,0,0,0,0|3,0,0]=4 1760 B15R0.81 CNC(=O)CCCSCCCCCCCO 62a_100000760002_100000741757 [1,0,0,0,0,0|3,0,0]=4 1761 B15R0.81 CNC(=O)CCCSCCCCCCOC 62a_100000741757_100011998445 [1,0,0,0,0,0|3,0,0]=4 1762 B15R0.81 CNC(=O)CCCSCCCCCCOC 62a_100011998445_100000741757 [1,0,0,0,0,0|3,0,0]=4 1763 B15R0.81 CNC(=O)CCNCCCCCCCCO 2230a_100000738227_100000033203 [1,0,0,0,0,0|3,0,0]=4 1764 B15R0.81 CNC(=O)CCNCCCCCCCCO 2230a_102515433106_100000737683 [1,0,0,0,0,0|3,0,0]=4 1765 B15R0.81 CNC(=O)CCNCCCCCCCCO 34a_100000738227_100000033203 [1,0,0,0,0,0|3,0,0]=4 1766 B15R0.81 CNC(=O)CCNCCCCCCCCO 34a_102515433106_100012179268 [1,0,0,0,0,0|3,0,0]=4 1767 B15R0.81 CNC(=O)CCOCCCCCCCCBr 34a_100009813846_100012179268 [1,0,0,0,0,0|3,0,0]=4 1768 B15R0.81 CNC(=O)CCOCCCCCCCCBr 7a_100009813846_100000737683 [1,0,0,0,0,0|3,0,0]=4 1769 B15R0.81 CNC(=O)CCOCCCCCCCCCl 34a_100000033203_100012179268 [1,0,0,0,0,0|3,0,0]=4 1770 B15R0.81 CNC(=O)CCOCCCCCCCCCl 7a_100000033203_100000737683 [1,0,0,0,0,0|3,0,0]=4 1771 B15R0.81 CNC(=O)CCOCCCCCCCCN 34a_102515433106_100012179268 [1,0,0,0,0,0|3,0,0]=4 1772 B15R0.81 CNC(=O)CCOCCCCCCCCO 34a_100000754576_100000033203 [1,0,0,0,0,0|3,0,0]=4 1773 B15R0.81 CNC(=O)CCSCCCCCCCCO 62a_100000033203_100000737683 [1,0,0,0,0,0|3,0,0]=4 1774 B15R0.81 CNC(=O)CCSCCCCCCCCO 62a_100000737683_100000033203 [1,0,0,0,0,0|3,0,0]=4 1775 B15R0.81 CNC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183359 [1,0,0,0,0,0|3,0,0]=4 1776 B15R0.81 CNC(=O)CNCCCCCCCCCO 2230a_100000693194_100009813782 [1,0,0,0,0,0|3,0,0]=4 1777 B15R0.81 CNC(=O)CNCCCCCCCCCO 34a_100000078944_100000183359 [1,0,0,0,0,0|3,0,0]=4 1778 B15R0.81 CNC(=O)COCCCCCCCCCBr 34a_100009813782_100000183359 [1,0,0,0,0,0|3,0,0]=4 1779 B15R0.81 CNC(=O)COCCCCCCCCCBr 7a_100009813782_100000183359 [1,0,0,0,0,0|3,0,0]=4 1780 B15R0.81 CNC(=O)COCCCCCCCCCCl 34a_100009868337_100000183359 [1,0,0,0,0,0|3,0,0]=4 1781 B15R0.81 CNC(=O)COCCCCCCCCCCl 7a_100009868337_100000183359 [1,0,0,0,0,0|3,0,0]=4 1782 B15R0.81 CNC(=O)COCCCCCCCCCN 34a_100000078944_100000183359 [1,0,0,0,0,0|3,0,0]=4 1783 B15R0.81 CNC(=O)COCCCCCCCCCO 34a_100000750040_100009813782 [1,0,0,0,0,0|3,0,0]=4 1784 B15R0.81 CNC(=O)CSCCCCCCCCCO 62a_100000183359_100009813782 [1,0,0,0,0,0|3,0,0]=4 1785 B15R0.81 CNC(=O)CSCCCCCCCCCO 62a_100009813782_100000183359 [1,0,0,0,0,0|3,0,0]=4 1786 B15R0.81 CNC(=O)NCCCCCCCCCCO 2708a_100000066964_106832991635 [1,0,0,0,0,0|3,0,0]=4 1787 B15R0.81 CNC(=O)NCCCCCCCCCCO 2708a_100102657272_100000066964 [1,0,0,0,0,0|3,0,0]=4 1788 B15R0.81 CNC(=O)NCCCCCCCCCCO 273464a_100000066964_100102657272 [1,0,0,0,0,0|3,0,0]=4 1789 B15R0.81 CNC(=O)NCCCCCCCCCCO 273464a_100102657272_100000066964 [1,0,0,0,0,0|3,0,0]=4 1790 B15R0.81 CNC(=O)NCCCCCCCCCCO 512a_100000066964_100102657272 [1,0,0,0,0,0|3,0,0]=4 1791 B15R0.81 CNC(=O)NCCCCCCCCCCO 512a_106832991638_100000066964 [1,0,0,0,0,0|3,0,0]=4 1792 B15R0.81 CNCCCCCCCCCCC(=O)OC 2230a_106832991635_100009812566 [1,0,0,0,0,0|1,0,0]=2 1793 B15R0.81 CNCCCCCCCCCCC(=O)OC 34a_100102657272_100009812566 [1,0,0,0,0,0|1,0,0]=2 1794 B15R0.81 CNCCCCCCCCCCC(=O)OC 7a_106832991635_100009812566 [1,0,0,0,0,0|1,0,0]=2 1795 B15R0.81 CNCCCCCOCCCCC(=O)OC 34a_100000722520_100000204269 [1,0,0,0,0,0|2,0,0]=3 1796 B15R0.81 CNCCCCCOCCOCC(=O)OC 34a_100000722520_100000090808 [1,0,0,0,0,0|3,0,0]=4 1797 B15R0.81 CNCCCOCCCCCCC(=O)OC 34a_100000213112_100009815986 [1,0,0,0,0,0|2,0,0]=3 1798 B15R0.81 CNCCOCCOCCCCC(=O)OC 34a_100000228057_100000204269 [1,0,0,0,0,0|3,0,0]=4 1799 B15R0.81 COC(=O)CCCCCCCCCCO[13CH3] 34a_100011003013_200025704644 [1,0,0,0,0,0|1,0,0]=2 1800 B15R0.81 COC(=O)CCCCCCCCCCO[13CH3] 7a_100011003013_200025704644 [1,0,0,0,0,0|1,0,0]=2 1801 B15R0.81 COC(=O)CCCCCCCCCCSC 62a_200000210301_100009812566 [1,0,0,0,0,0|1,0,0]=2 1802 B15R0.81 COC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009812566 [1,0,0,0,0,0|1,0,0]=2 1803 B15R0.81 COC(=O)CCCCCCCCCSCF 62a_100015361967_100009813843 [1,0,0,0,0,0|2,0,0]=3 1804 B15R0.81 COC(=O)CCCCCCCCNCCF 34a_100000724931_100010282707 [1,0,0,0,0,0|2,0,0]=3 1805 B15R0.81 COC(=O)CCCCCCCCNCCO 2230a_100016997473_100010282707 [1,0,0,0,0,0|2,0,0]=3 1806 B15R0.81 COC(=O)CCCCCCCCNCCO 34a_100016990907_100010282707 [1,0,0,0,0,0|2,0,0]=3 1807 B15R0.81 COC(=O)CCCCCCCCOCC#N 7a_100000035544_100011215382 [1,0,0,0,0,0|2,0,1]=4 1808 B15R0.81 COC(=O)CCCCCCCCOCC=O 34a_100000035544_200009817547 [1,0,0,0,0,0|2,0,1]=4 1809 B15R0.81 COC(=O)CCCCCCCCOCC=O 7a_100000035544_200015260668 [1,0,0,0,0,0|2,0,1]=4 1810 B15R0.81 COC(=O)CCCCCCCCOCCBr 34a_100000211926_100010282707 [1,0,0,0,0,0|2,0,0]=3 1811 B15R0.81 COC(=O)CCCCCCCCOCCF 34a_100000035544_100011217306 [1,0,0,0,0,0|2,0,0]=3 1812 B15R0.81 COC(=O)CCCCCCCCOCCF 7a_100000035544_100011217306 [1,0,0,0,0,0|2,0,0]=3 1813 B15R0.81 COC(=O)CCCCCCCCOCCN 34a_100000210304_100010282707 [1,0,0,0,0,0|2,0,0]=3 1814 B15R0.81 COC(=O)CCCCCCCCOCCO 34a_100000035544_100000211926 [1,0,0,0,0,0|2,0,0]=3 1815 B15R0.81 COC(=O)CCCCCCCCOCCO 7a_100000035544_100000211926 [1,0,0,0,0,0|2,0,0]=3 1816 B15R0.81 COC(=O)CCCCCCCCOCSC 34a_100000035544_100011218213 [1,0,0,0,0,0|2,0,0]=3 1817 B15R0.81 COC(=O)CCCCCCCCSCC#N 62a_100010282707_100011215382 [1,0,0,0,0,0|2,0,1]=4 1818 B15R0.81 COC(=O)CCCCCCCCSCC#N 62a_100011215382_100010282707 [1,0,0,0,0,0|2,0,1]=4 1819 B15R0.81 COC(=O)CCCCCCCCSCC=O 62a_100010282707_200015260668 [1,0,0,0,0,0|2,0,1]=4 1820 B15R0.81 COC(=O)CCCCCCCCSCC=O 62a_200015260668_100010282707 [1,0,0,0,0,0|2,0,1]=4 1821 B15R0.81 COC(=O)CCCCCCCCSCCF 62a_100010282707_100011217306 [1,0,0,0,0,0|2,0,0]=3 1822 B15R0.81 COC(=O)CCCCCCCCSCCF 62a_100011217306_100010282707 [1,0,0,0,0,0|2,0,0]=3 1823 B15R0.81 COC(=O)CCCCCCCCSCCO 62a_100000211926_100010282707 [1,0,0,0,0,0|2,0,0]=3 1824 B15R0.81 COC(=O)CCCCCCCCSCCO 62a_100010282707_100000211926 [1,0,0,0,0,0|2,0,0]=3 1825 B15R0.81 COC(=O)CCCCCCCCSCSC 62a_100010282707_100011218213 [1,0,0,0,0,0|2,0,0]=3 1826 B15R0.81 COC(=O)CCCCCCCCSCSC 62a_100011218213_100010282707 [1,0,0,0,0,0|2,0,0]=3 1827 B15R0.81 COC(=O)CCCCCCCNCCCF 2230a_100015189416_100010004213 [1,0,0,0,0,0|2,0,0]=3 1828 B15R0.81 COC(=O)CCCCCCCNCCCF 34a_100015189416_100010004213 [1,0,0,0,0,0|2,0,0]=3 1829 B15R0.81 COC(=O)CCCCCCCNCCSC 2230a_100020590264_100010004213 [1,0,0,0,0,0|2,0,0]=3 1830 B15R0.81 COC(=O)CCCCCCCOCCC#N 7a_100011022521_100000184422 [1,0,0,0,0,0|2,0,1]=4 1831 B15R0.81 COC(=O)CCCCCCCOCCCBr 34a_100011217188_100010004213 [1,0,0,0,0,0|2,0,0]=3 1832 B15R0.81 COC(=O)CCCCCCCOCCCCl 34a_100000230001_100010004213 [1,0,0,0,0,0|2,0,0]=3 1833 B15R0.81 COC(=O)CCCCCCCOCCCF 34a_100000759539_100010004213 [1,0,0,0,0,0|2,0,0]=3 1834 B15R0.81 COC(=O)CCCCCCCOCCCF 34a_100011022521_100011934791 [1,0,0,0,0,0|2,0,0]=3 1835 B15R0.81 COC(=O)CCCCCCCOCCCF 7a_100011022521_100011934791 [1,0,0,0,0,0|2,0,0]=3 1836 B15R0.81 COC(=O)CCCCCCCOCCCN 34a_100000182051_100010004213 [1,0,0,0,0,0|2,0,0]=3 1837 B15R0.81 COC(=O)CCCCCCCOCCCO 34a_100011022521_100000230001 [1,0,0,0,0,0|2,0,0]=3 1838 B15R0.81 COC(=O)CCCCCCCOCCCO 7a_100011022521_100011215043 [1,0,0,0,0,0|2,0,0]=3 1839 B15R0.81 COC(=O)CCCCCCCOCCON 34a_100000700252_100010004213 [1,0,0,0,0,0|3,0,0]=4 1840 B15R0.81 COC(=O)CCCCCCCOCCSC 34a_100000230434_100010004213 [1,0,0,0,0,0|2,0,0]=3 1841 B15R0.81 COC(=O)CCCCCCCOCCSC 34a_100011022521_100000212216 [1,0,0,0,0,0|2,0,0]=3 1842 B15R0.81 COC(=O)CCCCCCCOCCSC 7a_100000230434_100010004213 [1,0,0,0,0,0|2,0,0]=3 1843 B15R0.81 COC(=O)CCCCCCCOCCSC 7a_100011022521_100000212216 [1,0,0,0,0,0|2,0,0]=3 1844 B15R0.81 COC(=O)CCCCCCCSCCC#N 62a_100010004213_100011215226 [1,0,0,0,0,0|2,0,1]=4 1845 B15R0.81 COC(=O)CCCCCCCSCCC#N 62a_100011215226_100010004213 [1,0,0,0,0,0|2,0,1]=4 1846 B15R0.81 COC(=O)CCCCCCCSCCCF 62a_100010004213_100011934791 [1,0,0,0,0,0|2,0,0]=3 1847 B15R0.81 COC(=O)CCCCCCCSCCCF 62a_100011934791_100010004213 [1,0,0,0,0,0|2,0,0]=3 1848 B15R0.81 COC(=O)CCCCCCCSCCCO 62a_100010004213_100011215043 [1,0,0,0,0,0|2,0,0]=3 1849 B15R0.81 COC(=O)CCCCCCCSCCCO 62a_100011215043_100010004213 [1,0,0,0,0,0|2,0,0]=3 1850 B15R0.81 COC(=O)CCCCCCCSCCSC 62a_100000212216_100010004213 [1,0,0,0,0,0|2,0,0]=3 1851 B15R0.81 COC(=O)CCCCCCCSCCSC 62a_100010004213_100000751147 [1,0,0,0,0,0|2,0,0]=3 1852 B15R0.81 COC(=O)CCCCCCNCCCCO 2230a_100000750430_100009815986 [1,0,0,0,0,0|2,0,0]=3 1853 B15R0.81 COC(=O)CCCCCCNCCCCO 34a_100000750430_100009815986 [1,0,0,0,0,0|2,0,0]=3 1854 B15R0.81 COC(=O)CCCCCCNCCCSC 2230a_100000749238_100009815986 [1,0,0,0,0,0|2,0,0]=3 1855 B15R0.81 COC(=O)CCCCCCOCCCC#N 7a_100009863599_100000687738 [1,0,0,0,0,0|2,0,1]=4 1856 B15R0.81 COC(=O)CCCCCCOCCCC=O 7a_100009863599_200011292268 [1,0,0,0,0,0|2,0,1]=4 1857 B15R0.81 COC(=O)CCCCCCOCCCCBr 34a_100011216708_100009815986 [1,0,0,0,0,0|2,0,0]=3 1858 B15R0.81 COC(=O)CCCCCCOCCCCCl 34a_100000210776_100009815986 [1,0,0,0,0,0|2,0,0]=3 1859 B15R0.81 COC(=O)CCCCCCOCCCCCl 7a_100000210776_100009815986 [1,0,0,0,0,0|2,0,0]=3 1860 B15R0.81 COC(=O)CCCCCCOCCCCF 34a_100009863599_100000729493 [1,0,0,0,0,0|2,0,0]=3 1861 B15R0.81 COC(=O)CCCCCCOCCCCF 34a_100011995726_100009815986 [1,0,0,0,0,0|2,0,0]=3 1862 B15R0.81 COC(=O)CCCCCCOCCCCF 7a_100009863599_100000729493 [1,0,0,0,0,0|2,0,0]=3 1863 B15R0.81 COC(=O)CCCCCCOCCCCF 7a_100011995726_100009815986 [1,0,0,0,0,0|2,0,0]=3 1864 B15R0.81 COC(=O)CCCCCCOCCCCI 34a_200012148704_100009815986 [1,0,0,0,0,0|2,0,0]=3 1865 B15R0.81 COC(=O)CCCCCCOCCCCN 34a_100000750430_100009815986 [1,0,0,0,0,0|2,0,0]=3 1866 B15R0.81 COC(=O)CCCCCCOCCCCO 34a_100009863599_100011216708 [1,0,0,0,0,0|2,0,0]=3 1867 B15R0.81 COC(=O)CCCCCCOCCCCO 7a_100009863599_100000210776 [1,0,0,0,0,0|2,0,0]=3 1868 B15R0.81 COC(=O)CCCCCCOCCCSC 34a_100000690336_100009815986 [1,0,0,0,0,0|2,0,0]=3 1869 B15R0.81 COC(=O)CCCCCCOCCCSC 7a_100000690336_100009815986 [1,0,0,0,0,0|2,0,0]=3 1870 B15R0.81 COC(=O)CCCCCCSCCCC#N 62a_100000687738_100009815986 [1,0,0,0,0,0|2,0,1]=4 1871 B15R0.81 COC(=O)CCCCCCSCCCC#N 62a_100009815986_100000687738 [1,0,0,0,0,0|2,0,1]=4 1872 B15R0.81 COC(=O)CCCCCCSCCCC=O 62a_100009815986_200011292268 [1,0,0,0,0,0|2,0,1]=4 1873 B15R0.81 COC(=O)CCCCCCSCCCC=O 62a_200011292268_100009815986 [1,0,0,0,0,0|2,0,1]=4 1874 B15R0.81 COC(=O)CCCCCCSCCCCF 62a_100000729493_100009815986 [1,0,0,0,0,0|2,0,0]=3 1875 B15R0.81 COC(=O)CCCCCCSCCCCF 62a_100009815986_100000729493 [1,0,0,0,0,0|2,0,0]=3 1876 B15R0.81 COC(=O)CCCCCCSCCCCO 62a_100000210776_100009815986 [1,0,0,0,0,0|2,0,0]=3 1877 B15R0.81 COC(=O)CCCCCCSCCCCO 62a_100009815986_100000210776 [1,0,0,0,0,0|2,0,0]=3 1878 B15R0.81 COC(=O)CCCCCNCCCCCO 2230a_100000762737_100009816466 [1,0,0,0,0,0|2,0,0]=3 1879 B15R0.81 COC(=O)CCCCCNCCCCCO 34a_100000762737_100009816466 [1,0,0,0,0,0|2,0,0]=3 1880 B15R0.81 COC(=O)CCCCCNCCOCCO 2230a_100000211614_100009816466 [1,0,0,0,0,0|3,0,0]=4 1881 B15R0.81 COC(=O)CCCCCNCCOCCO 34a_100000211614_100009816466 [1,0,0,0,0,0|3,0,0]=4 1882 B15R0.81 COC(=O)CCCCCNCCSCCO 2230a_100011219999_100009816466 [1,0,0,0,0,0|3,0,0]=4 1883 B15R0.81 COC(=O)CCCCCOCCCCC#N 7a_100000074720_100000211819 [1,0,0,0,0,0|2,0,1]=4 1884 B15R0.81 COC(=O)CCCCCOCCCCC=O 7a_100000074720_100000139335 [1,0,0,0,0,0|2,0,1]=4 1885 B15R0.81 COC(=O)CCCCCOCCCCCBr 34a_100000746331_100009816466 [1,0,0,0,0,0|2,0,0]=3 1886 B15R0.81 COC(=O)CCCCCOCCCCCBr 7a_100000746331_100009816466 [1,0,0,0,0,0|2,0,0]=3 1887 B15R0.81 COC(=O)CCCCCOCCCCCCl 34a_100000746330_100009816466 [1,0,0,0,0,0|2,0,0]=3 1888 B15R0.81 COC(=O)CCCCCOCCCCCCl 7a_100000746330_100009816466 [1,0,0,0,0,0|2,0,0]=3 1889 B15R0.81 COC(=O)CCCCCOCCCCCF 34a_100000074720_100000729378 [1,0,0,0,0,0|2,0,0]=3 1890 B15R0.81 COC(=O)CCCCCOCCCCCF 7a_100000074720_100000729378 [1,0,0,0,0,0|2,0,0]=3 1891 B15R0.81 COC(=O)CCCCCOCCCCCI 34a_200012148887_100009816466 [1,0,0,0,0,0|2,0,0]=3 1892 B15R0.81 COC(=O)CCCCCOCCCCCI 7a_200012148887_100009816466 [1,0,0,0,0,0|2,0,0]=3 1893 B15R0.81 COC(=O)CCCCCOCCCCCN 34a_100000762737_100009816466 [1,0,0,0,0,0|2,0,0]=3 1894 B15R0.81 COC(=O)CCCCCOCCCCCO 34a_100000074720_100000746330 [1,0,0,0,0,0|2,0,0]=3 1895 B15R0.81 COC(=O)CCCCCOCCCCCO 7a_100000074720_100000746330 [1,0,0,0,0,0|2,0,0]=3 1896 B15R0.81 COC(=O)CCCCCOCCCCSC 34a_100011217163_100009816466 [1,0,0,0,0,0|2,0,0]=3 1897 B15R0.81 COC(=O)CCCCCOCCCCSC 7a_100011217163_100009816466 [1,0,0,0,0,0|2,0,0]=3 1898 B15R0.81 COC(=O)CCCCCOCCOCCBr 34a_100000692535_100009816466 [1,0,0,0,0,0|3,0,0]=4 1899 B15R0.81 COC(=O)CCCCCOCCOCCBr 7a_100000692535_100009816466 [1,0,0,0,0,0|3,0,0]=4 1900 B15R0.81 COC(=O)CCCCCOCCOCCCl 34a_100011215305_100009816466 [1,0,0,0,0,0|3,0,0]=4 1901 B15R0.81 COC(=O)CCCCCOCCOCCCl 7a_100011215305_100009816466 [1,0,0,0,0,0|3,0,0]=4 1902 B15R0.81 COC(=O)CCCCCOCCOCCF 34a_200015357709_100009816466 [1,0,0,0,0,0|3,0,0]=4 1903 B15R0.81 COC(=O)CCCCCOCCOCCF 7a_200015357709_100009816466 [1,0,0,0,0,0|3,0,0]=4 1904 B15R0.81 COC(=O)CCCCCOCCOCCI 34a_100012149058_100009816466 [1,0,0,0,0,0|3,0,0]=4 1905 B15R0.81 COC(=O)CCCCCOCCOCCI 7a_100012149058_100009816466 [1,0,0,0,0,0|3,0,0]=4 1906 B15R0.81 COC(=O)CCCCCOCCOCCN 34a_100000211614_100009816466 [1,0,0,0,0,0|3,0,0]=4 1907 B15R0.81 COC(=O)CCCCCOCCOCCO 34a_100000074720_100000692535 [1,0,0,0,0,0|3,0,0]=4 1908 B15R0.81 COC(=O)CCCCCOCCOCCO 7a_100000074720_100011215305 [1,0,0,0,0,0|3,0,0]=4 1909 B15R0.81 COC(=O)CCCCCSCCCCC#N 62a_100009816466_100000211819 [1,0,0,0,0,0|2,0,1]=4 1910 B15R0.81 COC(=O)CCCCCSCCCCC#N 62a_100011219923_100009816466 [1,0,0,0,0,0|2,0,1]=4 1911 B15R0.81 COC(=O)CCCCCSCCCCC=O 62a_100000139335_100009816466 [1,0,0,0,0,0|2,0,1]=4 1912 B15R0.81 COC(=O)CCCCCSCCCCC=O 62a_100009816466_100000139335 [1,0,0,0,0,0|2,0,1]=4 1913 B15R0.81 COC(=O)CCCCCSCCCCCF 62a_100000729378_100009816466 [1,0,0,0,0,0|2,0,0]=3 1914 B15R0.81 COC(=O)CCCCCSCCCCCF 62a_100009816466_100000729378 [1,0,0,0,0,0|2,0,0]=3 1915 B15R0.81 COC(=O)CCCCCSCCCCCO 62a_100000746330_100009816466 [1,0,0,0,0,0|2,0,0]=3 1916 B15R0.81 COC(=O)CCCCCSCCCCCO 62a_100009816466_100000746330 [1,0,0,0,0,0|2,0,0]=3 1917 B15R0.81 COC(=O)CCCCCSCCOCCO 62a_100009816466_100011215305 [1,0,0,0,0,0|3,0,0]=4 1918 B15R0.81 COC(=O)CCCCCSCCOCCO 62a_100011215305_100009816466 [1,0,0,0,0,0|3,0,0]=4 1919 B15R0.81 COC(=O)CCCCNCCCCCCO 2230a_100000686447_100000204269 [1,0,0,0,0,0|2,0,0]=3 1920 B15R0.81 COC(=O)CCCCNCCCCCCO 34a_100000686447_100000204269 [1,0,0,0,0,0|2,0,0]=3 1921 B15R0.81 COC(=O)CCCCOCCCCCC#N 7a_100000059025_100009813376 [1,0,0,0,0,0|2,0,1]=4 1922 B15R0.81 COC(=O)CCCCOCCCCCC=O 7a_100000059025_100000139337 [1,0,0,0,0,0|2,0,1]=4 1923 B15R0.81 COC(=O)CCCCOCCCCCCBr 34a_100011215345_100000204269 [1,0,0,0,0,0|2,0,0]=3 1924 B15R0.81 COC(=O)CCCCOCCCCCCBr 7a_100011215345_100000204269 [1,0,0,0,0,0|2,0,0]=3 1925 B15R0.81 COC(=O)CCCCOCCCCCCCl 34a_100000766143_100000204269 [1,0,0,0,0,0|2,0,0]=3 1926 B15R0.81 COC(=O)CCCCOCCCCCCCl 7a_100000766143_100000204269 [1,0,0,0,0,0|2,0,0]=3 1927 B15R0.81 COC(=O)CCCCOCCCCCCF 34a_100000059025_100015922095 [1,0,0,0,0,0|2,0,0]=3 1928 B15R0.81 COC(=O)CCCCOCCCCCCF 34a_100000732779_100000204269 [1,0,0,0,0,0|2,0,0]=3 1929 B15R0.81 COC(=O)CCCCOCCCCCCF 7a_100000059025_100015922095 [1,0,0,0,0,0|2,0,0]=3 1930 B15R0.81 COC(=O)CCCCOCCCCCCF 7a_100000732779_100000204269 [1,0,0,0,0,0|2,0,0]=3 1931 B15R0.81 COC(=O)CCCCOCCCCCCN 34a_100000686447_100000204269 [1,0,0,0,0,0|2,0,0]=3 1932 B15R0.81 COC(=O)CCCCOCCCCCCO 34a_100000059025_100000766143 [1,0,0,0,0,0|2,0,0]=3 1933 B15R0.81 COC(=O)CCCCOCCCCCCO 7a_100000059025_100000766143 [1,0,0,0,0,0|2,0,0]=3 1934 B15R0.81 COC(=O)CCCCSCCCCCC#N 62a_100000204269_100009813376 [1,0,0,0,0,0|2,0,1]=4 1935 B15R0.81 COC(=O)CCCCSCCCCCC#N 62a_100009813376_100000204269 [1,0,0,0,0,0|2,0,1]=4 1936 B15R0.81 COC(=O)CCCCSCCCCCC=O 62a_100000139337_100000204269 [1,0,0,0,0,0|2,0,1]=4 1937 B15R0.81 COC(=O)CCCCSCCCCCC=O 62a_100000204269_100000139337 [1,0,0,0,0,0|2,0,1]=4 1938 B15R0.81 COC(=O)CCCCSCCCCCCF 62a_100000204269_100015922095 [1,0,0,0,0,0|2,0,0]=3 1939 B15R0.81 COC(=O)CCCCSCCCCCCF 62a_100015922095_100000204269 [1,0,0,0,0,0|2,0,0]=3 1940 B15R0.81 COC(=O)CCCCSCCCCCCO 62a_100000204269_100000766143 [1,0,0,0,0,0|2,0,0]=3 1941 B15R0.81 COC(=O)CCCCSCCCCCCO 62a_100000766143_100000204269 [1,0,0,0,0,0|2,0,0]=3 1942 B15R0.81 COC(=O)CCCNCCCCCCCO 2230a_100011996573_100011218270 [1,0,0,0,0,0|2,0,0]=3 1943 B15R0.81 COC(=O)CCCNCCCCCCCO 34a_100011996573_100000742333 [1,0,0,0,0,0|2,0,0]=3 1944 B15R0.81 COC(=O)CCCNCCCOCCCO 2230a_100011310245_100011218270 [1,0,0,0,0,0|3,0,0]=4 1945 B15R0.81 COC(=O)CCCNCCCOCCCO 34a_100011310245_100000742333 [1,0,0,0,0,0|3,0,0]=4 1946 B15R0.81 COC(=O)CCCOCCCCCCCBr 34a_100000760002_100000742333 [1,0,0,0,0,0|2,0,0]=3 1947 B15R0.81 COC(=O)CCCOCCCCCCCBr 7a_100000760002_100011218270 [1,0,0,0,0,0|2,0,0]=3 1948 B15R0.81 COC(=O)CCCOCCCCCCCN 34a_100011996573_100000742333 [1,0,0,0,0,0|2,0,0]=3 1949 B15R0.81 COC(=O)CCCOCCCOCCCN 34a_100011310245_100000742333 [1,0,0,0,0,0|3,0,0]=4 1950 B15R0.81 COC(=O)CCCSCCCCCCC#N 62a_100009813337_100011218270 [1,0,0,0,0,0|2,0,1]=4 1951 B15R0.81 COC(=O)CCCSCCCCCCC#N 62a_100011218270_100009813337 [1,0,0,0,0,0|2,0,1]=4 1952 B15R0.81 COC(=O)CCCSCCCCCCCO 62a_100000760002_100011218270 [1,0,0,0,0,0|2,0,0]=3 1953 B15R0.81 COC(=O)CCCSCCCCCCCO 62a_100011218270_100000760002 [1,0,0,0,0,0|2,0,0]=3 1954 B15R0.81 COC(=O)CCNCCCCCCCCO 2230a_102515433106_100000204255 [1,0,0,0,0,0|2,0,0]=3 1955 B15R0.81 COC(=O)CCNCCCCCCCCO 34a_102515433106_100000742370 [1,0,0,0,0,0|2,0,0]=3 1956 B15R0.81 COC(=O)CCOCCCCCCCCBr 34a_100009813846_100000742370 [1,0,0,0,0,0|2,0,0]=3 1957 B15R0.81 COC(=O)CCOCCCCCCCCBr 7a_100009813846_100000204255 [1,0,0,0,0,0|2,0,0]=3 1958 B15R0.81 COC(=O)CCOCCCCCCCCCl 34a_100000033203_100000742370 [1,0,0,0,0,0|2,0,0]=3 1959 B15R0.81 COC(=O)CCOCCCCCCCCCl 7a_100000033203_100000204255 [1,0,0,0,0,0|2,0,0]=3 1960 B15R0.81 COC(=O)CCOCCCCCCCCN 34a_102515433106_100000742370 [1,0,0,0,0,0|2,0,0]=3 1961 B15R0.81 COC(=O)CCOCCCCCNCCN 34a_103619048469_100000742370 [1,0,0,0,0,0|3,0,0]=4 1962 B15R0.81 COC(=O)CCSCCCCCCCCO 62a_100000033203_100000204255 [1,0,0,0,0,0|2,0,0]=3 1963 B15R0.81 COC(=O)CCSCCCCCCCCO 62a_100000204255_100000033203 [1,0,0,0,0,0|2,0,0]=3 1964 B15R0.81 COC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747449 [1,0,0,0,0,0|2,0,0]=3 1965 B15R0.81 COC(=O)CNCCCCCCCCCO 34a_100000078944_100000747449 [1,0,0,0,0,0|2,0,0]=3 1966 B15R0.81 COC(=O)COCCCCCCCCCBr 34a_100009813782_100000747449 [1,0,0,0,0,0|2,0,0]=3 1967 B15R0.81 COC(=O)COCCCCCCCCCBr 7a_100009813782_100000747449 [1,0,0,0,0,0|2,0,0]=3 1968 B15R0.81 COC(=O)COCCCCCCCCCCl 34a_100009868337_100000747449 [1,0,0,0,0,0|2,0,0]=3 1969 B15R0.81 COC(=O)COCCCCCCCCCCl 7a_100009868337_100000747449 [1,0,0,0,0,0|2,0,0]=3 1970 B15R0.81 COC(=O)COCCCCCCCCCN 34a_100000078944_100000747449 [1,0,0,0,0,0|2,0,0]=3 1971 B15R0.81 COC(=O)COCCNCCCCCCO 2230a_100000686447_100000090808 [1,0,0,0,0,0|3,0,0]=4 1972 B15R0.81 COC(=O)COCCNCCCCCCO 34a_100000686447_100000090808 [1,0,0,0,0,0|3,0,0]=4 1973 B15R0.81 COC(=O)COCCOCCCCCCBr 34a_100011215345_100000090808 [1,0,0,0,0,0|3,0,0]=4 1974 B15R0.81 COC(=O)COCCOCCCCCCBr 7a_100011215345_100000090808 [1,0,0,0,0,0|3,0,0]=4 1975 B15R0.81 COC(=O)COCCOCCCCCCCl 34a_100000766143_100000090808 [1,0,0,0,0,0|3,0,0]=4 1976 B15R0.81 COC(=O)COCCOCCCCCCCl 7a_100000766143_100000090808 [1,0,0,0,0,0|3,0,0]=4 1977 B15R0.81 COC(=O)COCCOCCCCCCF 34a_100000732779_100000090808 [1,0,0,0,0,0|3,0,0]=4 1978 B15R0.81 COC(=O)COCCOCCCCCCF 7a_100000732779_100000090808 [1,0,0,0,0,0|3,0,0]=4 1979 B15R0.81 COC(=O)COCCOCCCCCCN 34a_100000686447_100000090808 [1,0,0,0,0,0|3,0,0]=4 1980 B15R0.81 COC(=O)COCCSCCCCCCF 62a_100000090808_100015922095 [1,0,0,0,0,0|3,0,0]=4 1981 B15R0.81 COC(=O)COCCSCCCCCCF 62a_100015922095_100000090808 [1,0,0,0,0,0|3,0,0]=4 1982 B15R0.81 COC(=O)COCCSCCCCCCO 62a_100000090808_100000766143 [1,0,0,0,0,0|3,0,0]=4 1983 B15R0.81 COC(=O)COCCSCCCCCCO 62a_100000766143_100000090808 [1,0,0,0,0,0|3,0,0]=4 1984 B15R0.81 COC(=O)CSCCCCCCCCCO 62a_100000747449_100009813782 [1,0,0,0,0,0|2,0,0]=3 1985 B15R0.81 COC(=O)CSCCCCCCCCCO 62a_100009813782_100000747449 [1,0,0,0,0,0|2,0,0]=3 1986 B15R0.81 COC(=O)NCCOCCCCCCCO 34a_100000757965_100000760002 [1,0,0,0,0,0|3,0,0]=4 1987 B15R0.81 COC(=O)OCCOCCCCCCCO 34a_100010262106_100000760002 [1,0,0,0,0,0|3,0,0]=4 1988 B15R0.81 COC(=O)OCSCCCCCCCCO 62a_100000033203_100000139417 [1,0,0,0,0,0|3,0,0]=4 1989 B15R0.81 COCCCCCCCCCCC(=O)OC 34a_100011003013_200000210301 [1,0,0,0,0,0|1,0,0]=2 1990 B15R0.81 COCCCCCCCCCCC(=O)OC 34a_100138415774_100009812566 [1,0,0,0,0,0|1,0,0]=2 1991 B15R0.81 COCCCCCCCCCCC(=O)OC 7a_100011003013_200000210301 [1,0,0,0,0,0|1,0,0]=2 1992 B15R0.81 COCCCCCCOCCCC(=O)OC 34a_200012092642_100000742333 [1,0,0,0,0,0|2,0,0]=3 1993 B15R0.81 COCCCCCCOCCCC(=O)OC 7a_200012092642_100011218270 [1,0,0,0,0,0|2,0,0]=3 1994 B15R0.81 COCCCCCCOCCNC(=O)OC 34a_100000757965_100011998445 [1,0,0,0,0,0|3,0,0]=4 1995 B15R0.81 COCCCCCCOCCOC(=O)OC 34a_100010262106_100011998445 [1,0,0,0,0,0|3,0,0]=4 1996 B15R0.81 COCCCCCCSCCCC(=O)OC 62a_100011218270_100011998445 [1,0,0,0,0,0|2,0,0]=3 1997 B15R0.81 COCCCCCCSCCCC(=O)OC 62a_100011998445_100011218270 [1,0,0,0,0,0|2,0,0]=3 1998 B15R0.81 COCCCCCNCCCCC(=O)OC 2230a_100000747528_100000204269 [1,0,0,0,0,0|2,0,0]=3 1999 B15R0.81 COCCCCCNCCCCC(=O)OC 34a_100000747528_100000204269 [1,0,0,0,0,0|2,0,0]=3 2000 B15R0.81 COCCCCCNCCOCC(=O)OC 2230a_100000747528_100000090808 [1,0,0,0,0,0|3,0,0]=4 2001 B15R0.81 COCCCCCNCCOCC(=O)OC 34a_100000747528_100000090808 [1,0,0,0,0,0|3,0,0]=4 2002 B15R0.81 COCCCCOCCCCCC(=O)OC 34a_100000074720_100000755781 [1,0,0,0,0,0|2,0,0]=3 2003 B15R0.81 COCCCCOCCCCCC(=O)OC 34a_100000740925_100009816466 [1,0,0,0,0,0|2,0,0]=3 2004 B15R0.81 COCCCCOCCCCCC(=O)OC 7a_100000074720_100000730899 [1,0,0,0,0,0|2,0,0]=3 2005 B15R0.81 COCCCCSCCCCCC(=O)OC 62a_100000730899_100009816466 [1,0,0,0,0,0|2,0,0]=3 2006 B15R0.81 COCCCCSCCCCCC(=O)OC 62a_100009816466_100000730899 [1,0,0,0,0,0|2,0,0]=3 2007 B15R0.81 COCCCNCCCCCCC(=O)OC 34a_100150723488_100009815986 [1,0,0,0,0,0|2,0,0]=3 2008 B15R0.81 COCCCOCCCCCCC(=O)OC 34a_100000740835_100009815986 [1,0,0,0,0,0|2,0,0]=3 2009 B15R0.81 COCCCOCCCCCCC(=O)OC 34a_100009863599_100000740836 [1,0,0,0,0,0|2,0,0]=3 2010 B15R0.81 COCCCOCCCCCCC(=O)OC 7a_100009863599_100000740836 [1,0,0,0,0,0|2,0,0]=3 2011 B15R0.81 COCCCOCCCOCCC(=O)OC 34a_200011215475_100000742370 [1,0,0,0,0,0|3,0,0]=4 2012 B15R0.81 COCCCOCCCOCCC(=O)OC 7a_200011215475_100000204255 [1,0,0,0,0,0|3,0,0]=4 2013 B15R0.81 COCCCSCCCCCCC(=O)OC 62a_100000709357_100009815986 [1,0,0,0,0,0|2,0,0]=3 2014 B15R0.81 COCCCSCCCCCCC(=O)OC 62a_100009815986_100000709357 [1,0,0,0,0,0|2,0,0]=3 2015 B15R0.81 COCCNCCCCCCCC(=O)OC 2230a_100000209980_100010004213 [1,0,0,0,0,0|2,0,0]=3 2016 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100000210237_100010004213 [1,0,0,0,0,0|2,0,0]=3 2017 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100011022521_100011201679 [1,0,0,0,0,0|2,0,0]=3 2018 B15R0.81 COCCOCCCCCCCC(=O)OC 7a_100011022521_100000233755 [1,0,0,0,0,0|2,0,0]=3 2019 B15R0.81 COCCOCCCNCCCC(=O)OC 2230a_100000206027_100011218270 [1,0,0,0,0,0|3,0,0]=4 2020 B15R0.81 COCCOCCCNCCCC(=O)OC 34a_100000206027_100000742333 [1,0,0,0,0,0|3,0,0]=4 2021 B15R0.81 COCCOCCCSCCCC(=O)OC 62a_100011216529_100011218270 [1,0,0,0,0,0|3,0,0]=4 2022 B15R0.81 COCCOCCCSCCCC(=O)OC 62a_100011218270_100011216529 [1,0,0,0,0,0|3,0,0]=4 2023 B15R0.81 COCCOCCNCCCCC(=O)OC 2230a_100000745349_100000204269 [1,0,0,0,0,0|3,0,0]=4 2024 B15R0.81 COCCOCCNCCCCC(=O)OC 34a_100000745349_100000204269 [1,0,0,0,0,0|3,0,0]=4 2025 B15R0.81 COCCOCCOCCCCC(=O)OC 34a_100000059025_100000695917 [1,0,0,0,0,0|3,0,0]=4 2026 B15R0.81 COCCOCCOCCCCC(=O)OC 34a_100011215163_100000204269 [1,0,0,0,0,0|3,0,0]=4 2027 B15R0.81 COCCOCCOCCCCC(=O)OC 7a_100000059025_100000695917 [1,0,0,0,0,0|3,0,0]=4 2028 B15R0.81 COCCOCCOCCCCC(=O)OC 7a_100011215163_100000204269 [1,0,0,0,0,0|3,0,0]=4 2029 B15R0.81 COCCOCCSCCCCC(=O)OC 62a_100000204269_100000695917 [1,0,0,0,0,0|3,0,0]=4 2030 B15R0.81 COCCOCCSCCCCC(=O)OC 62a_100000695917_100000204269 [1,0,0,0,0,0|3,0,0]=4 2031 B15R0.81 COCCOCSCCCCCC(=O)OC 62a_100000231047_100009816466 [1,0,0,0,0,0|3,0,0]=4 2032 B15R0.81 COCCOCSCCCCCC(=O)OC 62a_100009816466_100000231047 [1,0,0,0,0,0|3,0,0]=4 2033 B15R0.81 COCCSCCCCCCCC(=O)OC 62a_100000233755_100010004213 [1,0,0,0,0,0|2,0,0]=3 2034 B15R0.81 COCCSCCCCCCCC(=O)OC 62a_100010004213_100000233755 [1,0,0,0,0,0|2,0,0]=3 2035 B15R0.81 COCSCCCCCCCCC(=O)OC 62a_100000766300_100010282707 [1,0,0,0,0,0|2,0,0]=3 2036 B15R0.81 COCSCCCCCCCCC(=O)OC 62a_100010282707_100000766300 [1,0,0,0,0,0|2,0,0]=3 2037 B15R0.81 O=C(CO)CCCCCCCCCCCO 1458a_100000210174_100009812471 [1,0,0,0,0,0|3,0,0]=4 2038 B15R0.164 C#CCCCCCCCCOCCC(=O)C 7a_100000065265_100000053229 [1,0,0,0,0,0|1,0,2]=4 2039 B15R0.164 C#CCCCCCCCOCCCC(=O)C 34a_100000054614_100000685027 [1,0,0,0,0,0|1,0,2]=4 2040 B15R0.164 C#CCCCCCCCOCCCC(=O)C 34a_100000759063_100153394163 [1,0,0,0,0,0|1,0,2]=4 2041 B15R0.164 C#CCCCCCCCOCCCC(=O)C 7a_100000054614_100011215641 [1,0,0,0,0,0|1,0,2]=4 2042 B15R0.164 C#CCCCCCCCOCCCC(=O)C 7a_100000759063_100153394163 [1,0,0,0,0,0|1,0,2]=4 2043 B15R0.164 C#CCCCCCCCSCCCC(=O)C 62a_100011215641_100153394163 [1,0,0,0,0,0|1,0,2]=4 2044 B15R0.164 C#CCCCCCCCSCCCC(=O)C 62a_100153394163_100011215641 [1,0,0,0,0,0|1,0,2]=4 2045 B15R0.164 C#CCCCCCCOCCCCC(=O)C 34a_100011217361_100009817362 [1,0,0,0,0,0|1,0,2]=4 2046 B15R0.164 C#CCCCCCCOCCCCC(=O)C 7a_100011217361_100000735457 [1,0,0,0,0,0|1,0,2]=4 2047 B15R0.164 C#CCCCCCCSCCCCC(=O)C 62a_100000735457_100012276617 [1,0,0,0,0,0|1,0,2]=4 2048 B15R0.164 C#CCCCCCCSCCCCC(=O)C 62a_100012276617_100000735457 [1,0,0,0,0,0|1,0,2]=4 2049 B15R0.164 C=C(Br)CCOCCCCCCCCCC 34a_100009813270_100000210320 [1,0,0,0,0,0|2,0,1]=4 2050 B15R0.164 C=C(C)CCNCCCCCCCCCC 2230a_100000684558_100000730704 [1,0,0,0,0,0|2,0,0]=3 2051 B15R0.164 C=C(C)CCNCCCCCCCCCC 34a_100000684558_100000730704 [1,0,0,0,0,0|2,0,0]=3 2052 B15R0.164 C=C(C)CCNCCCCCCCCCO 2230a_100000078944_100000730704 [1,0,0,0,0,0|3,0,0]=4 2053 B15R0.164 C=C(C)CCNCCCCCCCCCO 34a_100000078944_100000730704 [1,0,0,0,0,0|3,0,0]=4 2054 B15R0.164 C=C(C)CCOCCCCCCCCCBr 34a_100009813782_100000730704 [1,0,0,0,0,0|3,0,0]=4 2055 B15R0.164 C=C(C)CCOCCCCCCCCCBr 7a_100009813782_100000730704 [1,0,0,0,0,0|3,0,0]=4 2056 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000210711_100000730704 [1,0,0,0,0,0|2,0,0]=3 2057 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000764851_100000210320 [1,0,0,0,0,0|2,0,0]=3 2058 B15R0.164 C=C(C)CCOCCCCCCCCCC 7a_100000210711_100000730704 [1,0,0,0,0,0|2,0,0]=3 2059 B15R0.164 C=C(C)CCOCCCCCCCCCCl 34a_100009868337_100000730704 [1,0,0,0,0,0|3,0,0]=4 2060 B15R0.164 C=C(C)CCOCCCCCCCCCCl 7a_100009868337_100000730704 [1,0,0,0,0,0|3,0,0]=4 2061 B15R0.164 C=C(C)CCOCCCCCCCCCN 34a_100000078944_100000730704 [1,0,0,0,0,0|3,0,0]=4 2062 B15R0.164 C=C(C)CCOCCCCCCCCCO 34a_100000764851_100009813782 [1,0,0,0,0,0|3,0,0]=4 2063 B15R0.164 C=C(C)CCSCCCCCCCCCC 62a_100000730704_100000210320 [1,0,0,0,0,0|2,0,0]=3 2064 B15R0.164 C=C(C)CCSCCCCCCCCCO 62a_100000730704_100009813782 [1,0,0,0,0,0|3,0,0]=4 2065 B15R0.164 C=C(C)CCSCCCCCCCCCO 62a_100009813782_100000730704 [1,0,0,0,0,0|3,0,0]=4 2066 B15R0.164 C=C(C)CNCCCCCCCCCCC 2230a_200011215754_100000748629 [1,0,0,0,0,0|2,0,0]=3 2067 B15R0.164 C=C(C)CNCCCCCCCCCCC 34a_200011215754_100000748629 [1,0,0,0,0,0|2,0,0]=3 2068 B15R0.164 C=C(C)CNCCCCCCCCCCO 2230a_100000066964_100000748629 [1,0,0,0,0,0|3,0,0]=4 2069 B15R0.164 C=C(C)CNCCCCCCCCCCO 34a_100000066964_100000748629 [1,0,0,0,0,0|3,0,0]=4 2070 B15R0.164 C=C(C)COCCCCCCCCCCBr 34a_100009813290_100000748629 [1,0,0,0,0,0|3,0,0]=4 2071 B15R0.164 C=C(C)COCCCCCCCCCCBr 7a_100009813290_100000748629 [1,0,0,0,0,0|3,0,0]=4 2072 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210245_100011215454 [1,0,0,0,0,0|2,0,0]=3 2073 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210809_100000748629 [1,0,0,0,0,0|2,0,0]=3 2074 B15R0.164 C=C(C)COCCCCCCCCCCC 7a_100000210809_100000748629 [1,0,0,0,0,0|2,0,0]=3 2075 B15R0.164 C=C(C)COCCCCCCCCCCCl 34a_200000033068_100000748629 [1,0,0,0,0,0|3,0,0]=4 2076 B15R0.164 C=C(C)COCCCCCCCCCCCl 7a_200000033068_100000748629 [1,0,0,0,0,0|3,0,0]=4 2077 B15R0.164 C=C(C)COCCCCCCCCCCN 34a_100000066964_100000748629 [1,0,0,0,0,0|3,0,0]=4 2078 B15R0.164 C=C(C)COCCCCCCCCCCO 34a_100000210245_100009813290 [1,0,0,0,0,0|3,0,0]=4 2079 B15R0.164 C=C(C)CSCCCCCCCCCCC 62a_100000748629_100011215454 [1,0,0,0,0,0|2,0,0]=3 2080 B15R0.164 C=C(C)CSCCCCCCCCCCO 62a_100000748629_200000033068 [1,0,0,0,0,0|3,0,0]=4 2081 B15R0.164 C=C(C)CSCCCCCCCCCCO 62a_100009813290_100000211660 [1,0,0,0,0,0|3,0,0]=4 2082 B15R0.164 C=C(F)CNCCCCCCCCCCC 2230a_200011215754_100009893438 [1,0,0,0,0,0|2,0,1]=4 2083 B15R0.164 C=C(F)CNCCCCCCCCCCC 34a_200011215754_100009893438 [1,0,0,0,0,0|2,0,1]=4 2084 B15R0.164 C=C(F)COCCCCCCCCCCC 34a_100000210809_100009893438 [1,0,0,0,0,0|2,0,1]=4 2085 B15R0.164 C=C(F)COCCCCCCCCCCC 34a_200010262243_100011215454 [1,0,0,0,0,0|2,0,1]=4 2086 B15R0.164 C=C(F)COCCCCCCCCCCC 7a_100000210809_100000042424 [1,0,0,0,0,0|2,0,1]=4 2087 B15R0.164 C=C(F)CSCCCCCCCCCCC 62a_100000042424_100011215454 [1,0,0,0,0,0|2,0,1]=4 2088 B15R0.164 C=CCCCCCCCCCCCC(=O)C 1458a_100000070787_102130925996 [1,0,0,0,0,0|0,0,2]=3 2089 B15R0.164 C=CCCCCCCCCCNCC(=O)O 269956a_100016091260_100009814027 [1,0,0,0,0,0|1,0,2]=4 2090 B15R0.164 C=CCCCCCCCCCOCC(=O)C 34a_100000211253_100009814027 [1,0,0,0,0,0|1,0,2]=4 2091 B15R0.164 C=CCCCCCCCCOCCC(=O)C 34a_100000759926_100011933949 [1,0,0,0,0,0|1,0,2]=4 2092 B15R0.164 C=CCCCCCCCCOCCC(=O)C 7a_100000759926_100011933949 [1,0,0,0,0,0|1,0,2]=4 2093 B15R0.164 C=CCCCCCCCCOCCC(=O)C 7a_100011215194_100000053229 [1,0,0,0,0,0|1,0,2]=4 2094 B15R0.164 C=CCCCCCCCCSCCC(=O)C 62a_100000053229_100011933949 [1,0,0,0,0,0|1,0,2]=4 2095 B15R0.164 C=CCCCCCCCCSCCC(=O)C 62a_100011933949_100000053229 [1,0,0,0,0,0|1,0,2]=4 2096 B15R0.164 C=CCCCCCCCOCCCC(=O)C 34a_100000730831_100000685027 [1,0,0,0,0,0|1,0,2]=4 2097 B15R0.164 C=CCCCCCCCOCCCC(=O)C 34a_100000759063_100012355270 [1,0,0,0,0,0|1,0,2]=4 2098 B15R0.164 C=CCCCCCCCOCCCC(=O)C 7a_100000730831_100011215641 [1,0,0,0,0,0|1,0,2]=4 2099 B15R0.164 C=CCCCCCCCOCCCC(=O)C 7a_100000759063_100012355270 [1,0,0,0,0,0|1,0,2]=4 2100 B15R0.164 C=CCCCCCCCSCCCC(=O)C 62a_100011215641_100012355270 [1,0,0,0,0,0|1,0,2]=4 2101 B15R0.164 C=CCCCCCCCSCCCC(=O)C 62a_100012355270_100011215641 [1,0,0,0,0,0|1,0,2]=4 2102 B15R0.164 C=CCCCCCCOCCCCC(=O)C 34a_200011216477_100009817362 [1,0,0,0,0,0|1,0,2]=4 2103 B15R0.164 C=CCCCCCCOCCCCC(=O)C 7a_200011216477_100000735457 [1,0,0,0,0,0|1,0,2]=4 2104 B15R0.164 C=CCCCCCCSCCCCC(=O)C 62a_100000735457_100011215473 [1,0,0,0,0,0|1,0,2]=4 2105 B15R0.164 C=CCCCCCCSCCCCC(=O)C 62a_100011215473_100000735457 [1,0,0,0,0,0|1,0,2]=4 2106 B15R0.164 CC(=O)CCCCCCCCCCCCO 1458a_100000070787_100009813331 [1,0,0,0,0,0|1,0,0]=2 2107 B15R0.164 CC(=O)CCCCCCOCCCCCO 1458a_100000070787_200132310570 [1,0,0,0,0,0|2,0,0]=3 2108 B15R0.164 CC(=O)CCCCNCCCCCCCO 34a_100011996573_100009817362 [1,0,0,0,0,0|2,0,0]=3 2109 B15R0.164 CC(=O)CCCCNCCCOCCCO 34a_100011310245_100009817362 [1,0,0,0,0,0|3,0,0]=4 2110 B15R0.164 CC(=O)CCCCOCCCCCCCBr 34a_100000760002_100009817362 [1,0,0,0,0,0|2,0,0]=3 2111 B15R0.164 CC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000735457 [1,0,0,0,0,0|2,0,0]=3 2112 B15R0.164 CC(=O)CCCCOCCCCCCCN 34a_100011996573_100009817362 [1,0,0,0,0,0|2,0,0]=3 2113 B15R0.164 CC(=O)CCCCOCCCOCCCN 34a_100011310245_100009817362 [1,0,0,0,0,0|3,0,0]=4 2114 B15R0.164 CC(=O)CCCCSCCCCCCC#N 62a_100000735457_100009813337 [1,0,0,0,0,0|2,0,1]=4 2115 B15R0.164 CC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000735457 [1,0,0,0,0,0|2,0,1]=4 2116 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000735457_100000760002 [1,0,0,0,0,0|2,0,0]=3 2117 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000760002_100000735457 [1,0,0,0,0,0|2,0,0]=3 2118 B15R0.164 CC(=O)CCCNCCCCCCCCO 34a_102515433106_100000685027 [1,0,0,0,0,0|2,0,0]=3 2119 B15R0.164 CC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000685027 [1,0,0,0,0,0|2,0,0]=3 2120 B15R0.164 CC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215641 [1,0,0,0,0,0|2,0,0]=3 2121 B15R0.164 CC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000685027 [1,0,0,0,0,0|2,0,0]=3 2122 B15R0.164 CC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215641 [1,0,0,0,0,0|2,0,0]=3 2123 B15R0.164 CC(=O)CCCOCCCCCCCCN 34a_102515433106_100000685027 [1,0,0,0,0,0|2,0,0]=3 2124 B15R0.164 CC(=O)CCCOCCCCCCCCO 34a_100000759063_100000033203 [1,0,0,0,0,0|2,0,0]=3 2125 B15R0.164 CC(=O)CCCOCCCCCCCCO 7a_100000759063_100000033203 [1,0,0,0,0,0|2,0,0]=3 2126 B15R0.164 CC(=O)CCCOCCCCCNCCN 34a_103619048469_100000685027 [1,0,0,0,0,0|3,0,0]=4 2127 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100000033203_100011215641 [1,0,0,0,0,0|2,0,0]=3 2128 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100011215641_100000033203 [1,0,0,0,0,0|2,0,0]=3 2129 B15R0.164 CC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000053229 [1,0,0,0,0,0|2,0,0]=3 2130 B15R0.164 CC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000053229 [1,0,0,0,0,0|2,0,0]=3 2131 B15R0.164 CC(=O)CCOCCCCCCCCCO 34a_100000759926_100009813782 [1,0,0,0,0,0|2,0,0]=3 2132 B15R0.164 CC(=O)CCOCCCCCCCCCO 7a_100000759926_100009813782 [1,0,0,0,0,0|2,0,0]=3 2133 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100000053229_100009813782 [1,0,0,0,0,0|2,0,0]=3 2134 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100009813782_100000053229 [1,0,0,0,0,0|2,0,0]=3 2135 B15R0.164 CC(=O)COCCCCCCCCCCO 34a_100000211253_100009813290 [1,0,0,0,0,0|2,0,0]=3 2136 B15R0.164 CC(=O)NCCCCCCNCCCCF 2230a_200011996284_100000729493 [1,0,0,0,0,0|3,0,0]=4 2137 B15R0.164 CC(=O)NCCCCCCNCCCCF 34a_200011996284_100000729493 [1,0,0,0,0,0|3,0,0]=4 2138 B15R0.164 CC(=O)NCCCCCCNCCCCO 2230a_200011996284_100000210776 [1,0,0,0,0,0|3,0,0]=4 2139 B15R0.164 CC(=O)NCCCCCCNCCCCO 34a_200011996284_100011216708 [1,0,0,0,0,0|3,0,0]=4 2140 B15R0.164 CC(=O)NCCCCCNCCCCCF 2230a_200012022750_100000729378 [1,0,0,0,0,0|3,0,0]=4 2141 B15R0.164 CC(=O)NCCCCCNCCCCCF 34a_200012022750_100000729378 [1,0,0,0,0,0|3,0,0]=4 2142 B15R0.164 CC(=O)NCCCCCNCCCCCO 2230a_200012022750_100000746330 [1,0,0,0,0,0|3,0,0]=4 2143 B15R0.164 CC(=O)NCCCCCNCCCCCO 34a_200012022750_100000746330 [1,0,0,0,0,0|3,0,0]=4 2144 B15R0.164 CC(=O)NCCCCNCCCCCCF 2230a_200011368371_100015922095 [1,0,0,0,0,0|3,0,0]=4 2145 B15R0.164 CC(=O)NCCCCNCCCCCCF 34a_200011368371_100015922095 [1,0,0,0,0,0|3,0,0]=4 2146 B15R0.164 CC(=O)NCCCCNCCCCCCO 2230a_200011368371_100000766143 [1,0,0,0,0,0|3,0,0]=4 2147 B15R0.164 CC(=O)NCCCCNCCCCCCO 34a_200011368371_100000766143 [1,0,0,0,0,0|3,0,0]=4 2148 B15R0.164 CC(=O)NCCCNCCCCCCCO 34a_100000736810_100000760002 [1,0,0,0,0,0|3,0,0]=4 2149 B15R0.164 CC(=O)NCCCOCCCCCCCO 34a_100000752032_100000760002 [1,0,0,0,0,0|3,0,0]=4 2150 B15R0.164 CC(=O)NCCNCCCCCCCCO 2230a_100000209853_100000033203 [1,0,0,0,0,0|3,0,0]=4 2151 B15R0.164 CC(=O)NCCNCCCCCCCCO 2230a_102515433106_100000189650 [1,0,0,0,0,0|3,0,0]=4 2152 B15R0.164 CC(=O)NCCOCCCCCCCCBr 7a_100009813846_100000189650 [1,0,0,0,0,0|3,0,0]=4 2153 B15R0.164 CC(=O)NCCOCCCCCCCCCl 7a_100000033203_100000189650 [1,0,0,0,0,0|3,0,0]=4 2154 B15R0.164 CC(=O)NCCOCCCCCCCCO 34a_100000158858_100000033203 [1,0,0,0,0,0|3,0,0]=4 2155 B15R0.164 CC(=O)NCCSCCCCCCCCO 62a_100000033203_100000189650 [1,0,0,0,0,0|3,0,0]=4 2156 B15R0.164 CC(=O)NCCSCCCCCCCCO 62a_100000189650_100000033203 [1,0,0,0,0,0|3,0,0]=4 2157 B15R0.164 CC(=O)OCCCCCNCCCCCO 2230a_100000762737_100009813381 [1,0,0,0,0,0|3,0,0]=4 2158 B15R0.164 CC(=O)OCCCCCNCCCCCO 34a_100000762737_100000033007 [1,0,0,0,0,0|3,0,0]=4 2159 B15R0.164 CC(=O)OCCCCCOCCCCCBr 34a_100000746331_100000033007 [1,0,0,0,0,0|3,0,0]=4 2160 B15R0.164 CC(=O)OCCCCCOCCCCCBr 7a_100000746331_100000033007 [1,0,0,0,0,0|3,0,0]=4 2161 B15R0.164 CC(=O)OCCCCCOCCCCCCl 34a_100000746330_100000033007 [1,0,0,0,0,0|3,0,0]=4 2162 B15R0.164 CC(=O)OCCCCCOCCCCCCl 7a_100000746330_100000033007 [1,0,0,0,0,0|3,0,0]=4 2163 B15R0.164 CC(=O)OCCCCCOCCCCCI 34a_200012148887_100000033007 [1,0,0,0,0,0|3,0,0]=4 2164 B15R0.164 CC(=O)OCCCCCOCCCCCI 7a_200012148887_100000033007 [1,0,0,0,0,0|3,0,0]=4 2165 B15R0.164 CC(=O)OCCCCCOCCCCCN 34a_100000762737_100000033007 [1,0,0,0,0,0|3,0,0]=4 2166 B15R0.164 CC(=O)OCCCCCSCCCCCF 62a_100000033007_100000729378 [1,0,0,0,0,0|3,0,0]=4 2167 B15R0.164 CC(=O)OCCCCCSCCCCCF 62a_100000729378_100000033007 [1,0,0,0,0,0|3,0,0]=4 2168 B15R0.164 CC(=O)OCCCCCSCCCCCO 62a_100000033007_100000746330 [1,0,0,0,0,0|3,0,0]=4 2169 B15R0.164 CC(=O)OCCCCCSCCCCCO 62a_100000746330_100000033007 [1,0,0,0,0,0|3,0,0]=4 2170 B15R0.164 CC(=O)OCCCCNCCCCCCO 34a_100000686447_100000033659 [1,0,0,0,0,0|3,0,0]=4 2171 B15R0.164 CC(=O)OCCCCOCCCCCCBr 34a_100011215345_100000033659 [1,0,0,0,0,0|3,0,0]=4 2172 B15R0.164 CC(=O)OCCCCOCCCCCCBr 7a_100011215345_100000033659 [1,0,0,0,0,0|3,0,0]=4 2173 B15R0.164 CC(=O)OCCCCOCCCCCCCl 34a_100000766143_100000033659 [1,0,0,0,0,0|3,0,0]=4 2174 B15R0.164 CC(=O)OCCCCOCCCCCCCl 7a_100000766143_100000033659 [1,0,0,0,0,0|3,0,0]=4 2175 B15R0.164 CC(=O)OCCCCOCCCCCCF 34a_100000073216_100015922095 [1,0,0,0,0,0|3,0,0]=4 2176 B15R0.164 CC(=O)OCCCCOCCCCCCF 34a_100000732779_100000033659 [1,0,0,0,0,0|3,0,0]=4 2177 B15R0.164 CC(=O)OCCCCOCCCCCCF 7a_100000073216_100015922095 [1,0,0,0,0,0|3,0,0]=4 2178 B15R0.164 CC(=O)OCCCCOCCCCCCF 7a_100000732779_100000033659 [1,0,0,0,0,0|3,0,0]=4 2179 B15R0.164 CC(=O)OCCCCOCCCCCCN 34a_100000686447_100000033659 [1,0,0,0,0,0|3,0,0]=4 2180 B15R0.164 CC(=O)OCCCCOCCCCCCO 34a_100000073216_100000766143 [1,0,0,0,0,0|3,0,0]=4 2181 B15R0.164 CC(=O)OCCCCOCCCCCCO 7a_100000073216_100000766143 [1,0,0,0,0,0|3,0,0]=4 2182 B15R0.164 CC(=O)OCCCCSCCCCCCF 62a_100000033659_100015922095 [1,0,0,0,0,0|3,0,0]=4 2183 B15R0.164 CC(=O)OCCCCSCCCCCCF 62a_100015922095_100000033659 [1,0,0,0,0,0|3,0,0]=4 2184 B15R0.164 CC(=O)OCCCCSCCCCCCO 62a_100000033659_100000766143 [1,0,0,0,0,0|3,0,0]=4 2185 B15R0.164 CC(=O)OCCCCSCCCCCCO 62a_100000766143_100000033659 [1,0,0,0,0,0|3,0,0]=4 2186 B15R0.164 CC(=O)OCCCNCCCCCCCO 34a_100011996573_100000042594 [1,0,0,0,0,0|3,0,0]=4 2187 B15R0.164 CC(=O)OCCCOCCCCCCCBr 34a_100000760002_100000042594 [1,0,0,0,0,0|3,0,0]=4 2188 B15R0.164 CC(=O)OCCCOCCCCCCCBr 7a_100000760002_100000042594 [1,0,0,0,0,0|3,0,0]=4 2189 B15R0.164 CC(=O)OCCCOCCCCCCCN 34a_100011996573_100000042594 [1,0,0,0,0,0|3,0,0]=4 2190 B15R0.164 CC(=O)OCCCSCCCCCCCO 62a_100000042594_100000760002 [1,0,0,0,0,0|3,0,0]=4 2191 B15R0.164 CC(=O)OCCCSCCCCCCCO 62a_100000760002_100000042594 [1,0,0,0,0,0|3,0,0]=4 2192 B15R0.164 CC(=O)OCCNCCCCCCCCO 34a_102515433106_100009814007 [1,0,0,0,0,0|3,0,0]=4 2193 B15R0.164 CC(=O)OCCOCCCCCCCCBr 34a_100009813846_100009814007 [1,0,0,0,0,0|3,0,0]=4 2194 B15R0.164 CC(=O)OCCOCCCCCCCCBr 7a_100009813846_100009814007 [1,0,0,0,0,0|3,0,0]=4 2195 B15R0.164 CC(=O)OCCOCCCCCCCCCl 34a_100000033203_100009814007 [1,0,0,0,0,0|3,0,0]=4 2196 B15R0.164 CC(=O)OCCOCCCCCCCCCl 7a_100000033203_100009814007 [1,0,0,0,0,0|3,0,0]=4 2197 B15R0.164 CC(=O)OCCOCCCCCCCCN 34a_102515433106_100009814007 [1,0,0,0,0,0|3,0,0]=4 2198 B15R0.164 CC(=O)OCCSCCCCCCCCO 62a_100000033203_100009814007 [1,0,0,0,0,0|3,0,0]=4 2199 B15R0.164 CC(=O)OCCSCCCCCCCCO 62a_100009814007_100000033203 [1,0,0,0,0,0|3,0,0]=4 2200 B15R0.164 CC(=O)OCNCCCCCCCCCO 34a_100000078944_100009813279 [1,0,0,0,0,0|3,0,0]=4 2201 B15R0.164 CC(=O)OCOCCCCCCCCCBr 34a_100009813782_100009813279 [1,0,0,0,0,0|3,0,0]=4 2202 B15R0.164 CC(=O)OCOCCCCCCCCCCl 34a_100009868337_100009813279 [1,0,0,0,0,0|3,0,0]=4 2203 B15R0.164 CC(=O)OCOCCCCCCCCCN 34a_100000078944_100009813279 [1,0,0,0,0,0|3,0,0]=4 2204 B15R0.164 CC(=O)OCSCCCCCCCCCO 62a_100000076356_100009813782 [1,0,0,0,0,0|3,0,0]=4 2205 B15R0.164 CC(=O)OCSCCCCCCCCCO 62a_100009813782_100000076356 [1,0,0,0,0,0|3,0,0]=4 2206 B15R0.164 CC(=O)SCCCCNCCCCCCO 2230a_100000686447_200010402107 [1,0,0,0,0,0|3,0,0]=4 2207 B15R0.164 CC(=O)SCCCCNCCCCCCO 34a_100000686447_200010402107 [1,0,0,0,0,0|3,0,0]=4 2208 B15R0.164 CC(=O)SCCCCOCCCCCCBr 34a_100011215345_200010402107 [1,0,0,0,0,0|3,0,0]=4 2209 B15R0.164 CC(=O)SCCCCOCCCCCCBr 7a_100011215345_200010402107 [1,0,0,0,0,0|3,0,0]=4 2210 B15R0.164 CC(=O)SCCCCOCCCCCCCl 34a_100000766143_200010402107 [1,0,0,0,0,0|3,0,0]=4 2211 B15R0.164 CC(=O)SCCCCOCCCCCCCl 7a_100000766143_200010402107 [1,0,0,0,0,0|3,0,0]=4 2212 B15R0.164 CC(=O)SCCCCOCCCCCCF 34a_100000732779_200010402107 [1,0,0,0,0,0|3,0,0]=4 2213 B15R0.164 CC(=O)SCCCCOCCCCCCF 7a_100000732779_200010402107 [1,0,0,0,0,0|3,0,0]=4 2214 B15R0.164 CC(=O)SCCCCOCCCCCCN 34a_100000686447_200010402107 [1,0,0,0,0,0|3,0,0]=4 2215 B15R0.164 CC(=O)SCCCCSCCCCCCF 62a_100015922095_200010402107 [1,0,0,0,0,0|3,0,0]=4 2216 B15R0.164 CC(=O)SCCCCSCCCCCCF 62a_200010402107_100015922095 [1,0,0,0,0,0|3,0,0]=4 2217 B15R0.164 CC(=O)SCCCCSCCCCCCO 62a_100000766143_200010402107 [1,0,0,0,0,0|3,0,0]=4 2218 B15R0.164 CC(=O)SCCCCSCCCCCCO 62a_200010402107_100000766143 [1,0,0,0,0,0|3,0,0]=4 2219 B15R0.164 CC(=O)SCCCNCCCCCCCO 2230a_100011996573_100000038929 [1,0,0,0,0,0|3,0,0]=4 2220 B15R0.164 CC(=O)SCCCNCCCCCCCO 34a_100011996573_100000038929 [1,0,0,0,0,0|3,0,0]=4 2221 B15R0.164 CC(=O)SCCCOCCCCCCCBr 34a_100000760002_100000038929 [1,0,0,0,0,0|3,0,0]=4 2222 B15R0.164 CC(=O)SCCCOCCCCCCCBr 7a_100000760002_100000038929 [1,0,0,0,0,0|3,0,0]=4 2223 B15R0.164 CC(=O)SCCCOCCCCCCCN 34a_100011996573_100000038929 [1,0,0,0,0,0|3,0,0]=4 2224 B15R0.164 CC(=O)SCCCSCCCCCCCO 62a_100000038929_100000760002 [1,0,0,0,0,0|3,0,0]=4 2225 B15R0.164 CC(=O)SCCCSCCCCCCCO 62a_100000760002_100000038929 [1,0,0,0,0,0|3,0,0]=4 2226 B15R0.164 CC/C=C\CCCCCOCCCC(=O)C 34a_100016268722_100000685027 [1,0,0,0,0,0|1,0,2]=4 2227 B15R0.164 CC/C=C\CCCCCOCCCC(=O)C 7a_100016268722_100011215641 [1,0,0,0,0,0|1,0,2]=4 2228 B15R0.164 CC/C=C\CCCCOCCCCC(=O)C 34a_100016287862_100009817362 [1,0,0,0,0,0|1,0,2]=4 2229 B15R0.164 CC/C=C\CCCCOCCCCC(=O)C 7a_100016287862_100000735457 [1,0,0,0,0,0|1,0,2]=4 2230 B15R0.164 CCC#CCCCCCCOCCC(=O)C 34a_100000759926_200000036426 [1,0,0,0,0,0|1,0,2]=4 2231 B15R0.164 CCC#CCCCCCCOCCC(=O)C 7a_100000759926_200000036426 [1,0,0,0,0,0|1,0,2]=4 2232 B15R0.164 CCC#CCCCCCCSCCC(=O)C 62a_100000053229_200000036426 [1,0,0,0,0,0|1,0,2]=4 2233 B15R0.164 CCC#CCCCCCCSCCC(=O)C 62a_200000036426_100000053229 [1,0,0,0,0,0|1,0,2]=4 2234 B15R0.164 CCCC/C=C/CCCCOCCC(=O)C 7a_200020645093_100000053229 [1,0,0,0,0,0|1,0,2]=4 2235 B15R0.164 CCCC/C=C\CCOCCCCC(=O)C 34a_200016286491_100009817362 [1,0,0,0,0,0|1,0,2]=4 2236 B15R0.164 CCCC/C=C\CCOCCCCC(=O)C 7a_200016286491_100000735457 [1,0,0,0,0,0|1,0,2]=4 2237 B15R0.164 CCCCC#CCCCCOCCC(=O)C 7a_200000066234_100000053229 [1,0,0,0,0,0|1,0,2]=4 2238 B15R0.164 CCCCC#CCCCOCCCC(=O)C 34a_100000759063_200000047210 [1,0,0,0,0,0|1,0,2]=4 2239 B15R0.164 CCCCC#CCCCOCCCC(=O)C 7a_100000759063_200000047210 [1,0,0,0,0,0|1,0,2]=4 2240 B15R0.164 CCCCC#CCCCSCCCC(=O)C 62a_100011215641_200000047210 [1,0,0,0,0,0|1,0,2]=4 2241 B15R0.164 CCCCC#CCCCSCCCC(=O)C 62a_200000047210_100011215641 [1,0,0,0,0,0|1,0,2]=4 2242 B15R0.164 CCCCC#CCCOCCCCC(=O)C 34a_100000037610_100009817362 [1,0,0,0,0,0|1,0,2]=4 2243 B15R0.164 CCCCC#CCCOCCCCC(=O)C 7a_100000037610_100000735457 [1,0,0,0,0,0|1,0,2]=4 2244 B15R0.164 CCCCC/C=C/COCCCCC(=O)C 34a_100016258190_100009817362 [1,0,0,0,0,0|1,0,2]=4 2245 B15R0.164 CCCCC/C=C/COCCCCC(=O)C 7a_100016258190_100000735457 [1,0,0,0,0,0|1,0,2]=4 2246 B15R0.164 CCCCC/C=C\CCCOCCC(=O)C 7a_100020655193_100000053229 [1,0,0,0,0,0|1,0,2]=4 2247 B15R0.164 CCCCC/C=C\CCOCCCC(=O)C 34a_100016277358_100000685027 [1,0,0,0,0,0|1,0,2]=4 2248 B15R0.164 CCCCC/C=C\CCOCCCC(=O)C 7a_100016277358_100011215641 [1,0,0,0,0,0|1,0,2]=4 2249 B15R0.164 CCCCCC#CCCOCCCC(=O)C 34a_200000042877_100000685027 [1,0,0,0,0,0|1,0,2]=4 2250 B15R0.164 CCCCCC#CCCOCCCC(=O)C 7a_200000042877_100011215641 [1,0,0,0,0,0|1,0,2]=4 2251 B15R0.164 CCCCCC#CCOCCCCC(=O)C 34a_200000033628_100009817362 [1,0,0,0,0,0|1,0,2]=4 2252 B15R0.164 CCCCCC#CCOCCCCC(=O)C 7a_200000033628_100000735457 [1,0,0,0,0,0|1,0,2]=4 2253 B15R0.164 CCCCCC#CCSCCCCC(=O)C 62a_100000735457_100009816472 [1,0,0,0,0,0|1,0,2]=4 2254 B15R0.164 CCCCCC#CCSCCCCC(=O)C 62a_100009816472_100000735457 [1,0,0,0,0,0|1,0,2]=4 2255 B15R0.164 CCCCCC/C=C/COCCCC(=O)C 34a_200016276170_100000685027 [1,0,0,0,0,0|1,0,2]=4 2256 B15R0.164 CCCCCC/C=C/COCCCC(=O)C 7a_200016276170_100011215641 [1,0,0,0,0,0|1,0,2]=4 2257 B15R0.164 CCCCCCC#CCCOCCC(=O)C 7a_200000033163_100000053229 [1,0,0,0,0,0|1,0,2]=4 2258 B15R0.164 CCCCCCC#CCOCCCC(=O)C 34a_200000037284_100000685027 [1,0,0,0,0,0|1,0,2]=4 2259 B15R0.164 CCCCCCC#CCOCCCC(=O)C 7a_200000037284_100011215641 [1,0,0,0,0,0|1,0,2]=4 2260 B15R0.164 CCCCCCCC#CCOCCC(=O)C 7a_200000061759_100000053229 [1,0,0,0,0,0|1,0,2]=4 2261 B15R0.164 CCCCCCCCCCC=NNC(=O)C 4a_100000189765_100011218819 [1,0,0,0,0,0|2,0,1]=4 2262 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000070787_100000210684 [1,0,0,0,0,0|0,0,0]=1 2263 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000756256_200000210301 [1,0,0,0,0,0|0,0,0]=1 2264 B15R0.164 CCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000756256_200025704644 [1,0,0,0,0,0|0,0,0]=1 2265 B15R0.164 CCCCCCCCCCCCCN(C)C 2230a_100102631434_100000210684 [1,0,0,0,0,0|2,0,0]=3 2266 B15R0.164 CCCCCCCCCCCCCN(C)C 269982a_100102631434_100000210684 [1,0,0,0,0,0|2,0,0]=3 2267 B15R0.164 CCCCCCCCCCCCCN(C)C 270004a_100102631434_200011215488 [1,0,0,0,0,0|2,0,0]=3 2268 B15R0.164 CCCCCCCCCCCCNC(=O)C 11a_100000210451_100015343762 [1,0,0,0,0,0|1,0,0]=2 2269 B15R0.164 CCCCCCCCCCCCNC(=O)C 1626a_100000210451_100015343762 [1,0,0,0,0,0|1,0,0]=2 2270 B15R0.164 CCCCCCCCCCCCNC(=O)C 240690a_100000210451_100015343762 [1,0,0,0,0,0|1,0,0]=2 2271 B15R0.164 CCCCCCCCCCCCNC(=O)C 527a_100000210451_100103153847 [1,0,0,0,0,0|1,0,0]=2 2272 B15R0.164 CCCCCCCCCCCCNC(C)C 2230a_100000210451_100000210206 [1,0,0,0,0,0|2,0,1]=4 2273 B15R0.164 CCCCCCCCCCCCNC(C)C 2230a_100138425928_100011215052 [1,0,0,0,0,0|2,0,1]=4 2274 B15R0.164 CCCCCCCCCCCCNC(C)C 34a_100000210451_100000210206 [1,0,0,0,0,0|2,0,1]=4 2275 B15R0.164 CCCCCCCCCCCCNC(C)C 34a_100138425928_100000759014 [1,0,0,0,0,0|2,0,1]=4 2276 B15R0.164 CCCCCCCCCCCCOC(C)C 34a_100000210810_100000210206 [1,0,0,0,0,0|2,0,1]=4 2277 B15R0.164 CCCCCCCCCCCCOC(C)C 34a_100000212225_100000759014 [1,0,0,0,0,0|2,0,1]=4 2278 B15R0.164 CCCCCCCCCCCCOC(C)C 7a_100000210810_100000210206 [1,0,0,0,0,0|2,0,1]=4 2279 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215454 [1,0,0,0,0,0|2,0,0]=3 2280 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_200011215754_100000747473 [1,0,0,0,0,0|2,0,0]=3 2281 B15R0.164 CCCCCCCCCCCNCC(=O)N 34a_200011215754_100000187820 [1,0,0,0,0,0|2,0,0]=3 2282 B15R0.164 CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011215454 [1,0,0,0,0,0|1,0,0]=2 2283 B15R0.164 CCCCCCCCCCCNCC(=O)[O-] 34a_200011215754_100020667443 [1,0,0,0,0,0|1,0,1]=3 2284 B15R0.164 CCCCCCCCCCCNCC(C)C 2230a_100000210953_100011215454 [1,0,0,0,0,0|2,0,1]=4 2285 B15R0.164 CCCCCCCCCCCNCC(C)C 2230a_200011215754_100000210760 [1,0,0,0,0,0|2,0,1]=4 2286 B15R0.164 CCCCCCCCCCCNCC(C)C 270004a_200011215754_100000210432 [1,0,0,0,0,0|2,0,1]=4 2287 B15R0.164 CCCCCCCCCCCNCC(C)C 34a_100000210953_100011215454 [1,0,0,0,0,0|2,0,1]=4 2288 B15R0.164 CCCCCCCCCCCNCC(C)C 34a_200011215754_100000210624 [1,0,0,0,0,0|2,0,1]=4 2289 B15R0.164 CCCCCCCCCCCNCC(C)O 2230a_100000210904_100011215454 [1,0,0,0,0,0|1,0,2]=4 2290 B15R0.164 CCCCCCCCCCCNCC(C)O 2230a_200011215754_100011218427 [1,0,0,0,0,0|1,0,2]=4 2291 B15R0.164 CCCCCCCCCCCNCC(C)O 34a_100000210904_100011215454 [1,0,0,0,0,0|1,0,2]=4 2292 B15R0.164 CCCCCCCCCCCNCC(C)O 34a_200011215754_100011218427 [1,0,0,0,0,0|1,0,2]=4 2293 B15R0.164 CCCCCCCCCCCNC[C@@H](C)O 2230a_200011215754_100009817552 [1,0,0,0,0,0|1,0,2]=4 2294 B15R0.164 CCCCCCCCCCCNC[C@@H](C)O 34a_200011215754_100009817552 [1,0,0,0,0,0|1,0,2]=4 2295 B15R0.164 CCCCCCCCCCCNC[N+](=O)[O-] 34a_200011215754_100000761209 [1,0,0,0,0,0|2,0,1]=4 2296 B15R0.164 CCCCCCCCCCCOCC(=O)C 34a_100000211253_100011215454 [1,0,0,0,0,0|1,0,0]=2 2297 B15R0.164 CCCCCCCCCCCOCC(=O)N 34a_100000210809_100000187820 [1,0,0,0,0,0|2,0,0]=3 2298 B15R0.164 CCCCCCCCCCCOCC(=O)N 7a_100000210809_100000187820 [1,0,0,0,0,0|2,0,0]=3 2299 B15R0.164 CCCCCCCCCCCOCC(=O)[O-] 34a_100000210809_100020667443 [1,0,0,0,0,0|1,0,1]=3 2300 B15R0.164 CCCCCCCCCCCOCC(C)Br 34a_100012180447_100011215454 [1,0,0,0,0,0|2,0,1]=4 2301 B15R0.164 CCCCCCCCCCCOCC(C)C 34a_100000210257_100011215454 [1,0,0,0,0,0|2,0,1]=4 2302 B15R0.164 CCCCCCCCCCCOCC(C)C 34a_100000210809_100000210624 [1,0,0,0,0,0|2,0,1]=4 2303 B15R0.164 CCCCCCCCCCCOCC(C)C 7a_100000210809_100000210760 [1,0,0,0,0,0|2,0,1]=4 2304 B15R0.164 CCCCCCCCCCCOCC(C)F 34a_100015925927_100011215454 [1,0,0,0,0,0|2,0,1]=4 2305 B15R0.164 CCCCCCCCCCCOCC(C)O 34a_100000210809_100011218427 [1,0,0,0,0,0|1,0,2]=4 2306 B15R0.164 CCCCCCCCCCCOCC(C)O 7a_100000210809_100011218427 [1,0,0,0,0,0|1,0,2]=4 2307 B15R0.164 CCCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011215454 [1,0,0,0,0,0|2,0,1]=4 2308 B15R0.164 CCCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011215454 [1,0,0,0,0,0|2,0,1]=4 2309 B15R0.164 CCCCCCCCCCCOC[C@@H](C)O 34a_100000210809_100009817552 [1,0,0,0,0,0|1,0,2]=4 2310 B15R0.164 CCCCCCCCCCCOC[C@@H](C)O 7a_100000210809_100009817552 [1,0,0,0,0,0|1,0,2]=4 2311 B15R0.164 CCCCCCCCCCCOC[N+](=O)[O-] 34a_100000210809_100000761209 [1,0,0,0,0,0|2,0,1]=4 2312 B15R0.164 CCCCCCCCCCCSCC(=O)N 62a_100000747473_100011215454 [1,0,0,0,0,0|2,0,0]=3 2313 B15R0.164 CCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011215454 [1,0,0,0,0,0|1,0,1]=3 2314 B15R0.164 CCCCCCCCCCCSCC(C)C 62a_100000210624_100011215454 [1,0,0,0,0,0|2,0,1]=4 2315 B15R0.164 CCCCCCCCCCCSCC(C)O 62a_100011218427_100011215454 [1,0,0,0,0,0|1,0,2]=4 2316 B15R0.164 CCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011215454 [1,0,0,0,0,0|1,0,2]=4 2317 B15R0.164 CCCCCCCCCCNCC=C(C)C 2230a_100000684558_100000761012 [1,0,0,0,0,0|2,0,1]=4 2318 B15R0.164 CCCCCCCCCCNCC=C(C)C 34a_100000684558_100000761012 [1,0,0,0,0,0|2,0,1]=4 2319 B15R0.164 CCCCCCCCCCNCC=C(C)C 34a_100000718196_100000210320 [1,0,0,0,0,0|2,0,1]=4 2320 B15R0.164 CCCCCCCCCCNCCC(=O)N 2230a_100000684558_100000744528 [1,0,0,0,0,0|2,0,0]=3 2321 B15R0.164 CCCCCCCCCCNCCC(=O)N 34a_100000684558_100000731001 [1,0,0,0,0,0|2,0,0]=3 2322 B15R0.164 CCCCCCCCCCNCCC(C)C 2230a_100000684558_100000210312 [1,0,0,0,0,0|2,0,1]=4 2323 B15R0.164 CCCCCCCCCCNCCC(C)C 269862a_100000684558_100000185833 [1,0,0,0,0,0|2,0,1]=4 2324 B15R0.164 CCCCCCCCCCNCCC(C)C 34a_100000684558_100000210312 [1,0,0,0,0,0|2,0,1]=4 2325 B15R0.164 CCCCCCCCCCNCCC(C)O 2230a_100000684558_100012276601 [1,0,0,0,0,0|1,0,2]=4 2326 B15R0.164 CCCCCCCCCCNCCC(C)O 2230a_200000755665_100000210320 [1,0,0,0,0,0|1,0,2]=4 2327 B15R0.164 CCCCCCCCCCNCCC(C)O 34a_100000684558_100012276601 [1,0,0,0,0,0|1,0,2]=4 2328 B15R0.164 CCCCCCCCCCNCOC(=O)C 34a_100000684558_100009813279 [1,0,0,0,0,0|2,0,0]=3 2329 B15R0.164 CCCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210320 [1,0,0,0,0,0|2,0,0]=3 2330 B15R0.164 CCCCCCCCCCOCC=C(C)C 34a_100000210711_100000761012 [1,0,0,0,0,0|2,0,1]=4 2331 B15R0.164 CCCCCCCCCCOCC=C(C)C 34a_100000753907_100000210320 [1,0,0,0,0,0|2,0,1]=4 2332 B15R0.164 CCCCCCCCCCOCC=C(C)C 7a_100000210711_100000761012 [1,0,0,0,0,0|2,0,1]=4 2333 B15R0.164 CCCCCCCCCCOCCC(=O)C 34a_100000759926_100000210320 [1,0,0,0,0,0|1,0,0]=2 2334 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000210711_100000053229 [1,0,0,0,0,0|1,0,0]=2 2335 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000759926_100000210320 [1,0,0,0,0,0|1,0,0]=2 2336 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000210711_100000731001 [1,0,0,0,0,0|2,0,0]=3 2337 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000757172_100000210320 [1,0,0,0,0,0|2,0,0]=3 2338 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000210711_100000744528 [1,0,0,0,0,0|2,0,0]=3 2339 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000757172_100000210320 [1,0,0,0,0,0|2,0,0]=3 2340 B15R0.164 CCCCCCCCCCOCCC(C)Br 34a_100009893172_100000210320 [1,0,0,0,0,0|2,0,1]=4 2341 B15R0.164 CCCCCCCCCCOCCC(C)C 34a_100000210254_100000210320 [1,0,0,0,0,0|2,0,1]=4 2342 B15R0.164 CCCCCCCCCCOCCC(C)C 34a_100000210711_100000210312 [1,0,0,0,0,0|2,0,1]=4 2343 B15R0.164 CCCCCCCCCCOCCC(C)C 7a_100000210254_100000210320 [1,0,0,0,0,0|2,0,1]=4 2344 B15R0.164 CCCCCCCCCCOCCC(C)C 7a_100000210711_100000210626 [1,0,0,0,0,0|2,0,1]=4 2345 B15R0.164 CCCCCCCCCCOCCC(C)O 34a_100000210711_100012276601 [1,0,0,0,0,0|1,0,2]=4 2346 B15R0.164 CCCCCCCCCCOCCC(C)O 7a_100000210711_100012276601 [1,0,0,0,0,0|1,0,2]=4 2347 B15R0.164 CCCCCCCCCCOCCN(C)C 7a_100000210711_100000755713 [1,0,0,0,0,0|3,0,0]=4 2348 B15R0.164 CCCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100000210320 [1,0,0,0,0,0|2,0,1]=4 2349 B15R0.164 CCCCCCCCCCOCOC(=O)C 34a_100000210711_100009813279 [1,0,0,0,0,0|2,0,0]=3 2350 B15R0.164 CCCCCCCCCCSCC=C(C)C 62a_100000761012_100000210320 [1,0,0,0,0,0|2,0,1]=4 2351 B15R0.164 CCCCCCCCCCSCCC(=O)C 62a_100000053229_100000210320 [1,0,0,0,0,0|1,0,0]=2 2352 B15R0.164 CCCCCCCCCCSCCC(=O)N 62a_100000744528_100000210320 [1,0,0,0,0,0|2,0,0]=3 2353 B15R0.164 CCCCCCCCCCSCCC(C)C 62a_100000210312_100000210320 [1,0,0,0,0,0|2,0,1]=4 2354 B15R0.164 CCCCCCCCCCSCCC(C)O 62a_100012276601_100000210320 [1,0,0,0,0,0|1,0,2]=4 2355 B15R0.164 CCCCCCCCCCSCOC(=O)C 62a_100000076356_100000210320 [1,0,0,0,0,0|2,0,0]=3 2356 B15R0.164 CCCCCCCCCNCCC=C(C)C 2230a_100000212291_100011217483 [1,0,0,0,0,0|2,0,1]=4 2357 B15R0.164 CCCCCCCCCNCCC=C(C)C 34a_100000212291_100011217483 [1,0,0,0,0,0|2,0,1]=4 2358 B15R0.164 CCCCCCCCCNCCCC(=O)C 34a_100000212291_100000685027 [1,0,0,0,0,0|1,0,0]=2 2359 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000212291_100102525003 [1,0,0,0,0,0|2,0,0]=3 2360 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000739312_100011214924 [1,0,0,0,0,0|2,0,0]=3 2361 B15R0.164 CCCCCCCCCNCCCC(C)C 2230a_100000212291_100011214892 [1,0,0,0,0,0|2,0,1]=4 2362 B15R0.164 CCCCCCCCCNCCCC(C)C 2230a_200000737386_100011214924 [1,0,0,0,0,0|2,0,1]=4 2363 B15R0.164 CCCCCCCCCNCCCC(C)C 34a_100000212291_100011214892 [1,0,0,0,0,0|2,0,1]=4 2364 B15R0.164 CCCCCCCCCNCCCC(C)C 34a_200000737386_100011214924 [1,0,0,0,0,0|2,0,1]=4 2365 B15R0.164 CCCCCCCCCNCCCC(C)O 2230a_100000212291_200000718107 [1,0,0,0,0,0|1,0,2]=4 2366 B15R0.164 CCCCCCCCCNCCCC(C)O 34a_100000212291_200000718107 [1,0,0,0,0,0|1,0,2]=4 2367 B15R0.164 CCCCCCCCCNCCCS(=O)C 2230a_200000753449_100011214924 [1,0,0,0,0,0|2,0,0]=3 2368 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000209853_100011214924 [1,0,0,0,0,0|2,0,0]=3 2369 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000212291_100000189650 [1,0,0,0,0,0|2,0,0]=3 2370 B15R0.164 CCCCCCCCCNCCNC(=O)N 2230a_100000212291_200000034859 [1,0,0,0,0,0|3,0,0]=4 2371 B15R0.164 CCCCCCCCCNCCNC(=O)N 34a_100020590234_100011214924 [1,0,0,0,0,0|3,0,0]=4 2372 B15R0.164 CCCCCCCCCNCCOC(=O)C 34a_100000212291_100009814007 [1,0,0,0,0,0|2,0,0]=3 2373 B15R0.164 CCCCCCCCCNCCOC(=O)N 34a_100000212291_200011214921 [1,0,0,0,0,0|3,0,0]=4 2374 B15R0.164 CCCCCCCCCOCCC=C(C)C 34a_100000210712_100011217483 [1,0,0,0,0,0|2,0,1]=4 2375 B15R0.164 CCCCCCCCCOCCC=C(C)C 7a_100000210712_100011217483 [1,0,0,0,0,0|2,0,1]=4 2376 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000210712_100000685027 [1,0,0,0,0,0|1,0,0]=2 2377 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000759063_100011214924 [1,0,0,0,0,0|1,0,0]=2 2378 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000210712_100011215641 [1,0,0,0,0,0|1,0,0]=2 2379 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210328 [1,0,0,0,0,0|1,0,0]=2 2380 B15R0.164 CCCCCCCCCOCCCC(=O)N 34a_100000210712_100102525003 [1,0,0,0,0,0|2,0,0]=3 2381 B15R0.164 CCCCCCCCCOCCCC(=O)N 7a_100000210712_100102525003 [1,0,0,0,0,0|2,0,0]=3 2382 B15R0.164 CCCCCCCCCOCCCC(C)C 34a_100000210712_100011214892 [1,0,0,0,0,0|2,0,1]=4 2383 B15R0.164 CCCCCCCCCOCCCC(C)C 34a_100000210774_100011214924 [1,0,0,0,0,0|2,0,1]=4 2384 B15R0.164 CCCCCCCCCOCCCC(C)C 7a_100000210712_100011214892 [1,0,0,0,0,0|2,0,1]=4 2385 B15R0.164 CCCCCCCCCOCCCC(C)C 7a_100000210774_100000210328 [1,0,0,0,0,0|2,0,1]=4 2386 B15R0.164 CCCCCCCCCOCCCC(C)O 34a_100000210712_200000718107 [1,0,0,0,0,0|1,0,2]=4 2387 B15R0.164 CCCCCCCCCOCCCC(C)O 7a_100000210712_200000718107 [1,0,0,0,0,0|1,0,2]=4 2388 B15R0.164 CCCCCCCCCOCCCN(C)C 7a_100000210712_100000757444 [1,0,0,0,0,0|3,0,0]=4 2389 B15R0.164 CCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100011214924 [1,0,0,0,0,0|2,0,1]=4 2390 B15R0.164 CCCCCCCCCOCCNC(=O)C 34a_100000158858_100011214924 [1,0,0,0,0,0|2,0,0]=3 2391 B15R0.164 CCCCCCCCCOCCNC(=O)C 7a_100000210712_100000189650 [1,0,0,0,0,0|2,0,0]=3 2392 B15R0.164 CCCCCCCCCOCCNC(=O)N 34a_100000181757_100011214924 [1,0,0,0,0,0|3,0,0]=4 2393 B15R0.164 CCCCCCCCCOCCNC(=O)N 7a_100000210712_200000034859 [1,0,0,0,0,0|3,0,0]=4 2394 B15R0.164 CCCCCCCCCOCCOC(=O)C 34a_100000210712_100009814007 [1,0,0,0,0,0|2,0,0]=3 2395 B15R0.164 CCCCCCCCCOCCOC(=O)C 7a_100000210712_100009814007 [1,0,0,0,0,0|2,0,0]=3 2396 B15R0.164 CCCCCCCCCOCCOC(=O)N 34a_100000210712_200011214921 [1,0,0,0,0,0|3,0,0]=4 2397 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000210712_200011214921 [1,0,0,0,0,0|3,0,0]=4 2398 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210328 [1,0,0,0,0,0|3,0,0]=4 2399 B15R0.164 CCCCCCCCCSCCC=C(C)C 62a_100011217483_100000210670 [1,0,0,0,0,0|2,0,1]=4 2400 B15R0.164 CCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210670 [1,0,0,0,0,0|1,0,0]=2 2401 B15R0.164 CCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210670 [1,0,0,0,0,0|2,0,0]=3 2402 B15R0.164 CCCCCCCCCSCCCC(C)C 62a_100011214892_100000210670 [1,0,0,0,0,0|2,0,1]=4 2403 B15R0.164 CCCCCCCCCSCCCC(C)O 62a_200000718107_100000210670 [1,0,0,0,0,0|1,0,2]=4 2404 B15R0.164 CCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210670 [1,0,0,0,0,0|2,0,0]=3 2405 B15R0.164 CCCCCCCCCSCCNC(=O)N 62a_200000034859_100000210670 [1,0,0,0,0,0|3,0,0]=4 2406 B15R0.164 CCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210670 [1,0,0,0,0,0|2,0,0]=3 2407 B15R0.164 CCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210670 [1,0,0,0,0,0|3,0,0]=4 2408 B15R0.164 CCCCCCCCNCCCCB(O)O 2230a_100000229939_200009817182 [1,0,0,0,0,0|2,0,1]=4 2409 B15R0.164 CCCCCCCCNCCCCB(O)O 34a_100000229939_200009817182 [1,0,0,0,0,0|2,0,1]=4 2410 B15R0.164 CCCCCCCCNCCCCC(=O)C 34a_100000229939_100009817362 [1,0,0,0,0,0|1,0,0]=2 2411 B15R0.164 CCCCCCCCNCCCCC(=O)N 34a_100000696515_100000210759 [1,0,0,0,0,0|2,0,0]=3 2412 B15R0.164 CCCCCCCCNCCCCC(C)C 2230a_100000229939_100011216152 [1,0,0,0,0,0|2,0,1]=4 2413 B15R0.164 CCCCCCCCNCCCCC(C)C 34a_100000229939_100011216152 [1,0,0,0,0,0|2,0,1]=4 2414 B15R0.164 CCCCCCCCNCCCNC(=O)C 34a_100000736810_100000210759 [1,0,0,0,0,0|2,0,0]=3 2415 B15R0.164 CCCCCCCCNCCCOC(=O)C 34a_100000229939_100000042594 [1,0,0,0,0,0|2,0,0]=3 2416 B15R0.164 CCCCCCCCNCCCOC(=S)C 2230a_100000229939_200135323944 [1,0,0,0,0,0|2,1,0]=4 2417 B15R0.164 CCCCCCCCNCCCOC(=S)C 34a_100000229939_200135323944 [1,0,0,0,0,0|2,1,0]=4 2418 B15R0.164 CCCCCCCCNCCCSC(=O)C 2230a_100000229939_100000038929 [1,0,0,0,0,0|2,0,0]=3 2419 B15R0.164 CCCCCCCCNCCCSC(=O)C 34a_100000229939_100000038929 [1,0,0,0,0,0|2,0,0]=3 2420 B15R0.164 CCCCCCCCNCCOCC(=O)N 2230a_100000229939_100000076697 [1,0,0,0,0,0|3,0,0]=4 2421 B15R0.164 CCCCCCCCNCCOCC(=O)N 34a_100000229939_100000076697 [1,0,0,0,0,0|3,0,0]=4 2422 B15R0.164 CCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210759 [1,0,0,0,0,0|2,0,0]=3 2423 B15R0.164 CCCCCCCCOCCCCB(O)O 34a_100000210232_200009817182 [1,0,0,0,0,0|2,0,1]=4 2424 B15R0.164 CCCCCCCCOCCCCB(O)O 7a_100000210232_200009817182 [1,0,0,0,0,0|2,0,1]=4 2425 B15R0.164 CCCCCCCCOCCCCC(=O)C 34a_100000210232_100009817362 [1,0,0,0,0,0|1,0,0]=2 2426 B15R0.164 CCCCCCCCOCCCCC(=O)C 7a_100000210232_100000735457 [1,0,0,0,0,0|1,0,0]=2 2427 B15R0.164 CCCCCCCCOCCCCC(=O)N 34a_100012022536_100000210759 [1,0,0,0,0,0|2,0,0]=3 2428 B15R0.164 CCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210759 [1,0,0,0,0,0|2,0,0]=3 2429 B15R0.164 CCCCCCCCOCCCCC(C)C 34a_100000210232_100011216152 [1,0,0,0,0,0|2,0,1]=4 2430 B15R0.164 CCCCCCCCOCCCCC(C)C 34a_100011214890_100000210759 [1,0,0,0,0,0|2,0,1]=4 2431 B15R0.164 CCCCCCCCOCCCCC(C)C 7a_100000210232_100011216152 [1,0,0,0,0,0|2,0,1]=4 2432 B15R0.164 CCCCCCCCOCCCCC(C)C 7a_100011214890_100000210759 [1,0,0,0,0,0|2,0,1]=4 2433 B15R0.164 CCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210759 [1,0,0,0,0,0|2,0,1]=4 2434 B15R0.164 CCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210759 [1,0,0,0,0,0|2,0,1]=4 2435 B15R0.164 CCCCCCCCOCCCNC(=O)C 34a_100000752032_100000210759 [1,0,0,0,0,0|2,0,0]=3 2436 B15R0.164 CCCCCCCCOCCCOC(=O)C 34a_100000210232_100000042594 [1,0,0,0,0,0|2,0,0]=3 2437 B15R0.164 CCCCCCCCOCCCOC(=O)C 7a_100000210232_100000042594 [1,0,0,0,0,0|2,0,0]=3 2438 B15R0.164 CCCCCCCCOCCCOC(=S)C 34a_100000210232_200135323944 [1,0,0,0,0,0|2,1,0]=4 2439 B15R0.164 CCCCCCCCOCCCOC(=S)C 7a_100000210232_200135323944 [1,0,0,0,0,0|2,1,0]=4 2440 B15R0.164 CCCCCCCCOCCCSC(=O)C 34a_100000210232_100000038929 [1,0,0,0,0,0|2,0,0]=3 2441 B15R0.164 CCCCCCCCOCCCSC(=O)C 7a_100000210232_100000038929 [1,0,0,0,0,0|2,0,0]=3 2442 B15R0.164 CCCCCCCCOCCOCC(=O)N 34a_100000210232_100000076697 [1,0,0,0,0,0|3,0,0]=4 2443 B15R0.164 CCCCCCCCOCCOCC(=O)N 7a_100000210232_100000076697 [1,0,0,0,0,0|3,0,0]=4 2444 B15R0.164 CCCCCCCCSCCCCB(O)O 62a_100000210759_200009817182 [1,0,0,0,0,0|2,0,1]=4 2445 B15R0.164 CCCCCCCCSCCCCB(O)O 62a_200009817182_100000210317 [1,0,0,0,0,0|2,0,1]=4 2446 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000210759_100000735457 [1,0,0,0,0,0|1,0,0]=2 2447 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210317 [1,0,0,0,0,0|1,0,0]=2 2448 B15R0.164 CCCCCCCCSCCCCC(C)C 62a_100000210759_100011216152 [1,0,0,0,0,0|2,0,1]=4 2449 B15R0.164 CCCCCCCCSCCCCC(C)C 62a_100011216152_100000210317 [1,0,0,0,0,0|2,0,1]=4 2450 B15R0.164 CCCCCCCCSCCCCN(C)C 62a_100000210759_100000690147 [1,0,0,0,0,0|3,0,0]=4 2451 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210317 [1,0,0,0,0,0|2,0,0]=3 2452 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000210759_100000042594 [1,0,0,0,0,0|2,0,0]=3 2453 B15R0.164 CCCCCCCCSCCCOC(=S)C 62a_100000210759_200135323944 [1,0,0,0,0,0|2,1,0]=4 2454 B15R0.164 CCCCCCCCSCCCOC(=S)C 62a_200135323944_100000210317 [1,0,0,0,0,0|2,1,0]=4 2455 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210317 [1,0,0,0,0,0|2,0,0]=3 2456 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000210759_100000038929 [1,0,0,0,0,0|2,0,0]=3 2457 B15R0.164 CCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210317 [1,0,0,0,0,0|3,0,0]=4 2458 B15R0.164 CCCCCCCCSCCOCC(=O)N 62a_100000210759_100000076697 [1,0,0,0,0,0|3,0,0]=4 2459 B15R0.164 CCCCCCCNCCCCCB(O)O 2230a_100000229938_200009817188 [1,0,0,0,0,0|2,0,1]=4 2460 B15R0.164 CCCCCCCNCCCCCC(=O)N 2230a_100000229938_100009817443 [1,0,0,0,0,0|2,0,0]=3 2461 B15R0.164 CCCCCCCNCCCCCC(C)C 2230a_100000229938_100000210682 [1,0,0,0,0,0|2,0,1]=4 2462 B15R0.164 CCCCCCCNCCCCCC(C)C 2230a_100011290863_100000210681 [1,0,0,0,0,0|2,0,1]=4 2463 B15R0.164 CCCCCCCNCCCCCC(C)C 34a_100011290863_100000210614 [1,0,0,0,0,0|2,0,1]=4 2464 B15R0.164 CCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210681 [1,0,0,0,0,0|2,0,0]=3 2465 B15R0.164 CCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210614 [1,0,0,0,0,0|2,0,0]=3 2466 B15R0.164 CCCCCCCNCCCCSC(=O)C 2230a_100000229938_200010402107 [1,0,0,0,0,0|2,0,0]=3 2467 B15R0.164 CCCCCCCOCCCCCB(O)O 34a_100000210272_200009817188 [1,0,0,0,0,0|2,0,1]=4 2468 B15R0.164 CCCCCCCOCCCCCB(O)O 7a_100000210272_200009817188 [1,0,0,0,0,0|2,0,1]=4 2469 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210614 [1,0,0,0,0,0|2,0,0]=3 2470 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000210272_100009817443 [1,0,0,0,0,0|2,0,0]=3 2471 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210614 [1,0,0,0,0,0|2,0,0]=3 2472 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000210272_100009817443 [1,0,0,0,0,0|2,0,0]=3 2473 B15R0.164 CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210614 [1,0,0,0,0,0|1,0,1]=3 2474 B15R0.164 CCCCCCCOCCCCCC(C)C 34a_100000210272_100000210682 [1,0,0,0,0,0|2,0,1]=4 2475 B15R0.164 CCCCCCCOCCCCCC(C)C 34a_100011995859_100000210614 [1,0,0,0,0,0|2,0,1]=4 2476 B15R0.164 CCCCCCCOCCCCCC(C)C 7a_100000210272_100000210682 [1,0,0,0,0,0|2,0,1]=4 2477 B15R0.164 CCCCCCCOCCCCCC(C)C 7a_100011995859_100000210614 [1,0,0,0,0,0|2,0,1]=4 2478 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210614 [1,0,0,0,0,0|2,0,0]=3 2479 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000210272_100000033659 [1,0,0,0,0,0|2,0,0]=3 2480 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210614 [1,0,0,0,0,0|2,0,0]=3 2481 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000210272_100000033659 [1,0,0,0,0,0|2,0,0]=3 2482 B15R0.164 CCCCCCCOCCCCSC(=O)C 34a_100000210272_200010402107 [1,0,0,0,0,0|2,0,0]=3 2483 B15R0.164 CCCCCCCOCCCCSC(=O)C 7a_100000210272_200010402107 [1,0,0,0,0,0|2,0,0]=3 2484 B15R0.164 CCCCCCCOCOCCOC(=O)C 34a_100000210272_100000076355 [1,0,0,0,0,0|3,0,0]=4 2485 B15R0.164 CCCCCCCSCCCCCB(O)O 62a_100000210614_200009817188 [1,0,0,0,0,0|2,0,1]=4 2486 B15R0.164 CCCCCCCSCCCCCB(O)O 62a_200009817188_100000210316 [1,0,0,0,0,0|2,0,1]=4 2487 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100000210614_100009817443 [1,0,0,0,0,0|2,0,0]=3 2488 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210316 [1,0,0,0,0,0|2,0,0]=3 2489 B15R0.164 CCCCCCCSCCCCCC(C)C 62a_100000210614_100000210682 [1,0,0,0,0,0|2,0,1]=4 2490 B15R0.164 CCCCCCCSCCCCCC(C)C 62a_100000210682_100000210316 [1,0,0,0,0,0|2,0,1]=4 2491 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210316 [1,0,0,0,0,0|2,0,0]=3 2492 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000210614_100000033659 [1,0,0,0,0,0|2,0,0]=3 2493 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_100000210614_200010402107 [1,0,0,0,0,0|2,0,0]=3 2494 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210316 [1,0,0,0,0,0|2,0,0]=3 2495 B15R0.164 CCCCCCCSCOCCOC(=O)C 62a_100000076355_100000210316 [1,0,0,0,0,0|3,0,0]=4 2496 B15R0.164 CCCCCCCSCOCCOC(=O)C 62a_100000210614_100000076355 [1,0,0,0,0,0|3,0,0]=4 2497 B15R0.164 CCCCCCNCCCCCCB(O)O 2230a_100000210581_100009817187 [1,0,0,0,0,0|2,0,1]=4 2498 B15R0.164 CCCCCCNCCCCCCC(C)C 2230a_100000211014_100000210314 [1,0,0,0,0,0|2,0,1]=4 2499 B15R0.164 CCCCCCNCCCCCCC(C)C 34a_100000211014_100000210314 [1,0,0,0,0,0|2,0,1]=4 2500 B15R0.164 CCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210314 [1,0,0,0,0,0|2,0,0]=3 2501 B15R0.164 CCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210314 [1,0,0,0,0,0|2,0,0]=3 2502 B15R0.164 CCCCCCNCCCCCOC(=O)C 2230a_100000210581_100009813381 [1,0,0,0,0,0|2,0,0]=3 2503 B15R0.164 CCCCCCNCCOCCOC(=O)C 2230a_100000210581_200000083610 [1,0,0,0,0,0|3,0,0]=4 2504 B15R0.164 CCCCCCOCCCCCCB(O)O 34a_100000210259_100009817187 [1,0,0,0,0,0|2,0,1]=4 2505 B15R0.164 CCCCCCOCCCCCCB(O)O 7a_100000210259_100009817187 [1,0,0,0,0,0|2,0,1]=4 2506 B15R0.164 CCCCCCOCCCCCOC(=O)C 34a_100000210259_100000033007 [1,0,0,0,0,0|2,0,0]=3 2507 B15R0.164 CCCCCCOCCCCCOC(=O)C 7a_100000210259_100000033007 [1,0,0,0,0,0|2,0,0]=3 2508 B15R0.164 CCCCCCOCCOCCCC(=O)C 34a_100000691444_100000685027 [1,0,0,0,0,0|2,0,0]=3 2509 B15R0.164 CCCCCCOCCOCCCC(=O)C 7a_100000691444_100011215641 [1,0,0,0,0,0|2,0,0]=3 2510 B15R0.164 CCCCCCOCCOCCCC(=O)N 34a_100000691444_100102525003 [1,0,0,0,0,0|3,0,0]=4 2511 B15R0.164 CCCCCCOCCOCCCC(=O)N 7a_100000691444_100102525003 [1,0,0,0,0,0|3,0,0]=4 2512 B15R0.164 CCCCCCOCCOCCNC(=O)C 7a_100000691444_100000189650 [1,0,0,0,0,0|3,0,0]=4 2513 B15R0.164 CCCCCCOCCOCCOC(=O)C 34a_100000210259_200000083610 [1,0,0,0,0,0|3,0,0]=4 2514 B15R0.164 CCCCCCOCCOCCOC(=O)C 34a_100000691444_100009814007 [1,0,0,0,0,0|3,0,0]=4 2515 B15R0.164 CCCCCCOCCOCCOC(=O)C 7a_100000210259_200000083610 [1,0,0,0,0,0|3,0,0]=4 2516 B15R0.164 CCCCCCOCCOCCOC(=O)C 7a_100000691444_100009814007 [1,0,0,0,0,0|3,0,0]=4 2517 B15R0.164 CCCCCCSCCCCCCB(O)O 62a_100000210314_100009817187 [1,0,0,0,0,0|2,0,1]=4 2518 B15R0.164 CCCCCCSCCCCCCB(O)O 62a_100009817187_100000210757 [1,0,0,0,0,0|2,0,1]=4 2519 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210757 [1,0,0,0,0,0|2,0,0]=3 2520 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000210314_100000033007 [1,0,0,0,0,0|2,0,0]=3 2521 B15R0.164 CCCCCCSCCOCCOC(=O)C 62a_100000210314_200000083610 [1,0,0,0,0,0|3,0,0]=4 2522 B15R0.164 CCCCCCSCCOCCOC(=O)C 62a_200000083610_100000210757 [1,0,0,0,0,0|3,0,0]=4 2523 B15R0.164 CCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210326 [1,0,0,0,0,0|2,0,0]=3 2524 B15R0.164 CCCCCNCCCCCCNC(=O)C 34a_200011996284_100000718602 [1,0,0,0,0,0|2,0,0]=3 2525 B15R0.164 CCCCCNCCOCCCCC(=O)C 34a_100000224656_100009817362 [1,0,0,0,0,0|2,0,0]=3 2526 B15R0.164 CCCCCNCCOCCCOC(=O)C 34a_100000224656_100000042594 [1,0,0,0,0,0|3,0,0]=4 2527 B15R0.164 CCCCCNCCOCCCSC(=O)C 34a_100000224656_100000038929 [1,0,0,0,0,0|3,0,0]=4 2528 B15R0.164 CCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210326 [1,0,0,0,0,0|3,0,0]=4 2529 B15R0.164 CCCCCOCCCCCCCC(C)C 34a_200000210741_100000718602 [1,0,0,0,0,0|2,0,1]=4 2530 B15R0.164 CCCCCOCCCCCCCC(C)C 7a_200000210741_100000210326 [1,0,0,0,0,0|2,0,1]=4 2531 B15R0.164 CCCCCOCCOCCCCC(=O)C 34a_100011215259_100009817362 [1,0,0,0,0,0|2,0,0]=3 2532 B15R0.164 CCCCCOCCOCCCCC(=O)C 7a_100011215259_100000735457 [1,0,0,0,0,0|2,0,0]=3 2533 B15R0.164 CCCCCOCCOCCCOC(=O)C 34a_100011215259_100000042594 [1,0,0,0,0,0|3,0,0]=4 2534 B15R0.164 CCCCCOCCOCCCOC(=O)C 7a_100011215259_100000042594 [1,0,0,0,0,0|3,0,0]=4 2535 B15R0.164 CCCCCOCCOCCCSC(=O)C 34a_100011215259_100000038929 [1,0,0,0,0,0|3,0,0]=4 2536 B15R0.164 CCCCCOCCOCCCSC(=O)C 7a_100011215259_100000038929 [1,0,0,0,0,0|3,0,0]=4 2537 B15R0.164 CCCCNCCCCOCCCC(=O)C 34a_200011216965_100000685027 [1,0,0,0,0,0|2,0,0]=3 2538 B15R0.164 CCCCNCCCCOCCCC(=O)N 34a_200011216965_100102525003 [1,0,0,0,0,0|3,0,0]=4 2539 B15R0.164 CCCCNCCCCOCCOC(=O)C 34a_200011216965_100009814007 [1,0,0,0,0,0|3,0,0]=4 2540 B15R0.164 CCCCOCCCCOCCCC(=O)C 34a_200000760531_100000685027 [1,0,0,0,0,0|2,0,0]=3 2541 B15R0.164 CCCCOCCCCOCCCC(=O)C 7a_200000760531_100011215641 [1,0,0,0,0,0|2,0,0]=3 2542 B15R0.164 CCCCOCCCCOCCCC(=O)N 34a_200000760531_100102525003 [1,0,0,0,0,0|3,0,0]=4 2543 B15R0.164 CCCCOCCCCOCCCC(=O)N 7a_200000760531_100102525003 [1,0,0,0,0,0|3,0,0]=4 2544 B15R0.164 CCCCOCCCCOCCNC(=O)C 7a_200000760531_100000189650 [1,0,0,0,0,0|3,0,0]=4 2545 B15R0.164 CCCCOCCCCOCCOC(=O)C 34a_200000760531_100009814007 [1,0,0,0,0,0|3,0,0]=4 2546 B15R0.164 CCCCOCCCCOCCOC(=O)C 7a_200000760531_100009814007 [1,0,0,0,0,0|3,0,0]=4 2547 B15R0.164 CCCCOCCCNCCCCC(=O)C 34a_200000211371_100009817362 [1,0,0,0,0,0|2,0,0]=3 2548 B15R0.164 CCCCOCCCNCCCOC(=O)C 34a_200000211371_100000042594 [1,0,0,0,0,0|3,0,0]=4 2549 B15R0.164 CCCCOCCCNCCCSC(=O)C 2230a_200000211371_100000038929 [1,0,0,0,0,0|3,0,0]=4 2550 B15R0.164 CCCCOCCCNCCCSC(=O)C 34a_200000211371_100000038929 [1,0,0,0,0,0|3,0,0]=4 2551 B15R0.164 CCCCOCCCOCCCCC(=O)C 34a_200011215613_100009817362 [1,0,0,0,0,0|2,0,0]=3 2552 B15R0.164 CCCCOCCCOCCCCC(=O)C 7a_200011215613_100000735457 [1,0,0,0,0,0|2,0,0]=3 2553 B15R0.164 CCCCOCCCOCCCOC(=O)C 34a_200011215613_100000042594 [1,0,0,0,0,0|3,0,0]=4 2554 B15R0.164 CCCCOCCCOCCCOC(=O)C 7a_200011215613_100000042594 [1,0,0,0,0,0|3,0,0]=4 2555 B15R0.164 CCCCOCCCOCCCSC(=O)C 34a_200011215613_100000038929 [1,0,0,0,0,0|3,0,0]=4 2556 B15R0.164 CCCCOCCCOCCCSC(=O)C 7a_200011215613_100000038929 [1,0,0,0,0,0|3,0,0]=4 2557 B15R0.164 CCCCOCCNCCCCNC(=O)C 2230a_200011368371_100000743108 [1,0,0,0,0,0|3,0,0]=4 2558 B15R0.164 CCCCOCCNCCCCNC(=O)C 34a_200011368371_100000743108 [1,0,0,0,0,0|3,0,0]=4 2559 B15R0.164 CCCCOCCOCCCCCC(=O)N 34a_100000123541_100000743108 [1,0,0,0,0,0|3,0,0]=4 2560 B15R0.164 CCCCOCCOCCCCCC(=O)N 34a_100000210238_100009817443 [1,0,0,0,0,0|3,0,0]=4 2561 B15R0.164 CCCCOCCOCCCCCC(=O)N 7a_100000123541_100000743108 [1,0,0,0,0,0|3,0,0]=4 2562 B15R0.164 CCCCOCCOCCCCCC(=O)N 7a_100000210238_100009817443 [1,0,0,0,0,0|3,0,0]=4 2563 B15R0.164 CCCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100000743108 [1,0,0,0,0,0|2,0,1]=4 2564 B15R0.164 CCCCOCCOCCCCOC(=O)C 34a_100000073216_100000743108 [1,0,0,0,0,0|3,0,0]=4 2565 B15R0.164 CCCCOCCOCCCCOC(=O)C 34a_100000210238_100000033659 [1,0,0,0,0,0|3,0,0]=4 2566 B15R0.164 CCCCOCCOCCCCOC(=O)C 7a_100000073216_100000743108 [1,0,0,0,0,0|3,0,0]=4 2567 B15R0.164 CCCCOCCOCCCCOC(=O)C 7a_100000210238_100000033659 [1,0,0,0,0,0|3,0,0]=4 2568 B15R0.164 CCCCOCCOCCCCSC(=O)C 34a_100000210238_200010402107 [1,0,0,0,0,0|3,0,0]=4 2569 B15R0.164 CCCCOCCOCCCCSC(=O)C 7a_100000210238_200010402107 [1,0,0,0,0,0|3,0,0]=4 2570 B15R0.164 CCCCOCCOCCOCCC(=O)C 7a_100011215186_100000053229 [1,0,0,0,0,0|3,0,0]=4 2571 B15R0.164 CCCCOCCSCCCCCC(=O)N 62a_100000743108_100009817443 [1,0,0,0,0,0|3,0,0]=4 2572 B15R0.164 CCCCOCCSCCCCCC(=O)N 62a_100009817443_100000743108 [1,0,0,0,0,0|3,0,0]=4 2573 B15R0.164 CCCCOCCSCCCCOC(=O)C 62a_100000033659_100000743108 [1,0,0,0,0,0|3,0,0]=4 2574 B15R0.164 CCCCOCCSCCCCOC(=O)C 62a_100000743108_100000033659 [1,0,0,0,0,0|3,0,0]=4 2575 B15R0.164 CCCCOCCSCCCCSC(=O)C 62a_100000743108_200010402107 [1,0,0,0,0,0|3,0,0]=4 2576 B15R0.164 CCCCOCCSCCCCSC(=O)C 62a_200010402107_100000743108 [1,0,0,0,0,0|3,0,0]=4 2577 B15R0.164 CCCCOCNCCCCCNC(=O)C 2230a_200012022750_100011995733 [1,0,0,0,0,0|3,0,0]=4 2578 B15R0.164 CCCCOCNCCCCCNC(=O)C 34a_200012022750_100011995733 [1,0,0,0,0,0|3,0,0]=4 2579 B15R0.164 CCCCOCSCCCCCOC(=O)C 62a_100000033007_100011995733 [1,0,0,0,0,0|3,0,0]=4 2580 B15R0.164 CCCCOCSCCCCCOC(=O)C 62a_100011995733_100000033007 [1,0,0,0,0,0|3,0,0]=4 2581 B15R0.164 CCCCSCCNCCCCCC(=O)N 2230a_100025743550_100009817443 [1,0,0,0,0,0|3,0,0]=4 2582 B15R0.164 CCCCSCCNCCCCSC(=O)C 2230a_100025743550_200010402107 [1,0,0,0,0,0|3,0,0]=4 2583 B15R0.164 CCCCSCCOCCCCCC(=O)N 34a_200000230436_100009817443 [1,0,0,0,0,0|3,0,0]=4 2584 B15R0.164 CCCCSCCOCCCCCC(=O)N 7a_200000230436_100009817443 [1,0,0,0,0,0|3,0,0]=4 2585 B15R0.164 CCCCSCCOCCCCOC(=O)C 34a_200000230436_100000033659 [1,0,0,0,0,0|3,0,0]=4 2586 B15R0.164 CCCCSCCOCCCCOC(=O)C 7a_200000230436_100000033659 [1,0,0,0,0,0|3,0,0]=4 2587 B15R0.164 CCCCSCCOCCCCSC(=O)C 34a_200000230436_200010402107 [1,0,0,0,0,0|3,0,0]=4 2588 B15R0.164 CCCCSCCOCCCCSC(=O)C 7a_200000230436_200010402107 [1,0,0,0,0,0|3,0,0]=4 2589 B15R0.164 CCCOCCCNCCCCCC(=O)N 2230a_100011217757_100009817443 [1,0,0,0,0,0|3,0,0]=4 2590 B15R0.164 CCCOCCCNCCCCCC(=O)N 34a_100011217757_100009817443 [1,0,0,0,0,0|3,0,0]=4 2591 B15R0.164 CCCOCCCNCCCCOC(=O)C 34a_100011217757_100000033659 [1,0,0,0,0,0|3,0,0]=4 2592 B15R0.164 CCCOCCCNCCCCSC(=O)C 2230a_100011217757_200010402107 [1,0,0,0,0,0|3,0,0]=4 2593 B15R0.164 CCCOCCCNCCCCSC(=O)C 34a_100011217757_200010402107 [1,0,0,0,0,0|3,0,0]=4 2594 B15R0.164 CCCOCCNCCCCCNC(=O)C 2230a_200012022750_100011215938 [1,0,0,0,0,0|3,0,0]=4 2595 B15R0.164 CCCOCCNCCCCCNC(=O)C 34a_200012022750_100011215938 [1,0,0,0,0,0|3,0,0]=4 2596 B15R0.164 CCCOCCNCCCCCOC(=O)C 2230a_100161115042_100009813381 [1,0,0,0,0,0|3,0,0]=4 2597 B15R0.164 CCCOCCNCCCCCOC(=O)C 34a_100161115042_100000033007 [1,0,0,0,0,0|3,0,0]=4 2598 B15R0.164 CCCOCCOCCCCCOC(=O)C 34a_100000752267_100000033007 [1,0,0,0,0,0|3,0,0]=4 2599 B15R0.164 CCCOCCOCCCCCOC(=O)C 7a_100000752267_100000033007 [1,0,0,0,0,0|3,0,0]=4 2600 B15R0.164 CCCOCCOCCNCCCC(=O)C 34a_200011904461_100000685027 [1,0,0,0,0,0|3,0,0]=4 2601 B15R0.164 CCCOCCSCCCCCOC(=O)C 62a_100000033007_100011215938 [1,0,0,0,0,0|3,0,0]=4 2602 B15R0.164 CCCOCCSCCCCCOC(=O)C 62a_100011215938_100000033007 [1,0,0,0,0,0|3,0,0]=4 2603 B15R0.164 CCCSCCNCCCCCOC(=O)C 2230a_100020603323_100009813381 [1,0,0,0,0,0|3,0,0]=4 2604 B15R0.164 CCCSCCOCCCCCOC(=O)C 34a_200000230433_100000033007 [1,0,0,0,0,0|3,0,0]=4 2605 B15R0.164 CCCSCCOCCCCCOC(=O)C 7a_200000230433_100000033007 [1,0,0,0,0,0|3,0,0]=4 2606 B15R0.164 CCNCCCCCCCCCCC(=O)N 2230a_100015525214_200010167045 [1,0,0,0,0,0|2,0,0]=3 2607 B15R0.164 CCOCCCCCCCCCCC(=O)N 34a_100121572206_200010167045 [1,0,0,0,0,0|2,0,0]=3 2608 B15R0.164 CCOCCCNCCCCCNC(=O)C 2230a_200012022750_100012232248 [1,0,0,0,0,0|3,0,0]=4 2609 B15R0.164 CCOCCCNCCCCCNC(=O)C 34a_200012022750_100012232248 [1,0,0,0,0,0|3,0,0]=4 2610 B15R0.164 CCOCCCNCCCCCOC(=O)C 2230a_100000210961_100009813381 [1,0,0,0,0,0|3,0,0]=4 2611 B15R0.164 CCOCCCNCCCCCOC(=O)C 34a_100000210961_100000033007 [1,0,0,0,0,0|3,0,0]=4 2612 B15R0.164 CCOCCCOCCCCCOC(=O)C 34a_100000757476_100000033007 [1,0,0,0,0,0|3,0,0]=4 2613 B15R0.164 CCOCCCOCCCCCOC(=O)C 7a_100000757476_100000033007 [1,0,0,0,0,0|3,0,0]=4 2614 B15R0.164 CCOCCCSCCCCCOC(=O)C 62a_100000033007_100012232248 [1,0,0,0,0,0|3,0,0]=4 2615 B15R0.164 CCOCCCSCCCCCOC(=O)C 62a_100012232248_100000033007 [1,0,0,0,0,0|3,0,0]=4 2616 B15R0.164 CCOCCNCCCCCCNC(=O)C 2230a_200011996284_100011215890 [1,0,0,0,0,0|3,0,0]=4 2617 B15R0.164 CCOCCNCCCCCCNC(=O)C 34a_200011996284_100000210147 [1,0,0,0,0,0|3,0,0]=4 2618 B15R0.164 CCOCCOCCNCCCCC(=O)C 34a_100102712874_100009817362 [1,0,0,0,0,0|3,0,0]=4 2619 B15R0.164 CCOCCOCCOCCCCC(=O)C 34a_100000210240_100009817362 [1,0,0,0,0,0|3,0,0]=4 2620 B15R0.164 CCOCCOCCOCCCCC(=O)C 7a_100000210240_100000735457 [1,0,0,0,0,0|3,0,0]=4 2621 B15R0.164 CCOCCOCCSCCCCC(=O)C 62a_100000735457_100011211534 [1,0,0,0,0,0|3,0,0]=4 2622 B15R0.164 CCOCCOCCSCCCCC(=O)C 62a_100011211534_100000735457 [1,0,0,0,0,0|3,0,0]=4 2623 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_100000210202_200010167045 [1,0,0,0,0,0|2,0,0]=3 2624 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210202 [1,0,0,0,0,0|2,0,0]=3 2625 B15R0.164 CCSCCCOCCCCCOC(=O)C 34a_100011216438_100000033007 [1,0,0,0,0,0|3,0,0]=4 2626 B15R0.164 CCSCCCOCCCCCOC(=O)C 7a_100011216438_100000033007 [1,0,0,0,0,0|3,0,0]=4 2627 B15R0.164 CCSCCNCCCCCCNC(=O)C 2230a_200011996284_100000757381 [1,0,0,0,0,0|3,0,0]=4 2628 B15R0.164 CCSCCNCCCCCCNC(=O)C 34a_200011996284_100000757381 [1,0,0,0,0,0|3,0,0]=4 2629 B15R0.164 CN(C)CCCCCCCCCCCCO 2230a_100102631434_100009813331 [1,0,0,0,0,0|3,0,0]=4 2630 B15R0.164 CN(C)CCCCCCCCCCCCO 269982a_100102631434_100009813331 [1,0,0,0,0,0|3,0,0]=4 2631 B15R0.164 CNCCCCCOCCCCCC(=O)N 34a_100000722520_100009817443 [1,0,0,0,0,0|3,0,0]=4 2632 B15R0.164 CNCCCCCOCCCCOC(=O)C 34a_100000722520_100000033659 [1,0,0,0,0,0|3,0,0]=4 2633 B15R0.164 CNCCCCCOCCCCSC(=O)C 34a_100000722520_200010402107 [1,0,0,0,0,0|3,0,0]=4 2634 B15R0.164 COCCCCCCNCCCCC(=O)N 34a_100000696515_100011998445 [1,0,0,0,0,0|3,0,0]=4 2635 B15R0.164 COCCCCCCNCCCNC(=O)C 34a_100000736810_100011998445 [1,0,0,0,0,0|3,0,0]=4 2636 B15R0.164 COCCCCCCNCCOCC(=O)O 269956a_100000700818_100011998445 [1,0,0,0,0,0|3,0,0]=4 2637 B15R0.164 COCCCCCCOCCCCC(=O)C 34a_200012092642_100009817362 [1,0,0,0,0,0|2,0,0]=3 2638 B15R0.164 COCCCCCCOCCCCC(=O)C 7a_200012092642_100000735457 [1,0,0,0,0,0|2,0,0]=3 2639 B15R0.164 COCCCCCCOCCCCC(=O)N 34a_100012022536_100011998445 [1,0,0,0,0,0|3,0,0]=4 2640 B15R0.164 COCCCCCCOCCCCC(=O)N 7a_100012022536_100011998445 [1,0,0,0,0,0|3,0,0]=4 2641 B15R0.164 COCCCCCCOCCCNC(=O)C 34a_100000752032_100011998445 [1,0,0,0,0,0|3,0,0]=4 2642 B15R0.164 COCCCCCCOCCCOC(=O)C 34a_200012092642_100000042594 [1,0,0,0,0,0|3,0,0]=4 2643 B15R0.164 COCCCCCCOCCCOC(=O)C 7a_200012092642_100000042594 [1,0,0,0,0,0|3,0,0]=4 2644 B15R0.164 COCCCCCCOCCCSC(=O)C 34a_200012092642_100000038929 [1,0,0,0,0,0|3,0,0]=4 2645 B15R0.164 COCCCCCCOCCCSC(=O)C 7a_200012092642_100000038929 [1,0,0,0,0,0|3,0,0]=4 2646 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100000735457_100011998445 [1,0,0,0,0,0|2,0,0]=3 2647 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100011998445_100000735457 [1,0,0,0,0,0|2,0,0]=3 2648 B15R0.164 COCCCCCCSCCCOC(=O)C 62a_100000042594_100011998445 [1,0,0,0,0,0|3,0,0]=4 2649 B15R0.164 COCCCCCCSCCCOC(=O)C 62a_100011998445_100000042594 [1,0,0,0,0,0|3,0,0]=4 2650 B15R0.164 COCCCCCCSCCCSC(=O)C 62a_100000038929_100011998445 [1,0,0,0,0,0|3,0,0]=4 2651 B15R0.164 COCCCCCCSCCCSC(=O)C 62a_100011998445_100000038929 [1,0,0,0,0,0|3,0,0]=4 2652 B15R0.164 COCCCCCNCCCCCC(=O)N 2230a_100000747528_100009817443 [1,0,0,0,0,0|3,0,0]=4 2653 B15R0.164 COCCCCCNCCCCCC(=O)N 34a_100000747528_100009817443 [1,0,0,0,0,0|3,0,0]=4 2654 B15R0.164 COCCCCCNCCCCOC(=O)C 34a_100000747528_100000033659 [1,0,0,0,0,0|3,0,0]=4 2655 B15R0.164 COCCCCCNCCCCSC(=O)C 2230a_100000747528_200010402107 [1,0,0,0,0,0|3,0,0]=4 2656 B15R0.164 COCCCCCNCCCCSC(=O)C 34a_100000747528_200010402107 [1,0,0,0,0,0|3,0,0]=4 2657 B15R0.164 COCCCCNCCCCCNC(=O)C 2230a_200012022750_100000730899 [1,0,0,0,0,0|3,0,0]=4 2658 B15R0.164 COCCCCNCCCCCNC(=O)C 34a_200012022750_100000755781 [1,0,0,0,0,0|3,0,0]=4 2659 B15R0.164 COCCCCOCCCCCOC(=O)C 34a_100000740925_100000033007 [1,0,0,0,0,0|3,0,0]=4 2660 B15R0.164 COCCCCSCCCCCOC(=O)C 62a_100000033007_100000730899 [1,0,0,0,0,0|3,0,0]=4 2661 B15R0.164 COCCCCSCCCCCOC(=O)C 62a_100000730899_100000033007 [1,0,0,0,0,0|3,0,0]=4 2662 B15R0.164 COCCCNCCCCCCNC(=O)C 2230a_200011996284_100000740836 [1,0,0,0,0,0|3,0,0]=4 2663 B15R0.164 COCCCNCCCCCCNC(=O)C 34a_200011996284_100000740836 [1,0,0,0,0,0|3,0,0]=4 2664 B15R0.164 COCCCOCCCOCCCC(=O)C 34a_200011215475_100000685027 [1,0,0,0,0,0|3,0,0]=4 2665 B15R0.164 COCCCOCCCOCCCC(=O)C 7a_200011215475_100011215641 [1,0,0,0,0,0|3,0,0]=4 2666 B15R0.164 COCCOCCCNCCCCC(=O)C 34a_100000206027_100009817362 [1,0,0,0,0,0|3,0,0]=4 2667 B15R0.164 COCCOCCCSCCCCC(=O)C 62a_100000735457_100011216529 [1,0,0,0,0,0|3,0,0]=4 2668 B15R0.164 COCCOCCCSCCCCC(=O)C 62a_100011216529_100000735457 [1,0,0,0,0,0|3,0,0]=4 2669 B15R0.164 CS(=O)CCCNCCCCCCCCO 2230a_200000753449_100000033203 [1,0,0,0,0,0|3,0,0]=4 2670 B15R0.164 CSCCCCOCCCCCOC(=O)C 34a_100011217163_100000033007 [1,0,0,0,0,0|3,0,0]=4 2671 B15R0.164 CSCCCCOCCCCCOC(=O)C 7a_100011217163_100000033007 [1,0,0,0,0,0|3,0,0]=4 2672 B15R0.164 NC(=O)CCCCCCCCCCSCF 62a_100015361967_200010167045 [1,0,0,0,0,0|3,0,0]=4 2673 B15R0.164 NC(=O)CCCCCCCCCCSCF 62a_200010167045_100015361967 [1,0,0,0,0,0|3,0,0]=4 2674 B15R0.164 NC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009817443 [1,0,0,0,0,0|3,0,0]=4 2675 B15R0.164 NC(=O)CCCCCNCCCCCCO 34a_100000686447_100009817443 [1,0,0,0,0,0|3,0,0]=4 2676 B15R0.164 NC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009817443 [1,0,0,0,0,0|3,0,0]=4 2677 B15R0.164 NC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009817443 [1,0,0,0,0,0|3,0,0]=4 2678 B15R0.164 NC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009817443 [1,0,0,0,0,0|3,0,0]=4 2679 B15R0.164 NC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009817443 [1,0,0,0,0,0|3,0,0]=4 2680 B15R0.164 NC(=O)CCCCCOCCCCCCF 34a_100000123541_100015922095 [1,0,0,0,0,0|3,0,0]=4 2681 B15R0.164 NC(=O)CCCCCOCCCCCCF 34a_100000732779_100009817443 [1,0,0,0,0,0|3,0,0]=4 2682 B15R0.164 NC(=O)CCCCCOCCCCCCF 7a_100000123541_100015922095 [1,0,0,0,0,0|3,0,0]=4 2683 B15R0.164 NC(=O)CCCCCOCCCCCCF 7a_100000732779_100009817443 [1,0,0,0,0,0|3,0,0]=4 2684 B15R0.164 NC(=O)CCCCCOCCCCCCO 34a_100000123541_100000766143 [1,0,0,0,0,0|3,0,0]=4 2685 B15R0.164 NC(=O)CCCCCOCCCCCCO 7a_100000123541_100000766143 [1,0,0,0,0,0|3,0,0]=4 2686 B15R0.164 NC(=O)CCCCCSCCCCCCF 62a_100009817443_100015922095 [1,0,0,0,0,0|3,0,0]=4 2687 B15R0.164 NC(=O)CCCCCSCCCCCCF 62a_100015922095_100009817443 [1,0,0,0,0,0|3,0,0]=4 2688 B15R0.164 NC(=O)CCCCCSCCCCCCO 62a_100000766143_100009817443 [1,0,0,0,0,0|3,0,0]=4 2689 B15R0.164 NC(=O)CCCCCSCCCCCCO 62a_100009817443_100000766143 [1,0,0,0,0,0|3,0,0]=4 2690 B15R0.164 NC(=O)CCCCNCCCCCCCO 34a_100000696515_100000760002 [1,0,0,0,0,0|3,0,0]=4 2691 B15R0.164 NC(=O)CCCCOCCCCCCCO 34a_100012022536_100000760002 [1,0,0,0,0,0|3,0,0]=4 2692 B15R0.164 NC(=O)CCCCOCCCCCCCO 7a_100012022536_100000760002 [1,0,0,0,0,0|3,0,0]=4 2693 B15R0.164 NC(=O)CCCNCCCCCCCCO 34a_100000739312_100000033203 [1,0,0,0,0,0|3,0,0]=4 2694 B15R0.164 NC(=O)CCCNCCCCCCCCO 34a_102515433106_100102525003 [1,0,0,0,0,0|3,0,0]=4 2695 B15R0.164 NC(=O)CCCOCCCCCCCCBr 34a_100009813846_100102525003 [1,0,0,0,0,0|3,0,0]=4 2696 B15R0.164 NC(=O)CCCOCCCCCCCCBr 7a_100009813846_100102525003 [1,0,0,0,0,0|3,0,0]=4 2697 B15R0.164 NC(=O)CCCOCCCCCCCCCl 34a_100000033203_100102525003 [1,0,0,0,0,0|3,0,0]=4 2698 B15R0.164 NC(=O)CCCOCCCCCCCCCl 7a_100000033203_100102525003 [1,0,0,0,0,0|3,0,0]=4 2699 B15R0.164 NC(=O)CCCSCCCCCCCCO 62a_100000033203_100102525003 [1,0,0,0,0,0|3,0,0]=4 2700 B15R0.164 NC(=O)CCCSCCCCCCCCO 62a_100102525003_100000033203 [1,0,0,0,0,0|3,0,0]=4 2701 B15R0.164 NC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000744528 [1,0,0,0,0,0|3,0,0]=4 2702 B15R0.164 NC(=O)CCNCCCCCCCCCO 34a_100000078944_100000731001 [1,0,0,0,0,0|3,0,0]=4 2703 B15R0.164 NC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000731001 [1,0,0,0,0,0|3,0,0]=4 2704 B15R0.164 NC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000744528 [1,0,0,0,0,0|3,0,0]=4 2705 B15R0.164 NC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000731001 [1,0,0,0,0,0|3,0,0]=4 2706 B15R0.164 NC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000744528 [1,0,0,0,0,0|3,0,0]=4 2707 B15R0.164 NC(=O)CCOCCCCCCCCCO 34a_100000757172_100009813782 [1,0,0,0,0,0|3,0,0]=4 2708 B15R0.164 NC(=O)CCOCCCCCCCCCO 7a_100000757172_100009813782 [1,0,0,0,0,0|3,0,0]=4 2709 B15R0.164 NC(=O)CCSCCCCCCCCCO 62a_100000744528_100009813782 [1,0,0,0,0,0|3,0,0]=4 2710 B15R0.164 NC(=O)CCSCCCCCCCCCO 62a_100009813782_100000744528 [1,0,0,0,0,0|3,0,0]=4 2711 B15R0.164 NC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747473 [1,0,0,0,0,0|3,0,0]=4 2712 B15R0.164 NC(=O)CNCCCCCCCCCCO 2230a_100000711301_100009813290 [1,0,0,0,0,0|3,0,0]=4 2713 B15R0.164 NC(=O)CNCCCCCCCCCCO 34a_100000066964_100000187820 [1,0,0,0,0,0|3,0,0]=4 2714 B15R0.164 NC(=O)COCCCCCCCCCCBr 34a_100009813290_100000187820 [1,0,0,0,0,0|3,0,0]=4 2715 B15R0.164 NC(=O)COCCCCCCCCCCBr 7a_100009813290_100000187820 [1,0,0,0,0,0|3,0,0]=4 2716 B15R0.164 NC(=O)COCCCCCCCCCCCl 34a_200000033068_100000187820 [1,0,0,0,0,0|3,0,0]=4 2717 B15R0.164 NC(=O)COCCCCCCCCCCCl 7a_200000033068_100000187820 [1,0,0,0,0,0|3,0,0]=4 2718 B15R0.164 NC(=O)CSCCCCCCCCCCO 62a_100000747473_200000033068 [1,0,0,0,0,0|3,0,0]=4 2719 B15R0.164 NC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747473 [1,0,0,0,0,0|3,0,0]=4 2720 B15R0.164 NCCCCCCCCCCOCC(=O)N 34a_100000066964_100000187820 [1,0,0,0,0,0|3,0,0]=4 2721 B15R0.164 NCCCCCCCCCCOCC(=O)[O-] 34a_100000066964_100020667443 [1,0,0,0,0,0|2,0,1]=4 2722 B15R0.164 NCCCCCCCCCOCCC(=O)N 34a_100000078944_100000731001 [1,0,0,0,0,0|3,0,0]=4 2723 B15R0.164 NCCCCCCCCOCCCC(=O)N 34a_102515433106_100102525003 [1,0,0,0,0,0|3,0,0]=4 2724 B15R0.164 NCCCCCCOCCCCCC(=O)N 34a_100000686447_100009817443 [1,0,0,0,0,0|3,0,0]=4 2725 B15R0.164 O=C(O)CNCCCCCCCCCCO 269956a_100016091260_100009813290 [1,0,0,0,0,0|2,0,0]=3 2726 B15R0.164 O=C(O)COCCNCCCCCCCO 269956a_100000700818_100000760002 [1,0,0,0,0,0|3,0,0]=4 2727 B15R0.164 O=C(O)CONCCCCCCCCCO 269956a_100000106656_100009813782 [1,0,0,0,0,0|3,0,0]=4 2728 B15R0.164 O=C([O-])CCCCCOCCCCCCF 7a_100102619762_100015922095 [1,0,0,0,0,0|2,0,1]=4 2729 B15R0.164 O=C([O-])CCCCCOCCCCCCO 7a_100102619762_100000766143 [1,0,0,0,0,0|2,0,1]=4 2730 B15R0.164 O=C([O-])CNCCCCCCCCCCO 34a_100000066964_100020667443 [1,0,0,0,0,0|2,0,1]=4 2731 B15R0.164 O=C([O-])COCCCCCCCCCCBr 34a_100009813290_100020667443 [1,0,0,0,0,0|2,0,1]=4 2732 B15R0.164 O=C([O-])COCCCCCCCCCCCl 34a_200000033068_100020667443 [1,0,0,0,0,0|2,0,1]=4 2733 B15R0.164 O=C([O-])CSCCCCCCCCCCO 62a_100009813290_100020667443 [1,0,0,0,0,0|2,0,1]=4 2734 B15R0.164 O=C([O-])CSCCCCCCCCCCO 62a_100020667443_200000033068 [1,0,0,0,0,0|2,0,1]=4 2735 B17R0.77 C#CCCCCCC(=O)CCCCCC(=O)OC 1458a_100000694772_100009816466 [0,1,0,0,0,0|0,0,3]=4 2736 B17R0.77 C#CCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100012094781 [0,1,0,0,0,0|0,0,3]=4 2737 B17R0.77 C=CCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000700193 [0,1,0,0,0,0|0,0,3]=4 2738 B17R0.77 C=CCCCCCC(=O)CCCCCC(=O)OC 1458a_100011934241_100009816466 [0,1,0,0,0,0|0,0,3]=4 2739 B17R0.77 CCCC/C=C/CC(=O)CCCCCC(=O)OC 1458a_200016282684_100009816466 [0,1,0,0,0,0|0,0,3]=4 2740 B17R0.77 CCCCCC#CC(=O)CCCCCC(=O)OC 1458a_100011215388_100009816466 [0,1,0,0,0,0|0,0,3]=4 2741 B17R0.77 CCCCCC=CC(=O)CCCCCC(=O)OC 1458a_100016263427_100009816466 [0,1,0,0,0,0|0,0,3]=4 2742 B17R0.77 CCCCCCCC(=O)CCCCCC(=O)OC 1458a_100000211969_100009816466 [0,1,0,0,0,0|0,0,1]=2 2743 B17R0.77 CCCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210614 [0,1,0,0,0,0|0,0,1]=2 2744 B17R0.77 CCCCCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000211969 [0,1,0,0,0,0|1,0,1]=3 2745 B17R0.77 CCCCCCCC(=O)OCSCCC(=O)OC 62a_100000204255_100009852258 [0,1,0,0,0,0|2,0,1]=4 2746 B17R0.77 CCCCCCCC(C)OCCCCC(=O)OC 34a_100000059025_200011218727 [0,1,0,0,0,0|1,0,0]=2 2747 B17R0.77 CCCCCCCC(C)OCCCCC(=O)OC 34a_200011215852_100000204269 [0,1,0,0,0,0|1,0,0]=2 2748 B17R0.77 CCCCCCCC(C)OCCCCC(=O)OC 7a_100000059025_200011218727 [0,1,0,0,0,0|1,0,0]=2 2749 B17R0.77 CCCCCCCC(C)OCCCCC(=O)OC 7a_200011215852_100000204269 [0,1,0,0,0,0|1,0,0]=2 2750 B17R0.77 CCCCCCCC(C)OCCOCC(=O)OC 34a_200011215852_100000090808 [0,1,0,0,0,0|2,0,0]=3 2751 B17R0.77 CCCCCCCC(C)OCCOCC(=O)OC 7a_200011215852_100000090808 [0,1,0,0,0,0|2,0,0]=3 2752 B17R0.77 CCCCCCCC(C)SCCCCC(=O)OC 62a_100000204269_200011218727 [0,1,0,0,0,0|1,0,0]=2 2753 B17R0.77 CCCCCCCC(C)SCCCCC(=O)OC 62a_200011218727_100000204269 [0,1,0,0,0,0|1,0,0]=2 2754 B17R0.77 CCCCCCCC(C)SCCOCC(=O)OC 62a_100000090808_200011218727 [0,1,0,0,0,0|2,0,0]=3 2755 B17R0.77 CCCCCCCC(C)SCCOCC(=O)OC 62a_200011218727_100000090808 [0,1,0,0,0,0|2,0,0]=3 2756 B17R0.77 CCCCCCCN(C)CCCCCC(=O)OC 2230a_100000228206_100009816466 [0,1,0,0,0,0|1,0,0]=2 2757 B17R0.77 CCCCCCCN(C)CCCCCC(=O)OC 269982a_100000228206_100009816466 [0,1,0,0,0,0|1,0,0]=2 2758 B17R0.77 CCCCCCNC(=O)CCCCCC(=O)OC 11a_100000210581_100009848860 [0,1,0,0,0,0|1,0,1]=3 2759 B17R0.77 CCCCCCNC(=O)CCCCCC(=O)OC 1626a_100000210581_100009848860 [0,1,0,0,0,0|1,0,1]=3 2760 B17R0.77 CCCCCCNC(=O)CCCCCC(=O)OC 240690a_100000210581_100009848860 [0,1,0,0,0,0|1,0,1]=3 2761 B17R0.77 CCCCCCNC(=O)CSCCCC(=O)OC 62a_100000230325_100011218270 [0,1,0,0,0,0|2,0,1]=4 2762 B17R0.77 CCCCCNNC(=O)CCCCCC(=O)OC 22a_100000694160_100009848860 [0,1,0,0,0,0|2,0,1]=4 2763 B17R0.77 CCCCOCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000743108 [0,1,0,0,0,0|1,0,1]=3 2764 B17R0.77 CCCOCCNC(=O)CCCCCC(=O)OC 1626a_100161115042_100009848860 [0,1,0,0,0,0|2,0,1]=4 2765 B17R0.77 CCCOCCNC(=O)CCCCCC(=O)OC 240690a_100161115042_100009848860 [0,1,0,0,0,0|2,0,1]=4 2766 B17R0.77 CCCSCCNC(=O)CCCCCC(=O)OC 11a_100020603323_100009848860 [0,1,0,0,0,0|2,0,1]=4 2767 B17R0.77 CCCSCCNC(=O)CCCCCC(=O)OC 240690a_100020603323_100009848860 [0,1,0,0,0,0|2,0,1]=4 2768 B17R0.77 CCOCCCNC(=O)CCCCCC(=O)OC 11a_100000210961_100009848860 [0,1,0,0,0,0|2,0,1]=4 2769 B17R0.77 CCOCCCNC(=O)CCCCCC(=O)OC 1626a_100000210961_100009848860 [0,1,0,0,0,0|2,0,1]=4 2770 B17R0.77 CCOCCCNC(=O)CCCCCC(=O)OC 240690a_100000210961_100009848860 [0,1,0,0,0,0|2,0,1]=4 2771 B17R0.77 COC(=O)CCCCCC(=O)CCCCCC#N 1458a_100009848860_100009813376 [0,1,0,0,0,0|1,0,2]=4 2772 B17R0.77 COC(=O)CCCCCC(=O)CCCCCCF 1458a_100009848860_100015922095 [0,1,0,0,0,0|1,0,1]=3 2773 B17R0.77 COC(=O)CCCCCC(=O)CCCCCCO 1458a_100009848860_100000766143 [0,1,0,0,0,0|1,0,1]=3 2774 B17R0.77 COC(=O)CCCCCC(=O)CCCCCCO 1458a_100011996774_100009816466 [0,1,0,0,0,0|1,0,1]=3 2775 B17R0.77 COC(=O)CCCCCC(=O)NCCCCCO 240690a_100000762737_100009848860 [0,1,0,0,0,0|2,0,1]=4 2776 B17R0.77 COC(=O)CCCCNC(=O)CCCCCCO 188690a_100000746077_100011996774 [0,1,0,0,0,0|2,0,1]=4 2777 B17R0.77 COCCCCCC(=O)CCCCCC(=O)OC 1458a_100011935119_100009816466 [0,1,0,0,0,0|1,0,1]=3 2778 B17R0.77 COCCCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100011935119 [0,1,0,0,0,0|2,0,1]=4 2779 B17R0.77 COCCOCCC(=O)CCCCCC(=O)OC 1458a_100000745395_100009816466 [0,1,0,0,0,0|2,0,1]=4 2780 B17R0.77 COCCOCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000695917 [0,1,0,0,0,0|2,0,1]=4 2781 B17R0.97 C#CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000034748_100000204269 [0,1,0,0,0,0|0,0,3]=4 2782 B17R0.97 C#CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100012276617 [0,1,0,0,0,0|0,0,3]=4 2783 B17R0.97 C=CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011215473 [0,1,0,0,0,0|0,0,3]=4 2784 B17R0.97 C=CCCCCCCC(=O)CCCCC(=O)OC 1458a_100011809334_100000204269 [0,1,0,0,0,0|0,0,3]=4 2785 B17R0.97 CCCCC/C=C/CC(=O)CCCCC(=O)OC 1458a_100020675968_100000204269 [0,1,0,0,0,0|0,0,3]=4 2786 B17R0.97 CCCCCC#CCC(=O)CCCCC(=O)OC 1458a_100000695723_100009816472 [0,1,0,0,0,0|0,0,3]=4 2787 B17R0.97 CCCCCCC=CC(=O)CCCCC(=O)OC 1458a_200015324643_100000204269 [0,1,0,0,0,0|0,0,3]=4 2788 B17R0.97 CCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000210188_100000204269 [0,1,0,0,0,0|0,0,1]=2 2789 B17R0.97 CCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210759 [0,1,0,0,0,0|0,0,1]=2 2790 B17R0.97 CCCCCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210759 [0,1,0,0,0,0|1,0,1]=3 2791 B17R0.97 CCCCCCCCC(=O)CCOCC(=O)OC 1458a_100000210188_100000090808 [0,1,0,0,0,0|1,0,1]=3 2792 B17R0.97 CCCCCCCCC(=O)NCCCC(=O)NC 11a_100000740002_100000210188 [0,1,0,0,0,0|2,0,1]=4 2793 B17R0.97 CCCCCCCCC(=O)NCCCC(=O)NC 240690a_100000740002_100000210188 [0,1,0,0,0,0|2,0,1]=4 2794 B17R0.97 CCCCCCCCC(=O)NCCCC(=O)NC 527a_100000740002_100000210188 [0,1,0,0,0,0|2,0,1]=4 2795 B17R0.97 CCCCCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100000210188 [0,1,0,0,0,0|1,0,1]=3 2796 B17R0.97 CCCCCCCCC(C)CNCCC(=O)NC 270004a_100000738227_100011995885 [0,1,0,0,0,0|2,0,0]=3 2797 B17R0.97 CCCCCCCCC(C)COCCC(=O)NC 34a_200012125181_100012179268 [0,1,0,0,0,0|2,0,0]=3 2798 B17R0.97 CCCCCCCCC(C)COCCC(=O)NC 7a_200012125181_100000737683 [0,1,0,0,0,0|2,0,0]=3 2799 B17R0.97 CCCCCCCCC(C)COCCC(=O)OC 34a_200012125181_100000742370 [0,1,0,0,0,0|1,0,0]=2 2800 B17R0.97 CCCCCCCCC(C)COCCC(=O)OC 7a_200012125181_100000204255 [0,1,0,0,0,0|1,0,0]=2 2801 B17R0.97 CCCCCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100011216694 [0,1,0,0,0,0|2,0,0]=3 2802 B17R0.97 CCCCCCCCC(C)NCCNC(=O)CC 270004a_100132302217_100011216694 [0,1,0,0,0,0|3,0,0]=4 2803 B17R0.97 CCCCCCCCC(C)OC/C=C/C(=O)OC 34a_100000210740_100000742655 [0,1,0,0,0,0|1,0,2]=4 2804 B17R0.97 CCCCCCCCC(C)OC/C=C/C(=O)OC 7a_100000210740_100000742655 [0,1,0,0,0,0|1,0,2]=4 2805 B17R0.97 CCCCCCCCC(C)OCCCC(=O)NC 34a_100000210740_100000741757 [0,1,0,0,0,0|2,0,0]=3 2806 B17R0.97 CCCCCCCCC(C)OCCCC(=O)NC 7a_100000210740_100000741757 [0,1,0,0,0,0|2,0,0]=3 2807 B17R0.97 CCCCCCCCC(C)OCCCC(=O)OC 34a_100000210740_100000742333 [0,1,0,0,0,0|1,0,0]=2 2808 B17R0.97 CCCCCCCCC(C)OCCCC(=O)OC 7a_100000210740_100011218270 [0,1,0,0,0,0|1,0,0]=2 2809 B17R0.97 CCCCCCCCC(C)OCCOC(=O)NC 34a_100000210740_200011997002 [0,1,0,0,0,0|3,0,0]=4 2810 B17R0.97 CCCCCCCCC(C)OCCOC(=O)NC 7a_100000210740_200011997002 [0,1,0,0,0,0|3,0,0]=4 2811 B17R0.97 CCCCCCCCN(C)CCCCC(=O)OC 2230a_100000207567_100000204269 [0,1,0,0,0,0|1,0,0]=2 2812 B17R0.97 CCCCCCCCN(C)CCCCC(=O)OC 269982a_100000207567_100000204269 [0,1,0,0,0,0|1,0,0]=2 2813 B17R0.97 CCCCCCCCN(C)CCOCC(=O)OC 2230a_100000207567_100000090808 [0,1,0,0,0,0|2,0,0]=3 2814 B17R0.97 CCCCCCCNC(=O)CCCCC(=O)OC 11a_100000229938_100000695723 [0,1,0,0,0,0|1,0,1]=3 2815 B17R0.97 CCCCCCCNC(=O)CCCCC(=O)OC 1626a_100000229938_100000695723 [0,1,0,0,0,0|1,0,1]=3 2816 B17R0.97 CCCCCCCNC(=O)CCCCC(=O)OC 240690a_100000229938_100000695723 [0,1,0,0,0,0|1,0,1]=3 2817 B17R0.97 CCCCCCCNC(=O)CCCCC(=O)OC 527a_100000229938_100000695723 [0,1,0,0,0,0|1,0,1]=3 2818 B17R0.97 CCCCCCCNC(=O)CCCNC(=O)OC 11a_100000229938_100000753017 [0,1,0,0,0,0|2,0,1]=4 2819 B17R0.97 CCCCCCCNC(=O)CCCNC(=O)OC 1626a_100000229938_100000753017 [0,1,0,0,0,0|2,0,1]=4 2820 B17R0.97 CCCCCCCNC(=O)CCCNC(=O)OC 240690a_100000229938_100000753017 [0,1,0,0,0,0|2,0,1]=4 2821 B17R0.97 CCCCCCCNC(=O)CCCNC(=O)OC 527a_100000229938_100000753017 [0,1,0,0,0,0|2,0,1]=4 2822 B17R0.97 CCCCCCNCC(=O)NCCCC(=O)OC 2230a_100000210581_100000230218 [0,1,0,0,0,0|2,0,1]=4 2823 B17R0.97 CCCCCCOCC(=O)NCCCC(=O)OC 34a_100000210259_100000230218 [0,1,0,0,0,0|2,0,1]=4 2824 B17R0.97 CCCCCCOCC(=O)NCCCC(=O)OC 7a_100000210259_100000230218 [0,1,0,0,0,0|2,0,1]=4 2825 B17R0.97 CCCCCCSCC(=O)NCCCC(=O)OC 62a_100000210314_100000230218 [0,1,0,0,0,0|2,0,1]=4 2826 B17R0.97 CCCCCCSCC(=O)NCCCC(=O)OC 62a_100000230218_100000210757 [0,1,0,0,0,0|2,0,1]=4 2827 B17R0.97 CCCCSCCNC(=O)CCCCC(=O)OC 11a_100025743550_100000695723 [0,1,0,0,0,0|2,0,1]=4 2828 B17R0.97 CCCCSCCNC(=O)CCCCC(=O)OC 1626a_100025743550_100000695723 [0,1,0,0,0,0|2,0,1]=4 2829 B17R0.97 CCCCSCCNC(=O)CCCCC(=O)OC 240690a_100025743550_100000695723 [0,1,0,0,0,0|2,0,1]=4 2830 B17R0.97 CCCCSCCNC(=O)CCCCC(=O)OC 527a_100025743550_100000695723 [0,1,0,0,0,0|2,0,1]=4 2831 B17R0.97 CCCOCCCNC(=O)CCCCC(=O)OC 1626a_100011217757_100000695723 [0,1,0,0,0,0|2,0,1]=4 2832 B17R0.97 CCCOCCCNC(=O)CCCCC(=O)OC 240690a_100011217757_100000695723 [0,1,0,0,0,0|2,0,1]=4 2833 B17R0.97 CCCOCCCNC(=O)CCCCC(=O)OC 527a_100011217757_100000695723 [0,1,0,0,0,0|2,0,1]=4 2834 B17R0.97 CCOCCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011211534 [0,1,0,0,0,0|2,0,1]=4 2835 B17R0.97 COC(=O)CCCCC(=O)CCCCCCC#N 1458a_100000695723_100009813337 [0,1,0,0,0,0|1,0,2]=4 2836 B17R0.97 COC(=O)CCCCC(=O)CCCCCCCO 1458a_100000695723_100000760002 [0,1,0,0,0,0|1,0,1]=3 2837 B17R0.97 COC(=O)CCCCC(=O)CCCCCCCO 1458a_100011219782_100000204269 [0,1,0,0,0,0|1,0,1]=3 2838 B17R0.97 COC(=O)CCCCC(=O)NCCCCCCO 240690a_100000686447_100000695723 [0,1,0,0,0,0|2,0,1]=4 2839 B17R0.97 COC(=O)CCCCC(=O)NCCCCCCO 527a_100000686447_100000695723 [0,1,0,0,0,0|2,0,1]=4 2840 B17R0.97 COC(=O)CCCNC(=O)CCCCCCCO 188690a_100000184769_100011219782 [0,1,0,0,0,0|2,0,1]=4 2841 B17R0.97 COC(=O)COCCC(=O)CCCCCCCO 1458a_100011219782_100000090808 [0,1,0,0,0,0|2,0,1]=4 2842 B17R0.97 COC(=O)NCCCC(=O)CCCCCCCO 1458a_100000753017_100000760002 [0,1,0,0,0,0|2,0,1]=4 2843 B17R0.97 COCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011998445 [0,1,0,0,0,0|1,0,1]=3 2844 B17R0.97 COCCCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100011998445 [0,1,0,0,0,0|2,0,1]=4 2845 B17R0.97 COCCCCCNC(=O)CCCCC(=O)OC 11a_100000747528_100000695723 [0,1,0,0,0,0|2,0,1]=4 2846 B17R0.97 COCCCCCNC(=O)CCCCC(=O)OC 1626a_100000747528_100000695723 [0,1,0,0,0,0|2,0,1]=4 2847 B17R0.97 COCCCCCNC(=O)CCCCC(=O)OC 240690a_100000747528_100000695723 [0,1,0,0,0,0|2,0,1]=4 2848 B17R0.97 COCCCCCNC(=O)CCCCC(=O)OC 527a_100000747528_100000695723 [0,1,0,0,0,0|2,0,1]=4 2849 B17R0.97 COCCOCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011216529 [0,1,0,0,0,0|2,0,1]=4 2850 B17R0.133 C#CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100010269958 [0,1,0,0,0,0|0,0,3]=4 2851 B17R0.133 C#CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000696528_100009815986 [0,1,0,0,0,0|0,0,3]=4 2852 B17R0.133 C=CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011215482 [0,1,0,0,0,0|0,0,3]=4 2853 B17R0.133 C=CCCCCC(=O)CCCCCCC(=O)OC 1458a_100011215552_100009815986 [0,1,0,0,0,0|0,0,3]=4 2854 B17R0.133 C=CCCCCN(C)CCCCCCC(=O)OC 2230a_100012000471_100009815986 [0,1,0,0,0,0|1,0,2]=4 2855 B17R0.133 C=CCCCCN(C)CCCCCCC(=O)OC 269982a_100012000471_100009815986 [0,1,0,0,0,0|1,0,2]=4 2856 B17R0.133 CC/C=C\CCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100015370543 [0,1,0,0,0,0|0,0,3]=4 2857 B17R0.133 CCC/C=C/CC(=O)CCCCCCC(=O)OC 1458a_200016266809_100009815986 [0,1,0,0,0,0|0,0,3]=4 2858 B17R0.133 CCCCC=CC(=O)CCCCCCC(=O)OC 1458a_100016266645_100009815986 [0,1,0,0,0,0|0,0,3]=4 2859 B17R0.133 CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210757 [0,1,0,0,0,0|0,0,1]=2 2860 B17R0.133 CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100102632555_100009815986 [0,1,0,0,0,0|0,0,1]=2 2861 B17R0.133 CCCCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100102632555 [0,1,0,0,0,0|1,0,1]=3 2862 B17R0.133 CCCCCCC(=O)NCCOCCC(=O)OC 188690a_100102954618_100102632555 [0,1,0,0,0,0|2,0,1]=4 2863 B17R0.133 CCCCCCC(C)CCOC/C=C/C(=O)OC 34a_200011024964_100000742655 [0,1,0,0,0,0|1,0,2]=4 2864 B17R0.133 CCCCCCC(C)CCOC/C=C/C(=O)OC 7a_200011024964_100000742655 [0,1,0,0,0,0|1,0,2]=4 2865 B17R0.133 CCCCCCC(C)CCOCCCC(=O)NC 34a_200011024964_100000741757 [0,1,0,0,0,0|2,0,0]=3 2866 B17R0.133 CCCCCCC(C)CCOCCCC(=O)NC 7a_200011024964_100000741757 [0,1,0,0,0,0|2,0,0]=3 2867 B17R0.133 CCCCCCC(C)CCOCCCC(=O)OC 34a_200011024964_100000742333 [0,1,0,0,0,0|1,0,0]=2 2868 B17R0.133 CCCCCCC(C)CCOCCCC(=O)OC 7a_200011024964_100011218270 [0,1,0,0,0,0|1,0,0]=2 2869 B17R0.133 CCCCCCC(C)CCOCCOC(=O)NC 34a_200011024964_200011997002 [0,1,0,0,0,0|3,0,0]=4 2870 B17R0.133 CCCCCCC(C)CCOCCOC(=O)NC 7a_200011024964_200011997002 [0,1,0,0,0,0|3,0,0]=4 2871 B17R0.133 CCCCCCC(C)NCCCCCC(=O)OC 2230a_100000210919_100009816466 [0,1,0,0,0,0|1,0,0]=2 2872 B17R0.133 CCCCCCC(C)NCCCCCC(=O)OC 34a_100000210919_100009816466 [0,1,0,0,0,0|1,0,0]=2 2873 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 34a_100000074720_100011215978 [0,1,0,0,0,0|1,0,0]=2 2874 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 34a_100000210265_100009816466 [0,1,0,0,0,0|1,0,0]=2 2875 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 7a_100000074720_100011215978 [0,1,0,0,0,0|1,0,0]=2 2876 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 7a_100000210265_100009816466 [0,1,0,0,0,0|1,0,0]=2 2877 B17R0.133 CCCCCCC(C)SCCCCCC(=O)OC 62a_100009816466_100011215978 [0,1,0,0,0,0|1,0,0]=2 2878 B17R0.133 CCCCCCC(C)SCCCCCC(=O)OC 62a_100011215978_100009816466 [0,1,0,0,0,0|1,0,0]=2 2879 B17R0.133 CCCCCCN(C)CCCCCCC(=O)OC 2230a_106256046315_100009815986 [0,1,0,0,0,0|1,0,0]=2 2880 B17R0.133 CCCCCCN(C)CCCCCCC(=O)OC 269982a_106256046315_100009815986 [0,1,0,0,0,0|1,0,0]=2 2881 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC 11a_100000209983_100000036694 [0,1,0,0,0,0|1,0,1]=3 2882 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC 1626a_100000209983_100000036694 [0,1,0,0,0,0|1,0,1]=3 2883 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC 240690a_100000209983_100000036694 [0,1,0,0,0,0|1,0,1]=3 2884 B17R0.133 CCCCCNC(=O)COCCCCC(=O)OC 34a_100000059025_100000230301 [0,1,0,0,0,0|2,0,1]=4 2885 B17R0.133 CCCCCNC(=O)COCCCCC(=O)OC 7a_100000059025_100000230301 [0,1,0,0,0,0|2,0,1]=4 2886 B17R0.133 CCCCCNC(=O)CSCCCCC(=O)OC 62a_100000204269_100000230301 [0,1,0,0,0,0|2,0,1]=4 2887 B17R0.133 CCCCCNC(=O)CSCCCCC(=O)OC 62a_100000230301_100000204269 [0,1,0,0,0,0|2,0,1]=4 2888 B17R0.133 CCCCNNC(=O)CCCCCCC(=O)OC 22a_100025702795_100000036694 [0,1,0,0,0,0|2,0,1]=4 2889 B17R0.133 CCCCOCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011995733 [0,1,0,0,0,0|1,0,1]=3 2890 B17R0.133 CCCCOCC(=O)CCCCCCC(=O)OC 1458a_100000757543_100009815986 [0,1,0,0,0,0|1,0,1]=3 2891 B17R0.133 CCCCOCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000757543 [0,1,0,0,0,0|2,0,1]=4 2892 B17R0.133 CCCCOCC(C)OCCCCCC(=O)OC 34a_100011217071_100009816466 [0,1,0,0,0,0|2,0,0]=3 2893 B17R0.133 CCCCOCC(C)OCCCCCC(=O)OC 7a_100011217071_100009816466 [0,1,0,0,0,0|2,0,0]=3 2894 B17R0.133 CCCCSCC(=O)CCCCCCC(=O)OC 1458a_100000191162_100009815986 [0,1,0,0,0,0|1,0,1]=3 2895 B17R0.133 CCCCSCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000191162 [0,1,0,0,0,0|2,0,1]=4 2896 B17R0.133 CCCOCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011215938 [0,1,0,0,0,0|1,0,1]=3 2897 B17R0.133 CCOCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100012232248 [0,1,0,0,0,0|1,0,1]=3 2898 B17R0.133 CCOCCNC(=O)CCCCCCC(=O)OC 11a_100011200944_100000036694 [0,1,0,0,0,0|2,0,1]=4 2899 B17R0.133 CCOCCNC(=O)CCCCCCC(=O)OC 1626a_102516460346_100000036694 [0,1,0,0,0,0|2,0,1]=4 2900 B17R0.133 CCOCCNC(=O)CCCCCCC(=O)OC 240690a_100011200944_100000036694 [0,1,0,0,0,0|2,0,1]=4 2901 B17R0.133 CCSCCNC(=O)CCCCCCC(=O)OC 11a_100000106463_100000036694 [0,1,0,0,0,0|2,0,1]=4 2902 B17R0.133 CCSCCNC(=O)CCCCCCC(=O)OC 1626a_100000106463_100000036694 [0,1,0,0,0,0|2,0,1]=4 2903 B17R0.133 CCSCCNC(=O)CCCCCCC(=O)OC 240690a_100000106463_100000036694 [0,1,0,0,0,0|2,0,1]=4 2904 B17R0.133 COC(=O)CCCCCCC(=O)CCCCC#N 1458a_100000036694_100000211819 [0,1,0,0,0,0|1,0,2]=4 2905 B17R0.133 COC(=O)CCCCCCC(=O)CCCCCF 1458a_100000036694_100000729378 [0,1,0,0,0,0|1,0,1]=3 2906 B17R0.133 COC(=O)CCCCCCC(=O)CCCCCO 1458a_100000036694_100000746330 [0,1,0,0,0,0|1,0,1]=3 2907 B17R0.133 COC(=O)CCCCCCC(=O)CCCCCO 1458a_100102619762_100009815986 [0,1,0,0,0,0|1,0,1]=3 2908 B17R0.133 COC(=O)CCCCCCC(=O)CCOCCO 1458a_100000036694_100011215305 [0,1,0,0,0,0|2,0,1]=4 2909 B17R0.133 COC(=O)CCCCCCC(=O)CCOCCO 1458a_100011229844_100009815986 [0,1,0,0,0,0|2,0,1]=4 2910 B17R0.133 COC(=O)CCCCCCC(=O)NCCCCO 240690a_100000750430_100000036694 [0,1,0,0,0,0|2,0,1]=4 2911 B17R0.133 COC(=O)CCCCCCC(=O)NCCCSC 11a_100000749238_100000036694 [0,1,0,0,0,0|2,0,1]=4 2912 B17R0.133 COC(=O)CCCCCCC(=O)NCCCSC 1626a_100000749238_100000036694 [0,1,0,0,0,0|2,0,1]=4 2913 B17R0.133 COC(=O)CCCCCCC(=O)NCCCSC 240690a_100000749238_100000036694 [0,1,0,0,0,0|2,0,1]=4 2914 B17R0.133 COC(=O)CCCCCCN(C)CCCCCO 2230a_100000722520_100009815986 [0,1,0,0,0,0|2,0,0]=3 2915 B17R0.133 COC(=O)CCCCCCN(C)CCCCCO 269982a_100000722520_100009815986 [0,1,0,0,0,0|2,0,0]=3 2916 B17R0.133 COC(=O)CCCCCCN(C)CCOCCO 2230a_100000228057_100009815986 [0,1,0,0,0,0|3,0,0]=4 2917 B17R0.133 COC(=O)CCCCCCN(C)CCOCCO 269982a_100000228057_100009815986 [0,1,0,0,0,0|3,0,0]=4 2918 B17R0.133 COC(=O)CCCCCNC(=O)CCCCCO 188690a_100000184999_100102619762 [0,1,0,0,0,0|2,0,1]=4 2919 B17R0.133 COCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000755781 [0,1,0,0,0,0|1,0,1]=3 2920 B17R0.133 COCCCNC(=O)CCCCCCC(=O)OC 1626a_100150723488_100000036694 [0,1,0,0,0,0|2,0,1]=4 2921 B17R0.133 COCCCNC(=O)CCCCCCC(=O)OC 240690a_100150723488_100000036694 [0,1,0,0,0,0|2,0,1]=4 2922 B17R0.133 COCCOCC(=O)CCCCCCC(=O)OC 1458a_100000211095_100009815986 [0,1,0,0,0,0|2,0,1]=4 2923 B17R0.195 C#CC(=O)CCCCCCCCCCCCCC 1458a_100000211873_100011215471 [0,1,0,0,0,0|1,0,1]=3 2924 B17R0.195 C#CC(=O)CCCCCCCCCCCCCO 1458a_100000211873_100009812470 [0,1,0,0,0,0|1,0,1]=3 2925 B17R0.195 C#CCCCCCCCCCCOCC(=O)CC 7a_100000054667_100000747405 [0,1,0,0,0,0|1,0,2]=4 2926 B17R0.195 C#CCCCCCCCCCCOCC(=O)NC 34a_100000054667_100000183359 [0,1,0,0,0,0|1,0,2]=4 2927 B17R0.195 C#CCCCCCCCCCCOCC(=O)NC 7a_100000054667_100000183359 [0,1,0,0,0,0|1,0,2]=4 2928 B17R0.195 C#CCCCCCCCCCCOCC(=O)OC 34a_100000054667_100000747449 [0,1,0,0,0,0|0,0,2]=3 2929 B17R0.195 C#CCCCCCCCCCCOCC(=O)OC 7a_100000054667_100000747449 [0,1,0,0,0,0|0,0,2]=3 2930 B17R0.195 C#CCCCCCCCCCOCCC(=O)NC 34a_100000034437_100012179268 [0,1,0,0,0,0|1,0,2]=4 2931 B17R0.195 C#CCCCCCCCCCOCCC(=O)NC 7a_100000034437_100000737683 [0,1,0,0,0,0|1,0,2]=4 2932 B17R0.195 C#CCCCCCCCCCOCCC(=O)OC 34a_100000034437_100000742370 [0,1,0,0,0,0|0,0,2]=3 2933 B17R0.195 C#CCCCCCCCCCOCCC(=O)OC 7a_100000034437_100000204255 [0,1,0,0,0,0|0,0,2]=3 2934 B17R0.195 C#CCCCCCCCCOCCCC(=O)NC 34a_100000065265_100000741757 [0,1,0,0,0,0|1,0,2]=4 2935 B17R0.195 C#CCCCCCCCCOCCCC(=O)NC 7a_100000065265_100000741757 [0,1,0,0,0,0|1,0,2]=4 2936 B17R0.195 C#CCCCCCCCCOCCCC(=O)OC 34a_100000065265_100000742333 [0,1,0,0,0,0|0,0,2]=3 2937 B17R0.195 C#CCCCCCCCCOCCCC(=O)OC 7a_100000065265_100011218270 [0,1,0,0,0,0|0,0,2]=3 2938 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 34a_100000054614_100000204269 [0,1,0,0,0,0|0,0,2]=3 2939 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100153394163 [0,1,0,0,0,0|0,0,2]=3 2940 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 7a_100000054614_100000204269 [0,1,0,0,0,0|0,0,2]=3 2941 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100153394163 [0,1,0,0,0,0|0,0,2]=3 2942 B17R0.195 C#CCCCCCCCOCCOCC(=O)OC 34a_100000054614_100000090808 [0,1,0,0,0,0|1,0,2]=4 2943 B17R0.195 C#CCCCCCCCOCCOCC(=O)OC 7a_100000054614_100000090808 [0,1,0,0,0,0|1,0,2]=4 2944 B17R0.195 C#CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100153394163 [0,1,0,0,0,0|0,0,2]=3 2945 B17R0.195 C#CCCCCCCCSCCCCC(=O)OC 62a_100153394163_100000204269 [0,1,0,0,0,0|0,0,2]=3 2946 B17R0.195 C#CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100153394163 [0,1,0,0,0,0|1,0,2]=4 2947 B17R0.195 C#CCCCCCCCSCCOCC(=O)OC 62a_100153394163_100000090808 [0,1,0,0,0,0|1,0,2]=4 2948 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100012276617 [0,1,0,0,0,0|0,0,2]=3 2949 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 34a_100011217361_100009816466 [0,1,0,0,0,0|0,0,2]=3 2950 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100012276617 [0,1,0,0,0,0|0,0,2]=3 2951 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 7a_100011217361_100009816466 [0,1,0,0,0,0|0,0,2]=3 2952 B17R0.195 C#CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100012276617 [0,1,0,0,0,0|0,0,2]=3 2953 B17R0.195 C#CCCCCCCSCCCCCC(=O)OC 62a_100012276617_100009816466 [0,1,0,0,0,0|0,0,2]=3 2954 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 34a_100000766912_100009815986 [0,1,0,0,0,0|0,0,2]=3 2955 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100012094781 [0,1,0,0,0,0|0,0,2]=3 2956 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 7a_100000766912_100009815986 [0,1,0,0,0,0|0,0,2]=3 2957 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100012094781 [0,1,0,0,0,0|0,0,2]=3 2958 B17R0.195 C#CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100012094781 [0,1,0,0,0,0|0,0,2]=3 2959 B17R0.195 C#CCCCCCSCCCCCCC(=O)OC 62a_100012094781_100009815986 [0,1,0,0,0,0|0,0,2]=3 2960 B17R0.195 C#CCCCCNCCCCCCCC(=O)OC 2230a_100000706060_100010004213 [0,1,0,0,0,0|0,0,2]=3 2961 B17R0.195 C#CCCCCNCCCCCCCC(=O)OC 34a_100000706060_100010004213 [0,1,0,0,0,0|0,0,2]=3 2962 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 34a_100000766709_100010004213 [0,1,0,0,0,0|0,0,2]=3 2963 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100010269958 [0,1,0,0,0,0|0,0,2]=3 2964 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 7a_100000766709_100010004213 [0,1,0,0,0,0|0,0,2]=3 2965 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100010269958 [0,1,0,0,0,0|0,0,2]=3 2966 B17R0.195 C#CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100010269958 [0,1,0,0,0,0|0,0,2]=3 2967 B17R0.195 C#CCCCCSCCCCCCCC(=O)OC 62a_100010269958_100010004213 [0,1,0,0,0,0|0,0,2]=3 2968 B17R0.195 C#CCCCNCCCCCCCCC(=O)OC 34a_100000718082_100010282707 [0,1,0,0,0,0|0,0,2]=3 2969 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000695029 [0,1,0,0,0,0|0,0,2]=3 2970 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 34a_100000215630_100010282707 [0,1,0,0,0,0|0,0,2]=3 2971 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100011215417 [0,1,0,0,0,0|0,0,2]=3 2972 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 7a_100000215630_100010282707 [0,1,0,0,0,0|0,0,2]=3 2973 B17R0.195 C#CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100011215417 [0,1,0,0,0,0|0,0,2]=3 2974 B17R0.195 C#CCCCSCCCCCCCCC(=O)OC 62a_100011215417_100010282707 [0,1,0,0,0,0|0,0,2]=3 2975 B17R0.195 C#CCCNCCCCCCCCCC(=O)OC 34a_100000755551_100009813843 [0,1,0,0,0,0|0,0,2]=3 2976 B17R0.195 C#CCCOCCCCCCCCCC(=O)OC 34a_100011215631_100009813843 [0,1,0,0,0,0|0,0,2]=3 2977 B17R0.195 C#CCCSCCCCCCCCCC(=O)OC 62a_100000688953_100009813843 [0,1,0,0,0,0|0,0,2]=3 2978 B17R0.195 C#CCNCCCCCCCCCCC(=O)OC 34a_100000212058_100009812566 [0,1,0,0,0,0|0,0,2]=3 2979 B17R0.195 C#CCOCCCCCCCCCCC(=O)OC 34a_100000210247_100009812566 [0,1,0,0,0,0|0,0,2]=3 2980 B17R0.195 C#CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000184674 [0,1,0,0,0,0|0,0,2]=3 2981 B17R0.195 C#CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000038162 [0,1,0,0,0,0|0,0,2]=3 2982 B17R0.195 C#CCOCCCCCCOCCCC(=O)OC 34a_200011021349_100000742333 [0,1,0,0,0,0|1,0,2]=4 2983 B17R0.195 C#CCOCCCCCCOCCCC(=O)OC 7a_200011021349_100011218270 [0,1,0,0,0,0|1,0,2]=4 2984 B17R0.195 C#CCOCCNCCCCCCCC(=O)OC 2230a_100000700922_100010004213 [0,1,0,0,0,0|1,0,2]=4 2985 B17R0.195 C#CCOCCNCCCCCCCC(=O)OC 34a_100000700922_100010004213 [0,1,0,0,0,0|1,0,2]=4 2986 B17R0.195 C#CCOCCOCCCCCCCC(=O)OC 34a_100000054580_100010004213 [0,1,0,0,0,0|1,0,2]=4 2987 B17R0.195 C#CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100010402529 [0,1,0,0,0,0|1,0,2]=4 2988 B17R0.195 C#CCOCCOCCCCCCCC(=O)OC 7a_100000054580_100010004213 [0,1,0,0,0,0|1,0,2]=4 2989 B17R0.195 C#CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100010402529 [0,1,0,0,0,0|1,0,2]=4 2990 B17R0.195 C#CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100010402529 [0,1,0,0,0,0|1,0,2]=4 2991 B17R0.195 C#CCOCCSCCCCCCCC(=O)OC 62a_100010402529_100010004213 [0,1,0,0,0,0|1,0,2]=4 2992 B17R0.195 C#CCSCCCCCCCCCCC(=O)OC 62a_100000038162_100009812566 [0,1,0,0,0,0|0,0,2]=3 2993 B17R0.195 C/C=C/CCOCCCCCCCCC(=O)OC 34a_100016278192_100010282707 [0,1,0,0,0,0|0,0,2]=3 2994 B17R0.195 C/C=C/COCCCCCCCCCC(=O)OC 34a_100016270725_100009813843 [0,1,0,0,0,0|0,0,2]=3 2995 B17R0.195 C/C=C/CSCCCCCCCCCC(=O)OC 62a_100102629194_100009813843 [0,1,0,0,0,0|0,0,2]=3 2996 B17R0.195 C=C(C#N)CNCCCCCCCCCCCC 2230a_100000210451_100000694840 [0,1,0,0,0,0|3,0,0]=4 2997 B17R0.195 C=C(C#N)CNCCCCCCCCCCCC 34a_100000210451_100000694840 [0,1,0,0,0,0|3,0,0]=4 2998 B17R0.195 C=C(C#N)COCCCCCCCCCCCC 34a_100000210810_100000694840 [0,1,0,0,0,0|3,0,0]=4 2999 B17R0.195 C=CC(=O)CCCCCCCCCCCCCC 1458a_100000185746_100011215471 [0,1,0,0,0,0|1,0,1]=3 3000 B17R0.195 C=CC(=O)CCCCCCCCCCCCCO 1458a_100000185746_100009812470 [0,1,0,0,0,0|1,0,1]=3 3001 B17R0.195 C=CC(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000185746 [0,1,0,0,0,0|1,0,1]=3 3002 B17R0.195 C=CC(=O)NCCCCCCCCCCCCC 240690a_100011215765_200121576911 [0,1,0,0,0,0|1,0,1]=3 3003 B17R0.195 C=CC(=O)NCCCCCCCCCCCCO 240690a_100000066677_200121576911 [0,1,0,0,0,0|2,0,1]=4 3004 B17R0.195 C=CC(=O)NCCCCOCCCCCCCC 34a_100014118770_100000210759 [0,1,0,0,0,0|2,0,1]=4 3005 B17R0.195 C=CC(=O)NCCNCCCCCCCCCC 2230a_114873766552_100000210320 [0,1,0,0,0,0|2,0,1]=4 3006 B17R0.195 C=CC(=O)NCCOCCCCCCCCCC 34a_100011304386_100000210320 [0,1,0,0,0,0|2,0,1]=4 3007 B17R0.195 C=CC(=O)OCCCCCCNCCCCCC 2230a_100000210581_100009894100 [0,1,0,0,0,0|2,0,1]=4 3008 B17R0.195 C=CC(=O)OCCCCCCOCCCCCC 34a_100000210259_100009894100 [0,1,0,0,0,0|2,0,1]=4 3009 B17R0.195 C=CC(=O)OCCCCCCOCCCCCC 7a_100000210259_100009894100 [0,1,0,0,0,0|2,0,1]=4 3010 B17R0.195 C=CC(=O)OCCCCCCSCCCCCC 62a_100000210314_100009894100 [0,1,0,0,0,0|2,0,1]=4 3011 B17R0.195 C=CC(=O)OCCCCCCSCCCCCC 62a_100009894100_100000210757 [0,1,0,0,0,0|2,0,1]=4 3012 B17R0.195 C=CC(=O)OCCCCCOCCCCCCC 7a_200011023508_100000210614 [0,1,0,0,0,0|2,0,1]=4 3013 B17R0.195 C=CC(=O)OCCNCCCCCCCCCC 2230a_100000684558_100009813456 [0,1,0,0,0,0|2,0,1]=4 3014 B17R0.195 C=CC(=O)OCCNCCCCCCCCCC 34a_100000684558_100009813456 [0,1,0,0,0,0|2,0,1]=4 3015 B17R0.195 C=CC(=O)OCCOCCCCCCCCCC 34a_100000210711_100009813456 [0,1,0,0,0,0|2,0,1]=4 3016 B17R0.195 C=CC(=O)OCCOCCCCCCCCCC 7a_100000210711_100009813456 [0,1,0,0,0,0|2,0,1]=4 3017 B17R0.195 C=CC(=O)OCCSCCCCCCCCCC 62a_100009813456_100000210320 [0,1,0,0,0,0|2,0,1]=4 3018 B17R0.195 C=CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011093070 [0,1,0,0,0,0|1,0,2]=4 3019 B17R0.195 C=CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011093070 [0,1,0,0,0,0|1,0,2]=4 3020 B17R0.195 C=CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011093070 [0,1,0,0,0,0|1,0,2]=4 3021 B17R0.195 C=CCCCCCCCCCCSCC(=O)CC 62a_100000747405_100011093070 [0,1,0,0,0,0|1,0,2]=4 3022 B17R0.195 C=CCCCCCCCCCCSCC(=O)CC 62a_100011093070_100000747405 [0,1,0,0,0,0|1,0,2]=4 3023 B17R0.195 C=CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011093070 [0,1,0,0,0,0|1,0,2]=4 3024 B17R0.195 C=CCCCCCCCCCCSCC(=O)NC 62a_100011093070_100000183359 [0,1,0,0,0,0|1,0,2]=4 3025 B17R0.195 C=CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011093070 [0,1,0,0,0,0|0,0,2]=3 3026 B17R0.195 C=CCCCCCCCCCCSCC(=O)OC 62a_100011093070_100000747449 [0,1,0,0,0,0|0,0,2]=3 3027 B17R0.195 C=CCCCCCCCCCNCCC(=O)NC 2230a_100000081888_100000737683 [0,1,0,0,0,0|1,0,2]=4 3028 B17R0.195 C=CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100009814027 [0,1,0,0,0,0|1,0,2]=4 3029 B17R0.195 C=CCCCCCCCCCNCCC(=O)NC 34a_100000081888_100012179268 [0,1,0,0,0,0|1,0,2]=4 3030 B17R0.195 C=CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100009814027 [0,1,0,0,0,0|1,0,2]=4 3031 B17R0.195 C=CCCCCCCCCCNCCC(=O)OC 2230a_100000081888_100000204255 [0,1,0,0,0,0|0,0,2]=3 3032 B17R0.195 C=CCCCCCCCCCNCCC(=O)OC 34a_100000081888_100000742370 [0,1,0,0,0,0|0,0,2]=3 3033 B17R0.195 C=CCCCCCCCCCOCCC(=O)NC 34a_100000038209_100012179268 [0,1,0,0,0,0|1,0,2]=4 3034 B17R0.195 C=CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100009814027 [0,1,0,0,0,0|1,0,2]=4 3035 B17R0.195 C=CCCCCCCCCCOCCC(=O)NC 7a_100000038209_100000737683 [0,1,0,0,0,0|1,0,2]=4 3036 B17R0.195 C=CCCCCCCCCCOCCC(=O)OC 34a_100000038209_100000742370 [0,1,0,0,0,0|0,0,2]=3 3037 B17R0.195 C=CCCCCCCCCCOCCC(=O)OC 7a_100000038209_100000204255 [0,1,0,0,0,0|0,0,2]=3 3038 B17R0.195 C=CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100009814027 [0,1,0,0,0,0|1,0,2]=4 3039 B17R0.195 C=CCCCCCCCCCSCCC(=O)NC 62a_100009814027_100000737683 [0,1,0,0,0,0|1,0,2]=4 3040 B17R0.195 C=CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100009814027 [0,1,0,0,0,0|0,0,2]=3 3041 B17R0.195 C=CCCCCCCCCCSCCC(=O)OC 62a_100009814027_100000204255 [0,1,0,0,0,0|0,0,2]=3 3042 B17R0.195 C=CCCCCCCCCCSCOC(=O)OC 62a_100009814027_100000139417 [0,1,0,0,0,0|1,0,2]=4 3043 B17R0.195 C=CCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011933949 [0,1,0,0,0,0|1,0,2]=4 3044 B17R0.195 C=CCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011933949 [0,1,0,0,0,0|1,0,2]=4 3045 B17R0.195 C=CCCCCCCCCOCCCC(=O)NC 34a_100011215194_100000741757 [0,1,0,0,0,0|1,0,2]=4 3046 B17R0.195 C=CCCCCCCCCOCCCC(=O)NC 7a_100011215194_100000741757 [0,1,0,0,0,0|1,0,2]=4 3047 B17R0.195 C=CCCCCCCCCOCCCC(=O)OC 34a_100011215194_100000742333 [0,1,0,0,0,0|0,0,2]=3 3048 B17R0.195 C=CCCCCCCCCOCCCC(=O)OC 7a_100011215194_100011218270 [0,1,0,0,0,0|0,0,2]=3 3049 B17R0.195 C=CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011933949 [0,1,0,0,0,0|1,0,2]=4 3050 B17R0.195 C=CCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011933949 [0,1,0,0,0,0|1,0,2]=4 3051 B17R0.195 C=CCCCCCCCCSCCCC(=O)NC 62a_100000741757_100011933949 [0,1,0,0,0,0|1,0,2]=4 3052 B17R0.195 C=CCCCCCCCCSCCCC(=O)NC 62a_100011933949_100000741757 [0,1,0,0,0,0|1,0,2]=4 3053 B17R0.195 C=CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100011933949 [0,1,0,0,0,0|0,0,2]=3 3054 B17R0.195 C=CCCCCCCCCSCCCC(=O)OC 62a_100011933949_100011218270 [0,1,0,0,0,0|0,0,2]=3 3055 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100012355270 [0,1,0,0,0,0|0,0,2]=3 3056 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 34a_100000730831_100000204269 [0,1,0,0,0,0|0,0,2]=3 3057 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100012355270 [0,1,0,0,0,0|0,0,2]=3 3058 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 7a_100000730831_100000204269 [0,1,0,0,0,0|0,0,2]=3 3059 B17R0.195 C=CCCCCCCCOCCOCC(=O)OC 34a_100000730831_100000090808 [0,1,0,0,0,0|1,0,2]=4 3060 B17R0.195 C=CCCCCCCCOCCOCC(=O)OC 7a_100000730831_100000090808 [0,1,0,0,0,0|1,0,2]=4 3061 B17R0.195 C=CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100012355270 [0,1,0,0,0,0|0,0,2]=3 3062 B17R0.195 C=CCCCCCCCSCCCCC(=O)OC 62a_100012355270_100000204269 [0,1,0,0,0,0|0,0,2]=3 3063 B17R0.195 C=CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100012355270 [0,1,0,0,0,0|1,0,2]=4 3064 B17R0.195 C=CCCCCCCCSCCOCC(=O)OC 62a_100012355270_100000090808 [0,1,0,0,0,0|1,0,2]=4 3065 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100011215473 [0,1,0,0,0,0|0,0,2]=3 3066 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 34a_200011216477_100009816466 [0,1,0,0,0,0|0,0,2]=3 3067 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100011215473 [0,1,0,0,0,0|0,0,2]=3 3068 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 7a_200011216477_100009816466 [0,1,0,0,0,0|0,0,2]=3 3069 B17R0.195 C=CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100011215473 [0,1,0,0,0,0|0,0,2]=3 3070 B17R0.195 C=CCCCCCCSCCCCCC(=O)OC 62a_100011215473_100009816466 [0,1,0,0,0,0|0,0,2]=3 3071 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000700193 [0,1,0,0,0,0|0,0,2]=3 3072 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 34a_100011216702_100009815986 [0,1,0,0,0,0|0,0,2]=3 3073 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000700193 [0,1,0,0,0,0|0,0,2]=3 3074 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 7a_100011216702_100009815986 [0,1,0,0,0,0|0,0,2]=3 3075 B17R0.195 C=CCCCCCSCCCCCCC(=O)OC 62a_100000700193_100009815986 [0,1,0,0,0,0|0,0,2]=3 3076 B17R0.195 C=CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000700193 [0,1,0,0,0,0|0,0,2]=3 3077 B17R0.195 C=CCCCCNCCCCCCCC(=O)OC 2230a_100000703577_100010004213 [0,1,0,0,0,0|0,0,2]=3 3078 B17R0.195 C=CCCCCNCCCCCCCC(=O)OC 34a_100000703577_100010004213 [0,1,0,0,0,0|0,0,2]=3 3079 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 34a_100000766645_100010004213 [0,1,0,0,0,0|0,0,2]=3 3080 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100011215482 [0,1,0,0,0,0|0,0,2]=3 3081 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 7a_100000766645_100010004213 [0,1,0,0,0,0|0,0,2]=3 3082 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100011215482 [0,1,0,0,0,0|0,0,2]=3 3083 B17R0.195 C=CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100011215482 [0,1,0,0,0,0|0,0,2]=3 3084 B17R0.195 C=CCCCCSCCCCCCCC(=O)OC 62a_100011215482_100010004213 [0,1,0,0,0,0|0,0,2]=3 3085 B17R0.195 C=CCCCNCCCCCCCCC(=O)OC 2230a_100000700776_100010282707 [0,1,0,0,0,0|0,0,2]=3 3086 B17R0.195 C=CCCCNCCCCCCCCC(=O)OC 34a_100000700776_100010282707 [0,1,0,0,0,0|0,0,2]=3 3087 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000757094 [0,1,0,0,0,0|0,0,2]=3 3088 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 34a_100000758997_100010282707 [0,1,0,0,0,0|0,0,2]=3 3089 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000757094 [0,1,0,0,0,0|0,0,2]=3 3090 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 7a_100000758997_100010282707 [0,1,0,0,0,0|0,0,2]=3 3091 B17R0.195 C=CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000757094 [0,1,0,0,0,0|0,0,2]=3 3092 B17R0.195 C=CCCCSCCCCCCCCC(=O)OC 62a_100011713584_100010282707 [0,1,0,0,0,0|0,0,2]=3 3093 B17R0.195 C=CCCNCCCCCCCCCC(=O)OC 2230a_100015191253_100009813843 [0,1,0,0,0,0|0,0,2]=3 3094 B17R0.195 C=CCCOCCCCCCCCCC(=O)OC 34a_100011205117_100009813843 [0,1,0,0,0,0|0,0,2]=3 3095 B17R0.195 C=CCCSCCCCCCCCCC(=O)OC 62a_100000754431_100009813843 [0,1,0,0,0,0|0,0,2]=3 3096 B17R0.195 C=CCNCCCCCCCCCCC(=O)OC 2230a_100020586998_100009812566 [0,1,0,0,0,0|0,0,2]=3 3097 B17R0.195 C=CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100015514636 [0,1,0,0,0,0|0,0,2]=3 3098 B17R0.195 C=CCOCCCCCCCCCCC(=O)OC 34a_200000210373_100009812566 [0,1,0,0,0,0|0,0,2]=3 3099 B17R0.195 C=CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100015514636 [0,1,0,0,0,0|0,0,2]=3 3100 B17R0.195 C=CCOCCOCCCCCCCC(=O)OC 34a_100000037705_100010004213 [0,1,0,0,0,0|1,0,2]=4 3101 B17R0.195 C=CCOCCOCCCCCCCC(=O)OC 7a_100000037705_100010004213 [0,1,0,0,0,0|1,0,2]=4 3102 B17R0.195 C=CCSCCCCCCCCCCC(=O)OC 62a_100000210623_100009812566 [0,1,0,0,0,0|0,0,2]=3 3103 B17R0.195 C=COCCCCOCCCCCCC(=O)OC 34a_100000031558_100009815986 [0,1,0,0,0,0|1,0,2]=4 3104 B17R0.195 C=COCCCCOCCCCCCC(=O)OC 7a_100000031558_100009815986 [0,1,0,0,0,0|1,0,2]=4 3105 B17R0.195 C=COCCCNCCCCCCCC(=O)OC 2230a_100000210767_100010004213 [0,1,0,0,0,0|1,0,2]=4 3106 B17R0.195 C=COCCCNCCCCCCCC(=O)OC 34a_100000210767_100010004213 [0,1,0,0,0,0|1,0,2]=4 3107 B17R0.195 C=COCCOCCCCCCCCC(=O)OC 34a_100000033082_100010282707 [0,1,0,0,0,0|1,0,2]=4 3108 B17R0.195 C=COCCOCCCCCCCCC(=O)OC 34a_100000035544_100000039644 [0,1,0,0,0,0|1,0,2]=4 3109 B17R0.195 C=COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000039644 [0,1,0,0,0,0|1,0,2]=4 3110 B17R0.195 C=COCCSCCCCCCCCC(=O)OC 62a_100000039644_100010282707 [0,1,0,0,0,0|1,0,2]=4 3111 B17R0.195 C=COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000039644 [0,1,0,0,0,0|1,0,2]=4 3112 B17R0.195 CC#CCCOCCCCCCCCC(=O)OC 34a_100000750427_100010282707 [0,1,0,0,0,0|0,0,2]=3 3113 B17R0.195 CC#CCNCCCCCCCCCC(=O)OC 2230a_100000685387_100009813843 [0,1,0,0,0,0|0,0,2]=3 3114 B17R0.195 CC#CCNCCCCCCCCCC(=O)OC 34a_100000685387_100009813843 [0,1,0,0,0,0|0,0,2]=3 3115 B17R0.195 CC#CCOCCCCCCCCCC(=O)OC 34a_100000761923_100009813843 [0,1,0,0,0,0|0,0,2]=3 3116 B17R0.195 CC#CCSCCCCCCCCCC(=O)OC 62a_100000748600_100009813843 [0,1,0,0,0,0|0,0,2]=3 3117 B17R0.195 CC/C=C/CCCOCCCCCCC(=O)OC 34a_100016287902_100009815986 [0,1,0,0,0,0|0,0,2]=3 3118 B17R0.195 CC/C=C/CCCOCCCCCCC(=O)OC 7a_100016287902_100009815986 [0,1,0,0,0,0|0,0,2]=3 3119 B17R0.195 CC/C=C\CCCCCCCNCCC(=O)NC 269862a_100000738227_200025770492 [0,1,0,0,0,0|1,0,2]=4 3120 B17R0.195 CC/C=C\CCCCCOCCCCC(=O)OC 34a_100016268722_100000204269 [0,1,0,0,0,0|0,0,2]=3 3121 B17R0.195 CC/C=C\CCCCCOCCCCC(=O)OC 7a_100016268722_100000204269 [0,1,0,0,0,0|0,0,2]=3 3122 B17R0.195 CC/C=C\CCCCCOCCOCC(=O)OC 34a_100016268722_100000090808 [0,1,0,0,0,0|1,0,2]=4 3123 B17R0.195 CC/C=C\CCCCCOCCOCC(=O)OC 7a_100016268722_100000090808 [0,1,0,0,0,0|1,0,2]=4 3124 B17R0.195 CC/C=C\CCCCOCCCCCC(=O)OC 34a_100016287862_100009816466 [0,1,0,0,0,0|0,0,2]=3 3125 B17R0.195 CC/C=C\CCCCOCCCCCC(=O)OC 7a_100016287862_100009816466 [0,1,0,0,0,0|0,0,2]=3 3126 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 34a_100011022521_100015370543 [0,1,0,0,0,0|0,0,2]=3 3127 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 34a_100016288707_100010004213 [0,1,0,0,0,0|0,0,2]=3 3128 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 7a_100011022521_100015370543 [0,1,0,0,0,0|0,0,2]=3 3129 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 7a_100016288707_100010004213 [0,1,0,0,0,0|0,0,2]=3 3130 B17R0.195 CC/C=C\CCSCCCCCCCC(=O)OC 62a_100010004213_100015370543 [0,1,0,0,0,0|0,0,2]=3 3131 B17R0.195 CC/C=C\CCSCCCCCCCC(=O)OC 62a_100015370543_100010004213 [0,1,0,0,0,0|0,0,2]=3 3132 B17R0.195 CC/C=C\COCCCCCCCCC(=O)OC 34a_100000035544_100103147603 [0,1,0,0,0,0|0,0,2]=3 3133 B17R0.195 CC/C=C\COCCCCCCCCC(=O)OC 34a_100016268518_100010282707 [0,1,0,0,0,0|0,0,2]=3 3134 B17R0.195 CC/C=C\COCCCCCCCCC(=O)OC 7a_100000035544_100103147603 [0,1,0,0,0,0|0,0,2]=3 3135 B17R0.195 CC/C=C\CSCCCCCCCCC(=O)OC 62a_100010282707_100103147603 [0,1,0,0,0,0|0,0,2]=3 3136 B17R0.195 CC/C=C\CSCCCCCCCCC(=O)OC 62a_100103147603_100010282707 [0,1,0,0,0,0|0,0,2]=3 3137 B17R0.195 CC=C=CCCOCCCCCCCC(=O)OC 34a_100011020354_100010004213 [0,1,0,0,0,0|0,0,3]=4 3138 B17R0.195 CC=CCCCOCCCCCCCC(=O)OC 34a_100020645299_100010004213 [0,1,0,0,0,0|0,0,2]=3 3139 B17R0.195 CC=CCSCCCCCCCCCC(=O)OC 62a_100000070051_100009813843 [0,1,0,0,0,0|0,0,2]=3 3140 B17R0.195 CCC#CCCCCCCCCOCC(=O)CC 7a_200000031908_100000747405 [0,1,0,0,0,0|1,0,2]=4 3141 B17R0.195 CCC#CCCCCCCCCOCC(=O)NC 34a_200000031908_100000183359 [0,1,0,0,0,0|1,0,2]=4 3142 B17R0.195 CCC#CCCCCCCCCOCC(=O)NC 7a_200000031908_100000183359 [0,1,0,0,0,0|1,0,2]=4 3143 B17R0.195 CCC#CCCCCCCCCOCC(=O)OC 34a_200000031908_100000747449 [0,1,0,0,0,0|0,0,2]=3 3144 B17R0.195 CCC#CCCCCCCCCOCC(=O)OC 7a_200000031908_100000747449 [0,1,0,0,0,0|0,0,2]=3 3145 B17R0.195 CCC#CCCCCCCNCCCC(=O)NC 2230a_100000740002_200000036426 [0,1,0,0,0,0|1,0,2]=4 3146 B17R0.195 CCC#CCCCCCCNCCCC(=O)NC 34a_100000740002_200000036426 [0,1,0,0,0,0|1,0,2]=4 3147 B17R0.195 CCC#CCCCCCCOCCNC(=O)OC 34a_100000757965_200000036426 [0,1,0,0,0,0|1,0,2]=4 3148 B17R0.195 CCC#CCCCCCCOCCOC(=O)OC 34a_100010262106_200000036426 [0,1,0,0,0,0|1,0,2]=4 3149 B17R0.195 CCC#CCCCCCCSCCCC(=O)NC 62a_100000741757_200000036426 [0,1,0,0,0,0|1,0,2]=4 3150 B17R0.195 CCC#CCCCCCCSCCCC(=O)NC 62a_200000036426_100000741757 [0,1,0,0,0,0|1,0,2]=4 3151 B17R0.195 CCC#CCCCCCCSCCCC(=O)OC 62a_100011218270_200000036426 [0,1,0,0,0,0|0,0,2]=3 3152 B17R0.195 CCC#CCCCCCCSCCCC(=O)OC 62a_200000036426_100011218270 [0,1,0,0,0,0|0,0,2]=3 3153 B17R0.195 CCC#CCCOCCCCCCCC(=O)OC 34a_100000036655_100010004213 [0,1,0,0,0,0|0,0,2]=3 3154 B17R0.195 CCC#CCCOCCCCCCCC(=O)OC 7a_100000036655_100010004213 [0,1,0,0,0,0|0,0,2]=3 3155 B17R0.195 CCC#CCOCCCCCCCCC(=O)OC 34a_100000032950_100010282707 [0,1,0,0,0,0|0,0,2]=3 3156 B17R0.195 CCC#CCOCCCCCCCCC(=O)OC 34a_100000035544_100009813939 [0,1,0,0,0,0|0,0,2]=3 3157 B17R0.195 CCC#CCOCCCCCCCCC(=O)OC 7a_100000035544_100009813939 [0,1,0,0,0,0|0,0,2]=3 3158 B17R0.195 CCC#CCSCCCCCCCCC(=O)OC 62a_100009813939_100010282707 [0,1,0,0,0,0|0,0,2]=3 3159 B17R0.195 CCC#CCSCCCCCCCCC(=O)OC 62a_100010282707_100009813939 [0,1,0,0,0,0|0,0,2]=3 3160 B17R0.195 CCC(=O)CCCCCCCCCCCCCO 1458a_100000210414_100009812470 [0,1,0,0,0,0|1,0,0]=2 3161 B17R0.195 CCC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000747405 [0,1,0,0,0,0|2,0,0]=3 3162 B17R0.195 CCC(=O)COCCCCCCCCCCCO 34a_100000725409_100009812471 [0,1,0,0,0,0|2,0,0]=3 3163 B17R0.195 CCC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747405 [0,1,0,0,0,0|2,0,0]=3 3164 B17R0.195 CCC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000210414 [0,1,0,0,0,0|2,0,0]=3 3165 B17R0.195 CCC(=O)NCCNCCCCCCCCCO 34a_100132302217_100009813782 [0,1,0,0,0,0|3,0,0]=4 3166 B17R0.195 CCC(=O)NCCOCCCCCCCCCO 34a_200000158885_100009813782 [0,1,0,0,0,0|3,0,0]=4 3167 B17R0.195 CCC(=O)NCCOCCCCCCCCCO 7a_200000158885_100009813782 [0,1,0,0,0,0|3,0,0]=4 3168 B17R0.195 CCC(=O)OCCOCCCCCCCCCO 7a_200000031056_100009813782 [0,1,0,0,0,0|3,0,0]=4 3169 B17R0.195 CCC/C=C/COCCCCCCCC(=O)OC 34a_100016278788_100010004213 [0,1,0,0,0,0|0,0,2]=3 3170 B17R0.195 CCC/C=C/COCCCCCCCC(=O)OC 7a_100016278788_100010004213 [0,1,0,0,0,0|0,0,2]=3 3171 B17R0.195 CCCC#CCCOCCCCCCC(=O)OC 34a_100000042726_100009815986 [0,1,0,0,0,0|0,0,2]=3 3172 B17R0.195 CCCC#CCCOCCCCCCC(=O)OC 7a_100000042726_100009815986 [0,1,0,0,0,0|0,0,2]=3 3173 B17R0.195 CCCC#CCOCCCCCCCC(=O)OC 34a_100000034806_100010004213 [0,1,0,0,0,0|0,0,2]=3 3174 B17R0.195 CCCC#CCOCCCCCCCC(=O)OC 7a_100000034806_100010004213 [0,1,0,0,0,0|0,0,2]=3 3175 B17R0.195 CCCC/C=C/CCCCOCCCC(=O)NC 34a_200020645093_100000741757 [0,1,0,0,0,0|1,0,2]=4 3176 B17R0.195 CCCC/C=C/CCCCOCCCC(=O)NC 7a_200020645093_100000741757 [0,1,0,0,0,0|1,0,2]=4 3177 B17R0.195 CCCC/C=C/CCCCOCCCC(=O)OC 34a_200020645093_100000742333 [0,1,0,0,0,0|0,0,2]=3 3178 B17R0.195 CCCC/C=C/CCCCOCCCC(=O)OC 7a_200020645093_100011218270 [0,1,0,0,0,0|0,0,2]=3 3179 B17R0.195 CCCC/C=C/COCCCCCCC(=O)OC 34a_200016272032_100009815986 [0,1,0,0,0,0|0,0,2]=3 3180 B17R0.195 CCCC/C=C/COCCCCCCC(=O)OC 7a_200016272032_100009815986 [0,1,0,0,0,0|0,0,2]=3 3181 B17R0.195 CCCC/C=C\CCOCCCCCC(=O)OC 34a_200016286491_100009816466 [0,1,0,0,0,0|0,0,2]=3 3182 B17R0.195 CCCC/C=C\CCOCCCCCC(=O)OC 7a_200016286491_100009816466 [0,1,0,0,0,0|0,0,2]=3 3183 B17R0.195 CCCCC#CCCCCCCNCC(=O)NC 2230a_100000693194_200000043322 [0,1,0,0,0,0|1,0,2]=4 3184 B17R0.195 CCCCC#CCCCCCCOCC(=O)CC 34a_100000725409_200000043322 [0,1,0,0,0,0|1,0,2]=4 3185 B17R0.195 CCCCC#CCCCCCCOCC(=O)NC 34a_100000750040_200000043322 [0,1,0,0,0,0|1,0,2]=4 3186 B17R0.195 CCCCC#CCCCCCCSCC(=O)CC 62a_100000747405_200000043322 [0,1,0,0,0,0|1,0,2]=4 3187 B17R0.195 CCCCC#CCCCCCCSCC(=O)CC 62a_200000043322_100000747405 [0,1,0,0,0,0|1,0,2]=4 3188 B17R0.195 CCCCC#CCCCCCCSCC(=O)NC 62a_100000183359_200000043322 [0,1,0,0,0,0|1,0,2]=4 3189 B17R0.195 CCCCC#CCCCCCCSCC(=O)NC 62a_200000043322_100000183359 [0,1,0,0,0,0|1,0,2]=4 3190 B17R0.195 CCCCC#CCCCCCCSCC(=O)OC 62a_100000747449_200000043322 [0,1,0,0,0,0|0,0,2]=3 3191 B17R0.195 CCCCC#CCCCCCCSCC(=O)OC 62a_200000043322_100000747449 [0,1,0,0,0,0|0,0,2]=3 3192 B17R0.195 CCCCC#CCCCCOCCCC(=O)NC 34a_200000066234_100000741757 [0,1,0,0,0,0|1,0,2]=4 3193 B17R0.195 CCCCC#CCCCCOCCCC(=O)NC 7a_200000066234_100000741757 [0,1,0,0,0,0|1,0,2]=4 3194 B17R0.195 CCCCC#CCCCCOCCCC(=O)OC 34a_200000066234_100000742333 [0,1,0,0,0,0|0,0,2]=3 3195 B17R0.195 CCCCC#CCCCCOCCCC(=O)OC 7a_200000066234_100011218270 [0,1,0,0,0,0|0,0,2]=3 3196 B17R0.195 CCCCC#CCCCOCCCCC(=O)OC 34a_100000059025_200000047210 [0,1,0,0,0,0|0,0,2]=3 3197 B17R0.195 CCCCC#CCCCOCCCCC(=O)OC 7a_100000059025_200000047210 [0,1,0,0,0,0|0,0,2]=3 3198 B17R0.195 CCCCC#CCCCSCCCCC(=O)OC 62a_100000204269_200000047210 [0,1,0,0,0,0|0,0,2]=3 3199 B17R0.195 CCCCC#CCCCSCCCCC(=O)OC 62a_200000047210_100000204269 [0,1,0,0,0,0|0,0,2]=3 3200 B17R0.195 CCCCC#CCCCSCCOCC(=O)OC 62a_100000090808_200000047210 [0,1,0,0,0,0|1,0,2]=4 3201 B17R0.195 CCCCC#CCCCSCCOCC(=O)OC 62a_200000047210_100000090808 [0,1,0,0,0,0|1,0,2]=4 3202 B17R0.195 CCCCC#CCCOCCCCCC(=O)OC 34a_100000037610_100009816466 [0,1,0,0,0,0|0,0,2]=3 3203 B17R0.195 CCCCC#CCCOCCCCCC(=O)OC 7a_100000037610_100009816466 [0,1,0,0,0,0|0,0,2]=3 3204 B17R0.195 CCCCC#CCOCCCCCCC(=O)OC 34a_200000034558_100009815986 [0,1,0,0,0,0|0,0,2]=3 3205 B17R0.195 CCCCC#CCOCCCCCCC(=O)OC 7a_200000034558_100009815986 [0,1,0,0,0,0|0,0,2]=3 3206 B17R0.195 CCCCC/C=C/COCCCCCC(=O)OC 34a_100016258190_100009816466 [0,1,0,0,0,0|0,0,2]=3 3207 B17R0.195 CCCCC/C=C/COCCCCCC(=O)OC 7a_100016258190_100009816466 [0,1,0,0,0,0|0,0,2]=3 3208 B17R0.195 CCCCC/C=C\CCCOCCCC(=O)NC 34a_100020655193_100000741757 [0,1,0,0,0,0|1,0,2]=4 3209 B17R0.195 CCCCC/C=C\CCCOCCCC(=O)NC 7a_100020655193_100000741757 [0,1,0,0,0,0|1,0,2]=4 3210 B17R0.195 CCCCC/C=C\CCCOCCCC(=O)OC 34a_100020655193_100000742333 [0,1,0,0,0,0|0,0,2]=3 3211 B17R0.195 CCCCC/C=C\CCCOCCCC(=O)OC 7a_100020655193_100011218270 [0,1,0,0,0,0|0,0,2]=3 3212 B17R0.195 CCCCC/C=C\CCOCCCCC(=O)OC 34a_100016277358_100000204269 [0,1,0,0,0,0|0,0,2]=3 3213 B17R0.195 CCCCC/C=C\CCOCCCCC(=O)OC 7a_100016277358_100000204269 [0,1,0,0,0,0|0,0,2]=3 3214 B17R0.195 CCCCC/C=C\CCOCCOCC(=O)OC 34a_100016277358_100000090808 [0,1,0,0,0,0|1,0,2]=4 3215 B17R0.195 CCCCC/C=C\CCOCCOCC(=O)OC 7a_100016277358_100000090808 [0,1,0,0,0,0|1,0,2]=4 3216 B17R0.195 CCCCCC#CCCOCCCCC(=O)OC 34a_200000042877_100000204269 [0,1,0,0,0,0|0,0,2]=3 3217 B17R0.195 CCCCCC#CCCOCCCCC(=O)OC 7a_200000042877_100000204269 [0,1,0,0,0,0|0,0,2]=3 3218 B17R0.195 CCCCCC#CCCOCCOCC(=O)OC 34a_200000042877_100000090808 [0,1,0,0,0,0|1,0,2]=4 3219 B17R0.195 CCCCCC#CCCOCCOCC(=O)OC 7a_200000042877_100000090808 [0,1,0,0,0,0|1,0,2]=4 3220 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 34a_100000074720_100009816472 [0,1,0,0,0,0|0,0,2]=3 3221 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 34a_200000033628_100009816466 [0,1,0,0,0,0|0,0,2]=3 3222 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 7a_100000074720_100009816472 [0,1,0,0,0,0|0,0,2]=3 3223 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 7a_200000033628_100009816466 [0,1,0,0,0,0|0,0,2]=3 3224 B17R0.195 CCCCCC#CCSCCCCCC(=O)OC 62a_100009816466_100009816472 [0,1,0,0,0,0|0,0,2]=3 3225 B17R0.195 CCCCCC#CCSCCCCCC(=O)OC 62a_100009816472_100009816466 [0,1,0,0,0,0|0,0,2]=3 3226 B17R0.195 CCCCCC/C=C/COCCCCC(=O)OC 34a_200016276170_100000204269 [0,1,0,0,0,0|0,0,2]=3 3227 B17R0.195 CCCCCC/C=C/COCCCCC(=O)OC 7a_200016276170_100000204269 [0,1,0,0,0,0|0,0,2]=3 3228 B17R0.195 CCCCCC/C=C/COCCOCC(=O)OC 34a_200016276170_100000090808 [0,1,0,0,0,0|1,0,2]=4 3229 B17R0.195 CCCCCC/C=C/COCCOCC(=O)OC 7a_200016276170_100000090808 [0,1,0,0,0,0|1,0,2]=4 3230 B17R0.195 CCCCCCC#CCCOCCCC(=O)NC 34a_200000033163_100000741757 [0,1,0,0,0,0|1,0,2]=4 3231 B17R0.195 CCCCCCC#CCCOCCCC(=O)NC 7a_200000033163_100000741757 [0,1,0,0,0,0|1,0,2]=4 3232 B17R0.195 CCCCCCC#CCCOCCCC(=O)OC 34a_200000033163_100000742333 [0,1,0,0,0,0|0,0,2]=3 3233 B17R0.195 CCCCCCC#CCCOCCCC(=O)OC 7a_200000033163_100011218270 [0,1,0,0,0,0|0,0,2]=3 3234 B17R0.195 CCCCCCC#CCOCCCCC(=O)OC 34a_200000037284_100000204269 [0,1,0,0,0,0|0,0,2]=3 3235 B17R0.195 CCCCCCC#CCOCCCCC(=O)OC 7a_200000037284_100000204269 [0,1,0,0,0,0|0,0,2]=3 3236 B17R0.195 CCCCCCC#CCOCCOCC(=O)OC 34a_200000037284_100000090808 [0,1,0,0,0,0|1,0,2]=4 3237 B17R0.195 CCCCCCC#CCOCCOCC(=O)OC 7a_200000037284_100000090808 [0,1,0,0,0,0|1,0,2]=4 3238 B17R0.195 CCCCCCCC#CCOCCCC(=O)NC 34a_200000061759_100000741757 [0,1,0,0,0,0|1,0,2]=4 3239 B17R0.195 CCCCCCCC#CCOCCCC(=O)NC 7a_200000061759_100000741757 [0,1,0,0,0,0|1,0,2]=4 3240 B17R0.195 CCCCCCCC#CCOCCCC(=O)OC 34a_200000061759_100000742333 [0,1,0,0,0,0|0,0,2]=3 3241 B17R0.195 CCCCCCCC#CCOCCCC(=O)OC 7a_200000061759_100011218270 [0,1,0,0,0,0|0,0,2]=3 3242 B17R0.195 CCCCCCCC/C=C/COCCC(=O)NC 34a_200020667288_100012179268 [0,1,0,0,0,0|1,0,2]=4 3243 B17R0.195 CCCCCCCC/C=C/COCCC(=O)NC 7a_200020667288_100000737683 [0,1,0,0,0,0|1,0,2]=4 3244 B17R0.195 CCCCCCCC/C=C/COCCC(=O)OC 34a_200020667288_100000742370 [0,1,0,0,0,0|0,0,2]=3 3245 B17R0.195 CCCCCCCC/C=C/COCCC(=O)OC 7a_200020667288_100000204255 [0,1,0,0,0,0|0,0,2]=3 3246 B17R0.195 CCCCCCCCC/C=C/COCC(=O)CC 7a_100015232335_100000747405 [0,1,0,0,0,0|1,0,2]=4 3247 B17R0.195 CCCCCCCCC/C=C/COCC(=O)NC 34a_100015232335_100000183359 [0,1,0,0,0,0|1,0,2]=4 3248 B17R0.195 CCCCCCCCC/C=C/COCC(=O)NC 7a_100015232335_100000183359 [0,1,0,0,0,0|1,0,2]=4 3249 B17R0.195 CCCCCCCCC/C=C/COCC(=O)OC 34a_100015232335_100000747449 [0,1,0,0,0,0|0,0,2]=3 3250 B17R0.195 CCCCCCCCC/C=C/COCC(=O)OC 7a_100015232335_100000747449 [0,1,0,0,0,0|0,0,2]=3 3251 B17R0.195 CCCCCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218549 [0,1,0,0,0,0|2,0,1]=4 3252 B17R0.195 CCCCCCCCCCCCCCC(=O)CF 1458a_100000297455_100015361967 [0,1,0,0,0,0|2,0,0]=3 3253 B17R0.195 CCCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215471 [0,1,0,0,0,0|2,0,0]=3 3254 B17R0.195 CCCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000297455 [0,1,0,0,0,0|1,0,0]=2 3255 B17R0.195 CCCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000297455 [0,1,0,0,0,0|1,0,0]=2 3256 B17R0.195 CCCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000297455 [0,1,0,0,0,0|1,0,0]=2 3257 B17R0.195 CCCCCCCCCCCCCCN(C)CC 2230a_100000225621_100011215471 [0,1,0,0,0,0|3,0,0]=4 3258 B17R0.195 CCCCCCCCCCCCCCN(C)CC 269982a_100000225621_100011215471 [0,1,0,0,0,0|3,0,0]=4 3259 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 11a_100011215765_100000210414 [0,1,0,0,0,0|1,0,0]=2 3260 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 1626a_100011215765_100000210414 [0,1,0,0,0,0|1,0,0]=2 3261 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 240690a_100011215765_100000210414 [0,1,0,0,0,0|1,0,0]=2 3262 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 527a_100011215765_100000210414 [0,1,0,0,0,0|1,0,0]=2 3263 B17R0.195 CCCCCCCCCCCCCNC(=O)CO 240690a_100011215765_100000210174 [0,1,0,0,0,0|2,0,0]=3 3264 B17R0.195 CCCCCCCCCCCCCNC(=O)CO 527a_100011215765_100000210174 [0,1,0,0,0,0|2,0,0]=3 3265 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 2708a_100011215765_106832991635 [0,1,0,0,0,0|1,0,0]=2 3266 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100011215765 [0,1,0,0,0,0|1,0,0]=2 3267 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 273464a_100011215765_100102657272 [0,1,0,0,0,0|1,0,0]=2 3268 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100011215765 [0,1,0,0,0,0|1,0,0]=2 3269 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 512a_100011215765_100102657272 [0,1,0,0,0,0|1,0,0]=2 3270 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 512a_106832991638_100011215765 [0,1,0,0,0,0|1,0,0]=2 3271 B17R0.195 CCCCCCCCCCCCCNC(C)CC 2230a_100000209981_100000210684 [0,1,0,0,0,0|2,0,1]=4 3272 B17R0.195 CCCCCCCCCCCCCNC(C)CC 2230a_100011215765_100000758301 [0,1,0,0,0,0|2,0,1]=4 3273 B17R0.195 CCCCCCCCCCCCCNC(C)CC 270004a_100000209981_200011215488 [0,1,0,0,0,0|2,0,1]=4 3274 B17R0.195 CCCCCCCCCCCCCNC(C)CC 34a_100011215765_100011215416 [0,1,0,0,0,0|2,0,1]=4 3275 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 2230a_100000210451_100000183359 [0,1,0,0,0,0|1,0,0]=2 3276 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215052 [0,1,0,0,0,0|1,0,0]=2 3277 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 270004a_100000693194_100011218549 [0,1,0,0,0,0|1,0,0]=2 3278 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 34a_100000210451_100000183359 [0,1,0,0,0,0|1,0,0]=2 3279 B17R0.195 CCCCCCCCCCCCNCC(=O)OC 2230a_100000210451_100000747449 [0,1,0,0,0,0|0,0,0]=1 3280 B17R0.195 CCCCCCCCCCCCNCC(=O)OC 34a_100000210451_100000747449 [0,1,0,0,0,0|0,0,0]=1 3281 B17R0.195 CCCCCCCCCCCCNCC(C)CC 2230a_100000210451_100000748023 [0,1,0,0,0,0|2,0,1]=4 3282 B17R0.195 CCCCCCCCCCCCNCC(C)CC 2230a_100020588543_100011215052 [0,1,0,0,0,0|2,0,1]=4 3283 B17R0.195 CCCCCCCCCCCCNCC(C)CC 270004a_100000210451_100000243153 [0,1,0,0,0,0|2,0,1]=4 3284 B17R0.195 CCCCCCCCCCCCNCC(C)CC 270004a_100020588543_100011218549 [0,1,0,0,0,0|2,0,1]=4 3285 B17R0.195 CCCCCCCCCCCCNCC(C)CC 34a_100000210451_100000748023 [0,1,0,0,0,0|2,0,1]=4 3286 B17R0.195 CCCCCCCCCCCCNCC(O)CC 2230a_100000210451_100011218378 [0,1,0,0,0,0|1,0,2]=4 3287 B17R0.195 CCCCCCCCCCCCNCC(O)CC 2230a_100011218483_100011215052 [0,1,0,0,0,0|1,0,2]=4 3288 B17R0.195 CCCCCCCCCCCCNCC(O)CC 270004a_100011218483_100011218549 [0,1,0,0,0,0|1,0,2]=4 3289 B17R0.195 CCCCCCCCCCCCNCC(O)CC 34a_100000210451_100011218378 [0,1,0,0,0,0|1,0,2]=4 3290 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)CC 2230a_100000210451_100009816398 [0,1,0,0,0,0|2,0,1]=4 3291 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)CC 34a_100000210451_100009816398 [0,1,0,0,0,0|2,0,1]=4 3292 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011215052 [0,1,0,0,0,0|1,0,1]=3 3293 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)OC 270004a_100020591295_100011218549 [0,1,0,0,0,0|1,0,1]=3 3294 B17R0.195 CCCCCCCCCCCCOCC(=O)CC 34a_100000725409_100000759014 [0,1,0,0,0,0|1,0,0]=2 3295 B17R0.195 CCCCCCCCCCCCOCC(=O)CC 7a_100000210810_100000747405 [0,1,0,0,0,0|1,0,0]=2 3296 B17R0.195 CCCCCCCCCCCCOCC(=O)NC 34a_100000210810_100000183359 [0,1,0,0,0,0|1,0,0]=2 3297 B17R0.195 CCCCCCCCCCCCOCC(=O)NC 34a_100000750040_100000759014 [0,1,0,0,0,0|1,0,0]=2 3298 B17R0.195 CCCCCCCCCCCCOCC(=O)NC 7a_100000210810_100000183359 [0,1,0,0,0,0|1,0,0]=2 3299 B17R0.195 CCCCCCCCCCCCOCC(=O)OC 34a_100000210810_100000747449 [0,1,0,0,0,0|0,0,0]=1 3300 B17R0.195 CCCCCCCCCCCCOCC(=O)OC 7a_100000210810_100000747449 [0,1,0,0,0,0|0,0,0]=1 3301 B17R0.195 CCCCCCCCCCCCOCC(C)CC 34a_100000210810_100000748023 [0,1,0,0,0,0|2,0,1]=4 3302 B17R0.195 CCCCCCCCCCCCOCC(C)CC 7a_100000210810_100000748023 [0,1,0,0,0,0|2,0,1]=4 3303 B17R0.195 CCCCCCCCCCCCOCC(C)OC 34a_100000690652_100000759014 [0,1,0,0,0,0|1,0,1]=3 3304 B17R0.195 CCCCCCCCCCCCOCC(O)CC 34a_100000210810_100011218378 [0,1,0,0,0,0|1,0,2]=4 3305 B17R0.195 CCCCCCCCCCCCOCC(O)CC 7a_100000210810_100011218378 [0,1,0,0,0,0|1,0,2]=4 3306 B17R0.195 CCCCCCCCCCCCOC[C@@H](C)CC 34a_100000210810_100009816398 [0,1,0,0,0,0|2,0,1]=4 3307 B17R0.195 CCCCCCCCCCCCOC[C@@H](C)CC 7a_100000210810_100009816398 [0,1,0,0,0,0|2,0,1]=4 3308 B17R0.195 CCCCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000759014 [0,1,0,0,0,0|2,0,1]=4 3309 B17R0.195 CCCCCCCCCCCCSCC(=O)CC 62a_100000747405_100000759014 [0,1,0,0,0,0|1,0,0]=2 3310 B17R0.195 CCCCCCCCCCCCSCC(=O)NC 62a_100000183359_100000759014 [0,1,0,0,0,0|1,0,0]=2 3311 B17R0.195 CCCCCCCCCCCCSCC(=O)OC 62a_100000747449_100000759014 [0,1,0,0,0,0|0,0,0]=1 3312 B17R0.195 CCCCCCCCCCCCSCC(O)CC 62a_100011218378_100000759014 [0,1,0,0,0,0|1,0,2]=4 3313 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011215454 [0,1,0,0,0,0|1,0,0]=2 3314 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 2230a_200011215754_100000737683 [0,1,0,0,0,0|1,0,0]=2 3315 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 34a_100000738227_100011215454 [0,1,0,0,0,0|1,0,0]=2 3316 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 34a_200011215754_100012179268 [0,1,0,0,0,0|1,0,0]=2 3317 B17R0.195 CCCCCCCCCCCNCCC(=O)OC 2230a_200011215754_100000204255 [0,1,0,0,0,0|0,0,0]=1 3318 B17R0.195 CCCCCCCCCCCNCCC(=O)OC 34a_200011215754_100000742370 [0,1,0,0,0,0|0,0,0]=1 3319 B17R0.195 CCCCCCCCCCCNCCC(C)CC 2230a_100020591266_100011215454 [0,1,0,0,0,0|2,0,1]=4 3320 B17R0.195 CCCCCCCCCCCOCCC(=NO)N 34a_100000749954_100011215454 [0,1,0,0,0,0|3,0,0]=4 3321 B17R0.195 CCCCCCCCCCCOCCC(=O)NC 34a_100000210809_100012179268 [0,1,0,0,0,0|1,0,0]=2 3322 B17R0.195 CCCCCCCCCCCOCCC(=O)NC 34a_100000754576_100011215454 [0,1,0,0,0,0|1,0,0]=2 3323 B17R0.195 CCCCCCCCCCCOCCC(=O)NC 7a_100000210809_100000737683 [0,1,0,0,0,0|1,0,0]=2 3324 B17R0.195 CCCCCCCCCCCOCCC(=O)OC 34a_100000210809_100000742370 [0,1,0,0,0,0|0,0,0]=1 3325 B17R0.195 CCCCCCCCCCCOCCC(=O)OC 7a_100000210809_100000204255 [0,1,0,0,0,0|0,0,0]=1 3326 B17R0.195 CCCCCCCCCCCOCCC(C)CC 7a_100011215188_100011215454 [0,1,0,0,0,0|2,0,1]=4 3327 B17R0.195 CCCCCCCCCCCOCCC(C)OC 7a_100000764861_100011215454 [0,1,0,0,0,0|1,0,1]=3 3328 B17R0.195 CCCCCCCCCCCSCCC(=O)NC 62a_100000737683_100011215454 [0,1,0,0,0,0|1,0,0]=2 3329 B17R0.195 CCCCCCCCCCCSCCC(=O)OC 62a_100000204255_100011215454 [0,1,0,0,0,0|0,0,0]=1 3330 B17R0.195 CCCCCCCCCCNC/C=C/C(=O)OC 2230a_100000684558_100000742655 [0,1,0,0,0,0|0,0,2]=3 3331 B17R0.195 CCCCCCCCCCNC/C=C/C(=O)OC 34a_100000684558_100000742655 [0,1,0,0,0,0|0,0,2]=3 3332 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 2230a_100000684558_100000741757 [0,1,0,0,0,0|1,0,0]=2 3333 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210320 [0,1,0,0,0,0|1,0,0]=2 3334 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 34a_100000684558_100000741757 [0,1,0,0,0,0|1,0,0]=2 3335 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 34a_100000740002_100000210320 [0,1,0,0,0,0|1,0,0]=2 3336 B17R0.195 CCCCCCCCCCNCCCC(=O)OC 2230a_100000684558_100011218270 [0,1,0,0,0,0|0,0,0]=1 3337 B17R0.195 CCCCCCCCCCNCCCC(=O)OC 34a_100000684558_100000742333 [0,1,0,0,0,0|0,0,0]=1 3338 B17R0.195 CCCCCCCCCCNCCCN(C)CC 2230a_100000684558_100015186262 [0,1,0,0,0,0|3,0,0]=4 3339 B17R0.195 CCCCCCCCCCNCCNC(=O)CC 34a_100132302217_100000210320 [0,1,0,0,0,0|2,0,0]=3 3340 B17R0.195 CCCCCCCCCCNCCNC(=O)NC 34a_100015205895_100000210320 [0,1,0,0,0,0|2,0,0]=3 3341 B17R0.195 CCCCCCCCCCNCCOC(=O)NC 34a_100000684558_200011997002 [0,1,0,0,0,0|2,0,0]=3 3342 B17R0.195 CCCCCCCCCCOC/C=C/C(=O)OC 34a_100000210711_100000742655 [0,1,0,0,0,0|0,0,2]=3 3343 B17R0.195 CCCCCCCCCCOC/C=C/C(=O)OC 7a_100000210711_100000742655 [0,1,0,0,0,0|0,0,2]=3 3344 B17R0.195 CCCCCCCCCCOCCCC(=O)NC 34a_100000210711_100000741757 [0,1,0,0,0,0|1,0,0]=2 3345 B17R0.195 CCCCCCCCCCOCCCC(=O)NC 7a_100000210711_100000741757 [0,1,0,0,0,0|1,0,0]=2 3346 B17R0.195 CCCCCCCCCCOCCCC(=O)NN 34a_100000211488_100000210320 [0,1,0,0,0,0|2,0,0]=3 3347 B17R0.195 CCCCCCCCCCOCCCC(=O)OC 34a_100000210711_100000742333 [0,1,0,0,0,0|0,0,0]=1 3348 B17R0.195 CCCCCCCCCCOCCCC(=O)OC 7a_100000210711_100011218270 [0,1,0,0,0,0|0,0,0]=1 3349 B17R0.195 CCCCCCCCCCOCCCC(C)CC 7a_100011216074_100000210320 [0,1,0,0,0,0|2,0,1]=4 3350 B17R0.195 CCCCCCCCCCOCCCN(C)CC 7a_100000210711_100015186262 [0,1,0,0,0,0|3,0,0]=4 3351 B17R0.195 CCCCCCCCCCOCCNC(=O)CC 34a_200000158885_100000210320 [0,1,0,0,0,0|2,0,0]=3 3352 B17R0.195 CCCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210320 [0,1,0,0,0,0|2,0,0]=3 3353 B17R0.195 CCCCCCCCCCOCCNC(=O)OC 34a_100000757965_100000210320 [0,1,0,0,0,0|1,0,0]=2 3354 B17R0.195 CCCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210320 [0,1,0,0,0,0|2,0,0]=3 3355 B17R0.195 CCCCCCCCCCOCCOC(=O)NC 34a_100000210711_200011997002 [0,1,0,0,0,0|2,0,0]=3 3356 B17R0.195 CCCCCCCCCCOCCOC(=O)NC 7a_100000210711_200011997002 [0,1,0,0,0,0|2,0,0]=3 3357 B17R0.195 CCCCCCCCCCOCCOC(=O)OC 34a_100010262106_100000210320 [0,1,0,0,0,0|1,0,0]=2 3358 B17R0.195 CCCCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210320 [0,1,0,0,0,0|0,0,2]=3 3359 B17R0.195 CCCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210320 [0,1,0,0,0,0|1,0,0]=2 3360 B17R0.195 CCCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210320 [0,1,0,0,0,0|0,0,0]=1 3361 B17R0.195 CCCCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210320 [0,1,0,0,0,0|2,0,0]=3 3362 B17R0.195 CCCCCCCCCNCCCCC(=O)OC 2230a_100000212291_100000204269 [0,1,0,0,0,0|0,0,0]=1 3363 B17R0.195 CCCCCCCCCNCCCCC(=O)OC 34a_100000212291_100000204269 [0,1,0,0,0,0|0,0,0]=1 3364 B17R0.195 CCCCCCCCCNCCOCC(=O)OC 2230a_100000212291_100000090808 [0,1,0,0,0,0|1,0,0]=2 3365 B17R0.195 CCCCCCCCCNCCOCC(=O)OC 34a_100000212291_100000090808 [0,1,0,0,0,0|1,0,0]=2 3366 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 34a_100000059025_100011214924 [0,1,0,0,0,0|0,0,0]=1 3367 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 34a_100000210712_100000204269 [0,1,0,0,0,0|0,0,0]=1 3368 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210328 [0,1,0,0,0,0|0,0,0]=1 3369 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 7a_100000210712_100000204269 [0,1,0,0,0,0|0,0,0]=1 3370 B17R0.195 CCCCCCCCCOCCOCC(=O)OC 34a_100000210712_100000090808 [0,1,0,0,0,0|1,0,0]=2 3371 B17R0.195 CCCCCCCCCOCCOCC(=O)OC 7a_100000210712_100000090808 [0,1,0,0,0,0|1,0,0]=2 3372 B17R0.195 CCCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210670 [0,1,0,0,0,0|0,0,0]=1 3373 B17R0.195 CCCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210670 [0,1,0,0,0,0|1,0,0]=2 3374 B17R0.195 CCCCCCCCNCCCCCC(=O)OC 2230a_100000229939_100009816466 [0,1,0,0,0,0|0,0,0]=1 3375 B17R0.195 CCCCCCCCNCCCCCC(=O)OC 34a_100000229939_100009816466 [0,1,0,0,0,0|0,0,0]=1 3376 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210759 [0,1,0,0,0,0|0,0,0]=1 3377 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 34a_100000210232_100009816466 [0,1,0,0,0,0|0,0,0]=1 3378 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210759 [0,1,0,0,0,0|0,0,0]=1 3379 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 7a_100000210232_100009816466 [0,1,0,0,0,0|0,0,0]=1 3380 B17R0.195 CCCCCCCCOCCCCCC(C)CC 7a_200000035636_100000210759 [0,1,0,0,0,0|2,0,1]=4 3381 B17R0.195 CCCCCCCCSCCCCCC(=O)OC 62a_100000210759_100009816466 [0,1,0,0,0,0|0,0,0]=1 3382 B17R0.195 CCCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210317 [0,1,0,0,0,0|0,0,0]=1 3383 B17R0.195 CCCCCCCNCCCCCCC(=O)OC 2230a_100000229938_100009815986 [0,1,0,0,0,0|0,0,0]=1 3384 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 34a_100000210272_100009815986 [0,1,0,0,0,0|0,0,0]=1 3385 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210614 [0,1,0,0,0,0|0,0,0]=1 3386 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 7a_100000210272_100009815986 [0,1,0,0,0,0|0,0,0]=1 3387 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210614 [0,1,0,0,0,0|0,0,0]=1 3388 B17R0.195 CCCCCCCSCCCCCCC(=O)OC 62a_100000210614_100009815986 [0,1,0,0,0,0|0,0,0]=1 3389 B17R0.195 CCCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210316 [0,1,0,0,0,0|0,0,0]=1 3390 B17R0.195 CCCCCCNCCCCCCCC(=O)OC 2230a_100000210581_100010004213 [0,1,0,0,0,0|0,0,0]=1 3391 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 34a_100000210259_100010004213 [0,1,0,0,0,0|0,0,0]=1 3392 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000210314 [0,1,0,0,0,0|0,0,0]=1 3393 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 7a_100000210259_100010004213 [0,1,0,0,0,0|0,0,0]=1 3394 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210314 [0,1,0,0,0,0|0,0,0]=1 3395 B17R0.195 CCCCCCOCCOCCCCC(=O)OC 34a_100000691444_100000204269 [0,1,0,0,0,0|1,0,0]=2 3396 B17R0.195 CCCCCCOCCOCCCCC(=O)OC 7a_100000691444_100000204269 [0,1,0,0,0,0|1,0,0]=2 3397 B17R0.195 CCCCCCOCCOCCOCC(=O)CC 7a_100000032842_100000747405 [0,1,0,0,0,0|3,0,0]=4 3398 B17R0.195 CCCCCCOCCOCCOCC(=O)NC 34a_100000032842_100000183359 [0,1,0,0,0,0|3,0,0]=4 3399 B17R0.195 CCCCCCOCCOCCOCC(=O)NC 7a_100000032842_100000183359 [0,1,0,0,0,0|3,0,0]=4 3400 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 34a_100000032842_100000747449 [0,1,0,0,0,0|2,0,0]=3 3401 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 34a_100000691444_100000090808 [0,1,0,0,0,0|2,0,0]=3 3402 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000210314 [0,1,0,0,0,0|2,0,0]=3 3403 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 7a_100000032842_100000747449 [0,1,0,0,0,0|2,0,0]=3 3404 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 7a_100000691444_100000090808 [0,1,0,0,0,0|2,0,0]=3 3405 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210314 [0,1,0,0,0,0|2,0,0]=3 3406 B17R0.195 CCCCCCSCCCCCCCC(=O)OC 62a_100000210314_100010004213 [0,1,0,0,0,0|0,0,0]=1 3407 B17R0.195 CCCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210757 [0,1,0,0,0,0|0,0,0]=1 3408 B17R0.195 CCCCCNCCCCCCCCC(=O)OC 2230a_100000209983_100010282707 [0,1,0,0,0,0|0,0,0]=1 3409 B17R0.195 CCCCCNCCOCCCCCC(=O)OC 34a_100000224656_100009816466 [0,1,0,0,0,0|1,0,0]=2 3410 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000718602 [0,1,0,0,0,0|0,0,0]=1 3411 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 34a_100000210253_100010282707 [0,1,0,0,0,0|0,0,0]=1 3412 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210326 [0,1,0,0,0,0|0,0,0]=1 3413 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 7a_100000210253_100010282707 [0,1,0,0,0,0|0,0,0]=1 3414 B17R0.195 CCCCCOCCOCCCCCC(=O)OC 34a_100011215259_100009816466 [0,1,0,0,0,0|1,0,0]=2 3415 B17R0.195 CCCCCOCCOCCCCCC(=O)OC 7a_100011215259_100009816466 [0,1,0,0,0,0|1,0,0]=2 3416 B17R0.195 CCCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000718602 [0,1,0,0,0,0|2,0,0]=3 3417 B17R0.195 CCCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210326 [0,1,0,0,0,0|2,0,0]=3 3418 B17R0.195 CCCCCSCCCCCCCCC(=O)OC 62a_100000210326_100010282707 [0,1,0,0,0,0|0,0,0]=1 3419 B17R0.195 CCCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210326 [0,1,0,0,0,0|0,0,0]=1 3420 B17R0.195 CCCCNCCCCCCCCCC(=O)OC 2230a_100000102301_100009813843 [0,1,0,0,0,0|0,0,0]=1 3421 B17R0.195 CCCCNCCCCCCCCCC(=O)OC 7a_106832991798_100009813843 [0,1,0,0,0,0|0,0,0]=1 3422 B17R0.195 CCCCNCCCCOCCCCC(=O)OC 34a_200011216965_100000204269 [0,1,0,0,0,0|1,0,0]=2 3423 B17R0.195 CCCCNCCCCOCCOCC(=O)OC 34a_200011216965_100000090808 [0,1,0,0,0,0|2,0,0]=3 3424 B17R0.195 CCCCOCCCCCCCCCC(=O)OC 34a_100000210227_100009813843 [0,1,0,0,0,0|0,0,0]=1 3425 B17R0.195 CCCCOCCCCCCCCCC(=O)OC 7a_100000210227_100009813843 [0,1,0,0,0,0|0,0,0]=1 3426 B17R0.195 CCCCOCCCCOCCCCC(=O)OC 34a_200000760531_100000204269 [0,1,0,0,0,0|1,0,0]=2 3427 B17R0.195 CCCCOCCCCOCCCCC(=O)OC 7a_200000760531_100000204269 [0,1,0,0,0,0|1,0,0]=2 3428 B17R0.195 CCCCOCCCCOCCOCC(=O)OC 34a_200000760531_100000090808 [0,1,0,0,0,0|2,0,0]=3 3429 B17R0.195 CCCCOCCCCOCCOCC(=O)OC 7a_200000760531_100000090808 [0,1,0,0,0,0|2,0,0]=3 3430 B17R0.195 CCCCOCCCNCCCCCC(=O)OC 2230a_200000211371_100009816466 [0,1,0,0,0,0|1,0,0]=2 3431 B17R0.195 CCCCOCCCNCCCCCC(=O)OC 34a_200000211371_100009816466 [0,1,0,0,0,0|1,0,0]=2 3432 B17R0.195 CCCCOCCCOCCCCCC(=O)OC 34a_200011215613_100009816466 [0,1,0,0,0,0|1,0,0]=2 3433 B17R0.195 CCCCOCCCOCCCCCC(=O)OC 7a_200011215613_100009816466 [0,1,0,0,0,0|1,0,0]=2 3434 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 34a_100000210238_100009815986 [0,1,0,0,0,0|1,0,0]=2 3435 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 34a_100009863599_100000743108 [0,1,0,0,0,0|1,0,0]=2 3436 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 7a_100000210238_100009815986 [0,1,0,0,0,0|1,0,0]=2 3437 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 7a_100009863599_100000743108 [0,1,0,0,0,0|1,0,0]=2 3438 B17R0.195 CCCCOCCOCCOCCCC(=O)NC 34a_100011215186_100000741757 [0,1,0,0,0,0|3,0,0]=4 3439 B17R0.195 CCCCOCCOCCOCCCC(=O)NC 7a_100011215186_100000741757 [0,1,0,0,0,0|3,0,0]=4 3440 B17R0.195 CCCCOCCOCCOCCCC(=O)OC 34a_100011215186_100000742333 [0,1,0,0,0,0|2,0,0]=3 3441 B17R0.195 CCCCOCCOCCOCCCC(=O)OC 7a_100011215186_100011218270 [0,1,0,0,0,0|2,0,0]=3 3442 B17R0.195 CCCCOCCSCCCCCCC(=O)OC 62a_100000743108_100009815986 [0,1,0,0,0,0|1,0,0]=2 3443 B17R0.195 CCCCOCCSCCCCCCC(=O)OC 62a_100009815986_100000743108 [0,1,0,0,0,0|1,0,0]=2 3444 B17R0.195 CCCCOCOCCCCCCCC(=O)OC 34a_100011022521_100011995733 [0,1,0,0,0,0|1,0,0]=2 3445 B17R0.195 CCCCOCOCCOCCOCC(=O)OC 34a_100011023656_100011995733 [0,1,0,0,0,0|3,0,0]=4 3446 B17R0.195 CCCCOCSCCCCCCCC(=O)OC 62a_100010004213_100011995733 [0,1,0,0,0,0|1,0,0]=2 3447 B17R0.195 CCCCOCSCCCCCCCC(=O)OC 62a_100011995733_100010004213 [0,1,0,0,0,0|1,0,0]=2 3448 B17R0.195 CCCCSCCCCCCCCCC(=O)OC 62a_100000210211_100009813843 [0,1,0,0,0,0|0,0,0]=1 3449 B17R0.195 CCCCSCCNCCCCCCC(=O)OC 2230a_100025743550_100009815986 [0,1,0,0,0,0|1,0,0]=2 3450 B17R0.195 CCCCSCCOCCCCCCC(=O)OC 34a_200000230436_100009815986 [0,1,0,0,0,0|1,0,0]=2 3451 B17R0.195 CCCCSCCOCCCCCCC(=O)OC 7a_200000230436_100009815986 [0,1,0,0,0,0|1,0,0]=2 3452 B17R0.195 CCCNN=CCCCCCCCCC(=O)OC 4a_100000740057_200010166605 [0,1,0,0,0,0|1,0,1]=3 3453 B17R0.195 CCCOCCCCCCCCCCC(=O)OC 34a_100000210258_100009812566 [0,1,0,0,0,0|0,0,0]=1 3454 B17R0.195 CCCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210303 [0,1,0,0,0,0|0,0,0]=1 3455 B17R0.195 CCCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210303 [0,1,0,0,0,0|0,0,0]=1 3456 B17R0.195 CCCOCCCNCCCCCCC(=O)OC 2230a_100011217757_100009815986 [0,1,0,0,0,0|1,0,0]=2 3457 B17R0.195 CCCOCCCNCCCCCCC(=O)OC 34a_100011217757_100009815986 [0,1,0,0,0,0|1,0,0]=2 3458 B17R0.195 CCCOCCNCCCCCCCC(=O)OC 2230a_100161115042_100010004213 [0,1,0,0,0,0|1,0,0]=2 3459 B17R0.195 CCCOCCNCCCCCCCC(=O)OC 34a_100161115042_100010004213 [0,1,0,0,0,0|1,0,0]=2 3460 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 34a_100000752267_100010004213 [0,1,0,0,0,0|1,0,0]=2 3461 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 34a_100011022521_100011215938 [0,1,0,0,0,0|1,0,0]=2 3462 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 7a_100000752267_100010004213 [0,1,0,0,0,0|1,0,0]=2 3463 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215938 [0,1,0,0,0,0|1,0,0]=2 3464 B17R0.195 CCCOCCOCCNCCCCC(=O)OC 2230a_200011904461_100000204269 [0,1,0,0,0,0|2,0,0]=3 3465 B17R0.195 CCCOCCOCCNCCCCC(=O)OC 34a_200011904461_100000204269 [0,1,0,0,0,0|2,0,0]=3 3466 B17R0.195 CCCOCCOCCNCCOCC(=O)OC 2230a_200011904461_100000090808 [0,1,0,0,0,0|3,0,0]=4 3467 B17R0.195 CCCOCCOCCNCCOCC(=O)OC 34a_200011904461_100000090808 [0,1,0,0,0,0|3,0,0]=4 3468 B17R0.195 CCCOCCOCCOCCOCC(=O)OC 34a_100011023656_100011215938 [0,1,0,0,0,0|3,0,0]=4 3469 B17R0.195 CCCOCCOCCOCCOCC(=O)OC 7a_100011023656_100011215938 [0,1,0,0,0,0|3,0,0]=4 3470 B17R0.195 CCCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215938 [0,1,0,0,0,0|1,0,0]=2 3471 B17R0.195 CCCOCCSCCCCCCCC(=O)OC 62a_100011215938_100010004213 [0,1,0,0,0,0|1,0,0]=2 3472 B17R0.195 CCCSCCCCCCCCCCC(=O)OC 62a_100000210303_100009812566 [0,1,0,0,0,0|0,0,0]=1 3473 B17R0.195 CCCSCCNCCCCCCCC(=O)OC 2230a_100020603323_100010004213 [0,1,0,0,0,0|1,0,0]=2 3474 B17R0.195 CCCSCCOCCCCCCCC(=O)OC 34a_200000230433_100010004213 [0,1,0,0,0,0|1,0,0]=2 3475 B17R0.195 CCCSCCOCCCCCCCC(=O)OC 7a_200000230433_100010004213 [0,1,0,0,0,0|1,0,0]=2 3476 B17R0.195 CCN(C)CCCCCCCCCCCCCO 2230a_100000225621_100009812470 [0,1,0,0,0,0|3,0,0]=4 3477 B17R0.195 CCN(C)CCCCCCCCCCCCCO 269982a_100000225621_100009812470 [0,1,0,0,0,0|3,0,0]=4 3478 B17R0.195 CCNCCCCCCCCCCCC(=O)OC 2230a_100015525214_100010983606 [0,1,0,0,0,0|0,0,0]=1 3479 B17R0.195 CCOCCCCCCCCCCCC(=O)OC 34a_100121572206_100010983606 [0,1,0,0,0,0|0,0,0]=1 3480 B17R0.195 CCOCCCCCCCCCOCC(=O)CC 7a_100009875440_100000747405 [0,1,0,0,0,0|2,0,0]=3 3481 B17R0.195 CCOCCCCCCCCCOCC(=O)NC 34a_100009875440_100000183359 [0,1,0,0,0,0|2,0,0]=3 3482 B17R0.195 CCOCCCCCCCCCOCC(=O)NC 7a_100009875440_100000183359 [0,1,0,0,0,0|2,0,0]=3 3483 B17R0.195 CCOCCCCCCCCCOCC(=O)OC 34a_100009875440_100000747449 [0,1,0,0,0,0|1,0,0]=2 3484 B17R0.195 CCOCCCCCCCCCOCC(=O)OC 7a_100009875440_100000747449 [0,1,0,0,0,0|1,0,0]=2 3485 B17R0.195 CCOCCCNCCCCCCCC(=O)OC 2230a_100000210961_100010004213 [0,1,0,0,0,0|1,0,0]=2 3486 B17R0.195 CCOCCCNCCCCCCCC(=O)OC 34a_100000210961_100010004213 [0,1,0,0,0,0|1,0,0]=2 3487 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 34a_100000757476_100010004213 [0,1,0,0,0,0|1,0,0]=2 3488 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 34a_100011022521_100012232248 [0,1,0,0,0,0|1,0,0]=2 3489 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 7a_100000757476_100010004213 [0,1,0,0,0,0|1,0,0]=2 3490 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 7a_100011022521_100012232248 [0,1,0,0,0,0|1,0,0]=2 3491 B17R0.195 CCOCCCOCCOCCOCC(=O)OC 34a_100011023656_100012232248 [0,1,0,0,0,0|3,0,0]=4 3492 B17R0.195 CCOCCCOCCOCCOCC(=O)OC 7a_100011023656_100012232248 [0,1,0,0,0,0|3,0,0]=4 3493 B17R0.195 CCOCCCSCCCCCCCC(=O)OC 62a_100010004213_100012232248 [0,1,0,0,0,0|1,0,0]=2 3494 B17R0.195 CCOCCCSCCCCCCCC(=O)OC 62a_100012232248_100010004213 [0,1,0,0,0,0|1,0,0]=2 3495 B17R0.195 CCOCCNCCCCCCCCC(=O)OC 2230a_102516460346_100010282707 [0,1,0,0,0,0|1,0,0]=2 3496 B17R0.195 CCOCCNCCCCCCCCC(=O)OC 34a_102516460346_100010282707 [0,1,0,0,0,0|1,0,0]=2 3497 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210147 [0,1,0,0,0,0|1,0,0]=2 3498 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 34a_100000210136_100010282707 [0,1,0,0,0,0|1,0,0]=2 3499 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 7a_100000035544_100011215890 [0,1,0,0,0,0|1,0,0]=2 3500 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 7a_100000210136_100010282707 [0,1,0,0,0,0|1,0,0]=2 3501 B17R0.195 CCOCCOCCNCCCCCC(=O)OC 2230a_100102712874_100009816466 [0,1,0,0,0,0|2,0,0]=3 3502 B17R0.195 CCOCCOCCNCCCCCC(=O)OC 34a_100102712874_100009816466 [0,1,0,0,0,0|2,0,0]=3 3503 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 34a_100000074720_100011211534 [0,1,0,0,0,0|2,0,0]=3 3504 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 34a_100000210240_100009816466 [0,1,0,0,0,0|2,0,0]=3 3505 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 7a_100000074720_100011211534 [0,1,0,0,0,0|2,0,0]=3 3506 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 7a_100000210240_100009816466 [0,1,0,0,0,0|2,0,0]=3 3507 B17R0.195 CCOCCOCCOCCNCCC(=O)OC 2230a_100012282185_100000204255 [0,1,0,0,0,0|3,0,0]=4 3508 B17R0.195 CCOCCOCCOCCNCCC(=O)OC 34a_100012282185_100000742370 [0,1,0,0,0,0|3,0,0]=4 3509 B17R0.195 CCOCCOCCOCCOCCC(=O)OC 34a_100000033264_100000742370 [0,1,0,0,0,0|3,0,0]=4 3510 B17R0.195 CCOCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210147 [0,1,0,0,0,0|3,0,0]=4 3511 B17R0.195 CCOCCOCCOCCOCCC(=O)OC 7a_100000033264_100000204255 [0,1,0,0,0,0|3,0,0]=4 3512 B17R0.195 CCOCCOCCOCCOCCC(=O)OC 7a_100010982084_100011215890 [0,1,0,0,0,0|3,0,0]=4 3513 B17R0.195 CCOCCOCCSCCCCCC(=O)OC 62a_100009816466_100011211534 [0,1,0,0,0,0|2,0,0]=3 3514 B17R0.195 CCOCCOCCSCCCCCC(=O)OC 62a_100011211534_100009816466 [0,1,0,0,0,0|2,0,0]=3 3515 B17R0.195 CCOCCSCCCCCCCCC(=O)OC 62a_100000210147_100010282707 [0,1,0,0,0,0|1,0,0]=2 3516 B17R0.195 CCOCCSCCCCCCCCC(=O)OC 62a_100010282707_100011215890 [0,1,0,0,0,0|1,0,0]=2 3517 B17R0.195 CCOCSCCCCCCCCCC(=O)OC 62a_100000739092_100009813843 [0,1,0,0,0,0|1,0,0]=2 3518 B17R0.195 CCSCCCCCCCCCCCC(=O)OC 62a_100000210202_100010983606 [0,1,0,0,0,0|0,0,0]=1 3519 B17R0.195 CCSCCCOCCCCCCCC(=O)OC 34a_100011216438_100010004213 [0,1,0,0,0,0|1,0,0]=2 3520 B17R0.195 CCSCCCOCCCCCCCC(=O)OC 7a_100011216438_100010004213 [0,1,0,0,0,0|1,0,0]=2 3521 B17R0.195 CCSCCNCCCCCCCCC(=O)OC 2230a_100000106463_100010282707 [0,1,0,0,0,0|1,0,0]=2 3522 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 34a_100000035544_100000757381 [0,1,0,0,0,0|1,0,0]=2 3523 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 34a_100000212035_100010282707 [0,1,0,0,0,0|1,0,0]=2 3524 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 7a_100000035544_100000757381 [0,1,0,0,0,0|1,0,0]=2 3525 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 7a_100000212035_100010282707 [0,1,0,0,0,0|1,0,0]=2 3526 B17R0.195 CCSCCOCCOCCOCCC(=O)OC 34a_100010982084_100000757381 [0,1,0,0,0,0|3,0,0]=4 3527 B17R0.195 CCSCCOCCOCCOCCC(=O)OC 7a_100010982084_100000757381 [0,1,0,0,0,0|3,0,0]=4 3528 B17R0.195 CCSCCSCCCCCCCCC(=O)OC 62a_100000757381_100010282707 [0,1,0,0,0,0|1,0,0]=2 3529 B17R0.195 CCSCCSCCCCCCCCC(=O)OC 62a_100010282707_100000757381 [0,1,0,0,0,0|1,0,0]=2 3530 B17R0.195 CNC(=O)CCCCCCCCCCCCCO 240690a_100102657272_100020644313 [0,1,0,0,0,0|1,0,0]=2 3531 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 2230a_100000078944_100000741757 [0,1,0,0,0,0|2,0,0]=3 3532 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 2230a_100000740002_100009813782 [0,1,0,0,0,0|2,0,0]=3 3533 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000741757 [0,1,0,0,0,0|2,0,0]=3 3534 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 34a_100000740002_100009813782 [0,1,0,0,0,0|2,0,0]=3 3535 B17R0.195 CNC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000741757 [0,1,0,0,0,0|2,0,0]=3 3536 B17R0.195 CNC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100000741757 [0,1,0,0,0,0|2,0,0]=3 3537 B17R0.195 CNC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000741757 [0,1,0,0,0,0|2,0,0]=3 3538 B17R0.195 CNC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100000741757 [0,1,0,0,0,0|2,0,0]=3 3539 B17R0.195 CNC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000741757 [0,1,0,0,0,0|2,0,0]=3 3540 B17R0.195 CNC(=O)CCCSCCCCCCCCCO 62a_100000741757_100009813782 [0,1,0,0,0,0|2,0,0]=3 3541 B17R0.195 CNC(=O)CCCSCCCCCCCCCO 62a_100009813782_100000741757 [0,1,0,0,0,0|2,0,0]=3 3542 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000737683 [0,1,0,0,0,0|2,0,0]=3 3543 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 2230a_100000738227_100009813290 [0,1,0,0,0,0|2,0,0]=3 3544 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 34a_100000066964_100012179268 [0,1,0,0,0,0|2,0,0]=3 3545 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 34a_100000738227_100009813290 [0,1,0,0,0,0|2,0,0]=3 3546 B17R0.195 CNC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100012179268 [0,1,0,0,0,0|2,0,0]=3 3547 B17R0.195 CNC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000737683 [0,1,0,0,0,0|2,0,0]=3 3548 B17R0.195 CNC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100012179268 [0,1,0,0,0,0|2,0,0]=3 3549 B17R0.195 CNC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000737683 [0,1,0,0,0,0|2,0,0]=3 3550 B17R0.195 CNC(=O)CCOCCCCCCCCCCN 34a_100000066964_100012179268 [0,1,0,0,0,0|2,0,0]=3 3551 B17R0.195 CNC(=O)CCOCCCCCCCCCCO 34a_100000754576_100009813290 [0,1,0,0,0,0|2,0,0]=3 3552 B17R0.195 CNC(=O)CCSCCCCCCCCCCO 62a_100000737683_200000033068 [0,1,0,0,0,0|2,0,0]=3 3553 B17R0.195 CNC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000737683 [0,1,0,0,0,0|2,0,0]=3 3554 B17R0.195 CNC(=O)CNCCCCCCCCCCCO 2230a_100000693194_100009812471 [0,1,0,0,0,0|2,0,0]=3 3555 B17R0.195 CNC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000183359 [0,1,0,0,0,0|2,0,0]=3 3556 B17R0.195 CNC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000183359 [0,1,0,0,0,0|2,0,0]=3 3557 B17R0.195 CNC(=O)COCCCCCCCCCCCO 34a_100000750040_100009812471 [0,1,0,0,0,0|2,0,0]=3 3558 B17R0.195 CNC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000183359 [0,1,0,0,0,0|2,0,0]=3 3559 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 2708a_100000066677_106832991635 [0,1,0,0,0,0|2,0,0]=3 3560 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 2708a_100102657272_100000066677 [0,1,0,0,0,0|2,0,0]=3 3561 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 273464a_100000066677_100102657272 [0,1,0,0,0,0|2,0,0]=3 3562 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 273464a_100102657272_100000066677 [0,1,0,0,0,0|2,0,0]=3 3563 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 512a_100000066677_100102657272 [0,1,0,0,0,0|2,0,0]=3 3564 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 512a_106832991638_100000066677 [0,1,0,0,0,0|2,0,0]=3 3565 B17R0.195 CNC(=O)NCCNCCCCCCCCCO 34a_100015205895_100009813782 [0,1,0,0,0,0|3,0,0]=4 3566 B17R0.195 CNC(=O)OCCNCCCCCCCCCO 34a_100000078944_200011997002 [0,1,0,0,0,0|3,0,0]=4 3567 B17R0.195 CNC(=O)OCCOCCCCCCCCCBr 34a_100009813782_200011997002 [0,1,0,0,0,0|3,0,0]=4 3568 B17R0.195 CNC(=O)OCCOCCCCCCCCCBr 7a_100009813782_200011997002 [0,1,0,0,0,0|3,0,0]=4 3569 B17R0.195 CNC(=O)OCCOCCCCCCCCCCl 34a_100009868337_200011997002 [0,1,0,0,0,0|3,0,0]=4 3570 B17R0.195 CNC(=O)OCCOCCCCCCCCCCl 7a_100009868337_200011997002 [0,1,0,0,0,0|3,0,0]=4 3571 B17R0.195 CNC(=O)OCCOCCCCCCCCCN 34a_100000078944_200011997002 [0,1,0,0,0,0|3,0,0]=4 3572 B17R0.195 CNC(=O)OCCSCCCCCCCCCO 62a_100009813782_200011997002 [0,1,0,0,0,0|3,0,0]=4 3573 B17R0.195 CNC(=O)OCCSCCCCCCCCCO 62a_200011997002_100009813782 [0,1,0,0,0,0|3,0,0]=4 3574 B17R0.195 CNCCCCCCCCCCCCC(=O)OC 2230a_106832991635_209314222159 [0,1,0,0,0,0|0,0,0]=1 3575 B17R0.195 CNCCCCCCCCCCCCC(=O)OC 34a_100102657272_209314222159 [0,1,0,0,0,0|0,0,0]=1 3576 B17R0.195 CNCCCCCCCCCCCCC(=O)OC 7a_106832991635_209314222159 [0,1,0,0,0,0|0,0,0]=1 3577 B17R0.195 CNCCCCCOCCCCCCC(=O)OC 34a_100000722520_100009815986 [0,1,0,0,0,0|1,0,0]=2 3578 B17R0.195 CNCCCOCCCCCCCCC(=O)OC 34a_100000213112_100010282707 [0,1,0,0,0,0|1,0,0]=2 3579 B17R0.195 CNCCOCCOCCCCCCC(=O)OC 34a_100000228057_100009815986 [0,1,0,0,0,0|2,0,0]=3 3580 B17R0.195 CNCCOCCOCCOCCCC(=O)OC 34a_200014138305_100000742333 [0,1,0,0,0,0|3,0,0]=4 3581 B17R0.195 COC(=O)/C=C/CNCCCCCCCCCO 2230a_100000078944_100000742655 [0,1,0,0,0,0|1,0,2]=4 3582 B17R0.195 COC(=O)/C=C/CNCCCCCCCCCO 34a_100000078944_100000742655 [0,1,0,0,0,0|1,0,2]=4 3583 B17R0.195 COC(=O)/C=C/COCCCCCCCCCBr 34a_100009813782_100000742655 [0,1,0,0,0,0|1,0,2]=4 3584 B17R0.195 COC(=O)/C=C/COCCCCCCCCCBr 7a_100009813782_100000742655 [0,1,0,0,0,0|1,0,2]=4 3585 B17R0.195 COC(=O)/C=C/COCCCCCCCCCCl 34a_100009868337_100000742655 [0,1,0,0,0,0|1,0,2]=4 3586 B17R0.195 COC(=O)/C=C/COCCCCCCCCCCl 7a_100009868337_100000742655 [0,1,0,0,0,0|1,0,2]=4 3587 B17R0.195 COC(=O)/C=C/COCCCCCCCCCN 34a_100000078944_100000742655 [0,1,0,0,0,0|1,0,2]=4 3588 B17R0.195 COC(=O)/C=C/CSCCCCCCCCCO 62a_100000742655_100009813782 [0,1,0,0,0,0|1,0,2]=4 3589 B17R0.195 COC(=O)/C=C/CSCCCCCCCCCO 62a_100009813782_100000742655 [0,1,0,0,0,0|1,0,2]=4 3590 B17R0.195 COC(=O)CCCCCCCCC=NNCCO 4a_100000210001_200010166605 [0,1,0,0,0,0|2,0,1]=4 3591 B17R0.195 COC(=O)CCCCCCCCCCCCSC 62a_200000210301_209314222159 [0,1,0,0,0,0|0,0,0]=1 3592 B17R0.195 COC(=O)CCCCCCCCCCCCS[13CH3] 62a_200025704644_209314222159 [0,1,0,0,0,0|0,0,0]=1 3593 B17R0.195 COC(=O)CCCCCCCCCCCSCF 62a_100015361967_100010983606 [0,1,0,0,0,0|1,0,0]=2 3594 B17R0.195 COC(=O)CCCCCCCCCCNCCF 34a_100000724931_100009812566 [0,1,0,0,0,0|1,0,0]=2 3595 B17R0.195 COC(=O)CCCCCCCCCCNCCO 2230a_100016997473_100009812566 [0,1,0,0,0,0|1,0,0]=2 3596 B17R0.195 COC(=O)CCCCCCCCCCNCCO 34a_100016990907_100009812566 [0,1,0,0,0,0|1,0,0]=2 3597 B17R0.195 COC(=O)CCCCCCCCCCOCC#N 7a_100011003013_100011215382 [0,1,0,0,0,0|1,0,1]=3 3598 B17R0.195 COC(=O)CCCCCCCCCCOCC=O 34a_100011003013_200009817547 [0,1,0,0,0,0|1,0,1]=3 3599 B17R0.195 COC(=O)CCCCCCCCCCOCC=O 7a_100011003013_200015260668 [0,1,0,0,0,0|1,0,1]=3 3600 B17R0.195 COC(=O)CCCCCCCCCCOCCBr 34a_100000211926_100009812566 [0,1,0,0,0,0|1,0,0]=2 3601 B17R0.195 COC(=O)CCCCCCCCCCOCCF 34a_100011003013_100011217306 [0,1,0,0,0,0|1,0,0]=2 3602 B17R0.195 COC(=O)CCCCCCCCCCOCCF 7a_100011003013_100011217306 [0,1,0,0,0,0|1,0,0]=2 3603 B17R0.195 COC(=O)CCCCCCCCCCOCCN 34a_100000210304_100009812566 [0,1,0,0,0,0|1,0,0]=2 3604 B17R0.195 COC(=O)CCCCCCCCCCOCCO 34a_100011003013_100000211926 [0,1,0,0,0,0|1,0,0]=2 3605 B17R0.195 COC(=O)CCCCCCCCCCOCCO 7a_100011003013_100000211926 [0,1,0,0,0,0|1,0,0]=2 3606 B17R0.195 COC(=O)CCCCCCCCCCOCSC 34a_100011003013_100011218213 [0,1,0,0,0,0|1,0,0]=2 3607 B17R0.195 COC(=O)CCCCCCCCCCSCC#N 62a_100011215382_100009812566 [0,1,0,0,0,0|1,0,1]=3 3608 B17R0.195 COC(=O)CCCCCCCCCCSCC=O 62a_200015260668_100009812566 [0,1,0,0,0,0|1,0,1]=3 3609 B17R0.195 COC(=O)CCCCCCCCCCSCCF 62a_100011217306_100009812566 [0,1,0,0,0,0|1,0,0]=2 3610 B17R0.195 COC(=O)CCCCCCCCCCSCCO 62a_100000211926_100009812566 [0,1,0,0,0,0|1,0,0]=2 3611 B17R0.195 COC(=O)CCCCCCCCCCSCSC 62a_100011218213_100009812566 [0,1,0,0,0,0|1,0,0]=2 3612 B17R0.195 COC(=O)CCCCCCCCCNCCCF 2230a_100015189416_100009813843 [0,1,0,0,0,0|1,0,0]=2 3613 B17R0.195 COC(=O)CCCCCCCCCNCCCF 34a_100015189416_100009813843 [0,1,0,0,0,0|1,0,0]=2 3614 B17R0.195 COC(=O)CCCCCCCCCNCCSC 2230a_100020590264_100009813843 [0,1,0,0,0,0|1,0,0]=2 3615 B17R0.195 COC(=O)CCCCCCCCCOCCCBr 34a_100011217188_100009813843 [0,1,0,0,0,0|1,0,0]=2 3616 B17R0.195 COC(=O)CCCCCCCCCOCCCCl 34a_100000230001_100009813843 [0,1,0,0,0,0|1,0,0]=2 3617 B17R0.195 COC(=O)CCCCCCCCCOCCCF 34a_100000759539_100009813843 [0,1,0,0,0,0|1,0,0]=2 3618 B17R0.195 COC(=O)CCCCCCCCCOCCCN 34a_100000182051_100009813843 [0,1,0,0,0,0|1,0,0]=2 3619 B17R0.195 COC(=O)CCCCCCCCCOCCON 34a_100000700252_100009813843 [0,1,0,0,0,0|2,0,0]=3 3620 B17R0.195 COC(=O)CCCCCCCCCOCCSC 34a_100000230434_100009813843 [0,1,0,0,0,0|1,0,0]=2 3621 B17R0.195 COC(=O)CCCCCCCCCOCCSC 7a_100000230434_100009813843 [0,1,0,0,0,0|1,0,0]=2 3622 B17R0.195 COC(=O)CCCCCCCCCSCCC#N 62a_100011215226_100009813843 [0,1,0,0,0,0|1,0,1]=3 3623 B17R0.195 COC(=O)CCCCCCCCCSCCCF 62a_100011934791_100009813843 [0,1,0,0,0,0|1,0,0]=2 3624 B17R0.195 COC(=O)CCCCCCCCCSCCCO 62a_100011215043_100009813843 [0,1,0,0,0,0|1,0,0]=2 3625 B17R0.195 COC(=O)CCCCCCCCCSCCSC 62a_100000212216_100009813843 [0,1,0,0,0,0|1,0,0]=2 3626 B17R0.195 COC(=O)CCCCCCCCCSCSC#N 62a_100000211825_100009813843 [0,1,0,0,0,0|2,0,1]=4 3627 B17R0.195 COC(=O)CCCCCCCCNCCCCO 2230a_100000750430_100010282707 [0,1,0,0,0,0|1,0,0]=2 3628 B17R0.195 COC(=O)CCCCCCCCNCCCCO 34a_100000750430_100010282707 [0,1,0,0,0,0|1,0,0]=2 3629 B17R0.195 COC(=O)CCCCCCCCNCCCSC 2230a_100000749238_100010282707 [0,1,0,0,0,0|1,0,0]=2 3630 B17R0.195 COC(=O)CCCCCCCCOCC#CCCl 34a_200000047223_100010282707 [0,1,0,0,0,0|1,0,2]=4 3631 B17R0.195 COC(=O)CCCCCCCCOCC#CCO 34a_100000035544_200000047223 [0,1,0,0,0,0|1,0,2]=4 3632 B17R0.195 COC(=O)CCCCCCCCOCC#CCO 7a_100000035544_200000047223 [0,1,0,0,0,0|1,0,2]=4 3633 B17R0.195 COC(=O)CCCCCCCCOCCCC#N 7a_100000035544_100000687738 [0,1,0,0,0,0|1,0,1]=3 3634 B17R0.195 COC(=O)CCCCCCCCOCCCC=O 7a_100000035544_200011292268 [0,1,0,0,0,0|1,0,1]=3 3635 B17R0.195 COC(=O)CCCCCCCCOCCCCBr 34a_100011216708_100010282707 [0,1,0,0,0,0|1,0,0]=2 3636 B17R0.195 COC(=O)CCCCCCCCOCCCCCl 34a_100000210776_100010282707 [0,1,0,0,0,0|1,0,0]=2 3637 B17R0.195 COC(=O)CCCCCCCCOCCCCCl 7a_100000210776_100010282707 [0,1,0,0,0,0|1,0,0]=2 3638 B17R0.195 COC(=O)CCCCCCCCOCCCCF 34a_100000035544_100000729493 [0,1,0,0,0,0|1,0,0]=2 3639 B17R0.195 COC(=O)CCCCCCCCOCCCCF 34a_100011995726_100010282707 [0,1,0,0,0,0|1,0,0]=2 3640 B17R0.195 COC(=O)CCCCCCCCOCCCCF 7a_100000035544_100000729493 [0,1,0,0,0,0|1,0,0]=2 3641 B17R0.195 COC(=O)CCCCCCCCOCCCCF 7a_100011995726_100010282707 [0,1,0,0,0,0|1,0,0]=2 3642 B17R0.195 COC(=O)CCCCCCCCOCCCCI 34a_200012148704_100010282707 [0,1,0,0,0,0|1,0,0]=2 3643 B17R0.195 COC(=O)CCCCCCCCOCCCCN 34a_100000750430_100010282707 [0,1,0,0,0,0|1,0,0]=2 3644 B17R0.195 COC(=O)CCCCCCCCOCCCCO 34a_100000035544_100011216708 [0,1,0,0,0,0|1,0,0]=2 3645 B17R0.195 COC(=O)CCCCCCCCOCCCCO 7a_100000035544_100000210776 [0,1,0,0,0,0|1,0,0]=2 3646 B17R0.195 COC(=O)CCCCCCCCOCCCSC 34a_100000690336_100010282707 [0,1,0,0,0,0|1,0,0]=2 3647 B17R0.195 COC(=O)CCCCCCCCOCCCSC 7a_100000690336_100010282707 [0,1,0,0,0,0|1,0,0]=2 3648 B17R0.195 COC(=O)CCCCCCCCSCC#CCO 62a_100010282707_200000047223 [0,1,0,0,0,0|1,0,2]=4 3649 B17R0.195 COC(=O)CCCCCCCCSCC#CCO 62a_200000047223_100010282707 [0,1,0,0,0,0|1,0,2]=4 3650 B17R0.195 COC(=O)CCCCCCCCSCCCC#N 62a_100000687738_100010282707 [0,1,0,0,0,0|1,0,1]=3 3651 B17R0.195 COC(=O)CCCCCCCCSCCCC#N 62a_100010282707_100000687738 [0,1,0,0,0,0|1,0,1]=3 3652 B17R0.195 COC(=O)CCCCCCCCSCCCC=O 62a_100010282707_200011292268 [0,1,0,0,0,0|1,0,1]=3 3653 B17R0.195 COC(=O)CCCCCCCCSCCCC=O 62a_200011292268_100010282707 [0,1,0,0,0,0|1,0,1]=3 3654 B17R0.195 COC(=O)CCCCCCCCSCCCCF 62a_100000729493_100010282707 [0,1,0,0,0,0|1,0,0]=2 3655 B17R0.195 COC(=O)CCCCCCCCSCCCCF 62a_100010282707_100000729493 [0,1,0,0,0,0|1,0,0]=2 3656 B17R0.195 COC(=O)CCCCCCCCSCCCCO 62a_100000210776_100010282707 [0,1,0,0,0,0|1,0,0]=2 3657 B17R0.195 COC(=O)CCCCCCCCSCCCCO 62a_100010282707_100000210776 [0,1,0,0,0,0|1,0,0]=2 3658 B17R0.195 COC(=O)CCCCCCCCSCCSC#N 62a_100000034367_100010282707 [0,1,0,0,0,0|2,0,1]=4 3659 B17R0.195 COC(=O)CCCCCCCCSCCSC#N 62a_100010282707_100000034367 [0,1,0,0,0,0|2,0,1]=4 3660 B17R0.195 COC(=O)CCCCCCCNCCCCCO 2230a_100000762737_100010004213 [0,1,0,0,0,0|1,0,0]=2 3661 B17R0.195 COC(=O)CCCCCCCNCCCCCO 34a_100000762737_100010004213 [0,1,0,0,0,0|1,0,0]=2 3662 B17R0.195 COC(=O)CCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100010004213 [0,1,0,0,0,0|3,0,0]=4 3663 B17R0.195 COC(=O)CCCCCCCNCCOCCO 2230a_100000211614_100010004213 [0,1,0,0,0,0|2,0,0]=3 3664 B17R0.195 COC(=O)CCCCCCCNCCOCCO 34a_100000211614_100010004213 [0,1,0,0,0,0|2,0,0]=3 3665 B17R0.195 COC(=O)CCCCCCCNCCSCCO 2230a_100011219999_100010004213 [0,1,0,0,0,0|2,0,0]=3 3666 B17R0.195 COC(=O)CCCCCCCOCCCCC#N 7a_100011022521_100000211819 [0,1,0,0,0,0|1,0,1]=3 3667 B17R0.195 COC(=O)CCCCCCCOCCCCC=O 7a_100011022521_100000139335 [0,1,0,0,0,0|1,0,1]=3 3668 B17R0.195 COC(=O)CCCCCCCOCCCCCBr 34a_100000746331_100010004213 [0,1,0,0,0,0|1,0,0]=2 3669 B17R0.195 COC(=O)CCCCCCCOCCCCCBr 7a_100000746331_100010004213 [0,1,0,0,0,0|1,0,0]=2 3670 B17R0.195 COC(=O)CCCCCCCOCCCCCCl 34a_100000746330_100010004213 [0,1,0,0,0,0|1,0,0]=2 3671 B17R0.195 COC(=O)CCCCCCCOCCCCCCl 7a_100000746330_100010004213 [0,1,0,0,0,0|1,0,0]=2 3672 B17R0.195 COC(=O)CCCCCCCOCCCCCF 34a_100011022521_100000729378 [0,1,0,0,0,0|1,0,0]=2 3673 B17R0.195 COC(=O)CCCCCCCOCCCCCF 7a_100011022521_100000729378 [0,1,0,0,0,0|1,0,0]=2 3674 B17R0.195 COC(=O)CCCCCCCOCCCCCI 34a_200012148887_100010004213 [0,1,0,0,0,0|1,0,0]=2 3675 B17R0.195 COC(=O)CCCCCCCOCCCCCI 7a_200012148887_100010004213 [0,1,0,0,0,0|1,0,0]=2 3676 B17R0.195 COC(=O)CCCCCCCOCCCCCN 34a_100000762737_100010004213 [0,1,0,0,0,0|1,0,0]=2 3677 B17R0.195 COC(=O)CCCCCCCOCCCCCO 34a_100011022521_100000746330 [0,1,0,0,0,0|1,0,0]=2 3678 B17R0.195 COC(=O)CCCCCCCOCCCCCO 7a_100011022521_100000746330 [0,1,0,0,0,0|1,0,0]=2 3679 B17R0.195 COC(=O)CCCCCCCOCCCCSC 34a_100011217163_100010004213 [0,1,0,0,0,0|1,0,0]=2 3680 B17R0.195 COC(=O)CCCCCCCOCCCCSC 7a_100011217163_100010004213 [0,1,0,0,0,0|1,0,0]=2 3681 B17R0.195 COC(=O)CCCCCCCOCCOCC#N 7a_100011022521_200000047693 [0,1,0,0,0,0|2,0,1]=4 3682 B17R0.195 COC(=O)CCCCCCCOCCOCCBr 34a_100000692535_100010004213 [0,1,0,0,0,0|2,0,0]=3 3683 B17R0.195 COC(=O)CCCCCCCOCCOCCBr 7a_100000692535_100010004213 [0,1,0,0,0,0|2,0,0]=3 3684 B17R0.195 COC(=O)CCCCCCCOCCOCCCl 34a_100011215305_100010004213 [0,1,0,0,0,0|2,0,0]=3 3685 B17R0.195 COC(=O)CCCCCCCOCCOCCCl 7a_100011215305_100010004213 [0,1,0,0,0,0|2,0,0]=3 3686 B17R0.195 COC(=O)CCCCCCCOCCOCCF 34a_200015357709_100010004213 [0,1,0,0,0,0|2,0,0]=3 3687 B17R0.195 COC(=O)CCCCCCCOCCOCCF 7a_200015357709_100010004213 [0,1,0,0,0,0|2,0,0]=3 3688 B17R0.195 COC(=O)CCCCCCCOCCOCCI 34a_100012149058_100010004213 [0,1,0,0,0,0|2,0,0]=3 3689 B17R0.195 COC(=O)CCCCCCCOCCOCCI 7a_100012149058_100010004213 [0,1,0,0,0,0|2,0,0]=3 3690 B17R0.195 COC(=O)CCCCCCCOCCOCCN 34a_100000211614_100010004213 [0,1,0,0,0,0|2,0,0]=3 3691 B17R0.195 COC(=O)CCCCCCCOCCOCCO 34a_100011022521_100000692535 [0,1,0,0,0,0|2,0,0]=3 3692 B17R0.195 COC(=O)CCCCCCCOCCOCCO 7a_100011022521_100011215305 [0,1,0,0,0,0|2,0,0]=3 3693 B17R0.195 COC(=O)CCCCCCCSCCCCC#N 62a_100010004213_100000211819 [0,1,0,0,0,0|1,0,1]=3 3694 B17R0.195 COC(=O)CCCCCCCSCCCCC#N 62a_100011219923_100010004213 [0,1,0,0,0,0|1,0,1]=3 3695 B17R0.195 COC(=O)CCCCCCCSCCCCC=O 62a_100000139335_100010004213 [0,1,0,0,0,0|1,0,1]=3 3696 B17R0.195 COC(=O)CCCCCCCSCCCCC=O 62a_100010004213_100000139335 [0,1,0,0,0,0|1,0,1]=3 3697 B17R0.195 COC(=O)CCCCCCCSCCCCCF 62a_100000729378_100010004213 [0,1,0,0,0,0|1,0,0]=2 3698 B17R0.195 COC(=O)CCCCCCCSCCCCCF 62a_100010004213_100000729378 [0,1,0,0,0,0|1,0,0]=2 3699 B17R0.195 COC(=O)CCCCCCCSCCCCCO 62a_100000746330_100010004213 [0,1,0,0,0,0|1,0,0]=2 3700 B17R0.195 COC(=O)CCCCCCCSCCCCCO 62a_100010004213_100000746330 [0,1,0,0,0,0|1,0,0]=2 3701 B17R0.195 COC(=O)CCCCCCCSCCOCC#N 62a_100010004213_200000047693 [0,1,0,0,0,0|2,0,1]=4 3702 B17R0.195 COC(=O)CCCCCCCSCCOCC#N 62a_200000047693_100010004213 [0,1,0,0,0,0|2,0,1]=4 3703 B17R0.195 COC(=O)CCCCCCCSCCOCCO 62a_100010004213_100011215305 [0,1,0,0,0,0|2,0,0]=3 3704 B17R0.195 COC(=O)CCCCCCCSCCOCCO 62a_100011215305_100010004213 [0,1,0,0,0,0|2,0,0]=3 3705 B17R0.195 COC(=O)CCCCCCNCCCCCCO 2230a_100000686447_100009815986 [0,1,0,0,0,0|1,0,0]=2 3706 B17R0.195 COC(=O)CCCCCCNCCCCCCO 34a_100000686447_100009815986 [0,1,0,0,0,0|1,0,0]=2 3707 B17R0.195 COC(=O)CCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100009815986 [0,1,0,0,0,0|3,0,0]=4 3708 B17R0.195 COC(=O)CCCCCCOCCCCCC#N 7a_100009863599_100009813376 [0,1,0,0,0,0|1,0,1]=3 3709 B17R0.195 COC(=O)CCCCCCOCCCCCC=O 7a_100009863599_100000139337 [0,1,0,0,0,0|1,0,1]=3 3710 B17R0.195 COC(=O)CCCCCCOCCCCCCBr 34a_100011215345_100009815986 [0,1,0,0,0,0|1,0,0]=2 3711 B17R0.195 COC(=O)CCCCCCOCCCCCCBr 7a_100011215345_100009815986 [0,1,0,0,0,0|1,0,0]=2 3712 B17R0.195 COC(=O)CCCCCCOCCCCCCCl 34a_100000766143_100009815986 [0,1,0,0,0,0|1,0,0]=2 3713 B17R0.195 COC(=O)CCCCCCOCCCCCCCl 7a_100000766143_100009815986 [0,1,0,0,0,0|1,0,0]=2 3714 B17R0.195 COC(=O)CCCCCCOCCCCCCF 34a_100000732779_100009815986 [0,1,0,0,0,0|1,0,0]=2 3715 B17R0.195 COC(=O)CCCCCCOCCCCCCF 34a_100009863599_100015922095 [0,1,0,0,0,0|1,0,0]=2 3716 B17R0.195 COC(=O)CCCCCCOCCCCCCF 7a_100000732779_100009815986 [0,1,0,0,0,0|1,0,0]=2 3717 B17R0.195 COC(=O)CCCCCCOCCCCCCF 7a_100009863599_100015922095 [0,1,0,0,0,0|1,0,0]=2 3718 B17R0.195 COC(=O)CCCCCCOCCCCCCN 34a_100000686447_100009815986 [0,1,0,0,0,0|1,0,0]=2 3719 B17R0.195 COC(=O)CCCCCCOCCCCCCO 34a_100009863599_100000766143 [0,1,0,0,0,0|1,0,0]=2 3720 B17R0.195 COC(=O)CCCCCCOCCCCCCO 7a_100009863599_100000766143 [0,1,0,0,0,0|1,0,0]=2 3721 B17R0.195 COC(=O)CCCCCCSCCCCCC#N 62a_100009813376_100009815986 [0,1,0,0,0,0|1,0,1]=3 3722 B17R0.195 COC(=O)CCCCCCSCCCCCC#N 62a_100009815986_100009813376 [0,1,0,0,0,0|1,0,1]=3 3723 B17R0.195 COC(=O)CCCCCCSCCCCCC=O 62a_100000139337_100009815986 [0,1,0,0,0,0|1,0,1]=3 3724 B17R0.195 COC(=O)CCCCCCSCCCCCC=O 62a_100009815986_100000139337 [0,1,0,0,0,0|1,0,1]=3 3725 B17R0.195 COC(=O)CCCCCCSCCCCCCF 62a_100009815986_100015922095 [0,1,0,0,0,0|1,0,0]=2 3726 B17R0.195 COC(=O)CCCCCCSCCCCCCF 62a_100015922095_100009815986 [0,1,0,0,0,0|1,0,0]=2 3727 B17R0.195 COC(=O)CCCCCCSCCCCCCO 62a_100000766143_100009815986 [0,1,0,0,0,0|1,0,0]=2 3728 B17R0.195 COC(=O)CCCCCCSCCCCCCO 62a_100009815986_100000766143 [0,1,0,0,0,0|1,0,0]=2 3729 B17R0.195 COC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100009816466 [0,1,0,0,0,0|1,0,0]=2 3730 B17R0.195 COC(=O)CCCCCNCCCCCCCO 34a_100011996573_100009816466 [0,1,0,0,0,0|1,0,0]=2 3731 B17R0.195 COC(=O)CCCCCNCCCOCCCO 2230a_100011310245_100009816466 [0,1,0,0,0,0|2,0,0]=3 3732 B17R0.195 COC(=O)CCCCCNCCCOCCCO 34a_100011310245_100009816466 [0,1,0,0,0,0|2,0,0]=3 3733 B17R0.195 COC(=O)CCCCCOCCCCCCC#N 7a_100000074720_100009813337 [0,1,0,0,0,0|1,0,1]=3 3734 B17R0.195 COC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100009816466 [0,1,0,0,0,0|1,0,0]=2 3735 B17R0.195 COC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100009816466 [0,1,0,0,0,0|1,0,0]=2 3736 B17R0.195 COC(=O)CCCCCOCCCCCCCN 34a_100011996573_100009816466 [0,1,0,0,0,0|1,0,0]=2 3737 B17R0.195 COC(=O)CCCCCOCCCCCCCO 34a_100000074720_100000760002 [0,1,0,0,0,0|1,0,0]=2 3738 B17R0.195 COC(=O)CCCCCOCCCCCCCO 7a_100000074720_100000760002 [0,1,0,0,0,0|1,0,0]=2 3739 B17R0.195 COC(=O)CCCCCOCCCOCCCN 34a_100011310245_100009816466 [0,1,0,0,0,0|2,0,0]=3 3740 B17R0.195 COC(=O)CCCCCSCCCCCCC#N 62a_100009813337_100009816466 [0,1,0,0,0,0|1,0,1]=3 3741 B17R0.195 COC(=O)CCCCCSCCCCCCC#N 62a_100009816466_100009813337 [0,1,0,0,0,0|1,0,1]=3 3742 B17R0.195 COC(=O)CCCCCSCCCCCCCO 62a_100000760002_100009816466 [0,1,0,0,0,0|1,0,0]=2 3743 B17R0.195 COC(=O)CCCCCSCCCCCCCO 62a_100009816466_100000760002 [0,1,0,0,0,0|1,0,0]=2 3744 B17R0.195 COC(=O)CCCCNCCCCCCCCO 2230a_102515433106_100000204269 [0,1,0,0,0,0|1,0,0]=2 3745 B17R0.195 COC(=O)CCCCNCCCCCCCCO 34a_102515433106_100000204269 [0,1,0,0,0,0|1,0,0]=2 3746 B17R0.195 COC(=O)CCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000204269 [0,1,0,0,0,0|3,0,0]=4 3747 B17R0.195 COC(=O)CCCCNCCOCCOCCO 2230a_100011998139_100000204269 [0,1,0,0,0,0|3,0,0]=4 3748 B17R0.195 COC(=O)CCCCNCCOCCOCCO 34a_100011998139_100000204269 [0,1,0,0,0,0|3,0,0]=4 3749 B17R0.195 COC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100000204269 [0,1,0,0,0,0|1,0,0]=2 3750 B17R0.195 COC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000204269 [0,1,0,0,0,0|1,0,0]=2 3751 B17R0.195 COC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100000204269 [0,1,0,0,0,0|1,0,0]=2 3752 B17R0.195 COC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000204269 [0,1,0,0,0,0|1,0,0]=2 3753 B17R0.195 COC(=O)CCCCOCCCCCCCCN 34a_102515433106_100000204269 [0,1,0,0,0,0|1,0,0]=2 3754 B17R0.195 COC(=O)CCCCOCCCCCCCCO 34a_100000059025_100000033203 [0,1,0,0,0,0|1,0,0]=2 3755 B17R0.195 COC(=O)CCCCOCCCCCCCCO 7a_100000059025_100000033203 [0,1,0,0,0,0|1,0,0]=2 3756 B17R0.195 COC(=O)CCCCOCCCCCNCCN 34a_103619048469_100000204269 [0,1,0,0,0,0|2,0,0]=3 3757 B17R0.195 COC(=O)CCCCOCCOCCOCCBr 34a_100010132937_100000204269 [0,1,0,0,0,0|3,0,0]=4 3758 B17R0.195 COC(=O)CCCCOCCOCCOCCBr 7a_100010132937_100000204269 [0,1,0,0,0,0|3,0,0]=4 3759 B17R0.195 COC(=O)CCCCOCCOCCOCCCl 34a_100000032323_100000204269 [0,1,0,0,0,0|3,0,0]=4 3760 B17R0.195 COC(=O)CCCCOCCOCCOCCCl 7a_100000032323_100000204269 [0,1,0,0,0,0|3,0,0]=4 3761 B17R0.195 COC(=O)CCCCOCCOCCOCCN 34a_100011998139_100000204269 [0,1,0,0,0,0|3,0,0]=4 3762 B17R0.195 COC(=O)CCCCOCCOCCOCCO 34a_100000059025_100000032323 [0,1,0,0,0,0|3,0,0]=4 3763 B17R0.195 COC(=O)CCCCOCCOCCOCCO 7a_100000059025_100000032323 [0,1,0,0,0,0|3,0,0]=4 3764 B17R0.195 COC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000204269 [0,1,0,0,0,0|1,0,0]=2 3765 B17R0.195 COC(=O)CCCCSCCCCCCCCO 62a_100000204269_100000033203 [0,1,0,0,0,0|1,0,0]=2 3766 B17R0.195 COC(=O)CCCCSCCOCCOCCO 62a_100000032323_100000204269 [0,1,0,0,0,0|3,0,0]=4 3767 B17R0.195 COC(=O)CCCCSCCOCCOCCO 62a_100000204269_100000032323 [0,1,0,0,0,0|3,0,0]=4 3768 B17R0.195 COC(=O)CCCNCCCCCCCCCO 2230a_100000078944_100011218270 [0,1,0,0,0,0|1,0,0]=2 3769 B17R0.195 COC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000742333 [0,1,0,0,0,0|1,0,0]=2 3770 B17R0.195 COC(=O)CCCNCCCOCCOCCO 2230a_100011996194_100011218270 [0,1,0,0,0,0|3,0,0]=4 3771 B17R0.195 COC(=O)CCCNCCCOCCOCCO 34a_100011996194_100000742333 [0,1,0,0,0,0|3,0,0]=4 3772 B17R0.195 COC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000742333 [0,1,0,0,0,0|1,0,0]=2 3773 B17R0.195 COC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011218270 [0,1,0,0,0,0|1,0,0]=2 3774 B17R0.195 COC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000742333 [0,1,0,0,0,0|1,0,0]=2 3775 B17R0.195 COC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011218270 [0,1,0,0,0,0|1,0,0]=2 3776 B17R0.195 COC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000742333 [0,1,0,0,0,0|1,0,0]=2 3777 B17R0.195 COC(=O)CCCOCCOCCOCCCN 34a_100011996194_100000742333 [0,1,0,0,0,0|3,0,0]=4 3778 B17R0.195 COC(=O)CCCSCCCCCCCCCO 62a_100009813782_100011218270 [0,1,0,0,0,0|1,0,0]=2 3779 B17R0.195 COC(=O)CCCSCCCCCCCCCO 62a_100011218270_100009813782 [0,1,0,0,0,0|1,0,0]=2 3780 B17R0.195 COC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000204255 [0,1,0,0,0,0|1,0,0]=2 3781 B17R0.195 COC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000742370 [0,1,0,0,0,0|1,0,0]=2 3782 B17R0.195 COC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000742370 [0,1,0,0,0,0|1,0,0]=2 3783 B17R0.195 COC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000204255 [0,1,0,0,0,0|1,0,0]=2 3784 B17R0.195 COC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000742370 [0,1,0,0,0,0|1,0,0]=2 3785 B17R0.195 COC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000204255 [0,1,0,0,0,0|1,0,0]=2 3786 B17R0.195 COC(=O)CCOCCCCCCCCCCN 34a_100000066964_100000742370 [0,1,0,0,0,0|1,0,0]=2 3787 B17R0.195 COC(=O)CCOCCOCCOCCCCF 34a_100010982084_100000729493 [0,1,0,0,0,0|3,0,0]=4 3788 B17R0.195 COC(=O)CCOCCOCCOCCCCF 7a_100010982084_100000729493 [0,1,0,0,0,0|3,0,0]=4 3789 B17R0.195 COC(=O)CCOCCOCCOCCCCO 34a_100010982084_100011216708 [0,1,0,0,0,0|3,0,0]=4 3790 B17R0.195 COC(=O)CCOCCOCCOCCCCO 7a_100010982084_100000210776 [0,1,0,0,0,0|3,0,0]=4 3791 B17R0.195 COC(=O)CCSCCCCCCCCCCO 62a_100000204255_200000033068 [0,1,0,0,0,0|1,0,0]=2 3792 B17R0.195 COC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000204255 [0,1,0,0,0,0|1,0,0]=2 3793 B17R0.195 COC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000747449 [0,1,0,0,0,0|1,0,0]=2 3794 B17R0.195 COC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000747449 [0,1,0,0,0,0|1,0,0]=2 3795 B17R0.195 COC(=O)COCCNCCCCCCCCO 2230a_102515433106_100000090808 [0,1,0,0,0,0|2,0,0]=3 3796 B17R0.195 COC(=O)COCCNCCCCCCCCO 34a_102515433106_100000090808 [0,1,0,0,0,0|2,0,0]=3 3797 B17R0.195 COC(=O)COCCOCCCCCCCCBr 34a_100009813846_100000090808 [0,1,0,0,0,0|2,0,0]=3 3798 B17R0.195 COC(=O)COCCOCCCCCCCCBr 7a_100009813846_100000090808 [0,1,0,0,0,0|2,0,0]=3 3799 B17R0.195 COC(=O)COCCOCCCCCCCCCl 34a_100000033203_100000090808 [0,1,0,0,0,0|2,0,0]=3 3800 B17R0.195 COC(=O)COCCOCCCCCCCCCl 7a_100000033203_100000090808 [0,1,0,0,0,0|2,0,0]=3 3801 B17R0.195 COC(=O)COCCOCCCCCCCCN 34a_102515433106_100000090808 [0,1,0,0,0,0|2,0,0]=3 3802 B17R0.195 COC(=O)COCCOCCCCCNCCN 34a_103619048469_100000090808 [0,1,0,0,0,0|3,0,0]=4 3803 B17R0.195 COC(=O)COCCOCCOCCCCCF 34a_100011023656_100000729378 [0,1,0,0,0,0|3,0,0]=4 3804 B17R0.195 COC(=O)COCCOCCOCCCCCF 7a_100011023656_100000729378 [0,1,0,0,0,0|3,0,0]=4 3805 B17R0.195 COC(=O)COCCOCCOCCCCCO 34a_100011023656_100000746330 [0,1,0,0,0,0|3,0,0]=4 3806 B17R0.195 COC(=O)COCCOCCOCCCCCO 7a_100011023656_100000746330 [0,1,0,0,0,0|3,0,0]=4 3807 B17R0.195 COC(=O)COCCSCCCCCCCCO 62a_100000033203_100000090808 [0,1,0,0,0,0|2,0,0]=3 3808 B17R0.195 COC(=O)COCCSCCCCCCCCO 62a_100000090808_100000033203 [0,1,0,0,0,0|2,0,0]=3 3809 B17R0.195 COC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747449 [0,1,0,0,0,0|1,0,0]=2 3810 B17R0.195 COC(=O)NCCOCCCCCCCCCO 34a_100000757965_100009813782 [0,1,0,0,0,0|2,0,0]=3 3811 B17R0.195 COC(=O)OCCOCCCCCCCCCO 34a_100010262106_100009813782 [0,1,0,0,0,0|2,0,0]=3 3812 B17R0.195 COC(=O)OCSCCCCCCCCCCO 62a_100009813290_100000139417 [0,1,0,0,0,0|2,0,0]=3 3813 B17R0.195 COC(C)CCOCCCCCCCCCCO 7a_100000764861_100009813290 [0,1,0,0,0,0|2,0,1]=4 3814 B17R0.195 COC(C)COCCCCCCCCCCCO 34a_100000690652_100009812471 [0,1,0,0,0,0|2,0,1]=4 3815 B17R0.195 COC(C)SCCCCCCCCCCCCO 62a_100009813331_100009879195 [0,1,0,0,0,0|2,0,1]=4 3816 B17R0.195 COCCCCCCCCCCCCC(=O)OC 34a_100138415774_209314222159 [0,1,0,0,0,0|0,0,0]=1 3817 B17R0.195 COCCCCCCOCCCCCC(=O)OC 34a_100000074720_100011998445 [0,1,0,0,0,0|1,0,0]=2 3818 B17R0.195 COCCCCCCOCCCCCC(=O)OC 34a_200012092642_100009816466 [0,1,0,0,0,0|1,0,0]=2 3819 B17R0.195 COCCCCCCOCCCCCC(=O)OC 7a_100000074720_100011998445 [0,1,0,0,0,0|1,0,0]=2 3820 B17R0.195 COCCCCCCOCCCCCC(=O)OC 7a_200012092642_100009816466 [0,1,0,0,0,0|1,0,0]=2 3821 B17R0.195 COCCCCCCSCCCCCC(=O)OC 62a_100009816466_100011998445 [0,1,0,0,0,0|1,0,0]=2 3822 B17R0.195 COCCCCCCSCCCCCC(=O)OC 62a_100011998445_100009816466 [0,1,0,0,0,0|1,0,0]=2 3823 B17R0.195 COCCCCCNCCCCCCC(=O)OC 2230a_100000747528_100009815986 [0,1,0,0,0,0|1,0,0]=2 3824 B17R0.195 COCCCCCNCCCCCCC(=O)OC 34a_100000747528_100009815986 [0,1,0,0,0,0|1,0,0]=2 3825 B17R0.195 COCCCCOCCCCCCCC(=O)OC 34a_100000740925_100010004213 [0,1,0,0,0,0|1,0,0]=2 3826 B17R0.195 COCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000755781 [0,1,0,0,0,0|1,0,0]=2 3827 B17R0.195 COCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000730899 [0,1,0,0,0,0|1,0,0]=2 3828 B17R0.195 COCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000755781 [0,1,0,0,0,0|3,0,0]=4 3829 B17R0.195 COCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000730899 [0,1,0,0,0,0|3,0,0]=4 3830 B17R0.195 COCCCCSCCCCCCCC(=O)OC 62a_100000730899_100010004213 [0,1,0,0,0,0|1,0,0]=2 3831 B17R0.195 COCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000730899 [0,1,0,0,0,0|1,0,0]=2 3832 B17R0.195 COCCCNCCCCCCCCC(=O)OC 34a_100150723488_100010282707 [0,1,0,0,0,0|1,0,0]=2 3833 B17R0.195 COCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000740836 [0,1,0,0,0,0|1,0,0]=2 3834 B17R0.195 COCCCOCCCCCCCCC(=O)OC 34a_100000740835_100010282707 [0,1,0,0,0,0|1,0,0]=2 3835 B17R0.195 COCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000740836 [0,1,0,0,0,0|1,0,0]=2 3836 B17R0.195 COCCCOCCCOCCCCC(=O)OC 34a_200011215475_100000204269 [0,1,0,0,0,0|2,0,0]=3 3837 B17R0.195 COCCCOCCCOCCCCC(=O)OC 7a_200011215475_100000204269 [0,1,0,0,0,0|2,0,0]=3 3838 B17R0.195 COCCCOCCCOCCOCC(=O)OC 34a_200011215475_100000090808 [0,1,0,0,0,0|3,0,0]=4 3839 B17R0.195 COCCCOCCCOCCOCC(=O)OC 7a_200011215475_100000090808 [0,1,0,0,0,0|3,0,0]=4 3840 B17R0.195 COCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000740836 [0,1,0,0,0,0|3,0,0]=4 3841 B17R0.195 COCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000740836 [0,1,0,0,0,0|3,0,0]=4 3842 B17R0.195 COCCCSCCCCCCCCC(=O)OC 62a_100000709357_100010282707 [0,1,0,0,0,0|1,0,0]=2 3843 B17R0.195 COCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000709357 [0,1,0,0,0,0|1,0,0]=2 3844 B17R0.195 COCCNCCCCCCCCCC(=O)OC 2230a_100000209980_100009813843 [0,1,0,0,0,0|1,0,0]=2 3845 B17R0.195 COCCOCCCCCCCCCC(=O)OC 34a_100000210237_100009813843 [0,1,0,0,0,0|1,0,0]=2 3846 B17R0.195 COCCOCCCNCCCCCC(=O)OC 2230a_100000206027_100009816466 [0,1,0,0,0,0|2,0,0]=3 3847 B17R0.195 COCCOCCCNCCCCCC(=O)OC 34a_100000206027_100009816466 [0,1,0,0,0,0|2,0,0]=3 3848 B17R0.195 COCCOCCCOCCCCCC(=O)OC 34a_100000074720_100011216529 [0,1,0,0,0,0|2,0,0]=3 3849 B17R0.195 COCCOCCCOCCCCCC(=O)OC 7a_100000074720_100011216529 [0,1,0,0,0,0|2,0,0]=3 3850 B17R0.195 COCCOCCCSCCCCCC(=O)OC 62a_100009816466_100011216529 [0,1,0,0,0,0|2,0,0]=3 3851 B17R0.195 COCCOCCCSCCCCCC(=O)OC 62a_100011216529_100009816466 [0,1,0,0,0,0|2,0,0]=3 3852 B17R0.195 COCCOCCNCCCCCCC(=O)OC 2230a_100000745349_100009815986 [0,1,0,0,0,0|2,0,0]=3 3853 B17R0.195 COCCOCCNCCCCCCC(=O)OC 34a_100000745349_100009815986 [0,1,0,0,0,0|2,0,0]=3 3854 B17R0.195 COCCOCCOCCCCCCC(=O)OC 34a_100009863599_100000695917 [0,1,0,0,0,0|2,0,0]=3 3855 B17R0.195 COCCOCCOCCCCCCC(=O)OC 34a_100011215163_100009815986 [0,1,0,0,0,0|2,0,0]=3 3856 B17R0.195 COCCOCCOCCCCCCC(=O)OC 7a_100009863599_100000695917 [0,1,0,0,0,0|2,0,0]=3 3857 B17R0.195 COCCOCCOCCCCCCC(=O)OC 7a_100011215163_100009815986 [0,1,0,0,0,0|2,0,0]=3 3858 B17R0.195 COCCOCCOCCNCCCC(=O)OC 2230a_100012028300_100011218270 [0,1,0,0,0,0|3,0,0]=4 3859 B17R0.195 COCCOCCOCCNCCCC(=O)OC 34a_100012028300_100000742333 [0,1,0,0,0,0|3,0,0]=4 3860 B17R0.195 COCCOCCOCCOCCCC(=O)OC 34a_100000688194_100000742333 [0,1,0,0,0,0|3,0,0]=4 3861 B17R0.195 COCCOCCOCCOCCCC(=O)OC 7a_100000688194_100011218270 [0,1,0,0,0,0|3,0,0]=4 3862 B17R0.195 COCCOCCOCCSCCCC(=O)OC 62a_100011218270_100013367474 [0,1,0,0,0,0|3,0,0]=4 3863 B17R0.195 COCCOCCOCCSCCCC(=O)OC 62a_100013367474_100011218270 [0,1,0,0,0,0|3,0,0]=4 3864 B17R0.195 COCCOCCSCCCCCCC(=O)OC 62a_100000695917_100009815986 [0,1,0,0,0,0|2,0,0]=3 3865 B17R0.195 COCCOCCSCCCCCCC(=O)OC 62a_100009815986_100000695917 [0,1,0,0,0,0|2,0,0]=3 3866 B17R0.195 COCCOCSCCCCCCCC(=O)OC 62a_100000231047_100010004213 [0,1,0,0,0,0|2,0,0]=3 3867 B17R0.195 COCCOCSCCCCCCCC(=O)OC 62a_100010004213_100000231047 [0,1,0,0,0,0|2,0,0]=3 3868 B17R0.195 COCCSCCCCCCCCCC(=O)OC 62a_100000233755_100009813843 [0,1,0,0,0,0|1,0,0]=2 3869 B17R0.195 COCSCCCCCCCCCCC(=O)OC 62a_100000766300_100009812566 [0,1,0,0,0,0|1,0,0]=2 3870 B17R0.195 CO[C@H](C)CNCCCCCCCCCCCO 2230a_100020591295_100009812471 [0,1,0,0,0,0|2,0,1]=4 3871 B17R0.195 NNC(=O)CCCOCCCCCCCCCO 34a_100000211488_100009813782 [0,1,0,0,0,0|3,0,0]=4 3872 B17R0.195 O=C(CO)CCCCCCCCCCCCCO 1458a_100000210174_100009812470 [0,1,0,0,0,0|2,0,0]=3 3873 B17R0.195 O=C(CO)NCCCCCCCCCCCCO 240690a_100000066677_100000210174 [0,1,0,0,0,0|3,0,0]=4 3874 B17R0.250 C#CCC(=O)CCCCCCCCCCCCC 1458a_100000756256_100000184674 [0,1,0,0,0,0|1,0,1]=3 3875 B17R0.250 C#CCC(=O)CCCCCCCCCCCCC 1458a_100011220946_100000210684 [0,1,0,0,0,0|1,0,1]=3 3876 B17R0.250 C#CCC(=O)CCCCCCCCCCCCO 1458a_100011220946_100009813331 [0,1,0,0,0,0|2,0,1]=4 3877 B17R0.250 C#CCC(=O)NCCCCCCCCCCCC 1626a_100000210451_100011220946 [0,1,0,0,0,0|2,0,1]=4 3878 B17R0.250 C#CCC(=O)NCCCCCCCCCCCC 527a_100000210451_100011220946 [0,1,0,0,0,0|2,0,1]=4 3879 B17R0.250 C#CCCCCCCCCCOCC(=O)OCC 34a_100000034437_100000188475 [0,1,0,0,0,0|1,0,2]=4 3880 B17R0.250 C#CCCCCCCCCCOCC(=O)OCC 7a_100000034437_100000188475 [0,1,0,0,0,0|1,0,2]=4 3881 B17R0.250 C#CCCCCCCCCOCCC(=O)OCC 34a_100000065265_100000765890 [0,1,0,0,0,0|1,0,2]=4 3882 B17R0.250 C#CCCCCCCCCOCCC(=O)OCC 7a_100000065265_100011206558 [0,1,0,0,0,0|1,0,2]=4 3883 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 34a_100000054614_100009991533 [0,1,0,0,0,0|1,0,2]=4 3884 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 7a_100000054614_100011215271 [0,1,0,0,0,0|1,0,2]=4 3885 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100153394163 [0,1,0,0,0,0|1,0,2]=4 3886 B17R0.250 C#CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100153394163 [0,1,0,0,0,0|1,0,2]=4 3887 B17R0.250 C#CCCCCCCCSCCCC(=O)OCC 62a_100153394163_100009991533 [0,1,0,0,0,0|1,0,2]=4 3888 B17R0.250 C#CCCCCCCOCCCCC(=O)OCC 34a_100011217361_100000750268 [0,1,0,0,0,0|1,0,2]=4 3889 B17R0.250 C#CCCCCCCOCCCCC(=O)OCC 7a_100011217361_100000750268 [0,1,0,0,0,0|1,0,2]=4 3890 B17R0.250 C#CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100012276617 [0,1,0,0,0,0|1,0,2]=4 3891 B17R0.250 C#CCCCCCCSCCCCC(=O)OCC 62a_100012276617_100000750268 [0,1,0,0,0,0|1,0,2]=4 3892 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 34a_100000766912_100000755133 [0,1,0,0,0,0|1,0,2]=4 3893 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 7a_100000766912_100000755133 [0,1,0,0,0,0|1,0,2]=4 3894 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100012094781 [0,1,0,0,0,0|1,0,2]=4 3895 B17R0.250 C#CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100012094781 [0,1,0,0,0,0|1,0,2]=4 3896 B17R0.250 C#CCCCCCSCCCCCC(=O)OCC 62a_100012094781_100000755133 [0,1,0,0,0,0|1,0,2]=4 3897 B17R0.250 C#CCCCCNCCCCCCC(=O)OCC 2230a_100000706060_100009814379 [0,1,0,0,0,0|1,0,2]=4 3898 B17R0.250 C#CCCCCNCCCCCCC(=O)OCC 34a_100000706060_100009814379 [0,1,0,0,0,0|1,0,2]=4 3899 B17R0.250 C#CCCCCOCCCCCCC(=O)OCC 34a_100000766709_100009814379 [0,1,0,0,0,0|1,0,2]=4 3900 B17R0.250 C#CCCCCOCCCCCCC(=O)OCC 7a_100000766709_100009814379 [0,1,0,0,0,0|1,0,2]=4 3901 B17R0.250 C#CCCCCSCCCCCCC(=O)OCC 62a_100010269958_100009814379 [0,1,0,0,0,0|1,0,2]=4 3902 B17R0.250 C#CCCCNCCCCCCCC(=O)OCC 34a_100000718082_100009991516 [0,1,0,0,0,0|1,0,2]=4 3903 B17R0.250 C#CCCCOCCCCCCCC(=O)OCC 34a_100000215630_100009991516 [0,1,0,0,0,0|1,0,2]=4 3904 B17R0.250 C#CCCCOCCCCCCCC(=O)OCC 7a_100000215630_100009991516 [0,1,0,0,0,0|1,0,2]=4 3905 B17R0.250 C#CCCCSCCCCCCCC(=O)OCC 62a_100011215417_100009991516 [0,1,0,0,0,0|1,0,2]=4 3906 B17R0.250 C#CCCNCCCCCCCCC(=O)OCC 34a_100000755551_100010175975 [0,1,0,0,0,0|1,0,2]=4 3907 B17R0.250 C#CCCOCCCCCCCCC(=O)OCC 34a_100011215631_100010175975 [0,1,0,0,0,0|1,0,2]=4 3908 B17R0.250 C#CCCSCCCCCCCCC(=O)OCC 62a_100000688953_100010175975 [0,1,0,0,0,0|1,0,2]=4 3909 B17R0.250 C#CCNCCCCCCCCCC(=O)OCC 34a_100000212058_100009828014 [0,1,0,0,0,0|1,0,2]=4 3910 B17R0.250 C#CCOCCCCCCCCCC(=O)OCC 34a_100000210247_100009828014 [0,1,0,0,0,0|1,0,2]=4 3911 B17R0.250 C#CCSCCCCCCCCCC(=O)OCC 62a_100000038162_100009828014 [0,1,0,0,0,0|1,0,2]=4 3912 B17R0.250 C/C=C/CCOCCCCCCCC(=O)OCC 34a_100016278192_100009991516 [0,1,0,0,0,0|1,0,2]=4 3913 B17R0.250 C/C=C/COCCCCCCCCC(=O)OCC 34a_100016270725_100010175975 [0,1,0,0,0,0|1,0,2]=4 3914 B17R0.250 C/C=C/CSCCCCCCCCC(=O)OCC 62a_100102629194_100010175975 [0,1,0,0,0,0|1,0,2]=4 3915 B17R0.250 C=CCC(=O)CCCCCCCCCCCCC 1458a_100000210193_100000210684 [0,1,0,0,0,0|1,0,1]=3 3916 B17R0.250 C=CCC(=O)CCCCCCCCCCCCC 1458a_100000756256_100000210623 [0,1,0,0,0,0|1,0,1]=3 3917 B17R0.250 C=CCC(=O)CCCCCCCCCCCCO 1458a_100000210193_100009813331 [0,1,0,0,0,0|2,0,1]=4 3918 B17R0.250 C=CCC(=O)NCCCCCCCCCCCC 11a_100000210451_100000210193 [0,1,0,0,0,0|2,0,1]=4 3919 B17R0.250 C=CCC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000210193 [0,1,0,0,0,0|2,0,1]=4 3920 B17R0.250 C=CCC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000210193 [0,1,0,0,0,0|2,0,1]=4 3921 B17R0.250 C=CCC(=O)NCCCCCCCCCCCC 527a_100000210451_100000210193 [0,1,0,0,0,0|2,0,1]=4 3922 B17R0.250 C=CCCCCCCCCCCCC(=O)C#CC 1458a_100000763181_102130925996 [0,1,0,0,0,0|1,0,2]=4 3923 B17R0.250 C=CCCCCCCCCCCCC(=O)C=CC 1458a_100000210699_102130925996 [0,1,0,0,0,0|1,0,2]=4 3924 B17R0.250 C=CCCCCCCCCCCCC(=O)CCC 1458a_100000211992_102130925996 [0,1,0,0,0,0|1,0,2]=4 3925 B17R0.250 C=CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_102130925996 [0,1,0,0,0,0|1,0,2]=4 3926 B17R0.250 C=CCCCCCCCCCCCC(=O)COC 1458a_100000210968_102130925996 [0,1,0,0,0,0|0,0,2]=3 3927 B17R0.250 C=CCCCCCCCCCCCC(=O)CSC 1458a_100000184570_102130925996 [0,1,0,0,0,0|0,1,2]=4 3928 B17R0.250 C=CCCCCCCCCCNCC(=O)OCC 2230a_100000081888_100000188475 [0,1,0,0,0,0|1,0,2]=4 3929 B17R0.250 C=CCCCCCCCCCNCC(=O)OCC 34a_100000081888_100000188475 [0,1,0,0,0,0|1,0,2]=4 3930 B17R0.250 C=CCCCCCCCCCOCC(=O)OCC 34a_100000038209_100000188475 [0,1,0,0,0,0|1,0,2]=4 3931 B17R0.250 C=CCCCCCCCCCOCC(=O)OCC 7a_100000038209_100000188475 [0,1,0,0,0,0|1,0,2]=4 3932 B17R0.250 C=CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100009814027 [0,1,0,0,0,0|1,0,2]=4 3933 B17R0.250 C=CCCCCCCCCCSCC(=O)OCC 62a_100009814027_100000188475 [0,1,0,0,0,0|1,0,2]=4 3934 B17R0.250 C=CCCCCCCCCOCCC(=O)OCC 34a_100011215194_100000765890 [0,1,0,0,0,0|1,0,2]=4 3935 B17R0.250 C=CCCCCCCCCOCCC(=O)OCC 7a_100011215194_100011206558 [0,1,0,0,0,0|1,0,2]=4 3936 B17R0.250 C=CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100011933949 [0,1,0,0,0,0|1,0,2]=4 3937 B17R0.250 C=CCCCCCCCCSCCC(=O)OCC 62a_100011933949_100000765890 [0,1,0,0,0,0|1,0,2]=4 3938 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 34a_100000730831_100009991533 [0,1,0,0,0,0|1,0,2]=4 3939 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 7a_100000730831_100011215271 [0,1,0,0,0,0|1,0,2]=4 3940 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100012355270 [0,1,0,0,0,0|1,0,2]=4 3941 B17R0.250 C=CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100012355270 [0,1,0,0,0,0|1,0,2]=4 3942 B17R0.250 C=CCCCCCCCSCCCC(=O)OCC 62a_100012355270_100009991533 [0,1,0,0,0,0|1,0,2]=4 3943 B17R0.250 C=CCCCCCCOCCCCC(=O)OCC 34a_200011216477_100000750268 [0,1,0,0,0,0|1,0,2]=4 3944 B17R0.250 C=CCCCCCCOCCCCC(=O)OCC 7a_200011216477_100000750268 [0,1,0,0,0,0|1,0,2]=4 3945 B17R0.250 C=CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100011215473 [0,1,0,0,0,0|1,0,2]=4 3946 B17R0.250 C=CCCCCCCSCCCCC(=O)OCC 62a_100011215473_100000750268 [0,1,0,0,0,0|1,0,2]=4 3947 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 34a_100011216702_100000755133 [0,1,0,0,0,0|1,0,2]=4 3948 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000700193 [0,1,0,0,0,0|1,0,2]=4 3949 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 7a_100011216702_100000755133 [0,1,0,0,0,0|1,0,2]=4 3950 B17R0.250 C=CCCCCCSCCCCCC(=O)OCC 62a_100000700193_100000755133 [0,1,0,0,0,0|1,0,2]=4 3951 B17R0.250 C=CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000700193 [0,1,0,0,0,0|1,0,2]=4 3952 B17R0.250 C=CCCCCNCCCCCCC(=O)OCC 2230a_100000703577_100009814379 [0,1,0,0,0,0|1,0,2]=4 3953 B17R0.250 C=CCCCCNCCCCCCC(=O)OCC 34a_100000703577_100009814379 [0,1,0,0,0,0|1,0,2]=4 3954 B17R0.250 C=CCCCCOCCCCCCC(=O)OCC 34a_100000766645_100009814379 [0,1,0,0,0,0|1,0,2]=4 3955 B17R0.250 C=CCCCCOCCCCCCC(=O)OCC 7a_100000766645_100009814379 [0,1,0,0,0,0|1,0,2]=4 3956 B17R0.250 C=CCCCCSCCCCCCC(=O)OCC 62a_100011215482_100009814379 [0,1,0,0,0,0|1,0,2]=4 3957 B17R0.250 C=CCCCNCCCCCCCC(=O)OCC 2230a_100000700776_100009991516 [0,1,0,0,0,0|1,0,2]=4 3958 B17R0.250 C=CCCCNCCCCCCCC(=O)OCC 34a_100000700776_100009991516 [0,1,0,0,0,0|1,0,2]=4 3959 B17R0.250 C=CCCCOCCCCCCCC(=O)OCC 34a_100000758997_100009991516 [0,1,0,0,0,0|1,0,2]=4 3960 B17R0.250 C=CCCCOCCCCCCCC(=O)OCC 7a_100000758997_100009991516 [0,1,0,0,0,0|1,0,2]=4 3961 B17R0.250 C=CCCCSCCCCCCCC(=O)OCC 62a_100011713584_100009991516 [0,1,0,0,0,0|1,0,2]=4 3962 B17R0.250 C=CCCNCCCCCCCCC(=O)OCC 2230a_100015191253_100010175975 [0,1,0,0,0,0|1,0,2]=4 3963 B17R0.250 C=CCCOCCCCCCCCC(=O)OCC 34a_100011205117_100010175975 [0,1,0,0,0,0|1,0,2]=4 3964 B17R0.250 C=CCCSCCCCCCCCC(=O)OCC 62a_100000754431_100010175975 [0,1,0,0,0,0|1,0,2]=4 3965 B17R0.250 C=CCNCCCCCCCCCC(=O)OCC 2230a_100020586998_100009828014 [0,1,0,0,0,0|1,0,2]=4 3966 B17R0.250 C=CCOCCCCCCCCCC(=O)OCC 34a_200000210373_100009828014 [0,1,0,0,0,0|1,0,2]=4 3967 B17R0.250 C=CCSCCCCCCCCCC(=O)OCC 62a_100000210623_100009828014 [0,1,0,0,0,0|1,0,2]=4 3968 B17R0.250 C=COC(=O)CNCCCCCCCCCCC 2230a_200011215754_100000036128 [0,1,0,0,0,0|1,0,1]=3 3969 B17R0.250 C=COC(=O)CNCCCCCCCCCCC 34a_200011215754_100000036128 [0,1,0,0,0,0|1,0,1]=3 3970 B17R0.250 C=COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000036128 [0,1,0,0,0,0|2,0,1]=4 3971 B17R0.250 C=COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000036128 [0,1,0,0,0,0|2,0,1]=4 3972 B17R0.250 C=COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000036128 [0,1,0,0,0,0|2,0,1]=4 3973 B17R0.250 C=COC(=O)COCCCCCCCCCCC 34a_100000210809_100000036128 [0,1,0,0,0,0|1,0,1]=3 3974 B17R0.250 C=COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000036128 [0,1,0,0,0,0|2,0,1]=4 3975 B17R0.250 C=COC(=O)COCCCCCCCCCCN 34a_100000066964_100000036128 [0,1,0,0,0,0|2,0,1]=4 3976 B17R0.250 C=COC(=O)CSCCCCCCCCCCC 62a_100000036128_100011215454 [0,1,0,0,0,0|1,0,1]=3 3977 B17R0.250 C=COC(=O)CSCCCCCCCCCCO 62a_100000036128_200000033068 [0,1,0,0,0,0|2,0,1]=4 3978 B17R0.250 C=COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000036128 [0,1,0,0,0,0|2,0,1]=4 3979 B17R0.250 CC#CC(=O)CCCCCCCCCCCCC 1458a_100000763181_100000210684 [0,1,0,0,0,0|1,0,0]=2 3980 B17R0.250 CC#CC(=O)CCCCCCCCCCCCO 1458a_100000763181_100009813331 [0,1,0,0,0,0|2,0,0]=3 3981 B17R0.250 CC#CC(=O)CCCCCCOCCCCCO 1458a_100000763181_200132310570 [0,1,0,0,0,0|3,0,0]=4 3982 B17R0.250 CC#CCCOCCCCCCCC(=O)OCC 34a_100000750427_100009991516 [0,1,0,0,0,0|1,0,2]=4 3983 B17R0.250 CC#CCNCCCCCCCCC(=O)OCC 2230a_100000685387_100010175975 [0,1,0,0,0,0|1,0,2]=4 3984 B17R0.250 CC#CCNCCCCCCCCC(=O)OCC 34a_100000685387_100010175975 [0,1,0,0,0,0|1,0,2]=4 3985 B17R0.250 CC#CCOCCCCCCCCC(=O)OCC 34a_100000761923_100010175975 [0,1,0,0,0,0|1,0,2]=4 3986 B17R0.250 CC#CCSCCCCCCCCC(=O)OCC 62a_100000748600_100010175975 [0,1,0,0,0,0|1,0,2]=4 3987 B17R0.250 CC/C=C/CCCOCCCCCC(=O)OCC 34a_100016287902_100000755133 [0,1,0,0,0,0|1,0,2]=4 3988 B17R0.250 CC/C=C/CCCOCCCCCC(=O)OCC 7a_100016287902_100000755133 [0,1,0,0,0,0|1,0,2]=4 3989 B17R0.250 CC/C=C\CCCCCOCCCC(=O)OCC 34a_100016268722_100009991533 [0,1,0,0,0,0|1,0,2]=4 3990 B17R0.250 CC/C=C\CCCCCOCCCC(=O)OCC 7a_100016268722_100011215271 [0,1,0,0,0,0|1,0,2]=4 3991 B17R0.250 CC/C=C\CCCCOCCCCC(=O)OCC 34a_100016287862_100000750268 [0,1,0,0,0,0|1,0,2]=4 3992 B17R0.250 CC/C=C\CCCCOCCCCC(=O)OCC 7a_100016287862_100000750268 [0,1,0,0,0,0|1,0,2]=4 3993 B17R0.250 CC/C=C\CCOCCCCCCC(=O)OCC 34a_100016288707_100009814379 [0,1,0,0,0,0|1,0,2]=4 3994 B17R0.250 CC/C=C\CCOCCCCCCC(=O)OCC 7a_100016288707_100009814379 [0,1,0,0,0,0|1,0,2]=4 3995 B17R0.250 CC/C=C\CCSCCCCCCC(=O)OCC 62a_100015370543_100009814379 [0,1,0,0,0,0|1,0,2]=4 3996 B17R0.250 CC/C=C\COCCCCCCCC(=O)OCC 34a_100016268518_100009991516 [0,1,0,0,0,0|1,0,2]=4 3997 B17R0.250 CC/C=C\CSCCCCCCCC(=O)OCC 62a_100103147603_100009991516 [0,1,0,0,0,0|1,0,2]=4 3998 B17R0.250 CC=CC(=O)CCCCCCCCCCCCC 1458a_100000210699_100000210684 [0,1,0,0,0,0|1,0,0]=2 3999 B17R0.250 CC=CC(=O)CCCCCCCCCCCCO 1458a_100000210699_100009813331 [0,1,0,0,0,0|2,0,0]=3 4000 B17R0.250 CC=CC(=O)CCCCCCOCCCCCO 1458a_100000210699_200132310570 [0,1,0,0,0,0|3,0,0]=4 4001 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 11a_100000210451_100000210699 [0,1,0,0,0,0|2,0,0]=3 4002 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000210699 [0,1,0,0,0,0|2,0,0]=3 4003 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000210699 [0,1,0,0,0,0|2,0,0]=3 4004 B17R0.250 CC=CCCCOCCCCCCC(=O)OCC 34a_100020645299_100009814379 [0,1,0,0,0,0|1,0,2]=4 4005 B17R0.250 CC=CCSCCCCCCCCC(=O)OCC 62a_100000070051_100010175975 [0,1,0,0,0,0|1,0,2]=4 4006 B17R0.250 CCC#CCCCCCCSCCC(=O)OCC 62a_100000765890_200000036426 [0,1,0,0,0,0|1,0,2]=4 4007 B17R0.250 CCC#CCCCCCCSCCC(=O)OCC 62a_200000036426_100000765890 [0,1,0,0,0,0|1,0,2]=4 4008 B17R0.250 CCC#CCCOCCCCCCC(=O)OCC 34a_100000036655_100009814379 [0,1,0,0,0,0|1,0,2]=4 4009 B17R0.250 CCC#CCCOCCCCCCC(=O)OCC 7a_100000036655_100009814379 [0,1,0,0,0,0|1,0,2]=4 4010 B17R0.250 CCC#CCOCCCCCCCC(=O)OCC 34a_100000032950_100009991516 [0,1,0,0,0,0|1,0,2]=4 4011 B17R0.250 CCC#CCSCCCCCCCC(=O)OCC 62a_100009813939_100009991516 [0,1,0,0,0,0|1,0,2]=4 4012 B17R0.250 CCC/C=C/COCCCCCCC(=O)OCC 34a_100016278788_100009814379 [0,1,0,0,0,0|1,0,2]=4 4013 B17R0.250 CCC/C=C/COCCCCCCC(=O)OCC 7a_100016278788_100009814379 [0,1,0,0,0,0|1,0,2]=4 4014 B17R0.250 CCCC#CCCOCCCCCC(=O)OCC 34a_100000042726_100000755133 [0,1,0,0,0,0|1,0,2]=4 4015 B17R0.250 CCCC#CCCOCCCCCC(=O)OCC 7a_100000042726_100000755133 [0,1,0,0,0,0|1,0,2]=4 4016 B17R0.250 CCCC#CCOCCCCCCC(=O)OCC 34a_100000034806_100009814379 [0,1,0,0,0,0|1,0,2]=4 4017 B17R0.250 CCCC#CCOCCCCCCC(=O)OCC 7a_100000034806_100009814379 [0,1,0,0,0,0|1,0,2]=4 4018 B17R0.250 CCCC(=O)CCCCCCCCCCCCO 1458a_100000211992_100009813331 [0,1,0,0,0,0|2,0,0]=3 4019 B17R0.250 CCCC(=O)CCCCCCOCCCCCO 1458a_100000211992_200132310570 [0,1,0,0,0,0|3,0,0]=4 4020 B17R0.250 CCCC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747444 [0,1,0,0,0,0|3,0,0]=4 4021 B17R0.250 CCCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747444 [0,1,0,0,0,0|3,0,0]=4 4022 B17R0.250 CCCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747444 [0,1,0,0,0,0|3,0,0]=4 4023 B17R0.250 CCCC(=O)CSCCCCCCCCCCO 62a_100000747444_200000033068 [0,1,0,0,0,0|3,0,0]=4 4024 B17R0.250 CCCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747444 [0,1,0,0,0,0|3,0,0]=4 4025 B17R0.250 CCCC/C=C/CCCCOCCC(=O)OCC 34a_200020645093_100000765890 [0,1,0,0,0,0|1,0,2]=4 4026 B17R0.250 CCCC/C=C/CCCCOCCC(=O)OCC 7a_200020645093_100011206558 [0,1,0,0,0,0|1,0,2]=4 4027 B17R0.250 CCCC/C=C/COCCCCCC(=O)OCC 34a_200016272032_100000755133 [0,1,0,0,0,0|1,0,2]=4 4028 B17R0.250 CCCC/C=C/COCCCCCC(=O)OCC 7a_200016272032_100000755133 [0,1,0,0,0,0|1,0,2]=4 4029 B17R0.250 CCCC/C=C\CCOCCCCC(=O)OCC 34a_200016286491_100000750268 [0,1,0,0,0,0|1,0,2]=4 4030 B17R0.250 CCCC/C=C\CCOCCCCC(=O)OCC 7a_200016286491_100000750268 [0,1,0,0,0,0|1,0,2]=4 4031 B17R0.250 CCCCC#CCCCCOCCC(=O)OCC 34a_200000066234_100000765890 [0,1,0,0,0,0|1,0,2]=4 4032 B17R0.250 CCCCC#CCCCCOCCC(=O)OCC 7a_200000066234_100011206558 [0,1,0,0,0,0|1,0,2]=4 4033 B17R0.250 CCCCC#CCCCOCCCC(=O)OCC 7a_100012001163_200000047210 [0,1,0,0,0,0|1,0,2]=4 4034 B17R0.250 CCCCC#CCCCSCCCC(=O)OCC 62a_100009991533_200000047210 [0,1,0,0,0,0|1,0,2]=4 4035 B17R0.250 CCCCC#CCCCSCCCC(=O)OCC 62a_200000047210_100009991533 [0,1,0,0,0,0|1,0,2]=4 4036 B17R0.250 CCCCC#CCCOCCCCC(=O)OCC 34a_100000037610_100000750268 [0,1,0,0,0,0|1,0,2]=4 4037 B17R0.250 CCCCC#CCCOCCCCC(=O)OCC 7a_100000037610_100000750268 [0,1,0,0,0,0|1,0,2]=4 4038 B17R0.250 CCCCC#CCOCCCCCC(=O)OCC 34a_200000034558_100000755133 [0,1,0,0,0,0|1,0,2]=4 4039 B17R0.250 CCCCC#CCOCCCCCC(=O)OCC 7a_200000034558_100000755133 [0,1,0,0,0,0|1,0,2]=4 4040 B17R0.250 CCCCC/C=C/COCCCCC(=O)OCC 34a_100016258190_100000750268 [0,1,0,0,0,0|1,0,2]=4 4041 B17R0.250 CCCCC/C=C/COCCCCC(=O)OCC 7a_100016258190_100000750268 [0,1,0,0,0,0|1,0,2]=4 4042 B17R0.250 CCCCC/C=C\CCCOCCC(=O)OCC 34a_100020655193_100000765890 [0,1,0,0,0,0|1,0,2]=4 4043 B17R0.250 CCCCC/C=C\CCCOCCC(=O)OCC 7a_100020655193_100011206558 [0,1,0,0,0,0|1,0,2]=4 4044 B17R0.250 CCCCC/C=C\CCOCCCC(=O)OCC 34a_100016277358_100009991533 [0,1,0,0,0,0|1,0,2]=4 4045 B17R0.250 CCCCC/C=C\CCOCCCC(=O)OCC 7a_100016277358_100011215271 [0,1,0,0,0,0|1,0,2]=4 4046 B17R0.250 CCCCCC#CCCOCCCC(=O)OCC 34a_200000042877_100009991533 [0,1,0,0,0,0|1,0,2]=4 4047 B17R0.250 CCCCCC#CCCOCCCC(=O)OCC 7a_200000042877_100011215271 [0,1,0,0,0,0|1,0,2]=4 4048 B17R0.250 CCCCCC#CCOCCCCC(=O)OCC 34a_200000033628_100000750268 [0,1,0,0,0,0|1,0,2]=4 4049 B17R0.250 CCCCCC#CCOCCCCC(=O)OCC 7a_200000033628_100000750268 [0,1,0,0,0,0|1,0,2]=4 4050 B17R0.250 CCCCCC#CCSCCCCC(=O)OCC 62a_100000750268_100009816472 [0,1,0,0,0,0|1,0,2]=4 4051 B17R0.250 CCCCCC#CCSCCCCC(=O)OCC 62a_100009816472_100000750268 [0,1,0,0,0,0|1,0,2]=4 4052 B17R0.250 CCCCCC/C=C/COCCCC(=O)OCC 34a_200016276170_100009991533 [0,1,0,0,0,0|1,0,2]=4 4053 B17R0.250 CCCCCC/C=C/COCCCC(=O)OCC 7a_200016276170_100011215271 [0,1,0,0,0,0|1,0,2]=4 4054 B17R0.250 CCCCCCC#CCCOCCC(=O)OCC 34a_200000033163_100000765890 [0,1,0,0,0,0|1,0,2]=4 4055 B17R0.250 CCCCCCC#CCCOCCC(=O)OCC 7a_200000033163_100011206558 [0,1,0,0,0,0|1,0,2]=4 4056 B17R0.250 CCCCCCC#CCOCCCC(=O)OCC 34a_200000037284_100009991533 [0,1,0,0,0,0|1,0,2]=4 4057 B17R0.250 CCCCCCC#CCOCCCC(=O)OCC 7a_200000037284_100011215271 [0,1,0,0,0,0|1,0,2]=4 4058 B17R0.250 CCCCCCCC#CCOCCC(=O)OCC 34a_200000061759_100000765890 [0,1,0,0,0,0|1,0,2]=4 4059 B17R0.250 CCCCCCCC#CCOCCC(=O)OCC 7a_200000061759_100011206558 [0,1,0,0,0,0|1,0,2]=4 4060 B17R0.250 CCCCCCCC/C=C/COCC(=O)OCC 34a_200020667288_100000188475 [0,1,0,0,0,0|1,0,2]=4 4061 B17R0.250 CCCCCCCC/C=C/COCC(=O)OCC 7a_200020667288_100000188475 [0,1,0,0,0,0|1,0,2]=4 4062 B17R0.250 CCCCCCCCCCC=NNC(=O)COC 4a_100000216845_100011218819 [0,1,0,0,0,0|2,0,1]=4 4063 B17R0.250 CCCCCCCCCCCCCC(=O)CC#N 1458a_100000756256_100011214920 [0,1,0,0,0,0|1,0,1]=3 4064 B17R0.250 CCCCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210684 [0,1,0,0,0,0|1,0,1]=3 4065 B17R0.250 CCCCCCCCCCCCCC(=O)CCF 1458a_100000756256_100011217306 [0,1,0,0,0,0|1,0,0]=2 4066 B17R0.250 CCCCCCCCCCCCCC(=O)CCO 1458a_100000756256_100000211926 [0,1,0,0,0,0|1,0,0]=2 4067 B17R0.250 CCCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210684 [0,1,0,0,0,0|1,0,0]=2 4068 B17R0.250 CCCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000210684 [0,1,0,0,0,0|0,0,0]=1 4069 B17R0.250 CCCCCCCCCCCCCC(=O)CSC 1458a_100000184570_100000210684 [0,1,0,0,0,0|0,1,0]=2 4070 B17R0.250 CCCCCCCCCCCCCC(=O)NCC 11a_100015525214_100000756256 [0,1,0,0,0,0|1,0,0]=2 4071 B17R0.250 CCCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000756256 [0,1,0,0,0,0|1,0,0]=2 4072 B17R0.250 CCCCCCCCCCCCCC(=O)NNC 22a_100016993582_100000756256 [0,1,0,0,0,0|1,0,0]=2 4073 B17R0.250 CCCCCCCCCCCCCC(C)NCC 270004a_100015525214_100011216122 [0,1,0,0,0,0|2,0,1]=4 4074 B17R0.250 CCCCCCCCCCCCCN(C)CCC 2230a_100000747261_100000210684 [0,1,0,0,0,0|3,0,0]=4 4075 B17R0.250 CCCCCCCCCCCCCN(C)CCC 269982a_100000747261_100000210684 [0,1,0,0,0,0|3,0,0]=4 4076 B17R0.250 CCCCCCCCCCCCCN(C)CCC 270004a_100000747261_200011215488 [0,1,0,0,0,0|3,0,0]=4 4077 B17R0.250 CCCCCCCCCCCCCN(C)CCO 2230a_100000210263_100000210684 [0,1,0,0,0,0|3,0,0]=4 4078 B17R0.250 CCCCCCCCCCCCCN(C)CCO 269982a_100000210263_100000210684 [0,1,0,0,0,0|3,0,0]=4 4079 B17R0.250 CCCCCCCCCCCCCN(C)CCO 270004a_100000210263_200011215488 [0,1,0,0,0,0|3,0,0]=4 4080 B17R0.250 CCCCCCCCCCCCNC(=O)C=CBr 1626a_100000210451_100016273825 [0,1,0,0,0,0|2,0,1]=4 4081 B17R0.250 CCCCCCCCCCCCNC(=O)C=CBr 240690a_100000210451_100016273825 [0,1,0,0,0,0|2,0,1]=4 4082 B17R0.250 CCCCCCCCCCCCNC(=O)C=CCl 11a_100000210451_200016279998 [0,1,0,0,0,0|2,0,1]=4 4083 B17R0.250 CCCCCCCCCCCCNC(=O)C=CCl 1626a_100000210451_200016279998 [0,1,0,0,0,0|2,0,1]=4 4084 B17R0.250 CCCCCCCCCCCCNC(=O)C=CCl 240690a_100000210451_200016279998 [0,1,0,0,0,0|2,0,1]=4 4085 B17R0.250 CCCCCCCCCCCCNC(=O)C=CI 1626a_100000210451_100016256311 [0,1,0,0,0,0|2,0,1]=4 4086 B17R0.250 CCCCCCCCCCCCNC(=O)CC#N 1626a_100000210451_100051588842 [0,1,0,0,0,0|2,0,1]=4 4087 B17R0.250 CCCCCCCCCCCCNC(=O)CC#N 240690a_100000210451_100051588842 [0,1,0,0,0,0|2,0,1]=4 4088 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 11a_100000210451_100000211992 [0,1,0,0,0,0|2,0,0]=3 4089 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 1626a_100000210451_100000211992 [0,1,0,0,0,0|2,0,0]=3 4090 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 240690a_100000210451_100000211992 [0,1,0,0,0,0|2,0,0]=3 4091 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 527a_100000210451_100000211992 [0,1,0,0,0,0|2,0,0]=3 4092 B17R0.250 CCCCCCCCCCCCNC(=O)CCO 240690a_100000210451_100011216618 [0,1,0,0,0,0|2,0,0]=3 4093 B17R0.250 CCCCCCCCCCCCNC(=O)COC 11a_100000210451_100000210968 [0,1,0,0,0,0|1,0,0]=2 4094 B17R0.250 CCCCCCCCCCCCNC(=O)COC 1626a_100000210451_100000210968 [0,1,0,0,0,0|1,0,0]=2 4095 B17R0.250 CCCCCCCCCCCCNC(=O)COC 240690a_100000210451_100000210968 [0,1,0,0,0,0|1,0,0]=2 4096 B17R0.250 CCCCCCCCCCCCNC(=O)COC 527a_100000210451_100000210968 [0,1,0,0,0,0|1,0,0]=2 4097 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 11a_100000210451_100000184570 [0,1,0,0,0,0|1,1,0]=3 4098 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 1626a_100000210451_100000184570 [0,1,0,0,0,0|1,1,0]=3 4099 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 240690a_100000210451_100000184570 [0,1,0,0,0,0|1,1,0]=3 4100 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 527a_100000210451_100000184570 [0,1,0,0,0,0|1,1,0]=3 4101 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 2708a_100000210451_100015525214 [0,1,0,0,0,0|2,0,0]=3 4102 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000210451 [0,1,0,0,0,0|2,0,0]=3 4103 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 273464a_100000210451_100015525214 [0,1,0,0,0,0|2,0,0]=3 4104 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000210451 [0,1,0,0,0,0|2,0,0]=3 4105 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 512a_100000210451_100015525214 [0,1,0,0,0,0|2,0,0]=3 4106 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 512a_100015525214_100000210451 [0,1,0,0,0,0|2,0,0]=3 4107 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 273464a_100000210451_100016993582 [0,1,0,0,0,0|2,0,0]=3 4108 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 512a_100000210451_100016993582 [0,1,0,0,0,0|2,0,0]=3 4109 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 512a_100016993582_100000210451 [0,1,0,0,0,0|2,0,0]=3 4110 B17R0.250 CCCCCCCCCCCCNC(C)COC 2230a_100000210451_100000765312 [0,1,0,0,0,0|2,0,1]=4 4111 B17R0.250 CCCCCCCCCCCCNC(C)COC 270004a_100000210451_100000749346 [0,1,0,0,0,0|2,0,1]=4 4112 B17R0.250 CCCCCCCCCCCCNC(C)COC 34a_100000210451_100000765312 [0,1,0,0,0,0|2,0,1]=4 4113 B17R0.250 CCCCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100011215052 [0,1,0,0,0,0|2,0,1]=4 4114 B17R0.250 CCCCCCCCCCCCN[C@H](C)COC 270004a_100000764878_100011218549 [0,1,0,0,0,0|2,0,1]=4 4115 B17R0.250 CCCCCCCCCCCCOC(C)COC 34a_100000210810_100000765312 [0,1,0,0,0,0|2,0,1]=4 4116 B17R0.250 CCCCCCCCCCCCOC(C)COC 7a_100000210810_100000765312 [0,1,0,0,0,0|2,0,1]=4 4117 B17R0.250 CCCCCCCCCCCCO[C@H](C)COC 34a_100011934205_100000759014 [0,1,0,0,0,0|2,0,1]=4 4118 B17R0.250 CCCCCCCCCCCCSC(C)COC 62a_100000765312_100000759014 [0,1,0,0,0,0|2,0,1]=4 4119 B17R0.250 CCCCCCCCCCCNCC(=O)CCC 2230a_200011215754_100000747444 [0,1,0,0,0,0|2,0,0]=3 4120 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011215454 [0,1,0,0,0,0|2,0,0]=3 4121 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 2230a_200011215754_100000183381 [0,1,0,0,0,0|2,0,0]=3 4122 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 34a_200011215754_100000183381 [0,1,0,0,0,0|2,0,0]=3 4123 B17R0.250 CCCCCCCCCCCNCC(=O)NCO 2230a_200011215754_100000185155 [0,1,0,0,0,0|2,0,0]=3 4124 B17R0.250 CCCCCCCCCCCNCC(=O)NCO 34a_200011215754_100000185155 [0,1,0,0,0,0|2,0,0]=3 4125 B17R0.250 CCCCCCCCCCCNCC(=O)OCC 2230a_200011215754_100000188475 [0,1,0,0,0,0|1,0,0]=2 4126 B17R0.250 CCCCCCCCCCCNCC(=O)OCC 34a_200011215754_100000188475 [0,1,0,0,0,0|1,0,0]=2 4127 B17R0.250 CCCCCCCCCCCNCC(O)COC 2230a_100000756049_100011215454 [0,1,0,0,0,0|1,0,2]=4 4128 B17R0.250 CCCCCCCCCCCNCC(O)COC 34a_100000756049_100011215454 [0,1,0,0,0,0|1,0,2]=4 4129 B17R0.250 CCCCCCCCCCCNCC(O)COC 34a_200011215754_100011215053 [0,1,0,0,0,0|1,0,2]=4 4130 B17R0.250 CCCCCCCCCCCOCC(=O)CCC 7a_100000210809_100000747444 [0,1,0,0,0,0|2,0,0]=3 4131 B17R0.250 CCCCCCCCCCCOCC(=O)NCC 34a_100000210809_100000183381 [0,1,0,0,0,0|2,0,0]=3 4132 B17R0.250 CCCCCCCCCCCOCC(=O)NCC 7a_100000210809_100000183381 [0,1,0,0,0,0|2,0,0]=3 4133 B17R0.250 CCCCCCCCCCCOCC(=O)NCO 34a_100000210809_100000185155 [0,1,0,0,0,0|2,0,0]=3 4134 B17R0.250 CCCCCCCCCCCOCC(=O)NCO 7a_100000210809_100000185155 [0,1,0,0,0,0|2,0,0]=3 4135 B17R0.250 CCCCCCCCCCCOCC(=O)OCC 34a_100000210809_100000188475 [0,1,0,0,0,0|1,0,0]=2 4136 B17R0.250 CCCCCCCCCCCOCC(=O)OCC 7a_100000210809_100000188475 [0,1,0,0,0,0|1,0,0]=2 4137 B17R0.250 CCCCCCCCCCCOCC(N)COC 34a_100000724102_100011215454 [0,1,0,0,0,0|2,0,1]=4 4138 B17R0.250 CCCCCCCCCCCOCC(O)COC 34a_100000210809_100011215053 [0,1,0,0,0,0|1,0,2]=4 4139 B17R0.250 CCCCCCCCCCCOCC(O)COC 7a_100000210809_100011215053 [0,1,0,0,0,0|1,0,2]=4 4140 B17R0.250 CCCCCCCCCCCSCC(=O)CCC 62a_100000747444_100011215454 [0,1,0,0,0,0|2,0,0]=3 4141 B17R0.250 CCCCCCCCCCCSCC(=O)NCC 62a_100000183381_100011215454 [0,1,0,0,0,0|2,0,0]=3 4142 B17R0.250 CCCCCCCCCCCSCC(=O)NCO 62a_100000185155_100011215454 [0,1,0,0,0,0|2,0,0]=3 4143 B17R0.250 CCCCCCCCCCCSCC(=O)OCC 62a_100000188475_100011215454 [0,1,0,0,0,0|1,0,0]=2 4144 B17R0.250 CCCCCCCCCCCSCC(O)COC 62a_100011215053_100011215454 [0,1,0,0,0,0|1,0,2]=4 4145 B17R0.250 CCCCCCCCCCNCCC(=O)NCC 2230a_100000684558_100000737597 [0,1,0,0,0,0|2,0,0]=3 4146 B17R0.250 CCCCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210320 [0,1,0,0,0,0|2,0,0]=3 4147 B17R0.250 CCCCCCCCCCNCCC(=O)OCC 2230a_100000684558_100011206558 [0,1,0,0,0,0|1,0,0]=2 4148 B17R0.250 CCCCCCCCCCNCCC(=O)OCC 34a_100000684558_100000765890 [0,1,0,0,0,0|1,0,0]=2 4149 B17R0.250 CCCCCCCCCCNCOC(=O)CCC 2230a_100000684558_100000034017 [0,1,0,0,0,0|3,0,0]=4 4150 B17R0.250 CCCCCCCCCCNCOC(=O)CCC 34a_100000684558_100000034017 [0,1,0,0,0,0|3,0,0]=4 4151 B17R0.250 CCCCCCCCCCOCCC(=O)NCC 7a_100000210711_100000737597 [0,1,0,0,0,0|2,0,0]=3 4152 B17R0.250 CCCCCCCCCCOCCC(=O)OCC 34a_100000210711_100000765890 [0,1,0,0,0,0|1,0,0]=2 4153 B17R0.250 CCCCCCCCCCOCCC(=O)OCC 7a_100000210711_100011206558 [0,1,0,0,0,0|1,0,0]=2 4154 B17R0.250 CCCCCCCCCCOCOC(=O)CCC 34a_100000210711_100000034017 [0,1,0,0,0,0|3,0,0]=4 4155 B17R0.250 CCCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210320 [0,1,0,0,0,0|2,0,0]=3 4156 B17R0.250 CCCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210320 [0,1,0,0,0,0|1,0,0]=2 4157 B17R0.250 CCCCCCCCCNC/C=C/C(=O)OCC 2230a_100000212291_100016267167 [0,1,0,0,0,0|1,0,2]=4 4158 B17R0.250 CCCCCCCCCNC/C=C/C(=O)OCC 34a_100000212291_100016267167 [0,1,0,0,0,0|1,0,2]=4 4159 B17R0.250 CCCCCCCCCNCCCC(=O)OCC 2230a_100000212291_100009991533 [0,1,0,0,0,0|1,0,0]=2 4160 B17R0.250 CCCCCCCCCNCCCC(=O)OCC 34a_100000212291_100009991533 [0,1,0,0,0,0|1,0,0]=2 4161 B17R0.250 CCCCCCCCCOC/C=C/C(=O)OCC 34a_100000210712_100016267167 [0,1,0,0,0,0|1,0,2]=4 4162 B17R0.250 CCCCCCCCCOC/C=C/C(=O)OCC 7a_100000210712_100016267167 [0,1,0,0,0,0|1,0,2]=4 4163 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 34a_100000210712_100009991533 [0,1,0,0,0,0|1,0,0]=2 4164 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 7a_100000210712_100011215271 [0,1,0,0,0,0|1,0,0]=2 4165 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210328 [0,1,0,0,0,0|1,0,0]=2 4166 B17R0.250 CCCCCCCCCOCCNC(=O)OCC 34a_100000158857_100011214924 [0,1,0,0,0,0|2,0,0]=3 4167 B17R0.250 CCCCCCCCCOCCNC(=O)OCC 7a_100000210712_200011445536 [0,1,0,0,0,0|2,0,0]=3 4168 B17R0.250 CCCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210670 [0,1,0,0,0,0|1,0,2]=4 4169 B17R0.250 CCCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210670 [0,1,0,0,0,0|1,0,0]=2 4170 B17R0.250 CCCCCCCCNCCCCC(=O)OCC 2230a_100000229939_100000750268 [0,1,0,0,0,0|1,0,0]=2 4171 B17R0.250 CCCCCCCCNCCCCC(=O)OCC 34a_100000229939_100000750268 [0,1,0,0,0,0|1,0,0]=2 4172 B17R0.250 CCCCCCCCNCCOCC(=O)OCC 2230a_100000229939_100000088970 [0,1,0,0,0,0|2,0,0]=3 4173 B17R0.250 CCCCCCCCNCCOCC(=O)OCC 34a_100000229939_100000088970 [0,1,0,0,0,0|2,0,0]=3 4174 B17R0.250 CCCCCCCCOCCCCC(=O)OCC 34a_100000210232_100000750268 [0,1,0,0,0,0|1,0,0]=2 4175 B17R0.250 CCCCCCCCOCCCCC(=O)OCC 7a_100000210232_100000750268 [0,1,0,0,0,0|1,0,0]=2 4176 B17R0.250 CCCCCCCCOCCOCC(=O)OCC 34a_100000210232_100000088970 [0,1,0,0,0,0|2,0,0]=3 4177 B17R0.250 CCCCCCCCOCCOCC(=O)OCC 7a_100000210232_100000088970 [0,1,0,0,0,0|2,0,0]=3 4178 B17R0.250 CCCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210759 [0,1,0,0,0,0|2,0,0]=3 4179 B17R0.250 CCCCCCCCSCCCCC(=O)OCC 62a_100000210759_100000750268 [0,1,0,0,0,0|1,0,0]=2 4180 B17R0.250 CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210317 [0,1,0,0,0,0|1,0,0]=2 4181 B17R0.250 CCCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210317 [0,1,0,0,0,0|2,0,0]=3 4182 B17R0.250 CCCCCCCCSCCOCC(=O)OCC 62a_100000210759_100000088970 [0,1,0,0,0,0|2,0,0]=3 4183 B17R0.250 CCCCCCCNCCCCCC(=O)OCC 2230a_100000229938_100000755133 [0,1,0,0,0,0|1,0,0]=2 4184 B17R0.250 CCCCCCCNCCCOCC(=O)OCC 2230a_100000229938_100009893628 [0,1,0,0,0,0|2,0,0]=3 4185 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 34a_100000210272_100000755133 [0,1,0,0,0,0|1,0,0]=2 4186 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 7a_100000210272_100000755133 [0,1,0,0,0,0|1,0,0]=2 4187 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210614 [0,1,0,0,0,0|1,0,0]=2 4188 B17R0.250 CCCCCCCOCCCOCC(=O)OCC 34a_100000210272_100009893628 [0,1,0,0,0,0|2,0,0]=3 4189 B17R0.250 CCCCCCCOCCCOCC(=O)OCC 7a_100000210272_100009893628 [0,1,0,0,0,0|2,0,0]=3 4190 B17R0.250 CCCCCCCSCCCCCC(=O)OCC 62a_100000210614_100000755133 [0,1,0,0,0,0|1,0,0]=2 4191 B17R0.250 CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210316 [0,1,0,0,0,0|1,0,0]=2 4192 B17R0.250 CCCCCCCSCCCOCC(=O)OCC 62a_100000210614_100009893628 [0,1,0,0,0,0|2,0,0]=3 4193 B17R0.250 CCCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210316 [0,1,0,0,0,0|2,0,0]=3 4194 B17R0.250 CCCCCCNCCCCCCC(=O)OCC 2230a_100000210581_100009814379 [0,1,0,0,0,0|1,0,0]=2 4195 B17R0.250 CCCCCCOCCCCCCC(=O)OCC 34a_100000210259_100009814379 [0,1,0,0,0,0|1,0,0]=2 4196 B17R0.250 CCCCCCOCCCCCCC(=O)OCC 7a_100000210259_100009814379 [0,1,0,0,0,0|1,0,0]=2 4197 B17R0.250 CCCCCCOCCOCCCC(=O)OCC 34a_100000691444_100009991533 [0,1,0,0,0,0|2,0,0]=3 4198 B17R0.250 CCCCCCOCCOCCCC(=O)OCC 7a_100000691444_100011215271 [0,1,0,0,0,0|2,0,0]=3 4199 B17R0.250 CCCCCCOCCOCCNC(=O)OCC 7a_100000691444_200011445536 [0,1,0,0,0,0|3,0,0]=4 4200 B17R0.250 CCCCCCSCCCCCCC(=O)OCC 62a_100000210314_100009814379 [0,1,0,0,0,0|1,0,0]=2 4201 B17R0.250 CCCCCNCCCCCCCC(=O)OCC 2230a_100000209983_100009991516 [0,1,0,0,0,0|1,0,0]=2 4202 B17R0.250 CCCCCNCCOCCCCC(=O)OCC 34a_100000224656_100000750268 [0,1,0,0,0,0|2,0,0]=3 4203 B17R0.250 CCCCCNCCOCCOCC(=O)OCC 34a_100000224656_100000088970 [0,1,0,0,0,0|3,0,0]=4 4204 B17R0.250 CCCCCNN=CCCCCCC(=O)OCC 4a_100000694160_100000085164 [0,1,0,0,0,0|2,0,1]=4 4205 B17R0.250 CCCCCOCCCCCCCC(=O)OCC 34a_100000210253_100009991516 [0,1,0,0,0,0|1,0,0]=2 4206 B17R0.250 CCCCCOCCCCCCCC(=O)OCC 7a_100000210253_100009991516 [0,1,0,0,0,0|1,0,0]=2 4207 B17R0.250 CCCCCOCCOCCCCC(=O)OCC 34a_100011215259_100000750268 [0,1,0,0,0,0|2,0,0]=3 4208 B17R0.250 CCCCCOCCOCCCCC(=O)OCC 7a_100011215259_100000750268 [0,1,0,0,0,0|2,0,0]=3 4209 B17R0.250 CCCCCOCCOCCOCC(=O)OCC 34a_100011215259_100000088970 [0,1,0,0,0,0|3,0,0]=4 4210 B17R0.250 CCCCCOCCOCCOCC(=O)OCC 7a_100011215259_100000088970 [0,1,0,0,0,0|3,0,0]=4 4211 B17R0.250 CCCCCSCCCCCCCC(=O)OCC 62a_100000210326_100009991516 [0,1,0,0,0,0|1,0,0]=2 4212 B17R0.250 CCCCNCCCCCCCCC(=O)OCC 2230a_100000102301_100010175975 [0,1,0,0,0,0|1,0,0]=2 4213 B17R0.250 CCCCNCCCCCCCCC(=O)OCC 7a_106832991798_100010175975 [0,1,0,0,0,0|1,0,0]=2 4214 B17R0.250 CCCCNCCCCOCCCC(=O)OCC 34a_200011216965_100009991533 [0,1,0,0,0,0|2,0,0]=3 4215 B17R0.250 CCCCOCCCCCCCCC(=O)OCC 34a_100000210227_100010175975 [0,1,0,0,0,0|1,0,0]=2 4216 B17R0.250 CCCCOCCCCCCCCC(=O)OCC 7a_100000210227_100010175975 [0,1,0,0,0,0|1,0,0]=2 4217 B17R0.250 CCCCOCCCCOCCCC(=O)OCC 34a_200000760531_100009991533 [0,1,0,0,0,0|2,0,0]=3 4218 B17R0.250 CCCCOCCCCOCCCC(=O)OCC 7a_200000760531_100011215271 [0,1,0,0,0,0|2,0,0]=3 4219 B17R0.250 CCCCOCCCCOCCNC(=O)OCC 7a_200000760531_200011445536 [0,1,0,0,0,0|3,0,0]=4 4220 B17R0.250 CCCCOCCCNCCCCC(=O)OCC 2230a_200000211371_100000750268 [0,1,0,0,0,0|2,0,0]=3 4221 B17R0.250 CCCCOCCCNCCCCC(=O)OCC 34a_200000211371_100000750268 [0,1,0,0,0,0|2,0,0]=3 4222 B17R0.250 CCCCOCCCNCCOCC(=O)OCC 2230a_200000211371_100000088970 [0,1,0,0,0,0|3,0,0]=4 4223 B17R0.250 CCCCOCCCNCCOCC(=O)OCC 34a_200000211371_100000088970 [0,1,0,0,0,0|3,0,0]=4 4224 B17R0.250 CCCCOCCCOCCCCC(=O)OCC 34a_200011215613_100000750268 [0,1,0,0,0,0|2,0,0]=3 4225 B17R0.250 CCCCOCCCOCCCCC(=O)OCC 7a_200011215613_100000750268 [0,1,0,0,0,0|2,0,0]=3 4226 B17R0.250 CCCCOCCCOCCOCC(=O)OCC 34a_200011215613_100000088970 [0,1,0,0,0,0|3,0,0]=4 4227 B17R0.250 CCCCOCCCOCCOCC(=O)OCC 7a_200011215613_100000088970 [0,1,0,0,0,0|3,0,0]=4 4228 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 34a_100000210238_100000755133 [0,1,0,0,0,0|2,0,0]=3 4229 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 7a_100000210238_100000755133 [0,1,0,0,0,0|2,0,0]=3 4230 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 7a_100011214988_100000743108 [0,1,0,0,0,0|2,0,0]=3 4231 B17R0.250 CCCCOCCOCCCOCC(=O)OCC 34a_100000210238_100009893628 [0,1,0,0,0,0|3,0,0]=4 4232 B17R0.250 CCCCOCCOCCCOCC(=O)OCC 7a_100000210238_100009893628 [0,1,0,0,0,0|3,0,0]=4 4233 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210210 [0,1,0,0,0,0|3,0,0]=4 4234 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 34a_100011215186_100000765890 [0,1,0,0,0,0|3,0,0]=4 4235 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210211 [0,1,0,0,0,0|3,0,0]=4 4236 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 7a_100011215186_100011206558 [0,1,0,0,0,0|3,0,0]=4 4237 B17R0.250 CCCCOCCSCCCCCC(=O)OCC 62a_100000743108_100000755133 [0,1,0,0,0,0|2,0,0]=3 4238 B17R0.250 CCCCOCCSCCCCCC(=O)OCC 62a_100000755133_100000743108 [0,1,0,0,0,0|2,0,0]=3 4239 B17R0.250 CCCCOCCSCCCOCC(=O)OCC 62a_100000743108_100009893628 [0,1,0,0,0,0|3,0,0]=4 4240 B17R0.250 CCCCOCCSCCCOCC(=O)OCC 62a_100009893628_100000743108 [0,1,0,0,0,0|3,0,0]=4 4241 B17R0.250 CCCCOCSCCCCCCC(=O)OCC 62a_100011995733_100009814379 [0,1,0,0,0,0|2,0,0]=3 4242 B17R0.250 CCCCSCCCCCCCCC(=O)OCC 62a_100000210211_100010175975 [0,1,0,0,0,0|1,0,0]=2 4243 B17R0.250 CCCCSCCNCCCCCC(=O)OCC 2230a_100025743550_100000755133 [0,1,0,0,0,0|2,0,0]=3 4244 B17R0.250 CCCCSCCNCCCOCC(=O)OCC 2230a_100025743550_100009893628 [0,1,0,0,0,0|3,0,0]=4 4245 B17R0.250 CCCCSCCOCCCCCC(=O)OCC 34a_200000230436_100000755133 [0,1,0,0,0,0|2,0,0]=3 4246 B17R0.250 CCCCSCCOCCCCCC(=O)OCC 7a_200000230436_100000755133 [0,1,0,0,0,0|2,0,0]=3 4247 B17R0.250 CCCCSCCOCCCOCC(=O)OCC 34a_200000230436_100009893628 [0,1,0,0,0,0|3,0,0]=4 4248 B17R0.250 CCCCSCCOCCCOCC(=O)OCC 7a_200000230436_100009893628 [0,1,0,0,0,0|3,0,0]=4 4249 B17R0.250 CCCNN=CCCCCCCCC(=O)OCC 4a_100000740057_100102623289 [0,1,0,0,0,0|2,0,1]=4 4250 B17R0.250 CCCOCCCCCCCCCC(=O)OCC 34a_100000210258_100009828014 [0,1,0,0,0,0|1,0,0]=2 4251 B17R0.250 CCCOCCCNCCCCCC(=O)OCC 2230a_100011217757_100000755133 [0,1,0,0,0,0|2,0,0]=3 4252 B17R0.250 CCCOCCCNCCCCCC(=O)OCC 34a_100011217757_100000755133 [0,1,0,0,0,0|2,0,0]=3 4253 B17R0.250 CCCOCCCNCCCOCC(=O)OCC 2230a_100011217757_100009893628 [0,1,0,0,0,0|3,0,0]=4 4254 B17R0.250 CCCOCCCNCCCOCC(=O)OCC 34a_100011217757_100009893628 [0,1,0,0,0,0|3,0,0]=4 4255 B17R0.250 CCCOCCNCCCCCCC(=O)OCC 2230a_100161115042_100009814379 [0,1,0,0,0,0|2,0,0]=3 4256 B17R0.250 CCCOCCNCCCCCCC(=O)OCC 34a_100161115042_100009814379 [0,1,0,0,0,0|2,0,0]=3 4257 B17R0.250 CCCOCCOCCCCCCC(=O)OCC 34a_100000752267_100009814379 [0,1,0,0,0,0|2,0,0]=3 4258 B17R0.250 CCCOCCOCCCCCCC(=O)OCC 7a_100000752267_100009814379 [0,1,0,0,0,0|2,0,0]=3 4259 B17R0.250 CCCOCCOCCNCCCC(=O)OCC 2230a_200011904461_100009991533 [0,1,0,0,0,0|3,0,0]=4 4260 B17R0.250 CCCOCCOCCNCCCC(=O)OCC 34a_200011904461_100009991533 [0,1,0,0,0,0|3,0,0]=4 4261 B17R0.250 CCCOCCSCCCCCCC(=O)OCC 62a_100011215938_100009814379 [0,1,0,0,0,0|2,0,0]=3 4262 B17R0.250 CCCSCCCCCCCCCC(=O)OCC 62a_100000210303_100009828014 [0,1,0,0,0,0|1,0,0]=2 4263 B17R0.250 CCCSCCNCCCCCCC(=O)OCC 2230a_100020603323_100009814379 [0,1,0,0,0,0|2,0,0]=3 4264 B17R0.250 CCCSCCOCCCCCCC(=O)OCC 34a_200000230433_100009814379 [0,1,0,0,0,0|2,0,0]=3 4265 B17R0.250 CCCSCCOCCCCCCC(=O)OCC 7a_200000230433_100009814379 [0,1,0,0,0,0|2,0,0]=3 4266 B17R0.250 CCNC(=O)CCCCCCCCCCCCO 240690a_100015525214_100102582631 [0,1,0,0,0,0|2,0,0]=3 4267 B17R0.250 CCNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737597 [0,1,0,0,0,0|3,0,0]=4 4268 B17R0.250 CCNC(=O)CCNCCCCCCCCCO 34a_100025743525_100009813782 [0,1,0,0,0,0|3,0,0]=4 4269 B17R0.250 CCNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737597 [0,1,0,0,0,0|3,0,0]=4 4270 B17R0.250 CCNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737597 [0,1,0,0,0,0|3,0,0]=4 4271 B17R0.250 CCNC(=O)CCSCCCCCCCCCO 62a_100000737597_100009813782 [0,1,0,0,0,0|3,0,0]=4 4272 B17R0.250 CCNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737597 [0,1,0,0,0,0|3,0,0]=4 4273 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183381 [0,1,0,0,0,0|3,0,0]=4 4274 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 2230a_100016988866_100009813290 [0,1,0,0,0,0|3,0,0]=4 4275 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183381 [0,1,0,0,0,0|3,0,0]=4 4276 B17R0.250 CCNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183381 [0,1,0,0,0,0|3,0,0]=4 4277 B17R0.250 CCNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183381 [0,1,0,0,0,0|3,0,0]=4 4278 B17R0.250 CCNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183381 [0,1,0,0,0,0|3,0,0]=4 4279 B17R0.250 CCNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183381 [0,1,0,0,0,0|3,0,0]=4 4280 B17R0.250 CCNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183381 [0,1,0,0,0,0|3,0,0]=4 4281 B17R0.250 CCNC(=O)CSCCCCCCCCCCO 62a_100000183381_200000033068 [0,1,0,0,0,0|3,0,0]=4 4282 B17R0.250 CCNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183381 [0,1,0,0,0,0|3,0,0]=4 4283 B17R0.250 CCNCCCCCCCCCCC(=O)OCC 2230a_100015525214_100009827693 [0,1,0,0,0,0|1,0,0]=2 4284 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 2230a_106832991635_100103168309 [0,1,0,0,0,0|1,0,0]=2 4285 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 34a_100102657272_100103168309 [0,1,0,0,0,0|1,0,0]=2 4286 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 7a_106832991635_100103168309 [0,1,0,0,0,0|1,0,0]=2 4287 B17R0.250 CCOC(=O)CCCCCCCCCCCOC 34a_100138415774_100103168309 [0,1,0,0,0,0|1,0,0]=2 4288 B17R0.250 CCOC(=O)CCCCCCCCCCCSC 62a_200000210301_100103168309 [0,1,0,0,0,0|1,0,0]=2 4289 B17R0.250 CCOC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100103168309 [0,1,0,0,0,0|1,0,0]=2 4290 B17R0.250 CCOC(=O)CCCCCCCCCCSCC 62a_100000210202_100009827693 [0,1,0,0,0,0|1,0,0]=2 4291 B17R0.250 CCOC(=O)CCCCCCCCCCSCF 62a_100015361967_100009827693 [0,1,0,0,0,0|2,0,0]=3 4292 B17R0.250 CCOC(=O)CCCCCCCCCNCCF 34a_100000724931_100009828014 [0,1,0,0,0,0|2,0,0]=3 4293 B17R0.250 CCOC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009828014 [0,1,0,0,0,0|2,0,0]=3 4294 B17R0.250 CCOC(=O)CCCCCCCCCNCCO 34a_100016990907_100009828014 [0,1,0,0,0,0|2,0,0]=3 4295 B17R0.250 CCOC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009828014 [0,1,0,0,0,0|2,0,0]=3 4296 B17R0.250 CCOC(=O)CCCCCCCCCOCCN 34a_100000210304_100009828014 [0,1,0,0,0,0|2,0,0]=3 4297 B17R0.250 CCOC(=O)CCCCCCCCCSCC#N 62a_100011215382_100009828014 [0,1,0,0,0,0|2,0,1]=4 4298 B17R0.250 CCOC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009828014 [0,1,0,0,0,0|2,0,1]=4 4299 B17R0.250 CCOC(=O)CCCCCCCCCSCCF 62a_100011217306_100009828014 [0,1,0,0,0,0|2,0,0]=3 4300 B17R0.250 CCOC(=O)CCCCCCCCCSCCO 62a_100000211926_100009828014 [0,1,0,0,0,0|2,0,0]=3 4301 B17R0.250 CCOC(=O)CCCCCCCCCSCOC 62a_100000766300_100009828014 [0,1,0,0,0,0|2,0,0]=3 4302 B17R0.250 CCOC(=O)CCCCCCCCCSCSC 62a_100011218213_100009828014 [0,1,0,0,0,0|2,0,0]=3 4303 B17R0.250 CCOC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010175975 [0,1,0,0,0,0|2,0,0]=3 4304 B17R0.250 CCOC(=O)CCCCCCCCNCCCF 34a_100015189416_100010175975 [0,1,0,0,0,0|2,0,0]=3 4305 B17R0.250 CCOC(=O)CCCCCCCCNCCOC 2230a_100000209980_100010175975 [0,1,0,0,0,0|2,0,0]=3 4306 B17R0.250 CCOC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010175975 [0,1,0,0,0,0|2,0,0]=3 4307 B17R0.250 CCOC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010175975 [0,1,0,0,0,0|2,0,0]=3 4308 B17R0.250 CCOC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010175975 [0,1,0,0,0,0|2,0,0]=3 4309 B17R0.250 CCOC(=O)CCCCCCCCOCCCF 34a_100000759539_100010175975 [0,1,0,0,0,0|2,0,0]=3 4310 B17R0.250 CCOC(=O)CCCCCCCCOCCCN 34a_100000182051_100010175975 [0,1,0,0,0,0|2,0,0]=3 4311 B17R0.250 CCOC(=O)CCCCCCCCOCCOC 34a_100000210237_100010175975 [0,1,0,0,0,0|2,0,0]=3 4312 B17R0.250 CCOC(=O)CCCCCCCCOCCON 34a_100000700252_100010175975 [0,1,0,0,0,0|3,0,0]=4 4313 B17R0.250 CCOC(=O)CCCCCCCCOCCSC 34a_100000230434_100010175975 [0,1,0,0,0,0|2,0,0]=3 4314 B17R0.250 CCOC(=O)CCCCCCCCOCCSC 7a_100000230434_100010175975 [0,1,0,0,0,0|2,0,0]=3 4315 B17R0.250 CCOC(=O)CCCCCCCCSCCC#N 62a_100011215226_100010175975 [0,1,0,0,0,0|2,0,1]=4 4316 B17R0.250 CCOC(=O)CCCCCCCCSCCCF 62a_100011934791_100010175975 [0,1,0,0,0,0|2,0,0]=3 4317 B17R0.250 CCOC(=O)CCCCCCCCSCCCO 62a_100011215043_100010175975 [0,1,0,0,0,0|2,0,0]=3 4318 B17R0.250 CCOC(=O)CCCCCCCCSCCOC 62a_100000233755_100010175975 [0,1,0,0,0,0|2,0,0]=3 4319 B17R0.250 CCOC(=O)CCCCCCCCSCCSC 62a_100000212216_100010175975 [0,1,0,0,0,0|2,0,0]=3 4320 B17R0.250 CCOC(=O)CCCCCCCNCCCCO 2230a_100000750430_100009991516 [0,1,0,0,0,0|2,0,0]=3 4321 B17R0.250 CCOC(=O)CCCCCCCNCCCCO 34a_100000750430_100009991516 [0,1,0,0,0,0|2,0,0]=3 4322 B17R0.250 CCOC(=O)CCCCCCCNCCCOC 34a_100150723488_100009991516 [0,1,0,0,0,0|2,0,0]=3 4323 B17R0.250 CCOC(=O)CCCCCCCNCCCSC 2230a_100000749238_100009991516 [0,1,0,0,0,0|2,0,0]=3 4324 B17R0.250 CCOC(=O)CCCCCCCNCCSCC 2230a_100000106463_100009991516 [0,1,0,0,0,0|2,0,0]=3 4325 B17R0.250 CCOC(=O)CCCCCCCOCCCCBr 34a_100011216708_100009991516 [0,1,0,0,0,0|2,0,0]=3 4326 B17R0.250 CCOC(=O)CCCCCCCOCCCCCl 34a_100000210776_100009991516 [0,1,0,0,0,0|2,0,0]=3 4327 B17R0.250 CCOC(=O)CCCCCCCOCCCCCl 7a_100000210776_100009991516 [0,1,0,0,0,0|2,0,0]=3 4328 B17R0.250 CCOC(=O)CCCCCCCOCCCCF 34a_100011995726_100009991516 [0,1,0,0,0,0|2,0,0]=3 4329 B17R0.250 CCOC(=O)CCCCCCCOCCCCF 7a_100011995726_100009991516 [0,1,0,0,0,0|2,0,0]=3 4330 B17R0.250 CCOC(=O)CCCCCCCOCCCCI 34a_200012148704_100009991516 [0,1,0,0,0,0|2,0,0]=3 4331 B17R0.250 CCOC(=O)CCCCCCCOCCCCN 34a_100000750430_100009991516 [0,1,0,0,0,0|2,0,0]=3 4332 B17R0.250 CCOC(=O)CCCCCCCOCCCNC 34a_100000213112_100009991516 [0,1,0,0,0,0|2,0,0]=3 4333 B17R0.250 CCOC(=O)CCCCCCCOCCCOC 34a_100000740835_100009991516 [0,1,0,0,0,0|2,0,0]=3 4334 B17R0.250 CCOC(=O)CCCCCCCOCCCSC 34a_100000690336_100009991516 [0,1,0,0,0,0|2,0,0]=3 4335 B17R0.250 CCOC(=O)CCCCCCCOCCCSC 7a_100000690336_100009991516 [0,1,0,0,0,0|2,0,0]=3 4336 B17R0.250 CCOC(=O)CCCCCCCOCCSCC 34a_100000212035_100009991516 [0,1,0,0,0,0|2,0,0]=3 4337 B17R0.250 CCOC(=O)CCCCCCCOCCSCC 7a_100000212035_100009991516 [0,1,0,0,0,0|2,0,0]=3 4338 B17R0.250 CCOC(=O)CCCCCCCSCCCC#N 62a_100000687738_100009991516 [0,1,0,0,0,0|2,0,1]=4 4339 B17R0.250 CCOC(=O)CCCCCCCSCCCC=O 62a_200011292268_100009991516 [0,1,0,0,0,0|2,0,1]=4 4340 B17R0.250 CCOC(=O)CCCCCCCSCCCCF 62a_100000729493_100009991516 [0,1,0,0,0,0|2,0,0]=3 4341 B17R0.250 CCOC(=O)CCCCCCCSCCCCO 62a_100000210776_100009991516 [0,1,0,0,0,0|2,0,0]=3 4342 B17R0.250 CCOC(=O)CCCCCCCSCCCOC 62a_100000709357_100009991516 [0,1,0,0,0,0|2,0,0]=3 4343 B17R0.250 CCOC(=O)CCCCCCCSCCSCC 62a_100000757381_100009991516 [0,1,0,0,0,0|2,0,0]=3 4344 B17R0.250 CCOC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009814379 [0,1,0,0,0,0|2,0,0]=3 4345 B17R0.250 CCOC(=O)CCCCCCNCCCCCO 34a_100000762737_100009814379 [0,1,0,0,0,0|2,0,0]=3 4346 B17R0.250 CCOC(=O)CCCCCCNCCOCCO 2230a_100000211614_100009814379 [0,1,0,0,0,0|3,0,0]=4 4347 B17R0.250 CCOC(=O)CCCCCCNCCOCCO 34a_100000211614_100009814379 [0,1,0,0,0,0|3,0,0]=4 4348 B17R0.250 CCOC(=O)CCCCCCNCCSCCO 2230a_100011219999_100009814379 [0,1,0,0,0,0|3,0,0]=4 4349 B17R0.250 CCOC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009814379 [0,1,0,0,0,0|2,0,0]=3 4350 B17R0.250 CCOC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009814379 [0,1,0,0,0,0|2,0,0]=3 4351 B17R0.250 CCOC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009814379 [0,1,0,0,0,0|2,0,0]=3 4352 B17R0.250 CCOC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009814379 [0,1,0,0,0,0|2,0,0]=3 4353 B17R0.250 CCOC(=O)CCCCCCOCCCCCI 34a_200012148887_100009814379 [0,1,0,0,0,0|2,0,0]=3 4354 B17R0.250 CCOC(=O)CCCCCCOCCCCCI 7a_200012148887_100009814379 [0,1,0,0,0,0|2,0,0]=3 4355 B17R0.250 CCOC(=O)CCCCCCOCCCCCN 34a_100000762737_100009814379 [0,1,0,0,0,0|2,0,0]=3 4356 B17R0.250 CCOC(=O)CCCCCCOCCCCOC 34a_100000740925_100009814379 [0,1,0,0,0,0|2,0,0]=3 4357 B17R0.250 CCOC(=O)CCCCCCOCCCCSC 34a_100011217163_100009814379 [0,1,0,0,0,0|2,0,0]=3 4358 B17R0.250 CCOC(=O)CCCCCCOCCCCSC 7a_100011217163_100009814379 [0,1,0,0,0,0|2,0,0]=3 4359 B17R0.250 CCOC(=O)CCCCCCOCCCSCC 34a_100011216438_100009814379 [0,1,0,0,0,0|2,0,0]=3 4360 B17R0.250 CCOC(=O)CCCCCCOCCCSCC 7a_100011216438_100009814379 [0,1,0,0,0,0|2,0,0]=3 4361 B17R0.250 CCOC(=O)CCCCCCOCCOCCBr 34a_100000692535_100009814379 [0,1,0,0,0,0|3,0,0]=4 4362 B17R0.250 CCOC(=O)CCCCCCOCCOCCBr 7a_100000692535_100009814379 [0,1,0,0,0,0|3,0,0]=4 4363 B17R0.250 CCOC(=O)CCCCCCOCCOCCCl 34a_100011215305_100009814379 [0,1,0,0,0,0|3,0,0]=4 4364 B17R0.250 CCOC(=O)CCCCCCOCCOCCCl 7a_100011215305_100009814379 [0,1,0,0,0,0|3,0,0]=4 4365 B17R0.250 CCOC(=O)CCCCCCOCCOCCF 34a_200015357709_100009814379 [0,1,0,0,0,0|3,0,0]=4 4366 B17R0.250 CCOC(=O)CCCCCCOCCOCCF 7a_200015357709_100009814379 [0,1,0,0,0,0|3,0,0]=4 4367 B17R0.250 CCOC(=O)CCCCCCOCCOCCI 34a_100012149058_100009814379 [0,1,0,0,0,0|3,0,0]=4 4368 B17R0.250 CCOC(=O)CCCCCCOCCOCCI 7a_100012149058_100009814379 [0,1,0,0,0,0|3,0,0]=4 4369 B17R0.250 CCOC(=O)CCCCCCOCCOCCN 34a_100000211614_100009814379 [0,1,0,0,0,0|3,0,0]=4 4370 B17R0.250 CCOC(=O)CCCCCCSCCCCC#N 62a_100011219923_100009814379 [0,1,0,0,0,0|2,0,1]=4 4371 B17R0.250 CCOC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009814379 [0,1,0,0,0,0|2,0,1]=4 4372 B17R0.250 CCOC(=O)CCCCCCSCCCCCF 62a_100000729378_100009814379 [0,1,0,0,0,0|2,0,0]=3 4373 B17R0.250 CCOC(=O)CCCCCCSCCCCCO 62a_100000746330_100009814379 [0,1,0,0,0,0|2,0,0]=3 4374 B17R0.250 CCOC(=O)CCCCCCSCCCCOC 62a_100000730899_100009814379 [0,1,0,0,0,0|2,0,0]=3 4375 B17R0.250 CCOC(=O)CCCCCCSCCOCCO 62a_100011215305_100009814379 [0,1,0,0,0,0|3,0,0]=4 4376 B17R0.250 CCOC(=O)CCCCCCSCOCCOC 62a_100000231047_100009814379 [0,1,0,0,0,0|3,0,0]=4 4377 B17R0.250 CCOC(=O)CCCCCNCCCCCCO 2230a_100000686447_100000755133 [0,1,0,0,0,0|2,0,0]=3 4378 B17R0.250 CCOC(=O)CCCCCNCCCCCCO 34a_100000686447_100000755133 [0,1,0,0,0,0|2,0,0]=3 4379 B17R0.250 CCOC(=O)CCCCCNCCCCCOC 2230a_100000747528_100000755133 [0,1,0,0,0,0|2,0,0]=3 4380 B17R0.250 CCOC(=O)CCCCCNCCCCCOC 34a_100000747528_100000755133 [0,1,0,0,0,0|2,0,0]=3 4381 B17R0.250 CCOC(=O)CCCCCNCCOCCOC 2230a_100000745349_100000755133 [0,1,0,0,0,0|3,0,0]=4 4382 B17R0.250 CCOC(=O)CCCCCNCCOCCOC 34a_100000745349_100000755133 [0,1,0,0,0,0|3,0,0]=4 4383 B17R0.250 CCOC(=O)CCCCCOCCCCCC#N 7a_100011214988_100009813376 [0,1,0,0,0,0|2,0,1]=4 4384 B17R0.250 CCOC(=O)CCCCCOCCCCCC=O 7a_100011214988_100000139337 [0,1,0,0,0,0|2,0,1]=4 4385 B17R0.250 CCOC(=O)CCCCCOCCCCCCBr 34a_100011215345_100000755133 [0,1,0,0,0,0|2,0,0]=3 4386 B17R0.250 CCOC(=O)CCCCCOCCCCCCBr 7a_100011215345_100000755133 [0,1,0,0,0,0|2,0,0]=3 4387 B17R0.250 CCOC(=O)CCCCCOCCCCCCCl 34a_100000766143_100000755133 [0,1,0,0,0,0|2,0,0]=3 4388 B17R0.250 CCOC(=O)CCCCCOCCCCCCCl 7a_100000766143_100000755133 [0,1,0,0,0,0|2,0,0]=3 4389 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 34a_100000732779_100000755133 [0,1,0,0,0,0|2,0,0]=3 4390 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 7a_100000732779_100000755133 [0,1,0,0,0,0|2,0,0]=3 4391 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 7a_100011214988_100015922095 [0,1,0,0,0,0|2,0,0]=3 4392 B17R0.250 CCOC(=O)CCCCCOCCCCCCN 34a_100000686447_100000755133 [0,1,0,0,0,0|2,0,0]=3 4393 B17R0.250 CCOC(=O)CCCCCOCCCCCCO 7a_100011214988_100000766143 [0,1,0,0,0,0|2,0,0]=3 4394 B17R0.250 CCOC(=O)CCCCCOCCCCCNC 34a_100000722520_100000755133 [0,1,0,0,0,0|2,0,0]=3 4395 B17R0.250 CCOC(=O)CCCCCOCCOCCNC 34a_100000228057_100000755133 [0,1,0,0,0,0|3,0,0]=4 4396 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 34a_100011215163_100000755133 [0,1,0,0,0,0|3,0,0]=4 4397 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 7a_100011214988_100000695917 [0,1,0,0,0,0|3,0,0]=4 4398 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 7a_100011215163_100000755133 [0,1,0,0,0,0|3,0,0]=4 4399 B17R0.250 CCOC(=O)CCCCCSCCCCCC#N 62a_100000755133_100009813376 [0,1,0,0,0,0|2,0,1]=4 4400 B17R0.250 CCOC(=O)CCCCCSCCCCCC#N 62a_100009813376_100000755133 [0,1,0,0,0,0|2,0,1]=4 4401 B17R0.250 CCOC(=O)CCCCCSCCCCCC=O 62a_100000139337_100000755133 [0,1,0,0,0,0|2,0,1]=4 4402 B17R0.250 CCOC(=O)CCCCCSCCCCCC=O 62a_100000755133_100000139337 [0,1,0,0,0,0|2,0,1]=4 4403 B17R0.250 CCOC(=O)CCCCCSCCCCCCF 62a_100000755133_100015922095 [0,1,0,0,0,0|2,0,0]=3 4404 B17R0.250 CCOC(=O)CCCCCSCCCCCCF 62a_100015922095_100000755133 [0,1,0,0,0,0|2,0,0]=3 4405 B17R0.250 CCOC(=O)CCCCCSCCCCCCO 62a_100000755133_100000766143 [0,1,0,0,0,0|2,0,0]=3 4406 B17R0.250 CCOC(=O)CCCCCSCCCCCCO 62a_100000766143_100000755133 [0,1,0,0,0,0|2,0,0]=3 4407 B17R0.250 CCOC(=O)CCCCCSCCOCCOC 62a_100000695917_100000755133 [0,1,0,0,0,0|3,0,0]=4 4408 B17R0.250 CCOC(=O)CCCCCSCCOCCOC 62a_100000755133_100000695917 [0,1,0,0,0,0|3,0,0]=4 4409 B17R0.250 CCOC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000750268 [0,1,0,0,0,0|2,0,0]=3 4410 B17R0.250 CCOC(=O)CCCCNCCCCCCCO 34a_100011996573_100000750268 [0,1,0,0,0,0|2,0,0]=3 4411 B17R0.250 CCOC(=O)CCCCNCCCOCCCO 2230a_100011310245_100000750268 [0,1,0,0,0,0|3,0,0]=4 4412 B17R0.250 CCOC(=O)CCCCNCCCOCCCO 34a_100011310245_100000750268 [0,1,0,0,0,0|3,0,0]=4 4413 B17R0.250 CCOC(=O)CCCCNCCCOCCOC 2230a_100000206027_100000750268 [0,1,0,0,0,0|3,0,0]=4 4414 B17R0.250 CCOC(=O)CCCCNCCCOCCOC 34a_100000206027_100000750268 [0,1,0,0,0,0|3,0,0]=4 4415 B17R0.250 CCOC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000750268 [0,1,0,0,0,0|2,0,0]=3 4416 B17R0.250 CCOC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000750268 [0,1,0,0,0,0|2,0,0]=3 4417 B17R0.250 CCOC(=O)CCCCOCCCCCCCN 34a_100011996573_100000750268 [0,1,0,0,0,0|2,0,0]=3 4418 B17R0.250 CCOC(=O)CCCCOCCCCCCOC 34a_200012092642_100000750268 [0,1,0,0,0,0|2,0,0]=3 4419 B17R0.250 CCOC(=O)CCCCOCCCCCCOC 7a_200012092642_100000750268 [0,1,0,0,0,0|2,0,0]=3 4420 B17R0.250 CCOC(=O)CCCCOCCCOCCCN 34a_100011310245_100000750268 [0,1,0,0,0,0|3,0,0]=4 4421 B17R0.250 CCOC(=O)CCCCSCCCCCCC#N 62a_100000750268_100009813337 [0,1,0,0,0,0|2,0,1]=4 4422 B17R0.250 CCOC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000750268 [0,1,0,0,0,0|2,0,1]=4 4423 B17R0.250 CCOC(=O)CCCCSCCCCCCCO 62a_100000750268_100000760002 [0,1,0,0,0,0|2,0,0]=3 4424 B17R0.250 CCOC(=O)CCCCSCCCCCCCO 62a_100000760002_100000750268 [0,1,0,0,0,0|2,0,0]=3 4425 B17R0.250 CCOC(=O)CCCCSCCCCCCOC 62a_100000750268_100011998445 [0,1,0,0,0,0|2,0,0]=3 4426 B17R0.250 CCOC(=O)CCCCSCCCCCCOC 62a_100011998445_100000750268 [0,1,0,0,0,0|2,0,0]=3 4427 B17R0.250 CCOC(=O)CCCCSCCCOCCOC 62a_100000750268_100011216529 [0,1,0,0,0,0|3,0,0]=4 4428 B17R0.250 CCOC(=O)CCCCSCCCOCCOC 62a_100011216529_100000750268 [0,1,0,0,0,0|3,0,0]=4 4429 B17R0.250 CCOC(=O)CCCNCCCCCCCCO 2230a_102515433106_100009991533 [0,1,0,0,0,0|2,0,0]=3 4430 B17R0.250 CCOC(=O)CCCNCCCCCCCCO 34a_102515433106_100009991533 [0,1,0,0,0,0|2,0,0]=3 4431 B17R0.250 CCOC(=O)CCCOCCCCCCCCBr 34a_100009813846_100009991533 [0,1,0,0,0,0|2,0,0]=3 4432 B17R0.250 CCOC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215271 [0,1,0,0,0,0|2,0,0]=3 4433 B17R0.250 CCOC(=O)CCCOCCCCCCCCCl 34a_100000033203_100009991533 [0,1,0,0,0,0|2,0,0]=3 4434 B17R0.250 CCOC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215271 [0,1,0,0,0,0|2,0,0]=3 4435 B17R0.250 CCOC(=O)CCCOCCCCCCCCN 34a_102515433106_100009991533 [0,1,0,0,0,0|2,0,0]=3 4436 B17R0.250 CCOC(=O)CCCOCCCCCCCCO 7a_100012001163_100000033203 [0,1,0,0,0,0|2,0,0]=3 4437 B17R0.250 CCOC(=O)CCCOCCCCCNCCN 34a_103619048469_100009991533 [0,1,0,0,0,0|3,0,0]=4 4438 B17R0.250 CCOC(=O)CCCOCCCOCCCOC 34a_200011215475_100009991533 [0,1,0,0,0,0|3,0,0]=4 4439 B17R0.250 CCOC(=O)CCCOCCCOCCCOC 7a_200011215475_100011215271 [0,1,0,0,0,0|3,0,0]=4 4440 B17R0.250 CCOC(=O)CCCSCCCCCCCCO 62a_100000033203_100009991533 [0,1,0,0,0,0|2,0,0]=3 4441 B17R0.250 CCOC(=O)CCCSCCCCCCCCO 62a_100009991533_100000033203 [0,1,0,0,0,0|2,0,0]=3 4442 B17R0.250 CCOC(=O)CCNCCCCCCCCCO 2230a_100000078944_100011206558 [0,1,0,0,0,0|2,0,0]=3 4443 B17R0.250 CCOC(=O)CCNCCCCCCCCCO 34a_100000078944_100000765890 [0,1,0,0,0,0|2,0,0]=3 4444 B17R0.250 CCOC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000765890 [0,1,0,0,0,0|2,0,0]=3 4445 B17R0.250 CCOC(=O)CCOCCCCCCCCCBr 7a_100009813782_100011206558 [0,1,0,0,0,0|2,0,0]=3 4446 B17R0.250 CCOC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000765890 [0,1,0,0,0,0|2,0,0]=3 4447 B17R0.250 CCOC(=O)CCOCCCCCCCCCCl 7a_100009868337_100011206558 [0,1,0,0,0,0|2,0,0]=3 4448 B17R0.250 CCOC(=O)CCOCCCCCCCCCN 34a_100000078944_100000765890 [0,1,0,0,0,0|2,0,0]=3 4449 B17R0.250 CCOC(=O)CCSCCCCCCCCCO 62a_100000765890_100009813782 [0,1,0,0,0,0|2,0,0]=3 4450 B17R0.250 CCOC(=O)CCSCCCCCCCCCO 62a_100009813782_100000765890 [0,1,0,0,0,0|2,0,0]=3 4451 B17R0.250 CCOC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000188475 [0,1,0,0,0,0|2,0,0]=3 4452 B17R0.250 CCOC(=O)CNCCCCCCCCCCO 34a_100000066964_100000188475 [0,1,0,0,0,0|2,0,0]=3 4453 B17R0.250 CCOC(=O)COCCCCCCCCCCBr 34a_100009813290_100000188475 [0,1,0,0,0,0|2,0,0]=3 4454 B17R0.250 CCOC(=O)COCCCCCCCCCCBr 7a_100009813290_100000188475 [0,1,0,0,0,0|2,0,0]=3 4455 B17R0.250 CCOC(=O)COCCCCCCCCCCCl 34a_200000033068_100000188475 [0,1,0,0,0,0|2,0,0]=3 4456 B17R0.250 CCOC(=O)COCCCCCCCCCCCl 7a_200000033068_100000188475 [0,1,0,0,0,0|2,0,0]=3 4457 B17R0.250 CCOC(=O)COCCCCCCCCCCN 34a_100000066964_100000188475 [0,1,0,0,0,0|2,0,0]=3 4458 B17R0.250 CCOC(=O)COCCCNCCCCCCO 2230a_100000686447_100009893628 [0,1,0,0,0,0|3,0,0]=4 4459 B17R0.250 CCOC(=O)COCCCNCCCCCCO 34a_100000686447_100009893628 [0,1,0,0,0,0|3,0,0]=4 4460 B17R0.250 CCOC(=O)COCCCNCCCCCOC 2230a_100000747528_100009893628 [0,1,0,0,0,0|3,0,0]=4 4461 B17R0.250 CCOC(=O)COCCCNCCCCCOC 34a_100000747528_100009893628 [0,1,0,0,0,0|3,0,0]=4 4462 B17R0.250 CCOC(=O)COCCCOCCCCCCBr 34a_100011215345_100009893628 [0,1,0,0,0,0|3,0,0]=4 4463 B17R0.250 CCOC(=O)COCCCOCCCCCCBr 7a_100011215345_100009893628 [0,1,0,0,0,0|3,0,0]=4 4464 B17R0.250 CCOC(=O)COCCCOCCCCCCCl 34a_100000766143_100009893628 [0,1,0,0,0,0|3,0,0]=4 4465 B17R0.250 CCOC(=O)COCCCOCCCCCCCl 7a_100000766143_100009893628 [0,1,0,0,0,0|3,0,0]=4 4466 B17R0.250 CCOC(=O)COCCCOCCCCCCF 34a_100000732779_100009893628 [0,1,0,0,0,0|3,0,0]=4 4467 B17R0.250 CCOC(=O)COCCCOCCCCCCF 7a_100000732779_100009893628 [0,1,0,0,0,0|3,0,0]=4 4468 B17R0.250 CCOC(=O)COCCCOCCCCCCN 34a_100000686447_100009893628 [0,1,0,0,0,0|3,0,0]=4 4469 B17R0.250 CCOC(=O)COCCCOCCCCCNC 34a_100000722520_100009893628 [0,1,0,0,0,0|3,0,0]=4 4470 B17R0.250 CCOC(=O)COCCCSCCCCCCF 62a_100009893628_100015922095 [0,1,0,0,0,0|3,0,0]=4 4471 B17R0.250 CCOC(=O)COCCCSCCCCCCF 62a_100015922095_100009893628 [0,1,0,0,0,0|3,0,0]=4 4472 B17R0.250 CCOC(=O)COCCCSCCCCCCO 62a_100000766143_100009893628 [0,1,0,0,0,0|3,0,0]=4 4473 B17R0.250 CCOC(=O)COCCCSCCCCCCO 62a_100009893628_100000766143 [0,1,0,0,0,0|3,0,0]=4 4474 B17R0.250 CCOC(=O)COCCNCCCCCCCO 2230a_100011996573_100000088970 [0,1,0,0,0,0|3,0,0]=4 4475 B17R0.250 CCOC(=O)COCCNCCCCCCCO 34a_100011996573_100000088970 [0,1,0,0,0,0|3,0,0]=4 4476 B17R0.250 CCOC(=O)COCCOCCCCCCCBr 34a_100000760002_100000088970 [0,1,0,0,0,0|3,0,0]=4 4477 B17R0.250 CCOC(=O)COCCOCCCCCCCBr 7a_100000760002_100000088970 [0,1,0,0,0,0|3,0,0]=4 4478 B17R0.250 CCOC(=O)COCCOCCCCCCCN 34a_100011996573_100000088970 [0,1,0,0,0,0|3,0,0]=4 4479 B17R0.250 CCOC(=O)COCCOCCCCCCOC 34a_200012092642_100000088970 [0,1,0,0,0,0|3,0,0]=4 4480 B17R0.250 CCOC(=O)COCCOCCCCCCOC 7a_200012092642_100000088970 [0,1,0,0,0,0|3,0,0]=4 4481 B17R0.250 CCOC(=O)COCCSCCCCCCCO 62a_100000088970_100000760002 [0,1,0,0,0,0|3,0,0]=4 4482 B17R0.250 CCOC(=O)COCCSCCCCCCCO 62a_100000760002_100000088970 [0,1,0,0,0,0|3,0,0]=4 4483 B17R0.250 CCOC(=O)COCCSCCCCCCOC 62a_100000088970_100011998445 [0,1,0,0,0,0|3,0,0]=4 4484 B17R0.250 CCOC(=O)COCCSCCCCCCOC 62a_100011998445_100000088970 [0,1,0,0,0,0|3,0,0]=4 4485 B17R0.250 CCOC(=O)CSCCCCCCCCCCO 62a_100000188475_200000033068 [0,1,0,0,0,0|2,0,0]=3 4486 B17R0.250 CCOC(=O)CSCCCCCCCCCCO 62a_100009813290_100000188475 [0,1,0,0,0,0|2,0,0]=3 4487 B17R0.250 CCOC(=O)CSCCOCCCCCCCO 7a_200000230590_100000760002 [0,1,0,0,0,0|3,0,0]=4 4488 B17R0.250 CCOC(=O)CSCCOCCCCCCOC 7a_200000230590_100011998445 [0,1,0,0,0,0|3,0,0]=4 4489 B17R0.250 CCOC(=O)NCCOCCCCCCCCBr 7a_100009813846_200011445536 [0,1,0,0,0,0|3,0,0]=4 4490 B17R0.250 CCOC(=O)NCCOCCCCCCCCCl 7a_100000033203_200011445536 [0,1,0,0,0,0|3,0,0]=4 4491 B17R0.250 CCOC(=O)NCCOCCCCCCCCO 34a_100000158857_100000033203 [0,1,0,0,0,0|3,0,0]=4 4492 B17R0.250 CCOC(=O)NCCSCCCCCCCCO 62a_100000033203_200011445536 [0,1,0,0,0,0|3,0,0]=4 4493 B17R0.250 CCOC(=O)OCSCCCCCCCCCO 62a_100009813782_100000075025 [0,1,0,0,0,0|3,0,0]=4 4494 B17R0.250 CCOCCCCCCCCCCC(=O)OCC 34a_100121572206_100009827693 [0,1,0,0,0,0|1,0,0]=2 4495 B17R0.250 CCOCCCNCCCCCCC(=O)OCC 2230a_100000210961_100009814379 [0,1,0,0,0,0|2,0,0]=3 4496 B17R0.250 CCOCCCNCCCCCCC(=O)OCC 34a_100000210961_100009814379 [0,1,0,0,0,0|2,0,0]=3 4497 B17R0.250 CCOCCCOCCCCCCC(=O)OCC 34a_100000757476_100009814379 [0,1,0,0,0,0|2,0,0]=3 4498 B17R0.250 CCOCCCOCCCCCCC(=O)OCC 7a_100000757476_100009814379 [0,1,0,0,0,0|2,0,0]=3 4499 B17R0.250 CCOCCCSCCCCCCC(=O)OCC 62a_100012232248_100009814379 [0,1,0,0,0,0|2,0,0]=3 4500 B17R0.250 CCOCCNCCCCCCCC(=O)OCC 2230a_102516460346_100009991516 [0,1,0,0,0,0|2,0,0]=3 4501 B17R0.250 CCOCCNCCCCCCCC(=O)OCC 34a_102516460346_100009991516 [0,1,0,0,0,0|2,0,0]=3 4502 B17R0.250 CCOCCOCCCCCCCC(=O)OCC 34a_100000210136_100009991516 [0,1,0,0,0,0|2,0,0]=3 4503 B17R0.250 CCOCCOCCCCCCCC(=O)OCC 7a_100000210136_100009991516 [0,1,0,0,0,0|2,0,0]=3 4504 B17R0.250 CCOCCOCCNCCCCC(=O)OCC 2230a_100102712874_100000750268 [0,1,0,0,0,0|3,0,0]=4 4505 B17R0.250 CCOCCOCCNCCCCC(=O)OCC 34a_100102712874_100000750268 [0,1,0,0,0,0|3,0,0]=4 4506 B17R0.250 CCOCCOCCOCCCCC(=O)OCC 34a_100000210240_100000750268 [0,1,0,0,0,0|3,0,0]=4 4507 B17R0.250 CCOCCOCCOCCCCC(=O)OCC 7a_100000210240_100000750268 [0,1,0,0,0,0|3,0,0]=4 4508 B17R0.250 CCOCCOCCSCCCCC(=O)OCC 62a_100000750268_100011211534 [0,1,0,0,0,0|3,0,0]=4 4509 B17R0.250 CCOCCOCCSCCCCC(=O)OCC 62a_100011211534_100000750268 [0,1,0,0,0,0|3,0,0]=4 4510 B17R0.250 CCOCCSCCCCCCCC(=O)OCC 62a_100000210147_100009991516 [0,1,0,0,0,0|2,0,0]=3 4511 B17R0.250 CCOCSCCCCCCCCC(=O)OCC 62a_100000739092_100010175975 [0,1,0,0,0,0|2,0,0]=3 4512 B17R0.250 CNNC(=O)CCCCCCCCCCCCO 22a_100016993582_100102582631 [0,1,0,0,0,0|2,0,0]=3 4513 B17R0.250 COCC(=O)CCCCCCCCCCCCO 1458a_100000210968_100009813331 [0,1,0,0,0,0|1,0,0]=2 4514 B17R0.250 COCC(=O)CCCCCCOCCCCCO 1458a_100000210968_200132310570 [0,1,0,0,0,0|2,0,0]=3 4515 B17R0.250 CSCC(=O)CCCCCCCCCCCCO 1458a_100000184570_100009813331 [0,1,0,0,0,0|1,1,0]=3 4516 B17R0.250 CSCC(=O)CCCCCCOCCCCCO 1458a_100000184570_200132310570 [0,1,0,0,0,0|2,1,0]=4 4517 B17R0.250 N#CCC(=O)CCCCCCCCCCCCO 1458a_100051588842_100009813331 [0,1,0,0,0,0|2,0,1]=4 4518 B17R0.250 NCCCCCCCCCCOCC(=O)NCO 34a_100000066964_100000185155 [0,1,0,0,0,0|3,0,0]=4 4519 B17R0.250 O=C(C=CBr)CCCCCCCCCCCCO 1458a_100016273825_100009813331 [0,1,0,0,0,0|2,0,1]=4 4520 B17R0.250 O=C(C=CCl)CCCCCCCCCCCCO 1458a_200016279998_100009813331 [0,1,0,0,0,0|2,0,1]=4 4521 B17R0.250 O=C(C=CI)CCCCCCCCCCCCO 1458a_100016256311_100009813331 [0,1,0,0,0,0|2,0,1]=4 4522 B17R0.250 O=C(CCO)CCCCCCCCCCCCO 1458a_100011216618_100009813331 [0,1,0,0,0,0|2,0,0]=3 4523 B17R0.250 O=C(CCO)CCCCCCOCCCCCO 1458a_100011216618_200132310570 [0,1,0,0,0,0|3,0,0]=4 4524 B17R0.250 O=C(CNCCCCCCCCCCO)NCO 2230a_100000066964_100000185155 [0,1,0,0,0,0|3,0,0]=4 4525 B17R0.250 O=C(CNCCCCCCCCCCO)NCO 34a_100000066964_100000185155 [0,1,0,0,0,0|3,0,0]=4 4526 B17R0.250 O=C(COCCCCCCCCCCBr)NCO 34a_100009813290_100000185155 [0,1,0,0,0,0|3,0,0]=4 4527 B17R0.250 O=C(COCCCCCCCCCCBr)NCO 7a_100009813290_100000185155 [0,1,0,0,0,0|3,0,0]=4 4528 B17R0.250 O=C(COCCCCCCCCCCCl)NCO 34a_200000033068_100000185155 [0,1,0,0,0,0|3,0,0]=4 4529 B17R0.250 O=C(COCCCCCCCCCCCl)NCO 7a_200000033068_100000185155 [0,1,0,0,0,0|3,0,0]=4 4530 B17R0.250 O=C(CSCCCCCCCCCCO)NCO 62a_100000185155_200000033068 [0,1,0,0,0,0|3,0,0]=4 4531 B17R0.250 O=C(CSCCCCCCCCCCO)NCO 62a_100009813290_100000185155 [0,1,0,0,0,0|3,0,0]=4 4532 B17R0.3062 C#CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000731252 [0,1,0,0,0,0|0,0,3]=4 4533 B17R0.3062 C#CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000690238_100010004213 [0,1,0,0,0,0|0,0,3]=4 4534 B17R0.3062 C=CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000757094 [0,1,0,0,0,0|0,0,3]=4 4535 B17R0.3062 C=CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000766728_100010004213 [0,1,0,0,0,0|0,0,3]=4 4536 B17R0.3062 CC/C=C/CC(=O)CCCCCCCC(=O)OC 1458a_100016274230_100010004213 [0,1,0,0,0,0|0,0,3]=4 4537 B17R0.3062 CC/C=C\CC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100103147603 [0,1,0,0,0,0|0,0,3]=4 4538 B17R0.3062 CCC#CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100009813939 [0,1,0,0,0,0|0,0,3]=4 4539 B17R0.3062 CCC#CCC(C)OCCCCCCC(=O)OC 34a_200000035118_100009815986 [0,1,0,0,0,0|1,0,2]=4 4540 B17R0.3062 CCC#CCC(C)OCCCCCCC(=O)OC 7a_200000035118_100009815986 [0,1,0,0,0,0|1,0,2]=4 4541 B17R0.3062 CCCC#CC(=O)CCCCCCCC(=O)OC 1458a_200011218047_100010004213 [0,1,0,0,0,0|0,0,3]=4 4542 B17R0.3062 CCCC=CC(=O)CCCCCCCC(=O)OC 1458a_100000212230_100010004213 [0,1,0,0,0,0|0,0,3]=4 4543 B17R0.3062 CCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210326 [0,1,0,0,0,0|0,0,1]=2 4544 B17R0.3062 CCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000212188_100010004213 [0,1,0,0,0,0|0,0,1]=2 4545 B17R0.3062 CCCCCC(=O)COCCCCCC(=O)OC 34a_100000074720_200012276598 [0,1,0,0,0,0|1,0,1]=3 4546 B17R0.3062 CCCCCC(=O)COCCCCCC(=O)OC 7a_100000074720_200012276598 [0,1,0,0,0,0|1,0,1]=3 4547 B17R0.3062 CCCCCC(=O)CSCCCCCC(=O)OC 62a_100009816466_200012276598 [0,1,0,0,0,0|1,0,1]=3 4548 B17R0.3062 CCCCCC(=O)CSCCCCCC(=O)OC 62a_200012276598_100009816466 [0,1,0,0,0,0|1,0,1]=3 4549 B17R0.3062 CCCCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000212188 [0,1,0,0,0,0|1,0,1]=3 4550 B17R0.3062 CCCCCC(C)NCCCCCCC(=O)OC 2230a_100000211957_100009815986 [0,1,0,0,0,0|1,0,0]=2 4551 B17R0.3062 CCCCCC(C)OCCCCCCC(=O)OC 34a_100009863599_200011218191 [0,1,0,0,0,0|1,0,0]=2 4552 B17R0.3062 CCCCCC(C)OCCCCCCC(=O)OC 34a_100011215632_100009815986 [0,1,0,0,0,0|1,0,0]=2 4553 B17R0.3062 CCCCCC(C)OCCCCCCC(=O)OC 7a_100009863599_200011218191 [0,1,0,0,0,0|1,0,0]=2 4554 B17R0.3062 CCCCCC(C)OCCCCCCC(=O)OC 7a_100011215632_100009815986 [0,1,0,0,0,0|1,0,0]=2 4555 B17R0.3062 CCCCCC(C)SCCCCCCC(=O)OC 62a_100009815986_200011218191 [0,1,0,0,0,0|1,0,0]=2 4556 B17R0.3062 CCCCCC(C)SCCCCCCC(=O)OC 62a_200011218191_100009815986 [0,1,0,0,0,0|1,0,0]=2 4557 B17R0.3062 CCCCCN(C)CCCCCCCC(=O)OC 2230a_100000223495_100010004213 [0,1,0,0,0,0|1,0,0]=2 4558 B17R0.3062 CCCCCN(C)CCCCCCCC(=O)OC 269982a_100000223495_100010004213 [0,1,0,0,0,0|1,0,0]=2 4559 B17R0.3062 CCCCNC(=O)CCCCCCCC(=O)OC 11a_100000102301_100000033222 [0,1,0,0,0,0|1,0,1]=3 4560 B17R0.3062 CCCCNC(=O)CCCCCCCC(=O)OC 1626a_100000102301_100000033222 [0,1,0,0,0,0|1,0,1]=3 4561 B17R0.3062 CCCCNC(=O)CCCCCCCC(=O)OC 240690a_100000102301_100000033222 [0,1,0,0,0,0|1,0,1]=3 4562 B17R0.3062 CCCCNC(=O)COCCCCCC(=O)OC 34a_100000074720_100000182744 [0,1,0,0,0,0|2,0,1]=4 4563 B17R0.3062 CCCCNC(=O)COCCCCCC(=O)OC 7a_100000074720_100000182744 [0,1,0,0,0,0|2,0,1]=4 4564 B17R0.3062 CCCCNC(=O)CSCCCCCC(=O)OC 62a_100000182744_100009816466 [0,1,0,0,0,0|2,0,1]=4 4565 B17R0.3062 CCCCNC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000182744 [0,1,0,0,0,0|2,0,1]=4 4566 B17R0.3062 CCCCOC(=O)COCCCCCC(=O)OC 34a_100000074720_100000211628 [0,1,0,0,0,0|2,0,1]=4 4567 B17R0.3062 CCCCOC(=O)COCCCCCC(=O)OC 7a_100000074720_100000211628 [0,1,0,0,0,0|2,0,1]=4 4568 B17R0.3062 CCCCOC(=O)CSCCCCCC(=O)OC 62a_100000211628_100009816466 [0,1,0,0,0,0|2,0,1]=4 4569 B17R0.3062 CCCCOC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000211628 [0,1,0,0,0,0|2,0,1]=4 4570 B17R0.3062 CCCOCC(=O)CCCCCCCC(=O)OC 1458a_100000745993_100010004213 [0,1,0,0,0,0|1,0,1]=3 4571 B17R0.3062 CCCOCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000745993 [0,1,0,0,0,0|2,0,1]=4 4572 B17R0.3062 CCCSCC(=O)CCCCCCCC(=O)OC 1458a_100000217233_100010004213 [0,1,0,0,0,0|1,0,1]=3 4573 B17R0.3062 CCCSCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000217233 [0,1,0,0,0,0|2,0,1]=4 4574 B17R0.3062 CCOCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100011215890 [0,1,0,0,0,0|1,0,1]=3 4575 B17R0.3062 CCOCCC(=O)CCCCCCCC(=O)OC 1458a_100000749530_100010004213 [0,1,0,0,0,0|1,0,1]=3 4576 B17R0.3062 CCOCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000749530 [0,1,0,0,0,0|2,0,1]=4 4577 B17R0.3062 CCSCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000757381 [0,1,0,0,0,0|1,0,1]=3 4578 B17R0.3062 CCSCCC(=O)CCCCCCCC(=O)OC 1458a_100000230768_100010004213 [0,1,0,0,0,0|1,0,1]=3 4579 B17R0.3062 CCSCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000230768 [0,1,0,0,0,0|2,0,1]=4 4580 B17R0.3062 COC(=O)CCCCCCCC(=O)CCCC#N 1458a_100000033222_100000211468 [0,1,0,0,0,0|1,0,2]=4 4581 B17R0.3062 COC(=O)CCCCCCCC(=O)CCCC#N 1458a_100000075515_100010004213 [0,1,0,0,0,0|1,0,2]=4 4582 B17R0.3062 COC(=O)CCCCCCCC(=O)CCCCF 1458a_100000033222_100000729493 [0,1,0,0,0,0|1,0,1]=3 4583 B17R0.3062 COC(=O)CCCCCCCC(=O)CCCCO 1458a_100000033222_100000210776 [0,1,0,0,0,0|1,0,1]=3 4584 B17R0.3062 COC(=O)CCCCCCCC(=O)CCCCO 1458a_100000695505_100010004213 [0,1,0,0,0,0|1,0,1]=3 4585 B17R0.3062 COC(=O)CCCCCCCC(=O)CCCSC 1458a_100000173376_100010004213 [0,1,0,0,0,0|1,0,1]=3 4586 B17R0.3062 COC(=O)CCCCCCCC(=O)COCCO 1458a_100000708028_100010004213 [0,1,0,0,0,0|2,0,1]=4 4587 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCCF 11a_100015189416_100000033222 [0,1,0,0,0,0|2,0,1]=4 4588 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCCF 1626a_100015189416_100000033222 [0,1,0,0,0,0|2,0,1]=4 4589 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCCF 240690a_100015189416_100000033222 [0,1,0,0,0,0|2,0,1]=4 4590 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCCO 240690a_100000182051_100000033222 [0,1,0,0,0,0|2,0,1]=4 4591 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCSC 11a_100020590264_100000033222 [0,1,0,0,0,0|2,0,1]=4 4592 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCSC 1626a_100020590264_100000033222 [0,1,0,0,0,0|2,0,1]=4 4593 B17R0.3062 COC(=O)CCCCCCCC(=O)NCCSC 240690a_100020590264_100000033222 [0,1,0,0,0,0|2,0,1]=4 4594 B17R0.3062 COC(=O)CCCCCCCN(C)CCCCO 2230a_100000717598_100010004213 [0,1,0,0,0,0|2,0,0]=3 4595 B17R0.3062 COC(=O)CCCCCCCN(C)CCCCO 269982a_100000717598_100010004213 [0,1,0,0,0,0|2,0,0]=3 4596 B17R0.3062 COC(=O)CCCCCCNC(=O)CCCCO 188690a_100000739044_100000695505 [0,1,0,0,0,0|2,0,1]=4 4597 B17R0.3062 COC(=O)CCCCCCNC(=O)CCCSC 188690a_100000739044_100000173376 [0,1,0,0,0,0|2,0,1]=4 4598 B17R0.3062 COC(=O)CCCCCOC[C@@H](N)CCCCN 34a_100016993712_100009816466 [0,1,0,0,0,0|2,0,0]=3 4599 B17R0.3062 COCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000740836 [0,1,0,0,0,0|1,0,1]=3 4600 B17R0.3062 COCCCC(=O)CCCCCCCC(=O)OC 1458a_100000741012_100010004213 [0,1,0,0,0,0|1,0,1]=3 4601 B17R0.3062 COCCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000741012 [0,1,0,0,0,0|2,0,1]=4 4602 B17R0.3062 COCCCC(C)OCCCCCCC(=O)OC 34a_200011539412_100009815986 [0,1,0,0,0,0|2,0,0]=3 4603 B17R0.3062 COCCCC(C)OCCCCCCC(=O)OC 7a_200011539412_100009815986 [0,1,0,0,0,0|2,0,0]=3 4604 B17R0.3062 COCCCN(C)CCCCCCCC(=O)OC 2230a_100000224831_100010004213 [0,1,0,0,0,0|2,0,0]=3 4605 B17R0.3062 COCCCN(C)CCCCCCCC(=O)OC 269982a_100000224831_100010004213 [0,1,0,0,0,0|2,0,0]=3 4606 B17R0.3062 COCCNC(=O)CCCCCCCC(=O)OC 1626a_100000209980_100000033222 [0,1,0,0,0,0|2,0,1]=4 4607 B17R0.3062 COCCNC(=O)CCCCCCCC(=O)OC 240690a_100000209980_100000033222 [0,1,0,0,0,0|2,0,1]=4 4608 B17R0.3112 C#CC(=O)C(C)CCCCCCCCCCCC 1458a_100000211873_200011217028 [0,1,0,0,0,0|1,0,1]=3 4609 B17R0.3112 C#CCCCCCCCCCOC(C)C(=O)OC 34a_100000034437_100000211248 [0,1,0,0,0,0|1,0,2]=4 4610 B17R0.3112 C#CCCCCCCCCCOC(C)C(=O)OC 7a_100000034437_100000211248 [0,1,0,0,0,0|1,0,2]=4 4611 B17R0.3112 C#CCCCCCCCCOCC(C)C(=O)OC 34a_100000065265_100000698445 [0,1,0,0,0,0|1,0,2]=4 4612 B17R0.3112 C#CCCCCCCCOCCC(C)C(=O)OC 34a_100000054614_100000034942 [0,1,0,0,0,0|1,0,2]=4 4613 B17R0.3112 C#CCCCCCCCOCCC(C)C(=O)OC 7a_100000054614_100000034942 [0,1,0,0,0,0|1,0,2]=4 4614 B17R0.3112 C#CCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100153394163 [0,1,0,0,0,0|1,0,2]=4 4615 B17R0.3112 C#CCCCCCCCSCCC(C)C(=O)OC 62a_100153394163_100000034942 [0,1,0,0,0,0|1,0,2]=4 4616 B17R0.3112 C/C=C(\C)/C(=O)CCCCCCCCCCCC 1458a_100020587367_100000759014 [0,1,0,0,0,0|2,0,1]=4 4617 B17R0.3112 C/C=C(\C)/C(C)NCCCCCCCCCCC 269862a_200011215754_100020675665 [0,1,0,0,0,0|3,0,0]=4 4618 B17R0.3112 C=C(CNCCCCCCCCCC)C(=O)OC 34a_100000684558_100009813391 [0,1,0,0,0,0|1,0,1]=3 4619 B17R0.3112 C=C(CNCCCCCCCCCO)C(=O)OC 34a_100000078944_100009813391 [0,1,0,0,0,0|2,0,1]=4 4620 B17R0.3112 C=C(COCCCCCCCCCBr)C(=O)OC 34a_100009813782_100009813391 [0,1,0,0,0,0|2,0,1]=4 4621 B17R0.3112 C=C(COCCCCCCCCCC)C(=O)OC 34a_100000210711_100009813391 [0,1,0,0,0,0|1,0,1]=3 4622 B17R0.3112 C=C(COCCCCCCCCCCl)C(=O)OC 34a_100009868337_100009813391 [0,1,0,0,0,0|2,0,1]=4 4623 B17R0.3112 C=C(COCCCCCCCCCN)C(=O)OC 34a_100000078944_100009813391 [0,1,0,0,0,0|2,0,1]=4 4624 B17R0.3112 C=C(CSCCCCCCCCCC)C(=O)OC 62a_100009813391_100000210320 [0,1,0,0,0,0|1,0,1]=3 4625 B17R0.3112 C=C(CSCCCCCCCCCO)C(=O)OC 62a_100009813391_100009813782 [0,1,0,0,0,0|2,0,1]=4 4626 B17R0.3112 C=C(CSCCCCCCCCCO)C(=O)OC 62a_100009813782_100009813391 [0,1,0,0,0,0|2,0,1]=4 4627 B17R0.3112 C=CC(=O)C(C)CCCCCCCCCCCC 1458a_100000185746_200011217028 [0,1,0,0,0,0|1,0,1]=3 4628 B17R0.3112 C=CC(=O)N(C)CCCCCCCCCCCC 1626a_100000227908_100000185746 [0,1,0,0,0,0|2,0,1]=4 4629 B17R0.3112 C=CC(=O)N(C)CCCCCCCCCCCC 240690a_100000227908_200121576911 [0,1,0,0,0,0|2,0,1]=4 4630 B17R0.3112 C=CCCCCCCCCCNC(C)C(=O)OC 2230a_100000081888_100000211248 [0,1,0,0,0,0|1,0,2]=4 4631 B17R0.3112 C=CCCCCCCCCCNC(C)C(=O)OC 34a_100000081888_100000211248 [0,1,0,0,0,0|1,0,2]=4 4632 B17R0.3112 C=CCCCCCCCCCOC(C)C(=O)OC 34a_100000038209_100000211248 [0,1,0,0,0,0|1,0,2]=4 4633 B17R0.3112 C=CCCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100009814027 [0,1,0,0,0,0|1,0,2]=4 4634 B17R0.3112 C=CCCCCCCCCCOC(C)C(=O)OC 7a_100000038209_100000211248 [0,1,0,0,0,0|1,0,2]=4 4635 B17R0.3112 C=CCCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100009814027 [0,1,0,0,0,0|1,0,2]=4 4636 B17R0.3112 C=CCCCCCCCCCSC(C)C(=O)OC 62a_100009814027_100000211248 [0,1,0,0,0,0|1,0,2]=4 4637 B17R0.3112 C=CCCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100011933949 [0,1,0,0,0,0|1,0,2]=4 4638 B17R0.3112 C=CCCCCCCCCOCC(C)C(=O)OC 34a_100011215194_100000698445 [0,1,0,0,0,0|1,0,2]=4 4639 B17R0.3112 C=CCCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100011933949 [0,1,0,0,0,0|1,0,2]=4 4640 B17R0.3112 C=CCCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100011933949 [0,1,0,0,0,0|1,0,2]=4 4641 B17R0.3112 C=CCCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011933949 [0,1,0,0,0,0|1,0,2]=4 4642 B17R0.3112 C=CCCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100011933949 [0,1,0,0,0,0|1,0,2]=4 4643 B17R0.3112 C=CCCCCCCCCSCC(C)C(=O)OC 62a_100011933949_100000698445 [0,1,0,0,0,0|1,0,2]=4 4644 B17R0.3112 C=CCCCCCCCOCCC(C)C(=O)OC 34a_100000730831_100000034942 [0,1,0,0,0,0|1,0,2]=4 4645 B17R0.3112 C=CCCCCCCCOCCC(C)C(=O)OC 7a_100000730831_100000034942 [0,1,0,0,0,0|1,0,2]=4 4646 B17R0.3112 C=CCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100012355270 [0,1,0,0,0,0|1,0,2]=4 4647 B17R0.3112 C=CCCCCCCCSCCC(C)C(=O)OC 62a_100012355270_100000034942 [0,1,0,0,0,0|1,0,2]=4 4648 B17R0.3112 CC/C=C\CCCCCOCCC(C)C(=O)OC 34a_100016268722_100000034942 [0,1,0,0,0,0|1,0,2]=4 4649 B17R0.3112 CC/C=C\CCCCCOCCC(C)C(=O)OC 7a_100016268722_100000034942 [0,1,0,0,0,0|1,0,2]=4 4650 B17R0.3112 CCC#CCCCCCCOCC(C)C(=O)OC 34a_100000749362_200000036426 [0,1,0,0,0,0|1,0,2]=4 4651 B17R0.3112 CCC#CCCCCCCOCC(C)C(=O)OC 7a_100000749362_200000036426 [0,1,0,0,0,0|1,0,2]=4 4652 B17R0.3112 CCC#CCCCCCCOCC(F)C(=O)OC 34a_200009849844_200000036426 [0,1,0,0,0,0|1,0,2]=4 4653 B17R0.3112 CCC#CCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_200000036426 [0,1,0,0,0,0|1,0,2]=4 4654 B17R0.3112 CCC#CCCCCCCSCC(C)C(=O)OC 62a_100000698445_200000036426 [0,1,0,0,0,0|1,0,2]=4 4655 B17R0.3112 CCC#CCCCCCCSCC(C)C(=O)OC 62a_200000036426_100000698445 [0,1,0,0,0,0|1,0,2]=4 4656 B17R0.3112 CCC(=O)C(C)NCCCCCCCCCCO 2230a_100000066964_100000742827 [0,1,0,0,0,0|3,0,0]=4 4657 B17R0.3112 CCC(=O)C(C)OCCCCCCCCCCBr 7a_100009813290_100000742827 [0,1,0,0,0,0|3,0,0]=4 4658 B17R0.3112 CCC(=O)C(C)OCCCCCCCCCCCl 7a_200000033068_100000742827 [0,1,0,0,0,0|3,0,0]=4 4659 B17R0.3112 CCC(=O)C(C)SCCCCCCCCCCO 62a_100000742827_200000033068 [0,1,0,0,0,0|3,0,0]=4 4660 B17R0.3112 CCC(=O)C(C)SCCCCCCCCCCO 62a_100009813290_100000742827 [0,1,0,0,0,0|3,0,0]=4 4661 B17R0.3112 CCCC/C=C/CCCCOCC(C)C(=O)OC 34a_200020645093_100000698445 [0,1,0,0,0,0|1,0,2]=4 4662 B17R0.3112 CCCCC#CCCCCOCC(C)C(=O)OC 34a_200000066234_100000698445 [0,1,0,0,0,0|1,0,2]=4 4663 B17R0.3112 CCCCC#CCCCSCCC(C)C(=O)OC 62a_100000034942_200000047210 [0,1,0,0,0,0|1,0,2]=4 4664 B17R0.3112 CCCCC#CCCCSCCC(C)C(=O)OC 62a_200000047210_100000034942 [0,1,0,0,0,0|1,0,2]=4 4665 B17R0.3112 CCCCC/C=C\CCCOCC(C)C(=O)OC 34a_100020655193_100000698445 [0,1,0,0,0,0|1,0,2]=4 4666 B17R0.3112 CCCCC/C=C\CCOCCC(C)C(=O)OC 34a_100016277358_100000034942 [0,1,0,0,0,0|1,0,2]=4 4667 B17R0.3112 CCCCC/C=C\CCOCCC(C)C(=O)OC 7a_100016277358_100000034942 [0,1,0,0,0,0|1,0,2]=4 4668 B17R0.3112 CCCCCC#CCCOCCC(C)C(=O)OC 34a_200000042877_100000034942 [0,1,0,0,0,0|1,0,2]=4 4669 B17R0.3112 CCCCCC#CCCOCCC(C)C(=O)OC 7a_200000042877_100000034942 [0,1,0,0,0,0|1,0,2]=4 4670 B17R0.3112 CCCCCC/C=C/COCCC(C)C(=O)OC 34a_200016276170_100000034942 [0,1,0,0,0,0|1,0,2]=4 4671 B17R0.3112 CCCCCC/C=C/COCCC(C)C(=O)OC 7a_200016276170_100000034942 [0,1,0,0,0,0|1,0,2]=4 4672 B17R0.3112 CCCCCCC#CCCOCC(C)C(=O)OC 34a_200000033163_100000698445 [0,1,0,0,0,0|1,0,2]=4 4673 B17R0.3112 CCCCCCC#CCOCCC(C)C(=O)OC 34a_200000037284_100000034942 [0,1,0,0,0,0|1,0,2]=4 4674 B17R0.3112 CCCCCCC#CCOCCC(C)C(=O)OC 7a_200000037284_100000034942 [0,1,0,0,0,0|1,0,2]=4 4675 B17R0.3112 CCCCCCCC#CCOCC(C)C(=O)OC 34a_200000061759_100000698445 [0,1,0,0,0,0|1,0,2]=4 4676 B17R0.3112 CCCCCCCC/C=C/COC(C)C(=O)OC 34a_200020667288_100000211248 [0,1,0,0,0,0|1,0,2]=4 4677 B17R0.3112 CCCCCCCC/C=C/COC(C)C(=O)OC 7a_200020667288_100000211248 [0,1,0,0,0,0|1,0,2]=4 4678 B17R0.3112 CCCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000759014 [0,1,0,0,0,0|1,0,1]=3 4679 B17R0.3112 CCCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000759014 [0,1,0,0,0,0|1,0,2]=4 4680 B17R0.3112 CCCCCCCCCCCCC(C)C(=O)CC 1458a_100000210414_200011217028 [0,1,0,0,0,0|1,0,0]=2 4681 B17R0.3112 CCCCCCCCCCCCC(C)C(=O)CO 1458a_100000210174_200011217028 [0,1,0,0,0,0|2,0,0]=3 4682 B17R0.3112 CCCCCCCCCCCCC(C)N(C)CC 2230a_100000225621_200011217028 [0,1,0,0,0,0|3,0,0]=4 4683 B17R0.3112 CCCCCCCCCCCCC(C)N(C)CC 269982a_100000225621_200011217028 [0,1,0,0,0,0|3,0,0]=4 4684 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)CC 11a_100000227908_100000210414 [0,1,0,0,0,0|2,0,0]=3 4685 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)CC 1626a_100000227908_100000210414 [0,1,0,0,0,0|2,0,0]=3 4686 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)CC 240690a_100000227908_100000210414 [0,1,0,0,0,0|2,0,0]=3 4687 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)CC 527a_100000227908_100000210414 [0,1,0,0,0,0|2,0,0]=3 4688 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)CO 240690a_100000227908_100000210174 [0,1,0,0,0,0|3,0,0]=4 4689 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)CO 527a_100000227908_100000210174 [0,1,0,0,0,0|3,0,0]=4 4690 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)NC 2708a_100102657272_100000227908 [0,1,0,0,0,0|2,0,0]=3 4691 B17R0.3112 CCCCCCCCCCCCN(C)C(=O)NC 273464a_100102657272_100000227908 [0,1,0,0,0,0|2,0,0]=3 4692 B17R0.3112 CCCCCCCCCCCCN(C)C(C)OC 269982a_100000227908_100009879195 [0,1,0,0,0,0|2,0,1]=4 4693 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)NC 1626a_200011215754_100011218921 [0,1,0,0,0,0|2,0,1]=4 4694 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)NC 240690a_200011215754_100011218921 [0,1,0,0,0,0|2,0,1]=4 4695 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)NC 527a_200011215754_100011218921 [0,1,0,0,0,0|2,0,1]=4 4696 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)OC 11a_200011215754_100000024059 [0,1,0,0,0,0|1,0,1]=3 4697 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)OC 1626a_200011215754_100000024059 [0,1,0,0,0,0|1,0,1]=3 4698 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)OC 240690a_200011215754_100000024059 [0,1,0,0,0,0|1,0,1]=3 4699 B17R0.3112 CCCCCCCCCCCNC(=O)C(=O)OC 527a_200011215754_100000024059 [0,1,0,0,0,0|1,0,1]=3 4700 B17R0.3112 CCCCCCCCCCCNC(C)C(=O)CC 2230a_200011215754_100000742827 [0,1,0,0,0,0|2,0,0]=3 4701 B17R0.3112 CCCCCCCCCCCNC(C)C(=O)NC 2230a_200011215754_100000731044 [0,1,0,0,0,0|2,0,0]=3 4702 B17R0.3112 CCCCCCCCCCCNC(C)C(=O)NC 34a_200011215754_100000731044 [0,1,0,0,0,0|2,0,0]=3 4703 B17R0.3112 CCCCCCCCCCCNC(C)C(=O)OC 2230a_200011215754_100000211248 [0,1,0,0,0,0|1,0,0]=2 4704 B17R0.3112 CCCCCCCCCCCNC(C)C(=O)OC 34a_200011215754_100000211248 [0,1,0,0,0,0|1,0,0]=2 4705 B17R0.3112 CCCCCCCCCCCNC(F)C(=O)NC 2230a_200011215754_100009813575 [0,1,0,0,0,0|2,0,0]=3 4706 B17R0.3112 CCCCCCCCCCCNC(F)C(=O)NC 34a_200011215754_100009813575 [0,1,0,0,0,0|2,0,0]=3 4707 B17R0.3112 CCCCCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100011215454 [0,1,0,0,0,0|2,0,0]=3 4708 B17R0.3112 CCCCCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100011215454 [0,1,0,0,0,0|2,0,0]=3 4709 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)CC 7a_100000210809_100000742827 [0,1,0,0,0,0|2,0,0]=3 4710 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)NC 34a_100000210809_100000731044 [0,1,0,0,0,0|2,0,0]=3 4711 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)NC 7a_100000210809_100000209862 [0,1,0,0,0,0|2,0,0]=3 4712 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)NN 34a_100000725659_100011215454 [0,1,0,0,0,0|3,0,0]=4 4713 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)OC 34a_100000210809_100000211248 [0,1,0,0,0,0|1,0,0]=2 4714 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100011215454 [0,1,0,0,0,0|1,0,0]=2 4715 B17R0.3112 CCCCCCCCCCCOC(C)C(=O)OC 7a_100000210809_100000211248 [0,1,0,0,0,0|1,0,0]=2 4716 B17R0.3112 CCCCCCCCCCCOC(F)C(=O)NC 34a_100000210809_100009813575 [0,1,0,0,0,0|2,0,0]=3 4717 B17R0.3112 CCCCCCCCCCCOC(F)C(=O)NC 7a_100000210809_100009813575 [0,1,0,0,0,0|2,0,0]=3 4718 B17R0.3112 CCCCCCCCCCCSC(C)C(=O)CC 62a_100000742827_100011215454 [0,1,0,0,0,0|2,0,0]=3 4719 B17R0.3112 CCCCCCCCCCCSC(C)C(=O)NC 62a_100000209862_100011215454 [0,1,0,0,0,0|2,0,0]=3 4720 B17R0.3112 CCCCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100011215454 [0,1,0,0,0,0|1,0,0]=2 4721 B17R0.3112 CCCCCCCCCCCSC(F)C(=O)NC 62a_100009813575_100011215454 [0,1,0,0,0,0|2,0,0]=3 4722 B17R0.3112 CCCCCCCCCCNCC(=O)C(=O)OC 34a_100000684558_100011610305 [0,1,0,0,0,0|1,0,1]=3 4723 B17R0.3112 CCCCCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100000210320 [0,1,0,0,0,0|2,0,0]=3 4724 B17R0.3112 CCCCCCCCCCNCC(C)C(=O)NC 34a_100015187722_100000210320 [0,1,0,0,0,0|2,0,0]=3 4725 B17R0.3112 CCCCCCCCCCNCC(C)C(=O)OC 34a_100000684558_100000698445 [0,1,0,0,0,0|1,0,0]=2 4726 B17R0.3112 CCCCCCCCCCOCC(=O)C(=O)OC 34a_100000210711_100011610305 [0,1,0,0,0,0|1,0,1]=3 4727 B17R0.3112 CCCCCCCCCCOCC(C)C(=O)OC 34a_100000210711_100000698445 [0,1,0,0,0,0|1,0,0]=2 4728 B17R0.3112 CCCCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100000210320 [0,1,0,0,0,0|1,0,0]=2 4729 B17R0.3112 CCCCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210320 [0,1,0,0,0,0|1,0,0]=2 4730 B17R0.3112 CCCCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100000210320 [0,1,0,0,0,0|1,0,0]=2 4731 B17R0.3112 CCCCCCCCCCOCC(N)C(=O)NN 34a_100016989258_100000210320 [0,1,0,0,0,0|3,0,0]=4 4732 B17R0.3112 CCCCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210320 [0,1,0,0,0,0|1,0,0]=2 4733 B17R0.3112 CCCCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210320 [0,1,0,0,0,0|1,0,1]=3 4734 B17R0.3112 CCCCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210320 [0,1,0,0,0,0|1,0,0]=2 4735 B17R0.3112 CCCCCCCCCNCCC(C)C(=O)OC 2230a_100000212291_100000034942 [0,1,0,0,0,0|1,0,0]=2 4736 B17R0.3112 CCCCCCCCCNCCC(C)C(=O)OC 34a_100000212291_100000034942 [0,1,0,0,0,0|1,0,0]=2 4737 B17R0.3112 CCCCCCCCCOCCC(C)C(=O)OC 34a_100000210712_100000034942 [0,1,0,0,0,0|1,0,0]=2 4738 B17R0.3112 CCCCCCCCCOCCC(C)C(=O)OC 7a_100000210712_100000034942 [0,1,0,0,0,0|1,0,0]=2 4739 B17R0.3112 CCCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210670 [0,1,0,0,0,0|1,0,0]=2 4740 B17R0.3112 CCCCCCOCCOCCC(C)C(=O)OC 34a_100000691444_100000034942 [0,1,0,0,0,0|2,0,0]=3 4741 B17R0.3112 CCCCCCOCCOCCC(C)C(=O)OC 7a_100000691444_100000034942 [0,1,0,0,0,0|2,0,0]=3 4742 B17R0.3112 CCCCNCCCCOCCC(C)C(=O)OC 34a_200011216965_100000034942 [0,1,0,0,0,0|2,0,0]=3 4743 B17R0.3112 CCCCOCCCCOCCC(C)C(=O)OC 34a_200000760531_100000034942 [0,1,0,0,0,0|2,0,0]=3 4744 B17R0.3112 CCCCOCCCCOCCC(C)C(=O)OC 7a_200000760531_100000034942 [0,1,0,0,0,0|2,0,0]=3 4745 B17R0.3112 CCCCOCCOCCOCC(C)C(=O)OC 34a_100011215186_100000698445 [0,1,0,0,0,0|3,0,0]=4 4746 B17R0.3112 CCCOCCOCCNCCC(C)C(=O)OC 2230a_200011904461_100000034942 [0,1,0,0,0,0|3,0,0]=4 4747 B17R0.3112 CCCOCCOCCNCCC(C)C(=O)OC 34a_200011904461_100000034942 [0,1,0,0,0,0|3,0,0]=4 4748 B17R0.3112 CNC(=O)C(=O)CCCCCCCCCCCO 1458a_100011218921_100009812471 [0,1,0,0,0,0|2,0,1]=4 4749 B17R0.3112 CNC(=O)C(C)CNCCCCCCCCCO 2230a_100015187722_100009813782 [0,1,0,0,0,0|3,0,0]=4 4750 B17R0.3112 CNC(=O)C(C)CNCCCCCCCCCO 34a_100015187722_100009813782 [0,1,0,0,0,0|3,0,0]=4 4751 B17R0.3112 CNC(=O)C(C)NCCCCCCCCCCO 2230a_100000066964_100000731044 [0,1,0,0,0,0|3,0,0]=4 4752 B17R0.3112 CNC(=O)C(C)NCCCCCCCCCCO 34a_100000066964_100000731044 [0,1,0,0,0,0|3,0,0]=4 4753 B17R0.3112 CNC(=O)C(C)OCCCCCCCCCCBr 34a_100009813290_100000731044 [0,1,0,0,0,0|3,0,0]=4 4754 B17R0.3112 CNC(=O)C(C)OCCCCCCCCCCBr 7a_100009813290_100000209862 [0,1,0,0,0,0|3,0,0]=4 4755 B17R0.3112 CNC(=O)C(C)OCCCCCCCCCCCl 34a_200000033068_100000731044 [0,1,0,0,0,0|3,0,0]=4 4756 B17R0.3112 CNC(=O)C(C)OCCCCCCCCCCCl 7a_200000033068_100000209862 [0,1,0,0,0,0|3,0,0]=4 4757 B17R0.3112 CNC(=O)C(C)OCCCCCCCCCCN 34a_100000066964_100000731044 [0,1,0,0,0,0|3,0,0]=4 4758 B17R0.3112 CNC(=O)C(C)SCCCCCCCCCCO 62a_100000209862_200000033068 [0,1,0,0,0,0|3,0,0]=4 4759 B17R0.3112 CNC(=O)C(C)SCCCCCCCCCCO 62a_100009813290_100000731044 [0,1,0,0,0,0|3,0,0]=4 4760 B17R0.3112 CNC(=O)C(F)NCCCCCCCCCCO 2230a_100000066964_100009813575 [0,1,0,0,0,0|3,0,0]=4 4761 B17R0.3112 CNC(=O)C(F)NCCCCCCCCCCO 34a_100000066964_100009813575 [0,1,0,0,0,0|3,0,0]=4 4762 B17R0.3112 CNC(=O)C(F)OCCCCCCCCCCBr 34a_100009813290_100009813575 [0,1,0,0,0,0|3,0,0]=4 4763 B17R0.3112 CNC(=O)C(F)OCCCCCCCCCCBr 7a_100009813290_100009813575 [0,1,0,0,0,0|3,0,0]=4 4764 B17R0.3112 CNC(=O)C(F)OCCCCCCCCCCCl 34a_200000033068_100009813575 [0,1,0,0,0,0|3,0,0]=4 4765 B17R0.3112 CNC(=O)C(F)OCCCCCCCCCCCl 7a_200000033068_100009813575 [0,1,0,0,0,0|3,0,0]=4 4766 B17R0.3112 CNC(=O)C(F)OCCCCCCCCCCN 34a_100000066964_100009813575 [0,1,0,0,0,0|3,0,0]=4 4767 B17R0.3112 CNC(=O)C(F)SCCCCCCCCCCO 62a_100009813290_100009813575 [0,1,0,0,0,0|3,0,0]=4 4768 B17R0.3112 CNC(=O)C(F)SCCCCCCCCCCO 62a_100009813575_200000033068 [0,1,0,0,0,0|3,0,0]=4 4769 B17R0.3112 CNC(=O)[C@@H](C)NCCCCCCCCCCO 2230a_100000684985_100009813290 [0,1,0,0,0,0|3,0,0]=4 4770 B17R0.3112 CNC(=O)[C@@H](C)NCCCCCCCCCCO 34a_100000684985_100009813290 [0,1,0,0,0,0|3,0,0]=4 4771 B17R0.3112 COC(=O)C(=O)CNCCCCCCCCCO 34a_100000078944_100011610305 [0,1,0,0,0,0|2,0,1]=4 4772 B17R0.3112 COC(=O)C(=O)COCCCCCCCCCBr 34a_100009813782_100011610305 [0,1,0,0,0,0|2,0,1]=4 4773 B17R0.3112 COC(=O)C(=O)COCCCCCCCCCCl 34a_100009868337_100011610305 [0,1,0,0,0,0|2,0,1]=4 4774 B17R0.3112 COC(=O)C(=O)COCCCCCCCCCN 34a_100000078944_100011610305 [0,1,0,0,0,0|2,0,1]=4 4775 B17R0.3112 COC(=O)C(=O)CSCCCCCCCCCO 62a_100009813782_100011610305 [0,1,0,0,0,0|2,0,1]=4 4776 B17R0.3112 COC(=O)C(=O)CSCCCCCCCCCO 62a_100011610305_100009813782 [0,1,0,0,0,0|2,0,1]=4 4777 B17R0.3112 COC(=O)C(=O)NCCCCCCCCCCO 240690a_100000066964_100000024059 [0,1,0,0,0,0|2,0,1]=4 4778 B17R0.3112 COC(=O)C(C)CCNCCCCCCCCO 2230a_102515433106_100000034942 [0,1,0,0,0,0|2,0,0]=3 4779 B17R0.3112 COC(=O)C(C)CCNCCCCCCCCO 34a_102515433106_100000034942 [0,1,0,0,0,0|2,0,0]=3 4780 B17R0.3112 COC(=O)C(C)CCOCCCCCCCCBr 34a_100009813846_100000034942 [0,1,0,0,0,0|2,0,0]=3 4781 B17R0.3112 COC(=O)C(C)CCOCCCCCCCCBr 7a_100009813846_100000034942 [0,1,0,0,0,0|2,0,0]=3 4782 B17R0.3112 COC(=O)C(C)CCOCCCCCCCCCl 34a_100000033203_100000034942 [0,1,0,0,0,0|2,0,0]=3 4783 B17R0.3112 COC(=O)C(C)CCOCCCCCCCCCl 7a_100000033203_100000034942 [0,1,0,0,0,0|2,0,0]=3 4784 B17R0.3112 COC(=O)C(C)CCOCCCCCCCCN 34a_102515433106_100000034942 [0,1,0,0,0,0|2,0,0]=3 4785 B17R0.3112 COC(=O)C(C)CCOCCCCCNCCN 34a_103619048469_100000034942 [0,1,0,0,0,0|3,0,0]=4 4786 B17R0.3112 COC(=O)C(C)CCSCCCCCCCCO 62a_100000033203_100000034942 [0,1,0,0,0,0|2,0,0]=3 4787 B17R0.3112 COC(=O)C(C)CCSCCCCCCCCO 62a_100000034942_100000033203 [0,1,0,0,0,0|2,0,0]=3 4788 B17R0.3112 COC(=O)C(C)CNCCCCCCCCCO 34a_100000078944_100000698445 [0,1,0,0,0,0|2,0,0]=3 4789 B17R0.3112 COC(=O)C(C)COCCCCCCCCCBr 34a_100009813782_100000698445 [0,1,0,0,0,0|2,0,0]=3 4790 B17R0.3112 COC(=O)C(C)COCCCCCCCCCCl 34a_100009868337_100000698445 [0,1,0,0,0,0|2,0,0]=3 4791 B17R0.3112 COC(=O)C(C)COCCCCCCCCCN 34a_100000078944_100000698445 [0,1,0,0,0,0|2,0,0]=3 4792 B17R0.3112 COC(=O)C(C)COCCCCCCCCCO 34a_100000749362_100009813782 [0,1,0,0,0,0|2,0,0]=3 4793 B17R0.3112 COC(=O)C(C)COCCCCCCCCCO 7a_100000749362_100009813782 [0,1,0,0,0,0|2,0,0]=3 4794 B17R0.3112 COC(=O)C(C)CSCCCCCCCCCO 62a_100000698445_100009813782 [0,1,0,0,0,0|2,0,0]=3 4795 B17R0.3112 COC(=O)C(C)CSCCCCCCCCCO 62a_100009813782_100000698445 [0,1,0,0,0,0|2,0,0]=3 4796 B17R0.3112 COC(=O)C(C)NCCCCCCCCCCO 2230a_100000066964_100000211248 [0,1,0,0,0,0|2,0,0]=3 4797 B17R0.3112 COC(=O)C(C)NCCCCCCCCCCO 34a_100000066964_100000211248 [0,1,0,0,0,0|2,0,0]=3 4798 B17R0.3112 COC(=O)C(C)OCCCCCCCCCCBr 34a_100009813290_100000211248 [0,1,0,0,0,0|2,0,0]=3 4799 B17R0.3112 COC(=O)C(C)OCCCCCCCCCCBr 7a_100009813290_100000211248 [0,1,0,0,0,0|2,0,0]=3 4800 B17R0.3112 COC(=O)C(C)OCCCCCCCCCCCl 34a_200000033068_100000211248 [0,1,0,0,0,0|2,0,0]=3 4801 B17R0.3112 COC(=O)C(C)OCCCCCCCCCCCl 7a_200000033068_100000211248 [0,1,0,0,0,0|2,0,0]=3 4802 B17R0.3112 COC(=O)C(C)OCCCCCCCCCCN 34a_100000066964_100000211248 [0,1,0,0,0,0|2,0,0]=3 4803 B17R0.3112 COC(=O)C(C)OCCCCCCCCCCO 34a_100011215400_100009813290 [0,1,0,0,0,0|2,0,0]=3 4804 B17R0.3112 COC(=O)C(C)SCCCCCCCCCCO 62a_100000211248_200000033068 [0,1,0,0,0,0|2,0,0]=3 4805 B17R0.3112 COC(=O)C(C)SCCCCCCCCCCO 62a_100009813290_100000211248 [0,1,0,0,0,0|2,0,0]=3 4806 B17R0.3112 COC(=O)C(F)COCCCCCCCCCO 34a_200009849844_100009813782 [0,1,0,0,0,0|2,0,0]=3 4807 B17R0.3112 COC(=O)[C@H](N)COCCCCCCCCCO 34a_100000003586_100009813782 [0,1,0,0,0,0|2,0,0]=3 4808 B17R0.3112 COCCCOCCCOCCC(C)C(=O)OC 34a_200011215475_100000034942 [0,1,0,0,0,0|3,0,0]=4 4809 B17R0.3112 COCCCOCCCOCCC(C)C(=O)OC 7a_200011215475_100000034942 [0,1,0,0,0,0|3,0,0]=4 4810 B17R0.3167 C#CCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000184674 [0,1,0,0,0,0|0,0,3]=4 4811 B17R0.3167 C#CCC(=O)CCCCCCCCCC(=O)OC 1458a_100011220946_100009813843 [0,1,0,0,0,0|0,0,3]=4 4812 B17R0.3167 C#CCC(C)OCCCCCCCCC(=O)OC 34a_100000685586_100010282707 [0,1,0,0,0,0|1,0,2]=4 4813 B17R0.3167 C#CCC(C)OCCCCCCCCC(=O)OC 7a_100000685586_100010282707 [0,1,0,0,0,0|1,0,2]=4 4814 B17R0.3167 C#CCN(C)CCCCCCCCCC(=O)OC 2230a_100000225692_100009813843 [0,1,0,0,0,0|1,0,2]=4 4815 B17R0.3167 C#CCN(C)CCCCCCCCCC(=O)OC 34a_100000225692_100009813843 [0,1,0,0,0,0|1,0,2]=4 4816 B17R0.3167 C/C=C/C(C)OCCCCCCCCC(=O)OC 34a_200102604097_100010282707 [0,1,0,0,0,0|1,0,2]=4 4817 B17R0.3167 C=CCC(=O)CCCCCCCCCC(=O)OC 1458a_100000210193_100009813843 [0,1,0,0,0,0|0,0,3]=4 4818 B17R0.3167 C=CCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000210623 [0,1,0,0,0,0|0,0,3]=4 4819 B17R0.3167 C=CCC(C)COCCCCCCCC(=O)OC 34a_100009832082_100010004213 [0,1,0,0,0,0|1,0,2]=4 4820 B17R0.3167 C=CCC(C)COCCCCCCCC(=O)OC 7a_100009832082_100010004213 [0,1,0,0,0,0|1,0,2]=4 4821 B17R0.3167 C=CCN(C)CCCCCCCCCC(=O)OC 2230a_100000225617_100009813843 [0,1,0,0,0,0|1,0,2]=4 4822 B17R0.3167 C=CCN(C)CCCCCCCCCC(=O)OC 269982a_100000225617_100009813843 [0,1,0,0,0,0|1,0,2]=4 4823 B17R0.3167 C=CC[C@@H](C)OCCCCCCCCC(=O)OC 34a_100000731007_100010282707 [0,1,0,0,0,0|1,0,2]=4 4824 B17R0.3167 C=CC[C@@H](C)OCCCCCCCCC(=O)OC 7a_100000731007_100010282707 [0,1,0,0,0,0|1,0,2]=4 4825 B17R0.3167 C=CC[C@@H](N)COCCCCCCCC(=O)OC 34a_100020615467_100010004213 [0,1,0,0,0,0|1,0,2]=4 4826 B17R0.3167 CC#CC(=O)CCCCCCCCCC(=O)OC 1458a_100000763181_100009813843 [0,1,0,0,0,0|0,0,3]=4 4827 B17R0.3167 CC#CC(C)OCCCCCCCCC(=O)OC 34a_100011216543_100010282707 [0,1,0,0,0,0|1,0,2]=4 4828 B17R0.3167 CC=CC(=O)CCCCCCCCCC(=O)OC 1458a_100000210699_100009813843 [0,1,0,0,0,0|0,0,3]=4 4829 B17R0.3167 CCCC(=O)CCCCCCCCCC(=O)OC 1458a_100000211992_100009813843 [0,1,0,0,0,0|0,0,1]=2 4830 B17R0.3167 CCCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000210303 [0,1,0,0,0,0|0,0,1]=2 4831 B17R0.3167 CCCC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000747444 [0,1,0,0,0,0|1,0,1]=3 4832 B17R0.3167 CCCC(=O)CSCCCCCCCC(=O)OC 62a_100000747444_100010004213 [0,1,0,0,0,0|1,0,1]=3 4833 B17R0.3167 CCCC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000747444 [0,1,0,0,0,0|1,0,1]=3 4834 B17R0.3167 CCCC(=O)OCOCCCCCCC(=O)OC 34a_100009863599_100000034017 [0,1,0,0,0,0|2,0,1]=4 4835 B17R0.3167 CCCC(=O)OCSCCCCCCC(=O)OC 62a_100009815986_100000034017 [0,1,0,0,0,0|2,0,1]=4 4836 B17R0.3167 CCCC(C)CCCOCCCCCC(=O)OC 34a_100011713154_100009816466 [0,1,0,0,0,0|1,0,0]=2 4837 B17R0.3167 CCCC(C)CCCOCCCCCC(=O)OC 7a_100011713154_100009816466 [0,1,0,0,0,0|1,0,0]=2 4838 B17R0.3167 CCCC(C)CCOCCCCCCC(=O)OC 34a_100011217855_100009815986 [0,1,0,0,0,0|1,0,0]=2 4839 B17R0.3167 CCCC(C)CCOCCCCCCC(=O)OC 7a_100011217855_100009815986 [0,1,0,0,0,0|1,0,0]=2 4840 B17R0.3167 CCCC(C)COCCCCCCCC(=O)OC 34a_100000688023_100010004213 [0,1,0,0,0,0|1,0,0]=2 4841 B17R0.3167 CCCC(C)COCCCCCCCC(=O)OC 34a_100011022521_100011216630 [0,1,0,0,0,0|1,0,0]=2 4842 B17R0.3167 CCCC(C)COCCCCCCCC(=O)OC 7a_100000688023_100010004213 [0,1,0,0,0,0|1,0,0]=2 4843 B17R0.3167 CCCC(C)COCCCCCCCC(=O)OC 7a_100011022521_100011216630 [0,1,0,0,0,0|1,0,0]=2 4844 B17R0.3167 CCCC(C)COCCOCCOCC(=O)OC 34a_100011023656_100011216630 [0,1,0,0,0,0|3,0,0]=4 4845 B17R0.3167 CCCC(C)COCCOCCOCC(=O)OC 7a_100011023656_100011216630 [0,1,0,0,0,0|3,0,0]=4 4846 B17R0.3167 CCCC(C)CSCCCCCCCC(=O)OC 62a_100010004213_100011216630 [0,1,0,0,0,0|1,0,0]=2 4847 B17R0.3167 CCCC(C)CSCCCCCCCC(=O)OC 62a_100011216630_100010004213 [0,1,0,0,0,0|1,0,0]=2 4848 B17R0.3167 CCCC(C)NCCCCCCCCC(=O)OC 2230a_100000741246_100010282707 [0,1,0,0,0,0|1,0,0]=2 4849 B17R0.3167 CCCC(C)OCCCCCCCCC(=O)OC 34a_100000035544_100000766640 [0,1,0,0,0,0|1,0,0]=2 4850 B17R0.3167 CCCC(C)OCCCCCCCCC(=O)OC 34a_100000764384_100010282707 [0,1,0,0,0,0|1,0,0]=2 4851 B17R0.3167 CCCC(C)OCCCCCCCCC(=O)OC 7a_100000035544_100000766640 [0,1,0,0,0,0|1,0,0]=2 4852 B17R0.3167 CCCC(C)OCCCCCCCCC(=O)OC 7a_100000764384_100010282707 [0,1,0,0,0,0|1,0,0]=2 4853 B17R0.3167 CCCC(C)OCCOCCOCCC(=O)OC 34a_100010982084_100000766640 [0,1,0,0,0,0|3,0,0]=4 4854 B17R0.3167 CCCC(C)OCCOCCOCCC(=O)OC 7a_100010982084_100000766640 [0,1,0,0,0,0|3,0,0]=4 4855 B17R0.3167 CCCC(C)SCCCCCCCCC(=O)OC 62a_100000766640_100010282707 [0,1,0,0,0,0|1,0,0]=2 4856 B17R0.3167 CCCC(C)SCCCCCCCCC(=O)OC 62a_100010282707_100000766640 [0,1,0,0,0,0|1,0,0]=2 4857 B17R0.3167 CCCN(C)CCCCCCCCCC(=O)OC 2230a_100000747261_100009813843 [0,1,0,0,0,0|1,0,0]=2 4858 B17R0.3167 CCCN(C)CCCCCCCCCC(=O)OC 269982a_100000747261_100009813843 [0,1,0,0,0,0|1,0,0]=2 4859 B17R0.3167 CCC[C@H](N)CCOCCCCCCC(=O)OC 34a_100015193777_100009815986 [0,1,0,0,0,0|1,0,0]=2 4860 B17R0.3167 CCC[C@H](N)COCCCCCCCC(=O)OC 34a_100000732646_100010004213 [0,1,0,0,0,0|1,0,0]=2 4861 B17R0.3167 CCNC(=O)CCCCCCCCCC(=O)OC 11a_100015525214_100009997464 [0,1,0,0,0,0|1,0,1]=3 4862 B17R0.3167 CCNC(=O)CCCCCCCCCC(=O)OC 240690a_100015525214_100009997464 [0,1,0,0,0,0|1,0,1]=3 4863 B17R0.3167 CCNC(=O)CCNCCCCCCC(=O)OC 34a_100025743525_100009815986 [0,1,0,0,0,0|2,0,1]=4 4864 B17R0.3167 CCNC(=O)CCOCCCCCCC(=O)OC 7a_100009863599_100000737597 [0,1,0,0,0,0|2,0,1]=4 4865 B17R0.3167 CCNC(=O)CCSCCCCCCC(=O)OC 62a_100000737597_100009815986 [0,1,0,0,0,0|2,0,1]=4 4866 B17R0.3167 CCNC(=O)CCSCCCCCCC(=O)OC 62a_100009815986_100000737597 [0,1,0,0,0,0|2,0,1]=4 4867 B17R0.3167 CCNC(=O)CNCCCCCCCC(=O)OC 2230a_100016988866_100010004213 [0,1,0,0,0,0|2,0,1]=4 4868 B17R0.3167 CCNC(=O)COCCCCCCCC(=O)OC 34a_100011022521_100000183381 [0,1,0,0,0,0|2,0,1]=4 4869 B17R0.3167 CCNC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000183381 [0,1,0,0,0,0|2,0,1]=4 4870 B17R0.3167 CCNC(=O)CSCCCCCCCC(=O)OC 62a_100000183381_100010004213 [0,1,0,0,0,0|2,0,1]=4 4871 B17R0.3167 CCNC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000183381 [0,1,0,0,0,0|2,0,1]=4 4872 B17R0.3167 CCOC(=O)CCCCCCCCCC(=O)CC 1458a_100000210414_100009828014 [0,1,0,0,0,0|2,0,1]=4 4873 B17R0.3167 CCOC(=O)CCCCCCCSCC(=O)OC 62a_100000747449_100009991516 [0,1,0,0,0,0|2,0,1]=4 4874 B17R0.3167 CCOC(=O)CCCCCCSCCC(=O)OC 62a_100000204255_100009814379 [0,1,0,0,0,0|2,0,1]=4 4875 B17R0.3167 CCOC(=O)CCCCCOCCCC(=O)OC 7a_100011214988_100011218270 [0,1,0,0,0,0|2,0,1]=4 4876 B17R0.3167 CCOC(=O)CCCCCSCCCC(=O)OC 62a_100000755133_100011218270 [0,1,0,0,0,0|2,0,1]=4 4877 B17R0.3167 CCOC(=O)CCCCCSCCCC(=O)OC 62a_100011218270_100000755133 [0,1,0,0,0,0|2,0,1]=4 4878 B17R0.3167 CCOC(=O)CCCCOCCCCC(=O)OC 34a_100000059025_100000750268 [0,1,0,0,0,0|2,0,1]=4 4879 B17R0.3167 CCOC(=O)CCCCOCCCCC(=O)OC 7a_100000059025_100000750268 [0,1,0,0,0,0|2,0,1]=4 4880 B17R0.3167 CCOC(=O)CCCCSCCCCC(=O)OC 62a_100000204269_100000750268 [0,1,0,0,0,0|2,0,1]=4 4881 B17R0.3167 CCOC(=O)CCCCSCCCCC(=O)OC 62a_100000750268_100000204269 [0,1,0,0,0,0|2,0,1]=4 4882 B17R0.3167 CCOC(=O)CCCOCCCCCC(=O)OC 34a_100000074720_100009991533 [0,1,0,0,0,0|2,0,1]=4 4883 B17R0.3167 CCOC(=O)CCCOCCCCCC(=O)OC 7a_100000074720_100011215271 [0,1,0,0,0,0|2,0,1]=4 4884 B17R0.3167 CCOC(=O)CCCOCCCCCC(=O)OC 7a_100012001163_100009816466 [0,1,0,0,0,0|2,0,1]=4 4885 B17R0.3167 CCOC(=O)CCCSCCCCCC(=O)OC 62a_100009816466_100009991533 [0,1,0,0,0,0|2,0,1]=4 4886 B17R0.3167 CCOC(=O)CCCSCCCCCC(=O)OC 62a_100009991533_100009816466 [0,1,0,0,0,0|2,0,1]=4 4887 B17R0.3167 CCOC(=O)CCOCCCCCCC(=O)OC 34a_100009863599_100000765890 [0,1,0,0,0,0|2,0,1]=4 4888 B17R0.3167 CCOC(=O)CCOCCCCCCC(=O)OC 7a_100009863599_100011206558 [0,1,0,0,0,0|2,0,1]=4 4889 B17R0.3167 CCOC(=O)CCSCCCCCCC(=O)OC 62a_100000765890_100009815986 [0,1,0,0,0,0|2,0,1]=4 4890 B17R0.3167 CCOC(=O)CCSCCCCCCC(=O)OC 62a_100009815986_100000765890 [0,1,0,0,0,0|2,0,1]=4 4891 B17R0.3167 CCOC(=O)COCCCCCCCC(=O)OC 34a_100011022521_100000188475 [0,1,0,0,0,0|2,0,1]=4 4892 B17R0.3167 CCOC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000188475 [0,1,0,0,0,0|2,0,1]=4 4893 B17R0.3167 CCOC(=O)CSCCCCCCCC(=O)OC 62a_100000188475_100010004213 [0,1,0,0,0,0|2,0,1]=4 4894 B17R0.3167 CCOC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000188475 [0,1,0,0,0,0|2,0,1]=4 4895 B17R0.3167 COC(=O)CCCCCCCCCC(=O)CC#N 1458a_100009997464_100011214920 [0,1,0,0,0,0|1,0,2]=4 4896 B17R0.3167 COC(=O)CCCCCCCCCC(=O)CC#N 1458a_100051588842_100009813843 [0,1,0,0,0,0|1,0,2]=4 4897 B17R0.3167 COC(=O)CCCCCCCCCC(=O)CCF 1458a_100009997464_100011217306 [0,1,0,0,0,0|1,0,1]=3 4898 B17R0.3167 COC(=O)CCCCCCCCCC(=O)CCO 1458a_100009997464_100000211926 [0,1,0,0,0,0|1,0,1]=3 4899 B17R0.3167 COC(=O)CCCCCCCCCC(=O)CCO 1458a_100011216618_100009813843 [0,1,0,0,0,0|1,0,1]=3 4900 B17R0.3167 COC(=O)CCCCCCCCCC(=O)CSC 1458a_100000184570_100009813843 [0,1,0,0,0,0|1,0,1]=3 4901 B17R0.3167 COC(=O)CCCCCCCCCN(C)CC#N 2230a_100000748184_100009813843 [0,1,0,0,0,0|2,0,1]=4 4902 B17R0.3167 COC(=O)CCCCCCCCCN(C)CCO 2230a_100000210263_100009813843 [0,1,0,0,0,0|2,0,0]=3 4903 B17R0.3167 COC(=O)CCCCCCCCCN(C)CCO 269982a_100000210263_100009813843 [0,1,0,0,0,0|2,0,0]=3 4904 B17R0.3167 COC(=O)CCCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100010282707 [0,1,0,0,0,0|2,0,1]=4 4905 B17R0.3167 COC(=O)CCCCCCCCN[C@H](C)CCO 2230a_100000706166_100010282707 [0,1,0,0,0,0|2,0,0]=3 4906 B17R0.3167 COC(=O)CCCCCCCCN[C@H](C)CCO 34a_100000706166_100010282707 [0,1,0,0,0,0|2,0,0]=3 4907 B17R0.3167 COC(=O)CCCCCCCCOC(C)CC#N 7a_100000035544_100009813641 [0,1,0,0,0,0|2,0,1]=4 4908 B17R0.3167 COC(=O)CCCCCCCCOC(C)CCBr 34a_100012276601_100010282707 [0,1,0,0,0,0|2,0,0]=3 4909 B17R0.3167 COC(=O)CCCCCCCCOC(C)CCO 34a_100000035544_100009893172 [0,1,0,0,0,0|2,0,0]=3 4910 B17R0.3167 COC(=O)CCCCCCCCOC(C)CCO 7a_100000035544_100009893172 [0,1,0,0,0,0|2,0,0]=3 4911 B17R0.3167 COC(=O)CCCCCCCCSC(C)CC#N 62a_100009813641_100010282707 [0,1,0,0,0,0|2,0,1]=4 4912 B17R0.3167 COC(=O)CCCCCCCCSC(C)CC#N 62a_100010282707_100009813641 [0,1,0,0,0,0|2,0,1]=4 4913 B17R0.3167 COC(=O)CCCCCCCCSC(C)CCO 62a_100009893172_100010282707 [0,1,0,0,0,0|2,0,0]=3 4914 B17R0.3167 COC(=O)CCCCCCCCSC(C)CCO 62a_100010282707_100009893172 [0,1,0,0,0,0|2,0,0]=3 4915 B17R0.3167 COC(=O)CCCCCCCOCC(C)CCN 34a_106354213184_100010004213 [0,1,0,0,0,0|2,0,0]=3 4916 B17R0.3167 COC(=O)CCCCCCCOC[C@@H](O)CC#N 7a_100011022521_100000001066 [0,1,0,0,0,0|2,0,1]=4 4917 B17R0.3167 COC(=O)CCCCCCCSC[C@@H](O)CC#N 62a_100000001066_100010004213 [0,1,0,0,0,0|2,0,1]=4 4918 B17R0.3167 COC(=O)CCCCCCCSC[C@@H](O)CC#N 62a_100010004213_100000001066 [0,1,0,0,0,0|2,0,1]=4 4919 B17R0.3167 COCC(=O)CCCCCCCCCC(=O)OC 1458a_100000210968_100009813843 [0,1,0,0,0,0|1,0,1]=3 4920 B17R0.3167 COCC(C)OCCCCCCCCC(=O)OC 34a_100000035544_100000765312 [0,1,0,0,0,0|2,0,0]=3 4921 B17R0.3167 COCC(C)OCCCCCCCCC(=O)OC 7a_100000035544_100000765312 [0,1,0,0,0,0|2,0,0]=3 4922 B17R0.3167 COCC(C)SCCCCCCCCC(=O)OC 62a_100000765312_100010282707 [0,1,0,0,0,0|2,0,0]=3 4923 B17R0.3167 COCC(C)SCCCCCCCCC(=O)OC 62a_100010282707_100000765312 [0,1,0,0,0,0|2,0,0]=3 4924 B17R0.3167 COCC(N)COCCCCCCCC(=O)OC 34a_100000724102_100010004213 [0,1,0,0,0,0|2,0,0]=3 4925 B17R0.3167 COCC(O)CNCCCCCCCC(=O)OC 2230a_100000756049_100010004213 [0,1,0,0,0,0|2,0,0]=3 4926 B17R0.3167 COCC(O)CNCCCCCCCC(=O)OC 34a_100000756049_100010004213 [0,1,0,0,0,0|2,0,0]=3 4927 B17R0.3167 COCC(O)COCCCCCCCC(=O)OC 34a_100011022521_100011215053 [0,1,0,0,0,0|2,0,0]=3 4928 B17R0.3167 COCC(O)COCCCCCCCC(=O)OC 7a_100011022521_100011215053 [0,1,0,0,0,0|2,0,0]=3 4929 B17R0.3167 COCC(O)CSCCCCCCCC(=O)OC 62a_100010004213_100011215053 [0,1,0,0,0,0|2,0,0]=3 4930 B17R0.3167 COCC(O)CSCCCCCCCC(=O)OC 62a_100011215053_100010004213 [0,1,0,0,0,0|2,0,0]=3 4931 B17R0.3167 COC[C@@H](C)NCCCCCCCCC(=O)OC 2230a_100000764878_100010282707 [0,1,0,0,0,0|2,0,0]=3 4932 B17R0.3167 COC[C@@H](C)OCCCCCCCCC(=O)OC 34a_100011934205_100010282707 [0,1,0,0,0,0|2,0,0]=3 4933 B17R0.3217 CCCCCCCCCCCCCC(CC)NC 270004a_106832991635_100000297468 [0,1,0,0,0,0|2,0,1]=4 4934 B17R0.3217 CCCCCCCCCCCCCN(CC)CC 2230a_100000724800_100000210684 [0,1,0,0,0,0|3,0,0]=4 4935 B17R0.3217 CCCCCCCCCCCCCN(CC)CC 269956a_100000042499_100000210684 [0,1,0,0,0,0|3,0,0]=4 4936 B17R0.3217 CCCCCCCCCCCCCN(CC)CC 269982a_100000724800_100000210684 [0,1,0,0,0,0|3,0,0]=4 4937 B17R0.3217 CCCCCCCCCCCCCN(CC)CC 270004a_100000724800_200011215488 [0,1,0,0,0,0|3,0,0]=4 4938 B17R0.3217 CCCCCCCCCCCNCC(OC)OC 2230a_200011215754_100000751394 [0,1,0,0,0,0|1,0,2]=4 4939 B17R0.3217 CCCCCCCCCCCNCC(OC)OC 270004a_200011215754_100000752162 [0,1,0,0,0,0|1,0,2]=4 4940 B17R0.3217 CCCCCCCCCCCNCC(OC)OC 34a_200011215754_100000211822 [0,1,0,0,0,0|1,0,2]=4 4941 B17R0.3217 CCCCCCCCCCCOCC(CC)OC 34a_100011934954_100011215454 [0,1,0,0,0,0|2,0,1]=4 4942 B17R0.3217 CCCCCCCCCCCOCC(CC)OC 7a_100011934954_100011215454 [0,1,0,0,0,0|2,0,1]=4 4943 B17R0.3217 CCCCCCCCCCCOCC(OC)OC 34a_100000210809_100000211822 [0,1,0,0,0,0|1,0,2]=4 4944 B17R0.3217 CCCCCCCCCCCOCC(OC)OC 34a_100011216393_100011215454 [0,1,0,0,0,0|1,0,2]=4 4945 B17R0.3217 CCCCCCCCCCCOCC(OC)OC 7a_100000210809_100000751394 [0,1,0,0,0,0|1,0,2]=4 4946 B17R0.3217 CCCCCCCCCCCSCC(OC)OC 62a_100000751394_100011215454 [0,1,0,0,0,0|1,0,2]=4 4947 B17R0.3217 CCCCCCCCCCNCCC(OC)OC 2230a_100000684558_100009813347 [0,1,0,0,0,0|1,0,2]=4 4948 B17R0.3217 CCCCCCCCCCNCCC(OC)OC 34a_100000684558_100000139399 [0,1,0,0,0,0|1,0,2]=4 4949 B17R0.3217 CCCCCCCCCCOCCC(OC)OC 34a_100000210711_100000139399 [0,1,0,0,0,0|1,0,2]=4 4950 B17R0.3217 CCCCCCCCCCOCCC(OC)OC 7a_100000210711_100009813347 [0,1,0,0,0,0|1,0,2]=4 4951 B17R0.3217 CCCCCCCCCCSCCC(OC)OC 62a_100000139399_100000210320 [0,1,0,0,0,0|1,0,2]=4 4952 B17R0.3217 CCCCCCCCCNCCCC(OC)OC 2230a_100000212291_100000069011 [0,1,0,0,0,0|1,0,2]=4 4953 B17R0.3217 CCCCCCCCCNCCCC(OC)OC 34a_100000212291_100000069011 [0,1,0,0,0,0|1,0,2]=4 4954 B17R0.3217 CCCCCCCCCOCCCC(OC)OC 34a_100000210712_100000069011 [0,1,0,0,0,0|1,0,2]=4 4955 B17R0.3217 CCCCCCCCCOCCCC(OC)OC 7a_100000210712_100000069011 [0,1,0,0,0,0|1,0,2]=4 4956 B17R0.3217 CCCCCCCCCSCCCC(OC)OC 62a_100000069011_100000210670 [0,1,0,0,0,0|1,0,2]=4 4957 B17R0.3217 CCCCCCCCOCCCCN(CC)N=O 34a_200000035056_100000210759 [0,1,0,0,0,0|3,0,0]=4 4958 B17R0.5801 C#CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000753159 [0,1,0,0,0,0|0,0,3]=4 4959 B17R0.5801 C#CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000692101_100010282707 [0,1,0,0,0,0|0,0,3]=4 4960 B17R0.5801 C/C=C/CC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100102629194 [0,1,0,0,0,0|0,0,3]=4 4961 B17R0.5801 C=CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000754431 [0,1,0,0,0,0|0,0,3]=4 4962 B17R0.5801 C=CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000749702_100010282707 [0,1,0,0,0,0|0,0,3]=4 4963 B17R0.5801 C=CCCC(C)OCCCCCCCC(=O)OC 34a_100000765329_100010004213 [0,1,0,0,0,0|1,0,2]=4 4964 B17R0.5801 C=CCCC(C)OCCCCCCCC(=O)OC 7a_100000765329_100010004213 [0,1,0,0,0,0|1,0,2]=4 4965 B17R0.5801 C=CCCN(C)CCCCCCCCC(=O)OC 2230a_100020639649_100010282707 [0,1,0,0,0,0|1,0,2]=4 4966 B17R0.5801 C=CCCN(C)CCCCCCCCC(=O)OC 269982a_100020639649_100010282707 [0,1,0,0,0,0|1,0,2]=4 4967 B17R0.5801 CC#CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000748600 [0,1,0,0,0,0|0,0,3]=4 4968 B17R0.5801 CC=CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000070051 [0,1,0,0,0,0|0,0,3]=4 4969 B17R0.5801 CC=CCC(=O)CCCCCCCCC(=O)OC 1458a_100121576822_100010282707 [0,1,0,0,0,0|0,0,3]=4 4970 B17R0.5801 CCC#CC(=O)CCCCCCCCC(=O)OC 1458a_100011827653_100010282707 [0,1,0,0,0,0|0,0,3]=4 4971 B17R0.5801 CCC#CC(C)OCCCCCCCC(=O)OC 34a_100000033903_100010004213 [0,1,0,0,0,0|1,0,2]=4 4972 B17R0.5801 CCC#CC(C)OCCCCCCCC(=O)OC 7a_100000033903_100010004213 [0,1,0,0,0,0|1,0,2]=4 4973 B17R0.5801 CCC=CC(=O)CCCCCCCCC(=O)OC 1458a_100000212282_100010282707 [0,1,0,0,0,0|0,0,3]=4 4974 B17R0.5801 CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210211 [0,1,0,0,0,0|0,0,1]=2 4975 B17R0.5801 CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000210183_100010282707 [0,1,0,0,0,0|0,0,1]=2 4976 B17R0.5801 CCCCC(=O)CCOCCOCCC(=O)OC 1458a_200020673210_100000210211 [0,1,0,0,0,0|2,0,1]=4 4977 B17R0.5801 CCCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000210183 [0,1,0,0,0,0|1,0,1]=3 4978 B17R0.5801 CCCCC(C)CCCCOC/C=C/C(=O)OC 34a_200011021034_100000742655 [0,1,0,0,0,0|1,0,2]=4 4979 B17R0.5801 CCCCC(C)CCCCOC/C=C/C(=O)OC 7a_200011021034_100000742655 [0,1,0,0,0,0|1,0,2]=4 4980 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)NC 34a_200011021034_100000741757 [0,1,0,0,0,0|2,0,0]=3 4981 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)NC 7a_200011021034_100000741757 [0,1,0,0,0,0|2,0,0]=3 4982 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)OC 34a_200011021034_100000742333 [0,1,0,0,0,0|1,0,0]=2 4983 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)OC 7a_200011021034_100011218270 [0,1,0,0,0,0|1,0,0]=2 4984 B17R0.5801 CCCCC(C)CCCCOCCOC(=O)NC 34a_200011021034_200011997002 [0,1,0,0,0,0|3,0,0]=4 4985 B17R0.5801 CCCCC(C)CCCCOCCOC(=O)NC 7a_200011021034_200011997002 [0,1,0,0,0,0|3,0,0]=4 4986 B17R0.5801 CCCCC(C)COCCCCCCC(=O)OC 34a_100011995851_100009815986 [0,1,0,0,0,0|1,0,0]=2 4987 B17R0.5801 CCCCC(C)COCCCCCCC(=O)OC 7a_100011995851_100009815986 [0,1,0,0,0,0|1,0,0]=2 4988 B17R0.5801 CCCCC(C)NCCCCCCCC(=O)OC 2230a_100000126638_100010004213 [0,1,0,0,0,0|1,0,0]=2 4989 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 34a_100000687866_100010004213 [0,1,0,0,0,0|1,0,0]=2 4990 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 34a_100011022521_200011215066 [0,1,0,0,0,0|1,0,0]=2 4991 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 7a_100000687866_100010004213 [0,1,0,0,0,0|1,0,0]=2 4992 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 7a_100011022521_200011215066 [0,1,0,0,0,0|1,0,0]=2 4993 B17R0.5801 CCCCC(C)OCCOCCOCC(=O)OC 34a_100011023656_200011215066 [0,1,0,0,0,0|3,0,0]=4 4994 B17R0.5801 CCCCC(C)OCCOCCOCC(=O)OC 7a_100011023656_200011215066 [0,1,0,0,0,0|3,0,0]=4 4995 B17R0.5801 CCCCC(C)SCCCCCCCC(=O)OC 62a_100010004213_200011215066 [0,1,0,0,0,0|1,0,0]=2 4996 B17R0.5801 CCCCC(C)SCCCCCCCC(=O)OC 62a_200011215066_100010004213 [0,1,0,0,0,0|1,0,0]=2 4997 B17R0.5801 CCCCN(C)CCCCCCCCC(=O)OC 2230a_100000207549_100010282707 [0,1,0,0,0,0|1,0,0]=2 4998 B17R0.5801 CCCCN(C)CCCCCCCCC(=O)OC 269982a_100000207549_100010282707 [0,1,0,0,0,0|1,0,0]=2 4999 B17R0.5801 CCCC[C@H](N)COCCCCCCC(=O)OC 34a_100011934283_100009815986 [0,1,0,0,0,0|1,0,0]=2 5000 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC 11a_100020643023_100000036616 [0,1,0,0,0,0|1,0,1]=3 5001 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC 1626a_100020643023_100000036616 [0,1,0,0,0,0|1,0,1]=3 5002 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC 240690a_100020643023_100000036616 [0,1,0,0,0,0|1,0,1]=3 5003 B17R0.5801 CCCNC(=O)CCCOCCCCC(=O)OC 7a_100000059025_100011194427 [0,1,0,0,0,0|2,0,1]=4 5004 B17R0.5801 CCCNC(=O)CCCSCCCCC(=O)OC 62a_100000204269_100011194427 [0,1,0,0,0,0|2,0,1]=4 5005 B17R0.5801 CCCNC(=O)CCCSCCCCC(=O)OC 62a_100011194427_100000204269 [0,1,0,0,0,0|2,0,1]=4 5006 B17R0.5801 CCCNC(=O)CNCCCCCCC(=O)OC 2230a_100000174927_100009815986 [0,1,0,0,0,0|2,0,1]=4 5007 B17R0.5801 CCCNC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000183358 [0,1,0,0,0,0|2,0,1]=4 5008 B17R0.5801 CCCNC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000183358 [0,1,0,0,0,0|2,0,1]=4 5009 B17R0.5801 CCCNC(=O)CSCCCCCCC(=O)OC 62a_100000183358_100009815986 [0,1,0,0,0,0|2,0,1]=4 5010 B17R0.5801 CCCNC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000183358 [0,1,0,0,0,0|2,0,1]=4 5011 B17R0.5801 CCCOC(=O)COCCCCCCC(=O)OC 34a_100009863599_200011215008 [0,1,0,0,0,0|2,0,1]=4 5012 B17R0.5801 CCCOC(=O)COCCCCCCC(=O)OC 7a_100009863599_200011215008 [0,1,0,0,0,0|2,0,1]=4 5013 B17R0.5801 CCCOC(=O)CSCCCCCCC(=O)OC 62a_100009815986_200011215008 [0,1,0,0,0,0|2,0,1]=4 5014 B17R0.5801 CCCOC(=O)CSCCCCCCC(=O)OC 62a_200011215008_100009815986 [0,1,0,0,0,0|2,0,1]=4 5015 B17R0.5801 CCCOC(C)CNCCCCCCC(=O)OC 2230a_100015185124_100009815986 [0,1,0,0,0,0|2,0,0]=3 5016 B17R0.5801 CCCOC(C)CNCCCCCCC(=O)OC 34a_100015185124_100009815986 [0,1,0,0,0,0|2,0,0]=3 5017 B17R0.5801 CCOCC(=O)CCCCCCCCC(=O)OC 1458a_100000211967_100010282707 [0,1,0,0,0,0|1,0,1]=3 5018 B17R0.5801 CCOCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000211967 [0,1,0,0,0,0|2,0,1]=4 5019 B17R0.5801 CCOCC(C)OCCCCCCCC(=O)OC 34a_100000718985_100010004213 [0,1,0,0,0,0|2,0,0]=3 5020 B17R0.5801 CCOCC(C)OCCCCCCCC(=O)OC 7a_100000718985_100010004213 [0,1,0,0,0,0|2,0,0]=3 5021 B17R0.5801 CCOCC(O)CNCCCCCCC(=O)OC 2230a_102515437182_100009815986 [0,1,0,0,0,0|2,0,0]=3 5022 B17R0.5801 CCOCC(O)CNCCCCCCC(=O)OC 34a_102515437182_100009815986 [0,1,0,0,0,0|2,0,0]=3 5023 B17R0.5801 CCSCC(=O)CCCCCCCCC(=O)OC 1458a_100000230394_100010282707 [0,1,0,0,0,0|1,0,1]=3 5024 B17R0.5801 CCSCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000230394 [0,1,0,0,0,0|2,0,1]=4 5025 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCC#N 1458a_100000036616_100011215226 [0,1,0,0,0,0|1,0,2]=4 5026 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCC#N 1458a_100011934036_100010282707 [0,1,0,0,0,0|1,0,2]=4 5027 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCCF 1458a_100000036616_100011934791 [0,1,0,0,0,0|1,0,1]=3 5028 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCCO 1458a_100000036616_100011215043 [0,1,0,0,0,0|1,0,1]=3 5029 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCSC 1458a_100000036616_100000751147 [0,1,0,0,0,0|1,0,1]=3 5030 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCSC 1458a_100000174002_100010282707 [0,1,0,0,0,0|1,0,1]=3 5031 B17R0.5801 COC(=O)CCCCCCCCC(=O)NCCF 11a_100000724931_100000036616 [0,1,0,0,0,0|2,0,1]=4 5032 B17R0.5801 COC(=O)CCCCCCCCC(=O)NCCF 1626a_100000724931_100000036616 [0,1,0,0,0,0|2,0,1]=4 5033 B17R0.5801 COC(=O)CCCCCCCCC(=O)NCCF 240690a_100000724931_100000036616 [0,1,0,0,0,0|2,0,1]=4 5034 B17R0.5801 COC(=O)CCCCCCCCC(=O)NCCO 240690a_100000210304_100000036616 [0,1,0,0,0,0|2,0,1]=4 5035 B17R0.5801 COC(=O)CCCCCCCCN(C)CCC#N 2230a_100000184479_100010282707 [0,1,0,0,0,0|2,0,1]=4 5036 B17R0.5801 COC(=O)CCCCCCCCN(C)CCCO 2230a_100000213112_100010282707 [0,1,0,0,0,0|2,0,0]=3 5037 B17R0.5801 COC(=O)CCCCCCCCN(C)CCCO 269982a_100000213112_100010282707 [0,1,0,0,0,0|2,0,0]=3 5038 B17R0.5801 COC(=O)CCCCCCCCN(C)CCSC 2230a_100000686725_100010282707 [0,1,0,0,0,0|2,0,0]=3 5039 B17R0.5801 COC(=O)CCCCCCCCN(C)CCSC 269982a_100000686725_100010282707 [0,1,0,0,0,0|2,0,0]=3 5040 B17R0.5801 COC(=O)CCCCCCCNC(=O)CCSC 188690a_100000687944_100000174002 [0,1,0,0,0,0|2,0,1]=4 5041 B17R0.5801 COC(=O)CCCCCCCOC(C)CCCCl 34a_200000718107_100010004213 [0,1,0,0,0,0|2,0,0]=3 5042 B17R0.5801 COC(=O)CCCCCCCOC(C)CCCCl 7a_200000718107_100010004213 [0,1,0,0,0,0|2,0,0]=3 5043 B17R0.5801 COC(=O)CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100009815986 [0,1,0,0,0,0|2,0,0]=3 5044 B17R0.5801 COC(=O)CCCCCCNC[C@H](C)CCCO 34a_100160569302_100009815986 [0,1,0,0,0,0|2,0,0]=3 5045 B17R0.5801 COC(=O)CCCCCCOC[C@@H](N)CCSC 34a_100011827619_100009815986 [0,1,0,0,0,0|2,0,0]=3 5046 B17R0.5801 COCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000233755 [0,1,0,0,0,0|1,0,1]=3 5047 B17R0.5801 COCCC(=O)CCCCCCCCC(=O)OC 1458a_100000749529_100010282707 [0,1,0,0,0,0|1,0,1]=3 5048 B17R0.5801 COCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000749529 [0,1,0,0,0,0|2,0,1]=4 5049 B17R0.5801 COCCN(C)CCCCCCCCC(=O)OC 2230a_100000743101_100010282707 [0,1,0,0,0,0|2,0,0]=3 5050 B17R0.5801 COCCN(C)CCCCCCCCC(=O)OC 269982a_100000743101_100010282707 [0,1,0,0,0,0|2,0,0]=3 5051 B17R0.5801 COCO[C@H](C)COCCCCCCC(=O)OC 34a_100016172286_100009815986 [0,1,0,0,0,0|3,0,0]=4 5052 B17R0.5801 COCO[C@H](C)COCCCCCCC(=O)OC 7a_100016172286_100009815986 [0,1,0,0,0,0|3,0,0]=4 5053 B17R0.8798 C#CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000087357_100011218270 [0,1,0,0,0,0|0,0,3]=4 5054 B17R0.8798 C#CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100153394163 [0,1,0,0,0,0|0,0,3]=4 5055 B17R0.8798 C#CCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100153394163 [0,1,0,0,0,0|1,0,2]=4 5056 B17R0.8798 C=CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100012355270 [0,1,0,0,0,0|0,0,3]=4 5057 B17R0.8798 C=CCCCCCCCC(=O)CCCC(=O)OC 1458a_100011216160_100011218270 [0,1,0,0,0,0|0,0,3]=4 5058 B17R0.8798 C=CCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100012355270 [0,1,0,0,0,0|1,0,2]=4 5059 B17R0.8798 CCCCC#CCCCC(=O)CCCC(=O)OC 1458a_100000239890_200000047210 [0,1,0,0,0,0|0,0,3]=4 5060 B17R0.8798 CCCCC#CCCCN(C)CCCC(=O)OC 269982a_100000739225_200000047210 [0,1,0,0,0,0|1,0,2]=4 5061 B17R0.8798 CCCCC/C=C/CCC(=O)CCCC(=O)OC 1458a_200015255902_100011218270 [0,1,0,0,0,0|0,0,3]=4 5062 B17R0.8798 CCCCCC/C=C/CC(=O)CCCC(=O)OC 1458a_100020681715_100011218270 [0,1,0,0,0,0|0,0,3]=4 5063 B17R0.8798 CCCCCCCC=CC(=O)CCCC(=O)OC 1458a_200015332781_100011218270 [0,1,0,0,0,0|0,0,3]=4 5064 B17R0.8798 CCCCCCCCCC(=O)CCCC(=O)NC 1458a_100000210558_100000741757 [0,1,0,0,0,0|1,0,1]=3 5065 B17R0.8798 CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000210558_100011218270 [0,1,0,0,0,0|0,0,1]=2 5066 B17R0.8798 CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210670 [0,1,0,0,0,0|0,0,1]=2 5067 B17R0.8798 CCCCCCCCCC(=O)CCOC(=O)NC 1458a_100000210558_200011997002 [0,1,0,0,0,0|2,0,1]=4 5068 B17R0.8798 CCCCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210670 [0,1,0,0,0,0|1,0,1]=3 5069 B17R0.8798 CCCCCCCCCC(=O)NCCC(=O)NC 11a_100000738227_100000210558 [0,1,0,0,0,0|2,0,1]=4 5070 B17R0.8798 CCCCCCCCCC(=O)NCCC(=O)NC 240690a_100000738227_100000210558 [0,1,0,0,0,0|2,0,1]=4 5071 B17R0.8798 CCCCCCCCCC(=O)NCCC(=O)NC 527a_100000738227_100000210558 [0,1,0,0,0,0|2,0,1]=4 5072 B17R0.8798 CCCCCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000210558 [0,1,0,0,0,0|1,0,1]=3 5073 B17R0.8798 CCCCCCCCCC(C)CNCC(=O)NC 270004a_100000693194_200011218516 [0,1,0,0,0,0|2,0,0]=3 5074 B17R0.8798 CCCCCCCCCC(C)CNC[C@@H](C)OC 270004a_100020591295_200011218516 [0,1,0,0,0,0|2,0,1]=4 5075 B17R0.8798 CCCCCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100011215753 [0,1,0,0,0,0|2,0,0]=3 5076 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)NC 34a_100011218016_100012179268 [0,1,0,0,0,0|2,0,0]=3 5077 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)NC 7a_100011218016_100000737683 [0,1,0,0,0,0|2,0,0]=3 5078 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)OC 34a_100011218016_100000742370 [0,1,0,0,0,0|1,0,0]=2 5079 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)OC 7a_100011218016_100000204255 [0,1,0,0,0,0|1,0,0]=2 5080 B17R0.8798 CCCCCCCCCN(C)C/C=C/C(=O)OC 2230a_100000232482_100000742655 [0,1,0,0,0,0|1,0,2]=4 5081 B17R0.8798 CCCCCCCCCN(C)C/C=C/C(=O)OC 269982a_100000232482_100000742655 [0,1,0,0,0,0|1,0,2]=4 5082 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)NC 2230a_100000232482_100000741757 [0,1,0,0,0,0|2,0,0]=3 5083 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)NC 269982a_100000232482_100000741757 [0,1,0,0,0,0|2,0,0]=3 5084 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC 2230a_100000232482_100011218270 [0,1,0,0,0,0|1,0,0]=2 5085 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC 269982a_100000232482_100011218270 [0,1,0,0,0,0|1,0,0]=2 5086 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210670 [0,1,0,0,0,0|1,0,0]=2 5087 B17R0.8798 CCCCCCCCCN(C)CCOC(=O)NC 269982a_100000232482_200011997002 [0,1,0,0,0,0|3,0,0]=4 5088 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 11a_100000229939_100000239890 [0,1,0,0,0,0|1,0,1]=3 5089 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 1626a_100000229939_100000239890 [0,1,0,0,0,0|1,0,1]=3 5090 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 240690a_100000229939_100000239890 [0,1,0,0,0,0|1,0,1]=3 5091 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 527a_100000229939_100000239890 [0,1,0,0,0,0|1,0,1]=3 5092 B17R0.8798 CCCCCCCCNC(=O)CSCC(=O)OC 11a_100000229939_100000191316 [0,1,0,0,0,0|2,0,1]=4 5093 B17R0.8798 CCCCCCCCNC(=O)CSCC(=O)OC 1626a_100000229939_100000191316 [0,1,0,0,0,0|2,0,1]=4 5094 B17R0.8798 CCCCCCCCNC(=O)CSCC(=O)OC 240690a_100000229939_100000191316 [0,1,0,0,0,0|2,0,1]=4 5095 B17R0.8798 CCCCCCCNCC(=O)NCCC(=O)OC 2230a_100000229938_100000230212 [0,1,0,0,0,0|2,0,1]=4 5096 B17R0.8798 CCCCCCCOCC(=O)NCCC(=O)OC 34a_100000210272_100000230212 [0,1,0,0,0,0|2,0,1]=4 5097 B17R0.8798 CCCCCCCOCC(=O)NCCC(=O)OC 7a_100000210272_100000230212 [0,1,0,0,0,0|2,0,1]=4 5098 B17R0.8798 CCCCCCCSCC(=O)NCCC(=O)OC 62a_100000210614_100000230212 [0,1,0,0,0,0|2,0,1]=4 5099 B17R0.8798 CCCCCCCSCC(=O)NCCC(=O)OC 62a_100000230212_100000210316 [0,1,0,0,0,0|2,0,1]=4 5100 B17R0.8798 CCCCOCCCNC(=O)CCCC(=O)OC 1626a_200000211371_100000239890 [0,1,0,0,0,0|2,0,1]=4 5101 B17R0.8798 CCCCOCCCNC(=O)CCCC(=O)OC 240690a_200000211371_100000239890 [0,1,0,0,0,0|2,0,1]=4 5102 B17R0.8798 CCCCOCCCNC(=O)CCCC(=O)OC 527a_200000211371_100000239890 [0,1,0,0,0,0|2,0,1]=4 5103 B17R0.8798 CCCCOCCOCC(=O)CCCC(=O)OC 1458a_100011216887_100011218270 [0,1,0,0,0,0|2,0,1]=4 5104 B17R0.8798 COC(=O)CCCC(=O)CCCCCCCCO 1458a_100000239890_100000033203 [0,1,0,0,0,0|1,0,1]=3 5105 B17R0.8798 COC(=O)CCCC(=O)NCCCCCCCO 240690a_100011996573_100000239890 [0,1,0,0,0,0|2,0,1]=4 5106 B17R0.8798 COC(=O)CCCN(C)CCCCCCCCO 269982a_100000739225_100000033203 [0,1,0,0,0,0|2,0,0]=3 5107 B17R0.8798 COC(=O)CCNC(=O)CCCCCCCCO 188690a_100000683876_100000015970 [0,1,0,0,0,0|2,0,1]=4 5108 B17R0.8798 COC(=O)CSCC(=O)CCCCCCCCO 1458a_100000191316_100000033203 [0,1,0,0,0,0|2,0,1]=4 5109 B17R0.11645 C#CC(=O)CCCCCCCCCCC(=O)OC 1458a_100000211873_100009812566 [0,1,0,0,0,0|0,0,3]=4 5110 B17R0.11645 C#CC(C)NCCCCCCCCCC(=O)OC 2230a_100000707721_100009813843 [0,1,0,0,0,0|1,0,2]=4 5111 B17R0.11645 C#CC(C)NCCCCCCCCCC(=O)OC 34a_100000707721_100009813843 [0,1,0,0,0,0|1,0,2]=4 5112 B17R0.11645 C#CC(C)SCCCCCCCCCC(=O)OC 62a_200000035995_100009813843 [0,1,0,0,0,0|1,0,2]=4 5113 B17R0.11645 C#CC(O)CCCCCOCCCCC(=O)OC 34a_100000059025_200010408556 [0,1,0,0,0,0|1,0,2]=4 5114 B17R0.11645 C#CC(O)CCCCCOCCCCC(=O)OC 7a_100000059025_200010408556 [0,1,0,0,0,0|1,0,2]=4 5115 B17R0.11645 C#CC(O)CCCCCSCCCCC(=O)OC 62a_100000204269_200010408556 [0,1,0,0,0,0|1,0,2]=4 5116 B17R0.11645 C#CC(O)CCCCCSCCCCC(=O)OC 62a_200010408556_100000204269 [0,1,0,0,0,0|1,0,2]=4 5117 B17R0.11645 C#C[C@@H](C)OCCCCCCCCCC(=O)OC 34a_100009815206_100009813843 [0,1,0,0,0,0|1,0,2]=4 5118 B17R0.11645 C#C[C@@H](C)OCCCCCCCCCC(=O)OC 7a_100009815206_100009813843 [0,1,0,0,0,0|1,0,2]=4 5119 B17R0.11645 C=CC(=O)CCCCCCCCCCC(=O)OC 1458a_100000185746_100009812566 [0,1,0,0,0,0|0,0,3]=4 5120 B17R0.11645 C=CC(C)COCCCCCCCCC(=O)OC 34a_100011215527_100010282707 [0,1,0,0,0,0|1,0,2]=4 5121 B17R0.11645 C=CC(C)COCCCCCCCCC(=O)OC 7a_100011215527_100010282707 [0,1,0,0,0,0|1,0,2]=4 5122 B17R0.11645 C=CC(C)OCCCCCCCCCC(=O)OC 34a_100000695699_100009813843 [0,1,0,0,0,0|1,0,2]=4 5123 B17R0.11645 C=CC(C)SCCCCCCCCCC(=O)OC 62a_100011215867_100009813843 [0,1,0,0,0,0|1,0,2]=4 5124 B17R0.11645 C=CC(O)COCCCCCCCCC(=O)OC 34a_100000035544_100000730141 [0,1,0,0,0,0|1,0,2]=4 5125 B17R0.11645 C=CC(O)COCCCCCCCCC(=O)OC 7a_100000035544_100000730141 [0,1,0,0,0,0|1,0,2]=4 5126 B17R0.11645 C=CC(O)CSCCCCCCCCC(=O)OC 62a_100000730141_100010282707 [0,1,0,0,0,0|1,0,2]=4 5127 B17R0.11645 C=CC(O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000730141 [0,1,0,0,0,0|1,0,2]=4 5128 B17R0.11645 C=C[C@H](N)COCCCCCCCCC(=O)OC 34a_100016989147_100010282707 [0,1,0,0,0,0|1,0,2]=4 5129 B17R0.11645 CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100000210414_100009812566 [0,1,0,0,0,0|0,0,1]=2 5130 B17R0.11645 CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100016987261_100000210202 [0,1,0,0,0,0|0,0,1]=2 5131 B17R0.11645 CCC(=O)COCCCCCCCCC(=O)OC 34a_100000725409_100010282707 [0,1,0,0,0,0|1,0,1]=3 5132 B17R0.11645 CCC(=O)COCCCCCCCCC(=O)OC 7a_100000035544_100000747405 [0,1,0,0,0,0|1,0,1]=3 5133 B17R0.11645 CCC(=O)CSCCCCCCCCC(=O)OC 62a_100000747405_100010282707 [0,1,0,0,0,0|1,0,1]=3 5134 B17R0.11645 CCC(=O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000747405 [0,1,0,0,0,0|1,0,1]=3 5135 B17R0.11645 CCC(=O)NCCNCCCCCCC(=O)OC 34a_100132302217_100009815986 [0,1,0,0,0,0|2,0,1]=4 5136 B17R0.11645 CCC(=O)NCCOCCCCCCC(=O)OC 34a_200000158885_100009815986 [0,1,0,0,0,0|2,0,1]=4 5137 B17R0.11645 CCC(=O)NCCOCCCCCCC(=O)OC 7a_200000158885_100009815986 [0,1,0,0,0,0|2,0,1]=4 5138 B17R0.11645 CCC(=O)OCCOCCCCCCC(=O)OC 7a_200000031056_100009815986 [0,1,0,0,0,0|2,0,1]=4 5139 B17R0.11645 CCC(C)CCCCCOCCCCC(=O)OC 7a_200000035636_100000204269 [0,1,0,0,0,0|1,0,0]=2 5140 B17R0.11645 CCC(C)CCCCCOCCOCC(=O)OC 7a_200000035636_100000090808 [0,1,0,0,0,0|2,0,0]=3 5141 B17R0.11645 CCC(C)CCCOCCCCCCC(=O)OC 7a_100011216074_100009815986 [0,1,0,0,0,0|1,0,0]=2 5142 B17R0.11645 CCC(C)CCNCCCCCCCC(=O)OC 2230a_100020591266_100010004213 [0,1,0,0,0,0|1,0,0]=2 5143 B17R0.11645 CCC(C)CCOCCCCCCCC(=O)OC 7a_100011215188_100010004213 [0,1,0,0,0,0|1,0,0]=2 5144 B17R0.11645 CCC(C)CNCCCCCCCCC(=O)OC 2230a_100020588543_100010282707 [0,1,0,0,0,0|1,0,0]=2 5145 B17R0.11645 CCC(C)COCCCCCCCCC(=O)OC 34a_100000035544_100000748023 [0,1,0,0,0,0|1,0,0]=2 5146 B17R0.11645 CCC(C)COCCCCCCCCC(=O)OC 7a_100000035544_100000748023 [0,1,0,0,0,0|1,0,0]=2 5147 B17R0.11645 CCC(C)COCCOCCOCCC(=O)OC 34a_100010982084_100000748023 [0,1,0,0,0,0|3,0,0]=4 5148 B17R0.11645 CCC(C)COCCOCCOCCC(=O)OC 7a_100010982084_100000748023 [0,1,0,0,0,0|3,0,0]=4 5149 B17R0.11645 CCC(C)CSCCCCCCCCC(=O)OC 62a_100000748023_100010282707 [0,1,0,0,0,0|1,0,0]=2 5150 B17R0.11645 CCC(C)CSCCCCCCCCC(=O)OC 62a_100010282707_100000748023 [0,1,0,0,0,0|1,0,0]=2 5151 B17R0.11645 CCC(C)NCCCCCCCCCC(=O)OC 2230a_100000209981_100009813843 [0,1,0,0,0,0|1,0,0]=2 5152 B17R0.11645 CCC(C)OCCCCCCCCCC(=O)OC 7a_100000210228_100009813843 [0,1,0,0,0,0|1,0,0]=2 5153 B17R0.11645 CCC(C)SCCCCCCCCCC(=O)OC 62a_100000758301_100009813843 [0,1,0,0,0,0|1,0,0]=2 5154 B17R0.11645 CCC(O)CNCCCCCCCCC(=O)OC 2230a_100011218483_100010282707 [0,1,0,0,0,0|1,0,0]=2 5155 B17R0.11645 CCC(O)COCCCCCCCCC(=O)OC 34a_100000035544_100011218378 [0,1,0,0,0,0|1,0,0]=2 5156 B17R0.11645 CCC(O)COCCCCCCCCC(=O)OC 7a_100000035544_100011218378 [0,1,0,0,0,0|1,0,0]=2 5157 B17R0.11645 CCC(O)COCCOCCOCCC(=O)OC 34a_100010982084_100011218378 [0,1,0,0,0,0|3,0,0]=4 5158 B17R0.11645 CCC(O)COCCOCCOCCC(=O)OC 7a_100010982084_100011218378 [0,1,0,0,0,0|3,0,0]=4 5159 B17R0.11645 CCC(O)CSCCCCCCCCC(=O)OC 62a_100010282707_100011218378 [0,1,0,0,0,0|1,0,0]=2 5160 B17R0.11645 CCC(O)CSCCCCCCCCC(=O)OC 62a_100011218378_100010282707 [0,1,0,0,0,0|1,0,0]=2 5161 B17R0.11645 CCN(C)CCCCCCCCCCC(=O)OC 2230a_100000225621_100009812566 [0,1,0,0,0,0|1,0,0]=2 5162 B17R0.11645 CCN(C)CCCCCCCCCCC(=O)OC 269982a_100000225621_100009812566 [0,1,0,0,0,0|1,0,0]=2 5163 B17R0.11645 CCN(C)CCCOCCCCCCC(=O)OC 7a_100009863599_100015186262 [0,1,0,0,0,0|2,0,0]=3 5164 B17R0.11645 CCN(C)CCCSCCCCCCC(=O)OC 62a_100009815986_100015186262 [0,1,0,0,0,0|2,0,0]=3 5165 B17R0.11645 CC[C@H](C)COCCCCCCCCC(=O)OC 34a_100000035544_100009816398 [0,1,0,0,0,0|1,0,0]=2 5166 B17R0.11645 CC[C@H](C)COCCCCCCCCC(=O)OC 7a_100000035544_100009816398 [0,1,0,0,0,0|1,0,0]=2 5167 B17R0.11645 CC[C@H](C)COCCCCCCCCC(=O)OC 7a_100009816381_100010282707 [0,1,0,0,0,0|1,0,0]=2 5168 B17R0.11645 CC[C@H](C)COCCOCCOCCC(=O)OC 34a_100010982084_100009816398 [0,1,0,0,0,0|3,0,0]=4 5169 B17R0.11645 CC[C@H](C)COCCOCCOCCC(=O)OC 7a_100010982084_100009816398 [0,1,0,0,0,0|3,0,0]=4 5170 B17R0.11645 CC[C@H](C)CSCCCCCCCCC(=O)OC 62a_100009816398_100010282707 [0,1,0,0,0,0|1,0,0]=2 5171 B17R0.11645 CC[C@H](C)CSCCCCCCCCC(=O)OC 62a_100010282707_100009816398 [0,1,0,0,0,0|1,0,0]=2 5172 B17R0.11645 CNC(=O)CCCCCCCCCCC(=O)OC 11a_106832991635_100016987261 [0,1,0,0,0,0|1,0,1]=3 5173 B17R0.11645 CNC(=O)CCCCCCCCCCC(=O)OC 1626a_100102657272_100016987261 [0,1,0,0,0,0|1,0,1]=3 5174 B17R0.11645 CNC(=O)CCCCCCCCCCC(=O)OC 240690a_100102657272_100016987261 [0,1,0,0,0,0|1,0,1]=3 5175 B17R0.11645 CNC(=O)CCCNCCCCCCC(=O)OC 2230a_100000740002_100009815986 [0,1,0,0,0,0|2,0,1]=4 5176 B17R0.11645 CNC(=O)CCCNCCCCCCC(=O)OC 34a_100000740002_100009815986 [0,1,0,0,0,0|2,0,1]=4 5177 B17R0.11645 CNC(=O)CCCOCCCCCCC(=O)OC 34a_100009863599_100000741757 [0,1,0,0,0,0|2,0,1]=4 5178 B17R0.11645 CNC(=O)CCCOCCCCCCC(=O)OC 7a_100009863599_100000741757 [0,1,0,0,0,0|2,0,1]=4 5179 B17R0.11645 CNC(=O)CCCSCCCCCCC(=O)OC 62a_100000741757_100009815986 [0,1,0,0,0,0|2,0,1]=4 5180 B17R0.11645 CNC(=O)CCCSCCCCCCC(=O)OC 62a_100009815986_100000741757 [0,1,0,0,0,0|2,0,1]=4 5181 B17R0.11645 CNC(=O)CCNCCCCCCCC(=O)OC 2230a_100000738227_100010004213 [0,1,0,0,0,0|2,0,1]=4 5182 B17R0.11645 CNC(=O)CCNCCCCCCCC(=O)OC 34a_100000738227_100010004213 [0,1,0,0,0,0|2,0,1]=4 5183 B17R0.11645 CNC(=O)CCOCCCCCCCC(=O)OC 34a_100000754576_100010004213 [0,1,0,0,0,0|2,0,1]=4 5184 B17R0.11645 CNC(=O)CCOCCCCCCCC(=O)OC 34a_100011022521_100012179268 [0,1,0,0,0,0|2,0,1]=4 5185 B17R0.11645 CNC(=O)CCOCCCCCCCC(=O)OC 7a_100011022521_100000737683 [0,1,0,0,0,0|2,0,1]=4 5186 B17R0.11645 CNC(=O)CCSCCCCCCCC(=O)OC 62a_100000737683_100010004213 [0,1,0,0,0,0|2,0,1]=4 5187 B17R0.11645 CNC(=O)CCSCCCCCCCC(=O)OC 62a_100010004213_100000737683 [0,1,0,0,0,0|2,0,1]=4 5188 B17R0.11645 CNC(=O)CNCCCCCCCCC(=O)OC 2230a_100000693194_100010282707 [0,1,0,0,0,0|2,0,1]=4 5189 B17R0.11645 CNC(=O)COCCCCCCCCC(=O)OC 34a_100000035544_100000183359 [0,1,0,0,0,0|2,0,1]=4 5190 B17R0.11645 CNC(=O)COCCCCCCCCC(=O)OC 34a_100000750040_100010282707 [0,1,0,0,0,0|2,0,1]=4 5191 B17R0.11645 CNC(=O)COCCCCCCCCC(=O)OC 7a_100000035544_100000183359 [0,1,0,0,0,0|2,0,1]=4 5192 B17R0.11645 CNC(=O)CSCCCCCCCCC(=O)OC 62a_100000183359_100010282707 [0,1,0,0,0,0|2,0,1]=4 5193 B17R0.11645 CNC(=O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000183359 [0,1,0,0,0,0|2,0,1]=4 5194 B17R0.11645 COC(=O)CCCCCCCCCCC(=O)CF 1458a_100016987261_100015361967 [0,1,0,0,0,0|1,0,1]=3 5195 B17R0.11645 COC(=O)CCCCCCCCCCC(=O)CO 1458a_100000210174_100009812566 [0,1,0,0,0,0|1,0,1]=3 5196 B17R0.11645 COC(=O)CCCCCCCCCNC(C)C#N 2230a_100000737613_100009813843 [0,1,0,0,0,0|2,0,1]=4 5197 B17R0.11645 COC(=O)CCCCCCCCCN[C@H](C)CO 2230a_100000737577_100009813843 [0,1,0,0,0,0|2,0,0]=3 5198 B17R0.11645 COC(=O)CCCCCCCCCOC(C)C#N 34a_100011218135_100009813843 [0,1,0,0,0,0|2,0,1]=4 5199 B17R0.11645 COC(=O)CCCCCCCCCOC(C)CF 34a_100016041109_100009813843 [0,1,0,0,0,0|2,0,0]=3 5200 B17R0.11645 COC(=O)CCCCCCCCCOC(C)CF 7a_100016041109_100009813843 [0,1,0,0,0,0|2,0,0]=3 5201 B17R0.11645 COC(=O)CCCCCCCCCOC(C)CN 34a_100000210904_100009813843 [0,1,0,0,0,0|2,0,0]=3 5202 B17R0.11645 COC(=O)CCCCCCCCCSC(C)C#N 62a_100000703298_100009813843 [0,1,0,0,0,0|2,0,1]=4 5203 B17R0.11645 COC(=O)CCCCCCCCCSC(C)CO 62a_100012180447_100009813843 [0,1,0,0,0,0|2,0,0]=3 5204 B17R0.11645 COC(=O)CCCCCCCCCSC(C)OC 62a_100009879195_100009813843 [0,1,0,0,0,0|2,0,0]=3 5205 B17R0.11645 COC(=O)CCCCCCCCCSC(F)C#N 62a_200000117898_100009813843 [0,1,0,0,0,0|2,0,1]=4 5206 B17R0.11645 COC(=O)CCCCCCCCCS[C@H](C)CO 62a_100016084084_100009813843 [0,1,0,0,0,0|2,0,0]=3 5207 B17R0.11645 COC(=O)CCCCCCCCNCC(C)CO 34a_100000744482_100010282707 [0,1,0,0,0,0|2,0,0]=3 5208 B17R0.11645 COC(=O)CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100010282707 [0,1,0,0,0,0|2,0,0]=3 5209 B17R0.11645 COC(=O)CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100010282707 [0,1,0,0,0,0|2,0,0]=3 5210 B17R0.11645 COC(=O)CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100010282707 [0,1,0,0,0,0|2,0,0]=3 5211 B17R0.11645 COC(=O)CCCCCCCCOCC(=O)OC 34a_100000035544_100000747449 [0,1,0,0,0,0|2,0,1]=4 5212 B17R0.11645 COC(=O)CCCCCCCCOCC(=O)OC 7a_100000035544_100000747449 [0,1,0,0,0,0|2,0,1]=4 5213 B17R0.11645 COC(=O)CCCCCCCCOCC(C)CN 34a_100000744482_100010282707 [0,1,0,0,0,0|2,0,0]=3 5214 B17R0.11645 COC(=O)CCCCCCCCOCC(C)OC 34a_100000690652_100010282707 [0,1,0,0,0,0|2,0,0]=3 5215 B17R0.11645 COC(=O)CCCCCCCCOCC(Cl)CCl 34a_100000033668_100010282707 [0,1,0,0,0,0|2,0,0]=3 5216 B17R0.11645 COC(=O)CCCCCCCCOCC(O)CO 34a_100000035544_100011219619 [0,1,0,0,0,0|2,0,0]=3 5217 B17R0.11645 COC(=O)CCCCCCCCOCC(O)CO 7a_100000035544_100011219619 [0,1,0,0,0,0|2,0,0]=3 5218 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](C)CO 34a_100000035544_100000059175 [0,1,0,0,0,0|2,0,0]=3 5219 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](C)CO 7a_100000035544_100000059175 [0,1,0,0,0,0|2,0,0]=3 5220 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CF 34a_100000035544_100015614560 [0,1,0,0,0,0|2,0,0]=3 5221 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CF 7a_100000035544_100015614560 [0,1,0,0,0,0|2,0,0]=3 5222 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CO 34a_100000035544_100009815848 [0,1,0,0,0,0|2,0,0]=3 5223 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CO 7a_100000035544_100009815848 [0,1,0,0,0,0|2,0,0]=3 5224 B17R0.11645 COC(=O)CCCCCCCCOC[C@H](F)CN 34a_100015665980_100010282707 [0,1,0,0,0,0|2,0,0]=3 5225 B17R0.11645 COC(=O)CCCCCCCCSCC(=O)OC 62a_100000747449_100010282707 [0,1,0,0,0,0|2,0,1]=4 5226 B17R0.11645 COC(=O)CCCCCCCCSCC(=O)OC 62a_100010282707_100000747449 [0,1,0,0,0,0|2,0,1]=4 5227 B17R0.11645 COC(=O)CCCCCCCCSCC(O)CO 62a_100010282707_100011219619 [0,1,0,0,0,0|2,0,0]=3 5228 B17R0.11645 COC(=O)CCCCCCCCSCC(O)CO 62a_100011219619_100010282707 [0,1,0,0,0,0|2,0,0]=3 5229 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100010282707 [0,1,0,0,0,0|2,0,0]=3 5230 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](C)CO 62a_100010282707_100000059175 [0,1,0,0,0,0|2,0,0]=3 5231 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CF 62a_100010282707_100015614560 [0,1,0,0,0,0|2,0,0]=3 5232 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CF 62a_100015614560_100010282707 [0,1,0,0,0,0|2,0,0]=3 5233 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100010282707 [0,1,0,0,0,0|2,0,0]=3 5234 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CO 62a_100010282707_100009815848 [0,1,0,0,0,0|2,0,0]=3 5235 B17R0.11645 COC(=O)CCCCCCCNCCC(C)CO 2230a_106354213184_100010004213 [0,1,0,0,0,0|2,0,0]=3 5236 B17R0.11645 COC(=O)CCCCCCCNCCC(C)CO 34a_106354213184_100010004213 [0,1,0,0,0,0|2,0,0]=3 5237 B17R0.11645 COC(=O)CCCCCCCOCCC(=O)OC 34a_100011022521_100000742370 [0,1,0,0,0,0|2,0,1]=4 5238 B17R0.11645 COC(=O)CCCCCCCOCCC(=O)OC 7a_100011022521_100000204255 [0,1,0,0,0,0|2,0,1]=4 5239 B17R0.11645 COC(=O)CCCCCCCOCCC(C)OC 7a_100000764861_100010004213 [0,1,0,0,0,0|2,0,0]=3 5240 B17R0.11645 COC(=O)CCCCCCCSCCC(=O)OC 62a_100000204255_100010004213 [0,1,0,0,0,0|2,0,1]=4 5241 B17R0.11645 COC(=O)CCCCCCCSCCC(=O)OC 62a_100010004213_100000204255 [0,1,0,0,0,0|2,0,1]=4 5242 B17R0.11645 COC(=O)CCCCCCOCCCC(=O)OC 34a_100009863599_100000742333 [0,1,0,0,0,0|2,0,1]=4 5243 B17R0.11645 COC(=O)CCCCCCOCCCC(=O)OC 7a_100009863599_100011218270 [0,1,0,0,0,0|2,0,1]=4 5244 B17R0.11645 COC(=O)CCCCCCOCCC[C@@H](C)CN 34a_100160569302_100009815986 [0,1,0,0,0,0|2,0,0]=3 5245 B17R0.11645 COC(=O)CCCCCCSCCCC(=O)OC 62a_100009815986_100011218270 [0,1,0,0,0,0|2,0,1]=4 5246 B17R0.11645 COC(=O)CCCCCCSCCCC(=O)OC 62a_100011218270_100009815986 [0,1,0,0,0,0|2,0,1]=4 5247 B17R0.11645 COC(=O)CCCCCOCCCCC(=O)OC 34a_100000059025_100009816466 [0,1,0,0,0,0|2,0,1]=4 5248 B17R0.11645 COC(=O)CCCCCOCCCCC(=O)OC 34a_100000074720_100000204269 [0,1,0,0,0,0|2,0,1]=4 5249 B17R0.11645 COC(=O)CCCCCOCCCCC(=O)OC 7a_100000059025_100009816466 [0,1,0,0,0,0|2,0,1]=4 5250 B17R0.11645 COC(=O)CCCCCOCCCCC(=O)OC 7a_100000074720_100000204269 [0,1,0,0,0,0|2,0,1]=4 5251 B17R0.11645 COC(=O)CCCCCSCCCCC(=O)OC 62a_100000204269_100009816466 [0,1,0,0,0,0|2,0,1]=4 5252 B17R0.11645 COC(=O)CCCCCSCCCCC(=O)OC 62a_100009816466_100000204269 [0,1,0,0,0,0|2,0,1]=4 5253 B17R0.12415 C=CCCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100011933949 [0,1,0,0,0,0|0,0,3]=4 5254 B17R0.12415 C=CCCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100011933949 [0,1,0,0,0,0|1,0,2]=4 5255 B17R0.12415 CCC#CCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_200000036426 [0,1,0,0,0,0|0,0,3]=4 5256 B17R0.12415 CCC#CCCCCCCN(C)CCC(=O)OC 269982a_100025711912_200000036426 [0,1,0,0,0,0|1,0,2]=4 5257 B17R0.12415 CCCCCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210319 [0,1,0,0,0,0|1,0,1]=3 5258 B17R0.12415 CCCCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210319 [0,1,0,0,0,0|0,0,1]=2 5259 B17R0.12415 CCCCCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100000210319 [0,1,0,0,0,0|2,0,1]=4 5260 B17R0.12415 CCCCCCCCCCC(=O)CNC(=O)CC 1458a_100000194589_100000210319 [0,1,0,0,0,0|2,0,1]=4 5261 B17R0.12415 CCCCCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210319 [0,1,0,0,0,0|1,0,1]=3 5262 B17R0.12415 CCCCCCCCCCC(=O)NCC(=O)NC 11a_100000693194_100000210375 [0,1,0,0,0,0|2,0,1]=4 5263 B17R0.12415 CCCCCCCCCCC(=O)NCC(=O)NC 240690a_100000693194_100000210375 [0,1,0,0,0,0|2,0,1]=4 5264 B17R0.12415 CCCCCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000210375 [0,1,0,0,0,0|1,0,1]=3 5265 B17R0.12415 CCCCCCCCCCC(C)NCC(=O)NC 270004a_100000693194_200011219864 [0,1,0,0,0,0|2,0,0]=3 5266 B17R0.12415 CCCCCCCCCCC(C)NC[C@@H](C)OC 270004a_100020591295_200011219864 [0,1,0,0,0,0|2,0,1]=4 5267 B17R0.12415 CCCCCCCCCCC(C)OCC(=O)CC 7a_100011215000_100000747405 [0,1,0,0,0,0|2,0,0]=3 5268 B17R0.12415 CCCCCCCCCCC(C)OCC(=O)NC 34a_100011215000_100000183359 [0,1,0,0,0,0|2,0,0]=3 5269 B17R0.12415 CCCCCCCCCCC(C)OCC(=O)NC 7a_100011215000_100000183359 [0,1,0,0,0,0|2,0,0]=3 5270 B17R0.12415 CCCCCCCCCCC(C)OCC(=O)OC 34a_100011215000_100000747449 [0,1,0,0,0,0|1,0,0]=2 5271 B17R0.12415 CCCCCCCCCCC(C)OCC(=O)OC 7a_100011215000_100000747449 [0,1,0,0,0,0|1,0,0]=2 5272 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)NC 2230a_100000207566_100000737683 [0,1,0,0,0,0|2,0,0]=3 5273 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100000210320 [0,1,0,0,0,0|2,0,0]=3 5274 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)NC 269982a_100000207566_100000737683 [0,1,0,0,0,0|2,0,0]=3 5275 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100000210320 [0,1,0,0,0,0|2,0,0]=3 5276 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)OC 2230a_100000207566_100000204255 [0,1,0,0,0,0|1,0,0]=2 5277 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)OC 269982a_100000207566_100000204255 [0,1,0,0,0,0|1,0,0]=2 5278 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210320 [0,1,0,0,0,0|1,0,0]=2 5279 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)NC 11a_100000212291_100011309844 [0,1,0,0,0,0|2,0,1]=4 5280 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)NC 1626a_100000212291_100011309844 [0,1,0,0,0,0|2,0,1]=4 5281 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)NC 240690a_100000212291_100011309844 [0,1,0,0,0,0|2,0,1]=4 5282 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)NC 527a_100000212291_100011309844 [0,1,0,0,0,0|2,0,1]=4 5283 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)OC 11a_100000212291_100000187943 [0,1,0,0,0,0|1,0,1]=3 5284 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)OC 1626a_100000212291_100000187943 [0,1,0,0,0,0|1,0,1]=3 5285 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)OC 240690a_100000212291_100000187943 [0,1,0,0,0,0|1,0,1]=3 5286 B17R0.12415 CCCCCCCCCNC(=O)CCC(=O)OC 527a_100000212291_100000187943 [0,1,0,0,0,0|1,0,1]=3 5287 B17R0.12415 CCCCCCCCCNC(=O)CNC(=O)OC 11a_100000212291_100000215747 [0,1,0,0,0,0|2,0,1]=4 5288 B17R0.12415 CCCCCCCCCNC(=O)CNC(=O)OC 1626a_100000212291_100000215747 [0,1,0,0,0,0|2,0,1]=4 5289 B17R0.12415 CCCCCCCCCNC(=O)CNC(=O)OC 240690a_100000212291_100000215747 [0,1,0,0,0,0|2,0,1]=4 5290 B17R0.12415 CCCCCCCCCNC(=O)CNC(=O)OC 527a_100000212291_100000215747 [0,1,0,0,0,0|2,0,1]=4 5291 B17R0.12415 CCCCCCCCNCC(=O)CCC(=O)OC 2230a_100000229939_100000691467 [0,1,0,0,0,0|1,0,1]=3 5292 B17R0.12415 CCCCCCCCNCC(=O)CCC(=O)OC 34a_100000229939_100000691467 [0,1,0,0,0,0|1,0,1]=3 5293 B17R0.12415 CCCCCCCCNCC(=O)NCC(=O)OC 2230a_100000229939_100000182966 [0,1,0,0,0,0|2,0,1]=4 5294 B17R0.12415 CCCCCCCCNCC(=O)NCC(=O)OC 34a_100000229939_100000182966 [0,1,0,0,0,0|2,0,1]=4 5295 B17R0.12415 CCCCCCCCOCC(=O)CCC(=O)OC 34a_100000210232_100000691467 [0,1,0,0,0,0|1,0,1]=3 5296 B17R0.12415 CCCCCCCCOCC(=O)CCC(=O)OC 7a_100000210232_100000691467 [0,1,0,0,0,0|1,0,1]=3 5297 B17R0.12415 CCCCCCCCOCC(=O)NCC(=O)OC 188690a_100000185156_100000759886 [0,1,0,0,0,0|2,0,1]=4 5298 B17R0.12415 CCCCCCCCOCC(=O)NCC(=O)OC 34a_100000210232_100000182966 [0,1,0,0,0,0|2,0,1]=4 5299 B17R0.12415 CCCCCCCCOCC(=O)NCC(=O)OC 7a_100000210232_100000182966 [0,1,0,0,0,0|2,0,1]=4 5300 B17R0.12415 CCCCCCCCSCC(=O)CCC(=O)OC 62a_100000210759_100000691467 [0,1,0,0,0,0|1,0,1]=3 5301 B17R0.12415 CCCCCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210317 [0,1,0,0,0,0|1,0,1]=3 5302 B17R0.12415 CCCCCCCCSCC(=O)NCC(=O)OC 62a_100000182966_100000210317 [0,1,0,0,0,0|2,0,1]=4 5303 B17R0.12415 CCCCCCCCSCC(=O)NCC(=O)OC 62a_100000210759_100000182966 [0,1,0,0,0,0|2,0,1]=4 5304 B17R0.12415 CCCCCNCCOCC(=O)CCC(=O)OC 34a_100000224656_100000691467 [0,1,0,0,0,0|2,0,1]=4 5305 B17R0.12415 CCCCCOCCOCC(=O)CCC(=O)OC 34a_100011215259_100000691467 [0,1,0,0,0,0|2,0,1]=4 5306 B17R0.12415 CCCCCOCCOCC(=O)CCC(=O)OC 7a_100011215259_100000691467 [0,1,0,0,0,0|2,0,1]=4 5307 B17R0.12415 CCCCOCCCNCC(=O)CCC(=O)OC 2230a_200000211371_100000691467 [0,1,0,0,0,0|2,0,1]=4 5308 B17R0.12415 CCCCOCCCNCC(=O)CCC(=O)OC 34a_200000211371_100000691467 [0,1,0,0,0,0|2,0,1]=4 5309 B17R0.12415 CCCCOCCCOCC(=O)CCC(=O)OC 34a_200011215613_100000691467 [0,1,0,0,0,0|2,0,1]=4 5310 B17R0.12415 CCCCOCCCOCC(=O)CCC(=O)OC 7a_200011215613_100000691467 [0,1,0,0,0,0|2,0,1]=4 5311 B17R0.12415 CNC(=O)CCC(=O)CCCCCCCCCO 1458a_100011309844_100009813782 [0,1,0,0,0,0|2,0,1]=4 5312 B17R0.12415 CNC(=O)CCN(C)CCCCCCCCCO 2230a_100000750875_100009813782 [0,1,0,0,0,0|3,0,0]=4 5313 B17R0.12415 CNC(=O)CCN(C)CCCCCCCCCO 269982a_100000750875_100009813782 [0,1,0,0,0,0|3,0,0]=4 5314 B17R0.12415 COC(=O)CCC(=O)CCCCCCCCCO 1458a_100000187943_100009813782 [0,1,0,0,0,0|1,0,1]=3 5315 B17R0.12415 COC(=O)CCC(=O)CNCCCCCCCO 2230a_100011996573_100000691467 [0,1,0,0,0,0|2,0,1]=4 5316 B17R0.12415 COC(=O)CCC(=O)CNCCCCCCCO 34a_100011996573_100000691467 [0,1,0,0,0,0|2,0,1]=4 5317 B17R0.12415 COC(=O)CCC(=O)COCCCCCCCBr 34a_100000760002_100000691467 [0,1,0,0,0,0|2,0,1]=4 5318 B17R0.12415 COC(=O)CCC(=O)COCCCCCCCBr 7a_100000760002_100000691467 [0,1,0,0,0,0|2,0,1]=4 5319 B17R0.12415 COC(=O)CCC(=O)COCCCCCCCN 34a_100011996573_100000691467 [0,1,0,0,0,0|2,0,1]=4 5320 B17R0.12415 COC(=O)CCC(=O)CSCCCCCCCO 62a_100000691467_100000760002 [0,1,0,0,0,0|2,0,1]=4 5321 B17R0.12415 COC(=O)CCC(=O)CSCCCCCCCO 62a_100000760002_100000691467 [0,1,0,0,0,0|2,0,1]=4 5322 B17R0.12415 COC(=O)CCC(=O)NCCCCCCCCO 240690a_102515433106_100000187943 [0,1,0,0,0,0|2,0,1]=4 5323 B17R0.12415 COC(=O)CCN(C)CCCCCCCCCO 269982a_100025711912_100009813782 [0,1,0,0,0,0|2,0,0]=3 5324 B17R0.12415 COC(=O)CNC(=O)CCCCCCCCCF 188690a_100000185156_200009909015 [0,1,0,0,0,0|2,0,1]=4 5325 B17R0.12415 COC(=O)CNC(=O)CCCCCCCCCO 188690a_100000185156_100000032657 [0,1,0,0,0,0|2,0,1]=4 5326 B17R0.12415 COC(=O)NCC(=O)CCCCCCCCCO 1458a_100000215747_100009813782 [0,1,0,0,0,0|2,0,1]=4 5327 B17R0.12415 COCCCCCCOCC(=O)CCC(=O)OC 34a_200012092642_100000691467 [0,1,0,0,0,0|2,0,1]=4 5328 B17R0.12415 COCCCCCCOCC(=O)CCC(=O)OC 7a_200012092642_100000691467 [0,1,0,0,0,0|2,0,1]=4 5329 B17R0.12415 COCCCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100011998445 [0,1,0,0,0,0|2,0,1]=4 5330 B17R0.12415 COCCCCCCSCC(=O)CCC(=O)OC 62a_100011998445_100000691467 [0,1,0,0,0,0|2,0,1]=4 5331 B17R0.13601 C#CCCCCCCCCOC(C)CC(=O)OC 34a_100000065265_100009817358 [0,1,0,0,0,0|1,0,2]=4 5332 B17R0.13601 C#CCCCCCCCCOC(C)CC(=O)OC 7a_100000065265_100009817358 [0,1,0,0,0,0|1,0,2]=4 5333 B17R0.13601 C#CCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000054614_100000754131 [0,1,0,0,0,0|1,0,2]=4 5334 B17R0.13601 C#CCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000054614_100000754131 [0,1,0,0,0,0|1,0,2]=4 5335 B17R0.13601 C#CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100153394163 [0,1,0,0,0,0|1,0,2]=4 5336 B17R0.13601 C#CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100153394163_100000754131 [0,1,0,0,0,0|1,0,2]=4 5337 B17R0.13601 C=CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100009814027 [0,1,0,0,0,0|0,0,3]=4 5338 B17R0.13601 C=CCCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100009814027 [0,1,0,0,0,0|1,0,2]=4 5339 B17R0.13601 C=CCCCCCCCCOC(C)CC(=O)OC 34a_100011215194_100009817358 [0,1,0,0,0,0|1,0,2]=4 5340 B17R0.13601 C=CCCCCCCCCOC(C)CC(=O)OC 7a_100011215194_100009817358 [0,1,0,0,0,0|1,0,2]=4 5341 B17R0.13601 C=CCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100011933949 [0,1,0,0,0,0|1,0,2]=4 5342 B17R0.13601 C=CCCCCCCCCSC(C)CC(=O)OC 62a_100011933949_100009817358 [0,1,0,0,0,0|1,0,2]=4 5343 B17R0.13601 C=CCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000730831_100000754131 [0,1,0,0,0,0|1,0,2]=4 5344 B17R0.13601 C=CCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000730831_100000754131 [0,1,0,0,0,0|1,0,2]=4 5345 B17R0.13601 C=CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100012355270 [0,1,0,0,0,0|1,0,2]=4 5346 B17R0.13601 C=CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100012355270_100000754131 [0,1,0,0,0,0|1,0,2]=4 5347 B17R0.13601 CC/C=C\CCCCCOC[C@H](O)CC(=O)OC 34a_100016268722_100000754131 [0,1,0,0,0,0|1,0,2]=4 5348 B17R0.13601 CC/C=C\CCCCCOC[C@H](O)CC(=O)OC 7a_100016268722_100000754131 [0,1,0,0,0,0|1,0,2]=4 5349 B17R0.13601 CCC#CCCCCCCSC(C)CC(=O)OC 62a_100009817358_200000036426 [0,1,0,0,0,0|1,0,2]=4 5350 B17R0.13601 CCC#CCCCCCCSC(C)CC(=O)OC 62a_200000036426_100009817358 [0,1,0,0,0,0|1,0,2]=4 5351 B17R0.13601 CCCC/C=C/CCCCOC(C)CC(=O)OC 34a_200020645093_100009817358 [0,1,0,0,0,0|1,0,2]=4 5352 B17R0.13601 CCCC/C=C/CCCCOC(C)CC(=O)OC 7a_200020645093_100009817358 [0,1,0,0,0,0|1,0,2]=4 5353 B17R0.13601 CCCCC#CCCCCOC(C)CC(=O)OC 34a_200000066234_100009817358 [0,1,0,0,0,0|1,0,2]=4 5354 B17R0.13601 CCCCC#CCCCCOC(C)CC(=O)OC 7a_200000066234_100009817358 [0,1,0,0,0,0|1,0,2]=4 5355 B17R0.13601 CCCCC#CCCCSC[C@H](O)CC(=O)OC 62a_100000754131_200000047210 [0,1,0,0,0,0|1,0,2]=4 5356 B17R0.13601 CCCCC#CCCCSC[C@H](O)CC(=O)OC 62a_200000047210_100000754131 [0,1,0,0,0,0|1,0,2]=4 5357 B17R0.13601 CCCCC/C=C\CCCOC(C)CC(=O)OC 34a_100020655193_100009817358 [0,1,0,0,0,0|1,0,2]=4 5358 B17R0.13601 CCCCC/C=C\CCCOC(C)CC(=O)OC 7a_100020655193_100009817358 [0,1,0,0,0,0|1,0,2]=4 5359 B17R0.13601 CCCCC/C=C\CCOC[C@H](O)CC(=O)OC 34a_100016277358_100000754131 [0,1,0,0,0,0|1,0,2]=4 5360 B17R0.13601 CCCCC/C=C\CCOC[C@H](O)CC(=O)OC 7a_100016277358_100000754131 [0,1,0,0,0,0|1,0,2]=4 5361 B17R0.13601 CCCCCC#CCCOC[C@H](O)CC(=O)OC 34a_200000042877_100000754131 [0,1,0,0,0,0|1,0,2]=4 5362 B17R0.13601 CCCCCC#CCCOC[C@H](O)CC(=O)OC 7a_200000042877_100000754131 [0,1,0,0,0,0|1,0,2]=4 5363 B17R0.13601 CCCCCC/C=C/COC[C@H](O)CC(=O)OC 34a_200016276170_100000754131 [0,1,0,0,0,0|1,0,2]=4 5364 B17R0.13601 CCCCCC/C=C/COC[C@H](O)CC(=O)OC 7a_200016276170_100000754131 [0,1,0,0,0,0|1,0,2]=4 5365 B17R0.13601 CCCCCCC#CCCOC(C)CC(=O)OC 34a_200000033163_100009817358 [0,1,0,0,0,0|1,0,2]=4 5366 B17R0.13601 CCCCCCC#CCCOC(C)CC(=O)OC 7a_200000033163_100009817358 [0,1,0,0,0,0|1,0,2]=4 5367 B17R0.13601 CCCCCCC#CCOC[C@H](O)CC(=O)OC 34a_200000037284_100000754131 [0,1,0,0,0,0|1,0,2]=4 5368 B17R0.13601 CCCCCCC#CCOC[C@H](O)CC(=O)OC 7a_200000037284_100000754131 [0,1,0,0,0,0|1,0,2]=4 5369 B17R0.13601 CCCCCCCC#CCOC(C)CC(=O)OC 34a_200000061759_100009817358 [0,1,0,0,0,0|1,0,2]=4 5370 B17R0.13601 CCCCCCCC#CCOC(C)CC(=O)OC 7a_200000061759_100009817358 [0,1,0,0,0,0|1,0,2]=4 5371 B17R0.13601 CCCCCCCCCC=CC(=O)CC(=O)OC 1458a_200015352897_100000747449 [0,1,0,0,0,0|0,0,3]=4 5372 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)CC 1458a_100000210736_100000747405 [0,1,0,0,0,0|1,0,1]=3 5373 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)NC 1458a_100000210736_100000183359 [0,1,0,0,0,0|1,0,1]=3 5374 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)OC 1458a_100000210736_100000747449 [0,1,0,0,0,0|0,0,1]=2 5375 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100011215454 [0,1,0,0,0,0|0,0,1]=2 5376 B17R0.13601 CCCCCCCCCCCC(O)CC(=O)NC 1626a_100102657272_100000082106 [0,1,0,0,0,0|1,0,0]=2 5377 B17R0.13601 CCCCCCCCCCCC(O)CC(=O)NC 240690a_100102657272_100000082106 [0,1,0,0,0,0|1,0,0]=2 5378 B17R0.13601 CCCCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100011215454 [0,1,0,0,0,0|2,0,0]=3 5379 B17R0.13601 CCCCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011215454 [0,1,0,0,0,0|1,0,0]=2 5380 B17R0.13601 CCCCCCCCCCNC(=O)CC(=O)OC 240690a_100000684558_100000211351 [0,1,0,0,0,0|1,0,1]=3 5381 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)OC 2230a_100000684558_100009817358 [0,1,0,0,0,0|1,0,0]=2 5382 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)OC 34a_100000684558_100009817358 [0,1,0,0,0,0|1,0,0]=2 5383 B17R0.13601 CCCCCCCCCCOC(=O)CC(=O)CC 1458a_100000210414_100000210668 [0,1,0,0,0,0|2,0,1]=4 5384 B17R0.13601 CCCCCCCCCCOC(C)CC(=O)OC 34a_100000210711_100009817358 [0,1,0,0,0,0|1,0,0]=2 5385 B17R0.13601 CCCCCCCCCCOC(C)CC(=O)OC 7a_100000210711_100009817358 [0,1,0,0,0,0|1,0,0]=2 5386 B17R0.13601 CCCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210320 [0,1,0,0,0,0|1,0,0]=2 5387 B17R0.13601 CCCCCCCCCNC[C@H](O)CC(=O)OC 34a_100000212291_100000754131 [0,1,0,0,0,0|1,0,0]=2 5388 B17R0.13601 CCCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000210712_100000754131 [0,1,0,0,0,0|1,0,0]=2 5389 B17R0.13601 CCCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000210712_100000754131 [0,1,0,0,0,0|1,0,0]=2 5390 B17R0.13601 CCCCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210670 [0,1,0,0,0,0|1,0,1]=3 5391 B17R0.13601 CCCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210670 [0,1,0,0,0,0|1,0,0]=2 5392 B17R0.13601 CCCCCCOCCOC[C@H](O)CC(=O)OC 34a_100000691444_100000754131 [0,1,0,0,0,0|2,0,0]=3 5393 B17R0.13601 CCCCCCOCCOC[C@H](O)CC(=O)OC 7a_100000691444_100000754131 [0,1,0,0,0,0|2,0,0]=3 5394 B17R0.13601 CCCCNCCCCOC[C@H](O)CC(=O)OC 34a_200011216965_100000754131 [0,1,0,0,0,0|2,0,0]=3 5395 B17R0.13601 CCCCOCCCCOC[C@H](O)CC(=O)OC 34a_200000760531_100000754131 [0,1,0,0,0,0|2,0,0]=3 5396 B17R0.13601 CCCCOCCCCOC[C@H](O)CC(=O)OC 7a_200000760531_100000754131 [0,1,0,0,0,0|2,0,0]=3 5397 B17R0.13601 CCCCOCCOCCOC(C)CC(=O)OC 34a_100011215186_100009817358 [0,1,0,0,0,0|3,0,0]=4 5398 B17R0.13601 CCCCOCCOCCOC(C)CC(=O)OC 7a_100011215186_100009817358 [0,1,0,0,0,0|3,0,0]=4 5399 B17R0.13601 CCCOCCOCCNC[C@H](O)CC(=O)OC 34a_200011904461_100000754131 [0,1,0,0,0,0|3,0,0]=4 5400 B17R0.13601 CNC(=O)CN(C)CCCCCCCCCCO 2230a_100000189611_100009813290 [0,1,0,0,0,0|3,0,0]=4 5401 B17R0.13601 COC(=O)CC(=O)CCCCCCCCCCO 1458a_100000211351_100009813290 [0,1,0,0,0,0|1,0,1]=3 5402 B17R0.13601 COC(=O)CC(=O)CSCCCCCCCCO 62a_100000033203_100000210525 [0,1,0,0,0,0|2,0,1]=4 5403 B17R0.13601 COC(=O)CC(=O)CSCCCCCCCCO 62a_100000210525_100000033203 [0,1,0,0,0,0|2,0,1]=4 5404 B17R0.13601 COC(=O)CC(=O)NCCCCCCCCCO 240690a_100000078944_100000211351 [0,1,0,0,0,0|2,0,1]=4 5405 B17R0.13601 COC(=O)CC(C)NCCCCCCCCCO 2230a_100000078944_100009817358 [0,1,0,0,0,0|2,0,0]=3 5406 B17R0.13601 COC(=O)CC(C)NCCCCCCCCCO 34a_100000078944_100009817358 [0,1,0,0,0,0|2,0,0]=3 5407 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCBr 34a_100009813782_100009817358 [0,1,0,0,0,0|2,0,0]=3 5408 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCBr 7a_100009813782_100009817358 [0,1,0,0,0,0|2,0,0]=3 5409 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCCl 34a_100009868337_100009817358 [0,1,0,0,0,0|2,0,0]=3 5410 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCCl 7a_100009868337_100009817358 [0,1,0,0,0,0|2,0,0]=3 5411 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCN 34a_100000078944_100009817358 [0,1,0,0,0,0|2,0,0]=3 5412 B17R0.13601 COC(=O)CC(C)SCCCCCCCCCO 62a_100009813782_100009817358 [0,1,0,0,0,0|2,0,0]=3 5413 B17R0.13601 COC(=O)CC(C)SCCCCCCCCCO 62a_100009817358_100009813782 [0,1,0,0,0,0|2,0,0]=3 5414 B17R0.13601 COC(=O)CN(C)CCCCCCCCCCO 2230a_100000198492_100009813290 [0,1,0,0,0,0|2,0,0]=3 5415 B17R0.13601 COC(=O)C[C@@H](O)CNCCCCCCCCO 34a_102515433106_100000754131 [0,1,0,0,0,0|2,0,0]=3 5416 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCBr 34a_100009813846_100000754131 [0,1,0,0,0,0|2,0,0]=3 5417 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCBr 7a_100009813846_100000754131 [0,1,0,0,0,0|2,0,0]=3 5418 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCCl 34a_100000033203_100000754131 [0,1,0,0,0,0|2,0,0]=3 5419 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCCl 7a_100000033203_100000754131 [0,1,0,0,0,0|2,0,0]=3 5420 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCN 34a_102515433106_100000754131 [0,1,0,0,0,0|2,0,0]=3 5421 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCNCCN 34a_103619048469_100000754131 [0,1,0,0,0,0|3,0,0]=4 5422 B17R0.13601 COC(=O)C[C@@H](O)CSCCCCCCCCO 62a_100000033203_100000754131 [0,1,0,0,0,0|2,0,0]=3 5423 B17R0.13601 COC(=O)C[C@@H](O)CSCCCCCCCCO 62a_100000754131_100000033203 [0,1,0,0,0,0|2,0,0]=3 5424 B17R0.13601 COCCCOCCCOC[C@H](O)CC(=O)OC 34a_200011215475_100000754131 [0,1,0,0,0,0|3,0,0]=4 5425 B17R0.13601 COCCCOCCCOC[C@H](O)CC(=O)OC 7a_200011215475_100000754131 [0,1,0,0,0,0|3,0,0]=4 5426 B17R0.14245 C=C(Br)C(=O)NCCCCCCCCCCCC 11a_100000210451_100009813364 [0,1,0,0,0,0|2,0,1]=4 5427 B17R0.14245 C=C(Br)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100009813364 [0,1,0,0,0,0|2,0,1]=4 5428 B17R0.14245 C=C(C)C(=O)CCCCCCCCCCCCC 1458a_100000185857_100000210684 [0,1,0,0,0,0|1,0,0]=2 5429 B17R0.14245 C=C(C)C(=O)CCCCCCCCCCCCO 1458a_100000185857_100009813331 [0,1,0,0,0,0|2,0,0]=3 5430 B17R0.14245 C=C(C)C(=O)CCCCCCOCCCCCO 1458a_100000185857_200132310570 [0,1,0,0,0,0|3,0,0]=4 5431 B17R0.14245 C=C(C)C(=O)NCCCCCCCCCCCC 11a_100000210451_100000185857 [0,1,0,0,0,0|2,0,0]=3 5432 B17R0.14245 C=C(C)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185857 [0,1,0,0,0,0|2,0,0]=3 5433 B17R0.14245 C=C(C)C(=O)NCCCNCCCCCCCC 2230a_100016987756_100000210759 [0,1,0,0,0,0|3,0,0]=4 5434 B17R0.14245 C=C(C)C(=O)NCCNCCCCCCCCC 2230a_100102636416_100011214924 [0,1,0,0,0,0|3,0,0]=4 5435 B17R0.14245 C=C(C)C(=O)OCCCCCCNCCCCC 2230a_100000209983_200010402237 [0,1,0,0,0,0|3,0,0]=4 5436 B17R0.14245 C=C(C)C(=O)OCCCCCCOCCCCC 34a_100000210253_200010402237 [0,1,0,0,0,0|3,0,0]=4 5437 B17R0.14245 C=C(C)C(=O)OCCCCCCOCCCCC 7a_100000210253_200010402237 [0,1,0,0,0,0|3,0,0]=4 5438 B17R0.14245 C=C(C)C(=O)OCCCCCCSCCCCC 62a_100000210326_200010402237 [0,1,0,0,0,0|3,0,0]=4 5439 B17R0.14245 C=C(C)C(=O)OCCCCCCSCCCCC 62a_200010402237_100000210326 [0,1,0,0,0,0|3,0,0]=4 5440 B17R0.14245 C=C(C)C(=O)OCCCCOCCCCCCC 7a_100000065474_100000210614 [0,1,0,0,0,0|3,0,0]=4 5441 B17R0.14245 C=C(C)C(=O)OCCCOCCCCCCCC 7a_100000032641_100000210759 [0,1,0,0,0,0|3,0,0]=4 5442 B17R0.14245 C=C(C)C(=O)OCCNCCCCCCCCC 2230a_100000212291_100009816335 [0,1,0,0,0,0|3,0,0]=4 5443 B17R0.14245 C=C(C)C(=O)OCCNCCCCCCCCC 34a_100000212291_100009816335 [0,1,0,0,0,0|3,0,0]=4 5444 B17R0.14245 C=C(C)C(=O)OCCOCCCCCCCCC 34a_100000210712_100009816335 [0,1,0,0,0,0|3,0,0]=4 5445 B17R0.14245 C=C(C)C(=O)OCCOCCCCCCCCC 7a_100000210712_100009816335 [0,1,0,0,0,0|3,0,0]=4 5446 B17R0.14245 C=C(C)C(=O)OCCSCCCCCCCCC 62a_100009816335_100000210670 [0,1,0,0,0,0|3,0,0]=4 5447 B17R0.14245 C=C(Cl)C(=O)NCCCCCCCCCCCC 11a_100000210451_100000039160 [0,1,0,0,0,0|2,0,1]=4 5448 B17R0.14245 C=C(Cl)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100000039160 [0,1,0,0,0,0|2,0,1]=4 5449 B17R0.14245 C=C(F)C(=O)NCCCCCCCCCCCC 11a_100000210451_100000036797 [0,1,0,0,0,0|2,0,1]=4 5450 B17R0.14245 C=C(F)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100000036797 [0,1,0,0,0,0|2,0,1]=4 5451 B17R0.14245 C=CCCCCCCCCCCCC(=O)C(=C)C 1458a_100000185857_102130925996 [0,1,0,0,0,0|1,0,2]=4 5452 B17R0.14245 C=CCCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_102130925996 [0,1,0,0,0,0|1,0,2]=4 5453 B17R0.14245 C=CCCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_102130925996 [0,1,0,0,0,0|1,0,2]=4 5454 B17R0.14245 C=CCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_102130925996 [0,1,0,0,0,0|1,0,2]=4 5455 B17R0.14245 C=CCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_102130925996 [0,1,0,0,0,0|1,0,2]=4 5456 B17R0.14245 CC(=O)C(=O)CNCCCCCCCCCCO 34a_100000066964_100011261029 [0,1,0,0,0,0|3,0,0]=4 5457 B17R0.14245 CC(=O)C(=O)COCCCCCCCCCCBr 34a_100009813290_100011261029 [0,1,0,0,0,0|3,0,0]=4 5458 B17R0.14245 CC(=O)C(=O)COCCCCCCCCCCCl 34a_200000033068_100011261029 [0,1,0,0,0,0|3,0,0]=4 5459 B17R0.14245 CC(=O)C(=O)COCCCCCCCCCCN 34a_100000066964_100011261029 [0,1,0,0,0,0|3,0,0]=4 5460 B17R0.14245 CC(=O)C(=O)CSCCCCCCCCCCO 62a_100009813290_100011261029 [0,1,0,0,0,0|3,0,0]=4 5461 B17R0.14245 CC(=O)C(=O)CSCCCCCCCCCCO 62a_100011261029_200000033068 [0,1,0,0,0,0|3,0,0]=4 5462 B17R0.14245 CC(C)C(=O)CCCCCCCCCCCCO 1458a_100000210198_100009813331 [0,1,0,0,0,0|2,0,0]=3 5463 B17R0.14245 CC(C)C(=O)CCCCCCOCCCCCO 1458a_100000210198_200132310570 [0,1,0,0,0,0|3,0,0]=4 5464 B17R0.14245 CC(C)C(=O)CNCCCCCCCCCCO 2230a_100000066964_100000753385 [0,1,0,0,0,0|3,0,0]=4 5465 B17R0.14245 CC(C)C(=O)CNCCCCCCCCCCO 34a_100000066964_100000753385 [0,1,0,0,0,0|3,0,0]=4 5466 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCBr 34a_100009813290_100000753385 [0,1,0,0,0,0|3,0,0]=4 5467 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCBr 7a_100009813290_100000753385 [0,1,0,0,0,0|3,0,0]=4 5468 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCCl 34a_200000033068_100000753385 [0,1,0,0,0,0|3,0,0]=4 5469 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCCl 7a_200000033068_100000753385 [0,1,0,0,0,0|3,0,0]=4 5470 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCN 34a_100000066964_100000753385 [0,1,0,0,0,0|3,0,0]=4 5471 B17R0.14245 CC(C)C(=O)CSCCCCCCCCCCO 62a_100000753385_200000033068 [0,1,0,0,0,0|3,0,0]=4 5472 B17R0.14245 CC(C)C(=O)CSCCCCCCCCCCO 62a_100009813290_100000753385 [0,1,0,0,0,0|3,0,0]=4 5473 B17R0.14245 CC(F)C(=O)CCCCCCCCCCCCO 1458a_100000062450_100009813331 [0,1,0,0,0,0|2,0,0]=3 5474 B17R0.14245 CC(F)C(=O)CCCCCCOCCCCCO 1458a_100000062450_200132310570 [0,1,0,0,0,0|3,0,0]=4 5475 B17R0.14245 CCCCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100000210684 [0,1,0,0,0,0|1,0,0]=2 5476 B17R0.14245 CCCCCCCCCCCCCC(=O)C(C)C 1458a_100000756256_100000210206 [0,1,0,0,0,0|1,0,0]=2 5477 B17R0.14245 CCCCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100000210684 [0,1,0,0,0,0|1,0,0]=2 5478 B17R0.14245 CCCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000210684 [0,1,0,0,0,0|2,0,0]=3 5479 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100000756256 [0,1,0,0,0,0|1,0,0]=2 5480 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100000756256 [0,1,0,0,0,0|1,0,0]=2 5481 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100000756256 [0,1,0,0,0,0|1,0,0]=2 5482 B17R0.14245 CCCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210684 [0,1,0,0,0,0|1,0,0]=2 5483 B17R0.14245 CCCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210684 [0,1,0,0,0,0|1,0,0]=2 5484 B17R0.14245 CCCCCCCCCCCCCC(C)N(C)C 270004a_100102631434_100011216122 [0,1,0,0,0,0|2,0,1]=4 5485 B17R0.14245 CCCCCCCCCCCCCN(C)C(C)C 269982a_200000211004_100000210684 [0,1,0,0,0,0|3,0,0]=4 5486 B17R0.14245 CCCCCCCCCCCCCN(C)C(C)C 270004a_200000211004_200011215488 [0,1,0,0,0,0|3,0,0]=4 5487 B17R0.14245 CCCCCCCCCCCCNC(=O)C(=O)N 240690a_100000210451_100011215815 [0,1,0,0,0,0|3,0,0]=4 5488 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 11a_100000210451_100000210198 [0,1,0,0,0,0|2,0,0]=3 5489 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 1626a_100000210451_100000210198 [0,1,0,0,0,0|2,0,0]=3 5490 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 240690a_100000210451_100000210198 [0,1,0,0,0,0|2,0,0]=3 5491 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 527a_100000210451_100000210198 [0,1,0,0,0,0|2,0,0]=3 5492 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 11a_100000210451_100000062450 [0,1,0,0,0,0|2,0,0]=3 5493 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 1626a_100000210451_100000062450 [0,1,0,0,0,0|2,0,0]=3 5494 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 240690a_100000210451_100000062450 [0,1,0,0,0,0|2,0,0]=3 5495 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 527a_100000210451_100000062450 [0,1,0,0,0,0|2,0,0]=3 5496 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 11a_100000210451_100000210393 [0,1,0,0,0,0|3,0,0]=4 5497 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 1626a_100000210451_100000210393 [0,1,0,0,0,0|3,0,0]=4 5498 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 240690a_100000210451_100000210393 [0,1,0,0,0,0|3,0,0]=4 5499 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 527a_100000210451_100000210393 [0,1,0,0,0,0|3,0,0]=4 5500 B17R0.14245 CCCCCCCCCCCCNC(=O)C(O)O 240690a_100000210451_100000233687 [0,1,0,0,0,0|3,0,0]=4 5501 B17R0.14245 CCCCCCCCCCCCNC(=O)N(C)C 2708a_100000210451_100102631434 [0,1,0,0,0,0|2,0,0]=3 5502 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_100000210451_100000717761 [0,1,0,0,0,0|2,0,0]=3 5503 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O 1626a_100000210451_217856618621 [0,1,0,0,0,0|2,0,0]=3 5504 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O 240690a_100000210451_217856618621 [0,1,0,0,0,0|2,0,0]=3 5505 B17R0.14245 CCCCCCCCCCCNCC(=O)C(=O)C 34a_200011215754_100011261029 [0,1,0,0,0,0|2,0,0]=3 5506 B17R0.14245 CCCCCCCCCCCNCC(=O)C(C)C 2230a_200011215754_100000753385 [0,1,0,0,0,0|2,0,0]=3 5507 B17R0.14245 CCCCCCCCCCCNCC(=O)C(C)C 34a_200011215754_100000753385 [0,1,0,0,0,0|2,0,0]=3 5508 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100011215454 [0,1,0,0,0,0|2,0,0]=3 5509 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 2230a_200011215754_100000185267 [0,1,0,0,0,0|2,0,0]=3 5510 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 34a_200011215754_100000692301 [0,1,0,0,0,0|2,0,0]=3 5511 B17R0.14245 CCCCCCCCCCCOCC(=O)C(=O)C 34a_100000210809_100011261029 [0,1,0,0,0,0|2,0,0]=3 5512 B17R0.14245 CCCCCCCCCCCOCC(=O)C(C)C 34a_100000210809_100000753385 [0,1,0,0,0,0|2,0,0]=3 5513 B17R0.14245 CCCCCCCCCCCOCC(=O)C(C)C 7a_100000210809_100000753385 [0,1,0,0,0,0|2,0,0]=3 5514 B17R0.14245 CCCCCCCCCCCOCC(=O)N(C)C 34a_100000210809_100000692301 [0,1,0,0,0,0|2,0,0]=3 5515 B17R0.14245 CCCCCCCCCCCOCC(=O)N(C)C 7a_100000210809_100000692301 [0,1,0,0,0,0|2,0,0]=3 5516 B17R0.14245 CCCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100011215454 [0,1,0,0,0,0|2,0,0]=3 5517 B17R0.14245 CCCCCCCCCCCSCC(=O)C(C)C 62a_100000753385_100011215454 [0,1,0,0,0,0|2,0,0]=3 5518 B17R0.14245 CCCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100011215454 [0,1,0,0,0,0|2,0,0]=3 5519 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C 2230a_100000684558_100000737620 [0,1,0,0,0,0|2,0,0]=3 5520 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100000210320 [0,1,0,0,0,0|2,0,0]=3 5521 B17R0.14245 CCCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100000210320 [0,1,0,0,0,0|2,0,0]=3 5522 B17R0.14245 CCCCCCCCCCOCCC(=O)N(C)C 7a_100000210711_100000737620 [0,1,0,0,0,0|2,0,0]=3 5523 B17R0.14245 CCCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210320 [0,1,0,0,0,0|2,0,0]=3 5524 B17R0.14245 CCCCCCCCCCSCOC(=O)C(C)C 62a_100000139345_100000210320 [0,1,0,0,0,0|3,0,0]=4 5525 B17R0.14245 CCCCCCCCCNCCCC(=O)N(C)C 2230a_100000212291_100000737642 [0,1,0,0,0,0|2,0,0]=3 5526 B17R0.14245 CCCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100011214924 [0,1,0,0,0,0|2,0,0]=3 5527 B17R0.14245 CCCCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100011214924 [0,1,0,0,0,0|3,0,0]=4 5528 B17R0.14245 CCCCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100011214924 [0,1,0,0,0,0|3,0,0]=4 5529 B17R0.14245 CCCCCCCCCOCCCC(=O)N(C)C 7a_100000210712_100000737642 [0,1,0,0,0,0|2,0,0]=3 5530 B17R0.14245 CCCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210670 [0,1,0,0,0,0|2,0,0]=3 5531 B17R0.14245 CCCCCCCCNCCCCC(=O)N(C)C 34a_100000229939_100000752486 [0,1,0,0,0,0|2,0,0]=3 5532 B17R0.14245 CCCCCCCCOCCCCC(=O)N(C)C 34a_100000210232_100000752486 [0,1,0,0,0,0|2,0,0]=3 5533 B17R0.14245 CCCCCCCCOCCCCC(=O)N(C)C 7a_100000210232_100000752486 [0,1,0,0,0,0|2,0,0]=3 5534 B17R0.14245 CCCCCCCCSCCCCC(=O)N(C)C 62a_100000210759_100000752486 [0,1,0,0,0,0|2,0,0]=3 5535 B17R0.14245 CCCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210317 [0,1,0,0,0,0|2,0,0]=3 5536 B17R0.14245 CCCCCCOCCOCCCC(=O)N(C)C 7a_100000691444_100000737642 [0,1,0,0,0,0|3,0,0]=4 5537 B17R0.14245 CCCCCNCCOCCCCC(=O)N(C)C 34a_100000224656_100000752486 [0,1,0,0,0,0|3,0,0]=4 5538 B17R0.14245 CCCCCOCCOCCCCC(=O)N(C)C 34a_100011215259_100000752486 [0,1,0,0,0,0|3,0,0]=4 5539 B17R0.14245 CCCCCOCCOCCCCC(=O)N(C)C 7a_100011215259_100000752486 [0,1,0,0,0,0|3,0,0]=4 5540 B17R0.14245 CCCCOCCCCOCCCC(=O)N(C)C 7a_200000760531_100000737642 [0,1,0,0,0,0|3,0,0]=4 5541 B17R0.14245 CCCCOCCCNCCCCC(=O)N(C)C 34a_200000211371_100000752486 [0,1,0,0,0,0|3,0,0]=4 5542 B17R0.14245 CCCCOCCCOCCCCC(=O)N(C)C 34a_200011215613_100000752486 [0,1,0,0,0,0|3,0,0]=4 5543 B17R0.14245 CCCCOCCCOCCCCC(=O)N(C)C 7a_200011215613_100000752486 [0,1,0,0,0,0|3,0,0]=4 5544 B17R0.14245 CN(C)C(=O)CCCCCCCCCCCCO 240690a_100102631434_100102582631 [0,1,0,0,0,0|2,0,0]=3 5545 B17R0.14245 CN(C)C(=O)CCCCNCCCCCCCO 34a_100011996573_100000752486 [0,1,0,0,0,0|3,0,0]=4 5546 B17R0.14245 CN(C)C(=O)CCCCOCCCCCCCBr 34a_100000760002_100000752486 [0,1,0,0,0,0|3,0,0]=4 5547 B17R0.14245 CN(C)C(=O)CCCCOCCCCCCCBr 7a_100000760002_100000752486 [0,1,0,0,0,0|3,0,0]=4 5548 B17R0.14245 CN(C)C(=O)CCCCOCCCCCCCN 34a_100011996573_100000752486 [0,1,0,0,0,0|3,0,0]=4 5549 B17R0.14245 CN(C)C(=O)CCCCSCCCCCCCO 62a_100000752486_100000760002 [0,1,0,0,0,0|3,0,0]=4 5550 B17R0.14245 CN(C)C(=O)CCCCSCCCCCCCO 62a_100000760002_100000752486 [0,1,0,0,0,0|3,0,0]=4 5551 B17R0.14245 CN(C)C(=O)CCCNCCCCCCCCO 2230a_102515433106_100000737642 [0,1,0,0,0,0|3,0,0]=4 5552 B17R0.14245 CN(C)C(=O)CCCNCCCCCCCCO 2230a_200000744827_100000033203 [0,1,0,0,0,0|3,0,0]=4 5553 B17R0.14245 CN(C)C(=O)CCCOCCCCCCCCBr 7a_100009813846_100000737642 [0,1,0,0,0,0|3,0,0]=4 5554 B17R0.14245 CN(C)C(=O)CCCOCCCCCCCCCl 7a_100000033203_100000737642 [0,1,0,0,0,0|3,0,0]=4 5555 B17R0.14245 CN(C)C(=O)CCCSCCCCCCCCO 62a_100000033203_100000737642 [0,1,0,0,0,0|3,0,0]=4 5556 B17R0.14245 CN(C)C(=O)CCCSCCCCCCCCO 62a_100000737642_100000033203 [0,1,0,0,0,0|3,0,0]=4 5557 B17R0.14245 CN(C)C(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737620 [0,1,0,0,0,0|3,0,0]=4 5558 B17R0.14245 CN(C)C(=O)CCNCCCCCCCCCO 2230a_100000738053_100009813782 [0,1,0,0,0,0|3,0,0]=4 5559 B17R0.14245 CN(C)C(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737620 [0,1,0,0,0,0|3,0,0]=4 5560 B17R0.14245 CN(C)C(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737620 [0,1,0,0,0,0|3,0,0]=4 5561 B17R0.14245 CN(C)C(=O)CCOCCCCCCCCCO 34a_200000747469_100009813782 [0,1,0,0,0,0|3,0,0]=4 5562 B17R0.14245 CN(C)C(=O)CCSCCCCCCCCCO 62a_100000737620_100009813782 [0,1,0,0,0,0|3,0,0]=4 5563 B17R0.14245 CN(C)C(=O)CCSCCCCCCCCCO 62a_100009813782_100000737620 [0,1,0,0,0,0|3,0,0]=4 5564 B17R0.14245 CN(C)C(=O)CNCCCCCCCCCCO 2230a_100000066964_100000185267 [0,1,0,0,0,0|3,0,0]=4 5565 B17R0.14245 CN(C)C(=O)CNCCCCCCCCCCO 2230a_100015183351_100009813290 [0,1,0,0,0,0|3,0,0]=4 5566 B17R0.14245 CN(C)C(=O)CNCCCCCCCCCCO 34a_100000066964_100000692301 [0,1,0,0,0,0|3,0,0]=4 5567 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCBr 34a_100009813290_100000692301 [0,1,0,0,0,0|3,0,0]=4 5568 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCBr 7a_100009813290_100000692301 [0,1,0,0,0,0|3,0,0]=4 5569 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCCl 34a_200000033068_100000692301 [0,1,0,0,0,0|3,0,0]=4 5570 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCCl 7a_200000033068_100000692301 [0,1,0,0,0,0|3,0,0]=4 5571 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCN 34a_100000066964_100000692301 [0,1,0,0,0,0|3,0,0]=4 5572 B17R0.14245 CN(C)C(=O)CSCCCCCCCCCCO 62a_100000692301_200000033068 [0,1,0,0,0,0|3,0,0]=4 5573 B17R0.14245 CN(C)C(=O)CSCCCCCCCCCCO 62a_100009813290_100000692301 [0,1,0,0,0,0|3,0,0]=4 5574 B17R0.14245 COCCCCCCOCCCCC(=O)N(C)C 34a_200012092642_100000752486 [0,1,0,0,0,0|3,0,0]=4 5575 B17R0.14245 COCCCCCCOCCCCC(=O)N(C)C 7a_200012092642_100000752486 [0,1,0,0,0,0|3,0,0]=4 5576 B17R0.14245 COCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100011998445 [0,1,0,0,0,0|3,0,0]=4 5577 B17R0.14245 COCCCCCCSCCCCC(=O)N(C)C 62a_100011998445_100000752486 [0,1,0,0,0,0|3,0,0]=4 5578 B17R0.14245 C[C@@H](O)C(=O)CCCCCCCCCCCCO 1458a_100000717761_100009813331 [0,1,0,0,0,0|2,0,0]=3 5579 B17R0.14245 C[C@@H](O)C(=O)CCCCCCOCCCCCO 1458a_100000717761_200132310570 [0,1,0,0,0,0|3,0,0]=4 5580 B17R0.14245 C[C@H](O)C(=O)CCCCCCCCCCCCO 1458a_217856618621_100009813331 [0,1,0,0,0,0|2,0,0]=3 5581 B17R0.14245 C[C@H](O)C(=O)CCCCCCOCCCCCO 1458a_217856618621_200132310570 [0,1,0,0,0,0|3,0,0]=4 5582 B17R0.14245 O=C(CCCCCCCCCCCCO)C(O)O 1458a_100000233687_100009813331 [0,1,0,0,0,0|3,0,0]=4 5583 B17R0.14363 C=C(Br)CCOCCCCCCCCC(=O)OC 34a_100009813270_100010282707 [0,1,0,0,0,0|1,0,2]=4 5584 B17R0.14363 C=C(C)CCOCCCCCCCCC(=O)OC 34a_100000035544_100000730704 [0,1,0,0,0,0|1,0,1]=3 5585 B17R0.14363 C=C(C)CCOCCCCCCCCC(=O)OC 34a_100000764851_100010282707 [0,1,0,0,0,0|1,0,1]=3 5586 B17R0.14363 C=C(C)CCOCCCCCCCCC(=O)OC 7a_100000035544_100000730704 [0,1,0,0,0,0|1,0,1]=3 5587 B17R0.14363 C=C(C)CCSCCCCCCCCC(=O)OC 62a_100000730704_100010282707 [0,1,0,0,0,0|1,0,1]=3 5588 B17R0.14363 C=C(C)CCSCCCCCCCCC(=O)OC 62a_100010282707_100000730704 [0,1,0,0,0,0|1,0,1]=3 5589 B17R0.14363 C=C(C)COCCCCCCCCCC(=O)OC 34a_100000210245_100009813843 [0,1,0,0,0,0|1,0,1]=3 5590 B17R0.14363 C=C(C)CSCCCCCCCCCC(=O)OC 62a_100000748629_100009813843 [0,1,0,0,0,0|1,0,1]=3 5591 B17R0.14363 C=C(F)COCCCCCCCCCC(=O)OC 34a_200010262243_100009813843 [0,1,0,0,0,0|1,0,2]=4 5592 B17R0.14363 C=C(F)CSCCCCCCCCCC(=O)OC 62a_100000042424_100009813843 [0,1,0,0,0,0|1,0,2]=4 5593 B17R0.14363 CNC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000741757 [0,1,0,0,0,0|2,0,0]=3 5594 B17R0.14363 CNC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100000741757 [0,1,0,0,0,0|2,0,0]=3 5595 B17R0.14363 CNC(=O)OCCOCCCCCCCC(C)C 34a_200000210741_200011997002 [0,1,0,0,0,0|3,0,0]=4 5596 B17R0.14363 CNC(=O)OCCOCCCCCCCC(C)C 7a_200000210741_200011997002 [0,1,0,0,0,0|3,0,0]=4 5597 B17R0.14363 COC(=O)/C=C/COCCCCCCCC(C)C 34a_200000210741_100000742655 [0,1,0,0,0,0|1,0,2]=4 5598 B17R0.14363 COC(=O)/C=C/COCCCCCCCC(C)C 7a_200000210741_100000742655 [0,1,0,0,0,0|1,0,2]=4 5599 B17R0.14363 COC(=O)CCCCCCCCC=NNC(C)C 4a_100000741168_200010166605 [0,1,0,0,0,0|2,0,1]=4 5600 B17R0.14363 COC(=O)CCCCCCCCCCCC(=O)C 1458a_100000070787_100010983606 [0,1,0,0,0,0|0,0,1]=2 5601 B17R0.14363 COC(=O)CCCCCCCCCCCN(C)C 2230a_100102631434_100010983606 [0,1,0,0,0,0|1,0,0]=2 5602 B17R0.14363 COC(=O)CCCCCCCCCCCN(C)C 269982a_100102631434_100010983606 [0,1,0,0,0,0|1,0,0]=2 5603 B17R0.14363 COC(=O)CCCCCCCCCCNC(=O)C 188690a_202495363284_100015343762 [0,1,0,0,0,0|1,0,1]=3 5604 B17R0.14363 COC(=O)CCCCCCCCCCNC(C)C 2230a_100138425928_100009812566 [0,1,0,0,0,0|1,0,0]=2 5605 B17R0.14363 COC(=O)CCCCCCCCCCNC(C)C 34a_100138425928_100009812566 [0,1,0,0,0,0|1,0,0]=2 5606 B17R0.14363 COC(=O)CCCCCCCCCCOC(C)C 34a_100000212225_100009812566 [0,1,0,0,0,0|1,0,0]=2 5607 B17R0.14363 COC(=O)CCCCCCCCCCOC(C)C 34a_100011003013_100000210206 [0,1,0,0,0,0|1,0,0]=2 5608 B17R0.14363 COC(=O)CCCCCCCCCCOC(C)C 7a_100011003013_100000210206 [0,1,0,0,0,0|1,0,0]=2 5609 B17R0.14363 COC(=O)CCCCCCCCCCSC(C)C 62a_100000210206_100009812566 [0,1,0,0,0,0|1,0,0]=2 5610 B17R0.14363 COC(=O)CCCCCCCCCNCC(=O)N 2230a_100000711301_100009813843 [0,1,0,0,0,0|2,0,1]=4 5611 B17R0.14363 COC(=O)CCCCCCCCCNCC(=O)O 269956a_100016091260_100009813843 [0,1,0,0,0,0|2,0,1]=4 5612 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)C 2230a_100000210953_100009813843 [0,1,0,0,0,0|1,0,0]=2 5613 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)C 34a_100000210953_100009813843 [0,1,0,0,0,0|1,0,0]=2 5614 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)O 2230a_100000210904_100009813843 [0,1,0,0,0,0|1,0,0]=2 5615 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)O 34a_100000210904_100009813843 [0,1,0,0,0,0|1,0,0]=2 5616 B17R0.14363 COC(=O)CCCCCCCCCNCC(F)F 34a_100000765723_100009813843 [0,1,0,0,0,0|2,0,0]=3 5617 B17R0.14363 COC(=O)CCCCCCCCCOCC(=O)C 34a_100000211253_100009813843 [0,1,0,0,0,0|1,0,1]=3 5618 B17R0.14363 COC(=O)CCCCCCCCCOCC(C)Br 34a_100012180447_100009813843 [0,1,0,0,0,0|1,0,0]=2 5619 B17R0.14363 COC(=O)CCCCCCCCCOCC(C)C 34a_100000210257_100009813843 [0,1,0,0,0,0|1,0,0]=2 5620 B17R0.14363 COC(=O)CCCCCCCCCOCC(C)F 34a_100015925927_100009813843 [0,1,0,0,0,0|1,0,0]=2 5621 B17R0.14363 COC(=O)CCCCCCCCCOCC(F)F 34a_100000743014_100009813843 [0,1,0,0,0,0|2,0,0]=3 5622 B17R0.14363 COC(=O)CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009813843 [0,1,0,0,0,0|1,0,0]=2 5623 B17R0.14363 COC(=O)CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100009813843 [0,1,0,0,0,0|1,0,0]=2 5624 B17R0.14363 COC(=O)CCCCCCCCCSCC(=O)N 62a_100000747473_100009813843 [0,1,0,0,0,0|2,0,1]=4 5625 B17R0.14363 COC(=O)CCCCCCCCCSCC(=O)[O-] 62a_100020667443_100009813843 [0,1,0,0,0,0|2,0,1]=4 5626 B17R0.14363 COC(=O)CCCCCCCCCSCC(C)C 62a_100000210624_100009813843 [0,1,0,0,0,0|1,0,0]=2 5627 B17R0.14363 COC(=O)CCCCCCCCCSCC(C)O 62a_100011218427_100009813843 [0,1,0,0,0,0|1,0,0]=2 5628 B17R0.14363 COC(=O)CCCCCCCCCSCC(F)F 62a_100011934356_100009813843 [0,1,0,0,0,0|2,0,0]=3 5629 B17R0.14363 COC(=O)CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100009813843 [0,1,0,0,0,0|1,0,0]=2 5630 B17R0.14363 COC(=O)CCCCCCCCNCC=C(C)C 34a_100000718196_100010282707 [0,1,0,0,0,0|1,0,2]=4 5631 B17R0.14363 COC(=O)CCCCCCCCNCCC(C)O 2230a_200000755665_100010282707 [0,1,0,0,0,0|1,0,0]=2 5632 B17R0.14363 COC(=O)CCCCCCCCOCC=C(C)C 34a_100000035544_100000761012 [0,1,0,0,0,0|1,0,2]=4 5633 B17R0.14363 COC(=O)CCCCCCCCOCC=C(C)C 34a_100000753907_100010282707 [0,1,0,0,0,0|1,0,2]=4 5634 B17R0.14363 COC(=O)CCCCCCCCOCC=C(C)C 7a_100000035544_100000761012 [0,1,0,0,0,0|1,0,2]=4 5635 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)C 34a_100000759926_100010282707 [0,1,0,0,0,0|1,0,1]=3 5636 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)C 7a_100000035544_100000053229 [0,1,0,0,0,0|1,0,1]=3 5637 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)C 7a_100000759926_100010282707 [0,1,0,0,0,0|1,0,1]=3 5638 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)N 34a_100000035544_100000731001 [0,1,0,0,0,0|2,0,1]=4 5639 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)N 34a_100000757172_100010282707 [0,1,0,0,0,0|2,0,1]=4 5640 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)N 7a_100000035544_100000744528 [0,1,0,0,0,0|2,0,1]=4 5641 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)N 7a_100000757172_100010282707 [0,1,0,0,0,0|2,0,1]=4 5642 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)Br 34a_100009893172_100010282707 [0,1,0,0,0,0|1,0,0]=2 5643 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 34a_100000035544_100000210312 [0,1,0,0,0,0|1,0,0]=2 5644 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 34a_100000210254_100010282707 [0,1,0,0,0,0|1,0,0]=2 5645 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 7a_100000035544_100000210626 [0,1,0,0,0,0|1,0,0]=2 5646 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 7a_100000210254_100010282707 [0,1,0,0,0,0|1,0,0]=2 5647 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)O 34a_100000035544_100012276601 [0,1,0,0,0,0|1,0,0]=2 5648 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)O 7a_100000035544_100012276601 [0,1,0,0,0,0|1,0,0]=2 5649 B17R0.14363 COC(=O)CCCCCCCCOCCC(F)F 34a_100103093639_100010282707 [0,1,0,0,0,0|2,0,0]=3 5650 B17R0.14363 COC(=O)CCCCCCCCOCCN(C)C 7a_100000035544_100000755713 [0,1,0,0,0,0|2,0,0]=3 5651 B17R0.14363 COC(=O)CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100010282707 [0,1,0,0,0,0|1,0,0]=2 5652 B17R0.14363 COC(=O)CCCCCCCCOCOC(=O)C 34a_100000035544_100009813279 [0,1,0,0,0,0|2,0,1]=4 5653 B17R0.14363 COC(=O)CCCCCCCCOCOC(C)C 34a_100000035544_100000709892 [0,1,0,0,0,0|2,0,0]=3 5654 B17R0.14363 COC(=O)CCCCCCCCSCC=C(C)C 62a_100000761012_100010282707 [0,1,0,0,0,0|1,0,2]=4 5655 B17R0.14363 COC(=O)CCCCCCCCSCC=C(C)C 62a_100010282707_100000761012 [0,1,0,0,0,0|1,0,2]=4 5656 B17R0.14363 COC(=O)CCCCCCCCSCCC(=O)C 62a_100000053229_100010282707 [0,1,0,0,0,0|1,0,1]=3 5657 B17R0.14363 COC(=O)CCCCCCCCSCCC(=O)C 62a_100010282707_100000053229 [0,1,0,0,0,0|1,0,1]=3 5658 B17R0.14363 COC(=O)CCCCCCCCSCCC(=O)N 62a_100000744528_100010282707 [0,1,0,0,0,0|2,0,1]=4 5659 B17R0.14363 COC(=O)CCCCCCCCSCCC(=O)N 62a_100010282707_100000744528 [0,1,0,0,0,0|2,0,1]=4 5660 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)C 62a_100000210312_100010282707 [0,1,0,0,0,0|1,0,0]=2 5661 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)C 62a_100010282707_100000210312 [0,1,0,0,0,0|1,0,0]=2 5662 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)O 62a_100010282707_100012276601 [0,1,0,0,0,0|1,0,0]=2 5663 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)O 62a_100012276601_100010282707 [0,1,0,0,0,0|1,0,0]=2 5664 B17R0.14363 COC(=O)CCCCCCCCSCCN(C)C 62a_100010282707_100000755713 [0,1,0,0,0,0|2,0,0]=3 5665 B17R0.14363 COC(=O)CCCCCCCCSCOC(=O)C 62a_100000076356_100010282707 [0,1,0,0,0,0|2,0,1]=4 5666 B17R0.14363 COC(=O)CCCCCCCCSCOC(=O)C 62a_100010282707_100000076356 [0,1,0,0,0,0|2,0,1]=4 5667 B17R0.14363 COC(=O)CCCCCCCCSCOC(C)C 62a_100000709892_100010282707 [0,1,0,0,0,0|2,0,0]=3 5668 B17R0.14363 COC(=O)CCCCCCCCSCOC(C)C 62a_100010282707_100000709892 [0,1,0,0,0,0|2,0,0]=3 5669 B17R0.14363 COC(=O)CCCCCCCNCCCC(=O)N 34a_100000739312_100010004213 [0,1,0,0,0,0|2,0,1]=4 5670 B17R0.14363 COC(=O)CCCCCCCNCCCC(C)C 2230a_200000737386_100010004213 [0,1,0,0,0,0|1,0,0]=2 5671 B17R0.14363 COC(=O)CCCCCCCNCCCC(C)C 34a_200000737386_100010004213 [0,1,0,0,0,0|1,0,0]=2 5672 B17R0.14363 COC(=O)CCCCCCCNCCCS(=O)C 2230a_200000753449_100010004213 [0,1,0,0,0,0|2,0,0]=3 5673 B17R0.14363 COC(=O)CCCCCCCNCCNC(=O)C 2230a_100000209853_100010004213 [0,1,0,0,0,0|2,0,1]=4 5674 B17R0.14363 COC(=O)CCCCCCCNCCOC(C)C 2230a_100000701111_100010004213 [0,1,0,0,0,0|2,0,0]=3 5675 B17R0.14363 COC(=O)CCCCCCCNCCOC(C)C 34a_100000701111_100010004213 [0,1,0,0,0,0|2,0,0]=3 5676 B17R0.14363 COC(=O)CCCCCCCNCCSC(C)C 2230a_100000731138_100010004213 [0,1,0,0,0,0|2,0,0]=3 5677 B17R0.14363 COC(=O)CCCCCCCNCCSC(C)C 34a_100000731138_100010004213 [0,1,0,0,0,0|2,0,0]=3 5678 B17R0.14363 COC(=O)CCCCCCCOCCC=C(C)C 34a_100011022521_100011217483 [0,1,0,0,0,0|1,0,2]=4 5679 B17R0.14363 COC(=O)CCCCCCCOCCC=C(C)C 7a_100011022521_100011217483 [0,1,0,0,0,0|1,0,2]=4 5680 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 34a_100000759063_100010004213 [0,1,0,0,0,0|1,0,1]=3 5681 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 34a_100011022521_100000685027 [0,1,0,0,0,0|1,0,1]=3 5682 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 7a_100000759063_100010004213 [0,1,0,0,0,0|1,0,1]=3 5683 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 7a_100011022521_100011215641 [0,1,0,0,0,0|1,0,1]=3 5684 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)N 34a_100011022521_100102525003 [0,1,0,0,0,0|2,0,1]=4 5685 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)N 7a_100011022521_100102525003 [0,1,0,0,0,0|2,0,1]=4 5686 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 34a_100000210774_100010004213 [0,1,0,0,0,0|1,0,0]=2 5687 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 34a_100011022521_100011214892 [0,1,0,0,0,0|1,0,0]=2 5688 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 7a_100000210774_100010004213 [0,1,0,0,0,0|1,0,0]=2 5689 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 7a_100011022521_100011214892 [0,1,0,0,0,0|1,0,0]=2 5690 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)O 34a_100011022521_200000718107 [0,1,0,0,0,0|1,0,0]=2 5691 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)O 7a_100011022521_200000718107 [0,1,0,0,0,0|1,0,0]=2 5692 B17R0.14363 COC(=O)CCCCCCCOCCCN(C)C 7a_100011022521_100000757444 [0,1,0,0,0,0|2,0,0]=3 5693 B17R0.14363 COC(=O)CCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100010004213 [0,1,0,0,0,0|3,0,0]=4 5694 B17R0.14363 COC(=O)CCCCCCCOCCNC(=O)C 34a_100000158858_100010004213 [0,1,0,0,0,0|2,0,1]=4 5695 B17R0.14363 COC(=O)CCCCCCCOCCNC(=O)C 7a_100011022521_100000189650 [0,1,0,0,0,0|2,0,1]=4 5696 B17R0.14363 COC(=O)CCCCCCCOCCNC(C)C 34a_100000224655_100010004213 [0,1,0,0,0,0|2,0,0]=3 5697 B17R0.14363 COC(=O)CCCCCCCOCCOC(=O)C 34a_100011022521_100009814007 [0,1,0,0,0,0|2,0,1]=4 5698 B17R0.14363 COC(=O)CCCCCCCOCCOC(=O)C 7a_100011022521_100009814007 [0,1,0,0,0,0|2,0,1]=4 5699 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 34a_100000211219_100010004213 [0,1,0,0,0,0|2,0,0]=3 5700 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 34a_100011022521_100000211751 [0,1,0,0,0,0|2,0,0]=3 5701 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 7a_100000211219_100010004213 [0,1,0,0,0,0|2,0,0]=3 5702 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 7a_100011022521_100000211751 [0,1,0,0,0,0|2,0,0]=3 5703 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 34a_100011022521_100000730970 [0,1,0,0,0,0|2,0,0]=3 5704 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 34a_200011212901_100010004213 [0,1,0,0,0,0|2,0,0]=3 5705 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 7a_100011022521_100000730970 [0,1,0,0,0,0|2,0,0]=3 5706 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 7a_200011212901_100010004213 [0,1,0,0,0,0|2,0,0]=3 5707 B17R0.14363 COC(=O)CCCCCCCSCCC=C(C)C 62a_100010004213_100011217483 [0,1,0,0,0,0|1,0,2]=4 5708 B17R0.14363 COC(=O)CCCCCCCSCCC=C(C)C 62a_100011217483_100010004213 [0,1,0,0,0,0|1,0,2]=4 5709 B17R0.14363 COC(=O)CCCCCCCSCCCC(=O)C 62a_100010004213_100011215641 [0,1,0,0,0,0|1,0,1]=3 5710 B17R0.14363 COC(=O)CCCCCCCSCCCC(=O)C 62a_100011215641_100010004213 [0,1,0,0,0,0|1,0,1]=3 5711 B17R0.14363 COC(=O)CCCCCCCSCCCC(=O)N 62a_100010004213_100102525003 [0,1,0,0,0,0|2,0,1]=4 5712 B17R0.14363 COC(=O)CCCCCCCSCCCC(=O)N 62a_100102525003_100010004213 [0,1,0,0,0,0|2,0,1]=4 5713 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)C 62a_100010004213_100011214892 [0,1,0,0,0,0|1,0,0]=2 5714 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)C 62a_100011214892_100010004213 [0,1,0,0,0,0|1,0,0]=2 5715 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)O 62a_100010004213_200000718107 [0,1,0,0,0,0|1,0,0]=2 5716 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)O 62a_200000718107_100010004213 [0,1,0,0,0,0|1,0,0]=2 5717 B17R0.14363 COC(=O)CCCCCCCSCCCN(C)C 62a_100010004213_100000757444 [0,1,0,0,0,0|2,0,0]=3 5718 B17R0.14363 COC(=O)CCCCCCCSCCNC(=O)C 62a_100000189650_100010004213 [0,1,0,0,0,0|2,0,1]=4 5719 B17R0.14363 COC(=O)CCCCCCCSCCNC(=O)C 62a_100010004213_100000189650 [0,1,0,0,0,0|2,0,1]=4 5720 B17R0.14363 COC(=O)CCCCCCCSCCOC(=O)C 62a_100009814007_100010004213 [0,1,0,0,0,0|2,0,1]=4 5721 B17R0.14363 COC(=O)CCCCCCCSCCOC(=O)C 62a_100010004213_100009814007 [0,1,0,0,0,0|2,0,1]=4 5722 B17R0.14363 COC(=O)CCCCCCCSCCOC(C)C 62a_100000211751_100010004213 [0,1,0,0,0,0|2,0,0]=3 5723 B17R0.14363 COC(=O)CCCCCCCSCCOC(C)C 62a_100010004213_100000211751 [0,1,0,0,0,0|2,0,0]=3 5724 B17R0.14363 COC(=O)CCCCCCCSCCSC(C)C 62a_100000730970_100010004213 [0,1,0,0,0,0|2,0,0]=3 5725 B17R0.14363 COC(=O)CCCCCCCSCCSC(C)C 62a_100010004213_100000730970 [0,1,0,0,0,0|2,0,0]=3 5726 B17R0.14363 COC(=O)CCCCCCNCCCCC(=O)N 34a_100000696515_100009815986 [0,1,0,0,0,0|2,0,1]=4 5727 B17R0.14363 COC(=O)CCCCCCNCCCNC(=O)C 34a_100000736810_100009815986 [0,1,0,0,0,0|2,0,1]=4 5728 B17R0.14363 COC(=O)CCCCCCNCCCOC(C)C 2230a_100000737246_100009815986 [0,1,0,0,0,0|2,0,0]=3 5729 B17R0.14363 COC(=O)CCCCCCNCCCOC(C)C 34a_100000737246_100009815986 [0,1,0,0,0,0|2,0,0]=3 5730 B17R0.14363 COC(=O)CCCCCCOCCCCB(O)O 34a_100009863599_200009817182 [0,1,0,0,0,0|3,0,0]=4 5731 B17R0.14363 COC(=O)CCCCCCOCCCCB(O)O 7a_100009863599_200009817182 [0,1,0,0,0,0|3,0,0]=4 5732 B17R0.14363 COC(=O)CCCCCCOCCCCC(=O)C 34a_100009863599_100009817362 [0,1,0,0,0,0|1,0,1]=3 5733 B17R0.14363 COC(=O)CCCCCCOCCCCC(=O)C 7a_100009863599_100000735457 [0,1,0,0,0,0|1,0,1]=3 5734 B17R0.14363 COC(=O)CCCCCCOCCCCC(=O)N 34a_100012022536_100009815986 [0,1,0,0,0,0|2,0,1]=4 5735 B17R0.14363 COC(=O)CCCCCCOCCCCC(=O)N 7a_100012022536_100009815986 [0,1,0,0,0,0|2,0,1]=4 5736 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 34a_100009863599_100011216152 [0,1,0,0,0,0|1,0,0]=2 5737 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 34a_100011214890_100009815986 [0,1,0,0,0,0|1,0,0]=2 5738 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 7a_100009863599_100011216152 [0,1,0,0,0,0|1,0,0]=2 5739 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 7a_100011214890_100009815986 [0,1,0,0,0,0|1,0,0]=2 5740 B17R0.14363 COC(=O)CCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100009815986 [0,1,0,0,0,0|3,0,0]=4 5741 B17R0.14363 COC(=O)CCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100009815986 [0,1,0,0,0,0|3,0,0]=4 5742 B17R0.14363 COC(=O)CCCCCCOCCCNC(=O)C 34a_100000752032_100009815986 [0,1,0,0,0,0|2,0,1]=4 5743 B17R0.14363 COC(=O)CCCCCCOCCCNC(C)C 34a_100000182298_100009815986 [0,1,0,0,0,0|2,0,0]=3 5744 B17R0.14363 COC(=O)CCCCCCOCCCOC(=O)C 34a_100009863599_100000042594 [0,1,0,0,0,0|2,0,1]=4 5745 B17R0.14363 COC(=O)CCCCCCOCCCOC(=O)C 7a_100009863599_100000042594 [0,1,0,0,0,0|2,0,1]=4 5746 B17R0.14363 COC(=O)CCCCCCOCCCOC(=S)C 34a_100009863599_200135323944 [0,1,0,0,0,0|2,0,1]=4 5747 B17R0.14363 COC(=O)CCCCCCOCCCOC(=S)C 7a_100009863599_200135323944 [0,1,0,0,0,0|2,0,1]=4 5748 B17R0.14363 COC(=O)CCCCCCOCCCSC(=O)C 34a_100009863599_100000038929 [0,1,0,0,0,0|2,0,1]=4 5749 B17R0.14363 COC(=O)CCCCCCOCCCSC(=O)C 7a_100009863599_100000038929 [0,1,0,0,0,0|2,0,1]=4 5750 B17R0.14363 COC(=O)CCCCCCOCCNCC(C)C 34a_100015185251_100009815986 [0,1,0,0,0,0|2,0,0]=3 5751 B17R0.14363 COC(=O)CCCCCCOCCOCC(C)C 34a_100000703358_100009815986 [0,1,0,0,0,0|2,0,0]=3 5752 B17R0.14363 COC(=O)CCCCCCOCCOCC(C)C 7a_100000703358_100009815986 [0,1,0,0,0,0|2,0,0]=3 5753 B17R0.14363 COC(=O)CCCCCCOCCOCC(F)F 34a_100000704375_100009815986 [0,1,0,0,0,0|3,0,0]=4 5754 B17R0.14363 COC(=O)CCCCCCOCCOCC(F)F 34a_100009863599_200012177212 [0,1,0,0,0,0|3,0,0]=4 5755 B17R0.14363 COC(=O)CCCCCCOCCOCC(F)F 7a_100000704375_100009815986 [0,1,0,0,0,0|3,0,0]=4 5756 B17R0.14363 COC(=O)CCCCCCOCCOCC(F)F 7a_100009863599_200012177212 [0,1,0,0,0,0|3,0,0]=4 5757 B17R0.14363 COC(=O)CCCCCCOCCSCC(C)C 34a_200000230437_100009815986 [0,1,0,0,0,0|2,0,0]=3 5758 B17R0.14363 COC(=O)CCCCCCOCCSCC(C)C 7a_200000230437_100009815986 [0,1,0,0,0,0|2,0,0]=3 5759 B17R0.14363 COC(=O)CCCCCCSCCCCB(O)O 62a_100009815986_200009817182 [0,1,0,0,0,0|3,0,0]=4 5760 B17R0.14363 COC(=O)CCCCCCSCCCCB(O)O 62a_200009817182_100009815986 [0,1,0,0,0,0|3,0,0]=4 5761 B17R0.14363 COC(=O)CCCCCCSCCCCC(=O)C 62a_100000735457_100009815986 [0,1,0,0,0,0|1,0,1]=3 5762 B17R0.14363 COC(=O)CCCCCCSCCCCC(=O)C 62a_100009815986_100000735457 [0,1,0,0,0,0|1,0,1]=3 5763 B17R0.14363 COC(=O)CCCCCCSCCCCC(C)C 62a_100009815986_100011216152 [0,1,0,0,0,0|1,0,0]=2 5764 B17R0.14363 COC(=O)CCCCCCSCCCCC(C)C 62a_100011216152_100009815986 [0,1,0,0,0,0|1,0,0]=2 5765 B17R0.14363 COC(=O)CCCCCCSCCCCN(C)C 62a_100009815986_100000690147 [0,1,0,0,0,0|2,0,0]=3 5766 B17R0.14363 COC(=O)CCCCCCSCCCOC(=O)C 62a_100000042594_100009815986 [0,1,0,0,0,0|2,0,1]=4 5767 B17R0.14363 COC(=O)CCCCCCSCCCOC(=O)C 62a_100009815986_100000042594 [0,1,0,0,0,0|2,0,1]=4 5768 B17R0.14363 COC(=O)CCCCCCSCCCOC(=S)C 62a_100009815986_200135323944 [0,1,0,0,0,0|2,0,1]=4 5769 B17R0.14363 COC(=O)CCCCCCSCCCOC(=S)C 62a_200135323944_100009815986 [0,1,0,0,0,0|2,0,1]=4 5770 B17R0.14363 COC(=O)CCCCCCSCCCSC(=O)C 62a_100000038929_100009815986 [0,1,0,0,0,0|2,0,1]=4 5771 B17R0.14363 COC(=O)CCCCCCSCCCSC(=O)C 62a_100009815986_100000038929 [0,1,0,0,0,0|2,0,1]=4 5772 B17R0.14363 COC(=O)CCCCCCSCCOCC(F)F 62a_100009815986_200012177212 [0,1,0,0,0,0|3,0,0]=4 5773 B17R0.14363 COC(=O)CCCCCCSCCOCC(F)F 62a_200012177212_100009815986 [0,1,0,0,0,0|3,0,0]=4 5774 B17R0.14363 COC(=O)CCCCCNCCCCCC(C)C 2230a_100011290863_100009816466 [0,1,0,0,0,0|1,0,0]=2 5775 B17R0.14363 COC(=O)CCCCCNCCCCCC(C)C 34a_100011290863_100009816466 [0,1,0,0,0,0|1,0,0]=2 5776 B17R0.14363 COC(=O)CCCCCNCCCCNC(=O)C 2230a_200011368371_100009816466 [0,1,0,0,0,0|2,0,1]=4 5777 B17R0.14363 COC(=O)CCCCCNCCCCNC(=O)C 34a_200011368371_100009816466 [0,1,0,0,0,0|2,0,1]=4 5778 B17R0.14363 COC(=O)CCCCCNCCCOCC(C)C 2230a_100000205972_100009816466 [0,1,0,0,0,0|2,0,0]=3 5779 B17R0.14363 COC(=O)CCCCCNCCCOCC(C)C 34a_100000205972_100009816466 [0,1,0,0,0,0|2,0,0]=3 5780 B17R0.14363 COC(=O)CCCCCOCCCCCB(O)O 34a_100000074720_200009817188 [0,1,0,0,0,0|3,0,0]=4 5781 B17R0.14363 COC(=O)CCCCCOCCCCCB(O)O 7a_100000074720_200009817188 [0,1,0,0,0,0|3,0,0]=4 5782 B17R0.14363 COC(=O)CCCCCOCCCCCC(=O)N 34a_100000074720_100009817443 [0,1,0,0,0,0|2,0,1]=4 5783 B17R0.14363 COC(=O)CCCCCOCCCCCC(=O)N 34a_100000123541_100009816466 [0,1,0,0,0,0|2,0,1]=4 5784 B17R0.14363 COC(=O)CCCCCOCCCCCC(=O)N 7a_100000074720_100009817443 [0,1,0,0,0,0|2,0,1]=4 5785 B17R0.14363 COC(=O)CCCCCOCCCCCC(=O)N 7a_100000123541_100009816466 [0,1,0,0,0,0|2,0,1]=4 5786 B17R0.14363 COC(=O)CCCCCOCCCCCC(=O)[O-] 7a_100102619762_100009816466 [0,1,0,0,0,0|2,0,1]=4 5787 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 34a_100000074720_100000210682 [0,1,0,0,0,0|1,0,0]=2 5788 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 34a_100011995859_100009816466 [0,1,0,0,0,0|1,0,0]=2 5789 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 7a_100000074720_100000210682 [0,1,0,0,0,0|1,0,0]=2 5790 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 7a_100011995859_100009816466 [0,1,0,0,0,0|1,0,0]=2 5791 B17R0.14363 COC(=O)CCCCCOCCCCNC(C)C 34a_100011521146_100009816466 [0,1,0,0,0,0|2,0,0]=3 5792 B17R0.14363 COC(=O)CCCCCOCCCCOC(=O)C 34a_100000073216_100009816466 [0,1,0,0,0,0|2,0,1]=4 5793 B17R0.14363 COC(=O)CCCCCOCCCCOC(=O)C 34a_100000074720_100000033659 [0,1,0,0,0,0|2,0,1]=4 5794 B17R0.14363 COC(=O)CCCCCOCCCCOC(=O)C 7a_100000073216_100009816466 [0,1,0,0,0,0|2,0,1]=4 5795 B17R0.14363 COC(=O)CCCCCOCCCCOC(=O)C 7a_100000074720_100000033659 [0,1,0,0,0,0|2,0,1]=4 5796 B17R0.14363 COC(=O)CCCCCOCCCCSC(=O)C 34a_100000074720_200010402107 [0,1,0,0,0,0|2,0,1]=4 5797 B17R0.14363 COC(=O)CCCCCOCCCCSC(=O)C 7a_100000074720_200010402107 [0,1,0,0,0,0|2,0,1]=4 5798 B17R0.14363 COC(=O)CCCCCSCCCCCB(O)O 62a_100009816466_200009817188 [0,1,0,0,0,0|3,0,0]=4 5799 B17R0.14363 COC(=O)CCCCCSCCCCCB(O)O 62a_200009817188_100009816466 [0,1,0,0,0,0|3,0,0]=4 5800 B17R0.14363 COC(=O)CCCCCSCCCCCC(=O)N 62a_100009816466_100009817443 [0,1,0,0,0,0|2,0,1]=4 5801 B17R0.14363 COC(=O)CCCCCSCCCCCC(=O)N 62a_100009817443_100009816466 [0,1,0,0,0,0|2,0,1]=4 5802 B17R0.14363 COC(=O)CCCCCSCCCCCC(C)C 62a_100000210682_100009816466 [0,1,0,0,0,0|1,0,0]=2 5803 B17R0.14363 COC(=O)CCCCCSCCCCCC(C)C 62a_100009816466_100000210682 [0,1,0,0,0,0|1,0,0]=2 5804 B17R0.14363 COC(=O)CCCCCSCCCCOC(=O)C 62a_100000033659_100009816466 [0,1,0,0,0,0|2,0,1]=4 5805 B17R0.14363 COC(=O)CCCCCSCCCCOC(=O)C 62a_100009816466_100000033659 [0,1,0,0,0,0|2,0,1]=4 5806 B17R0.14363 COC(=O)CCCCCSCCCCSC(=O)C 62a_100009816466_200010402107 [0,1,0,0,0,0|2,0,1]=4 5807 B17R0.14363 COC(=O)CCCCCSCCCCSC(=O)C 62a_200010402107_100009816466 [0,1,0,0,0,0|2,0,1]=4 5808 B17R0.14363 COC(=O)CCCCNCCCCCCC(C)C 2230a_100000211014_100000204269 [0,1,0,0,0,0|1,0,0]=2 5809 B17R0.14363 COC(=O)CCCCNCCCCCCC(C)C 34a_100000211014_100000204269 [0,1,0,0,0,0|1,0,0]=2 5810 B17R0.14363 COC(=O)CCCCNCCCCCNC(=O)C 2230a_200012022750_100000204269 [0,1,0,0,0,0|2,0,1]=4 5811 B17R0.14363 COC(=O)CCCCNCCCCCNC(=O)C 34a_200012022750_100000204269 [0,1,0,0,0,0|2,0,1]=4 5812 B17R0.14363 COC(=O)CCCCOCCCCCCB(O)O 34a_100000059025_100009817187 [0,1,0,0,0,0|3,0,0]=4 5813 B17R0.14363 COC(=O)CCCCOCCCCCCB(O)O 7a_100000059025_100009817187 [0,1,0,0,0,0|3,0,0]=4 5814 B17R0.14363 COC(=O)CCCCOCCCCCNC(C)C 34a_100011629493_100000204269 [0,1,0,0,0,0|2,0,0]=3 5815 B17R0.14363 COC(=O)CCCCOCCCCCOC(=O)C 34a_100000059025_100000033007 [0,1,0,0,0,0|2,0,1]=4 5816 B17R0.14363 COC(=O)CCCCOCCCCCOC(=O)C 7a_100000059025_100000033007 [0,1,0,0,0,0|2,0,1]=4 5817 B17R0.14363 COC(=O)CCCCSCCCCCCB(O)O 62a_100000204269_100009817187 [0,1,0,0,0,0|3,0,0]=4 5818 B17R0.14363 COC(=O)CCCCSCCCCCCB(O)O 62a_100009817187_100000204269 [0,1,0,0,0,0|3,0,0]=4 5819 B17R0.14363 COC(=O)CCCCSCCCCCOC(=O)C 62a_100000033007_100000204269 [0,1,0,0,0,0|2,0,1]=4 5820 B17R0.14363 COC(=O)CCCCSCCCCCOC(=O)C 62a_100000204269_100000033007 [0,1,0,0,0,0|2,0,1]=4 5821 B17R0.14363 COC(=O)CCCNCCCCCCNC(=O)C 2230a_200011996284_100011218270 [0,1,0,0,0,0|2,0,1]=4 5822 B17R0.14363 COC(=O)CCCNCCCCCCNC(=O)C 34a_200011996284_100000742333 [0,1,0,0,0,0|2,0,1]=4 5823 B17R0.14363 COC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000742333 [0,1,0,0,0,0|1,0,0]=2 5824 B17R0.14363 COC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100011218270 [0,1,0,0,0,0|1,0,0]=2 5825 B17R0.14363 COC(=O)CCOCCOCCOCCC(C)C 34a_100010982084_100000210312 [0,1,0,0,0,0|3,0,0]=4 5826 B17R0.14363 COC(=O)CCOCCOCCOCCC(C)C 7a_100010982084_100000210626 [0,1,0,0,0,0|3,0,0]=4 5827 B17R0.14363 COC(=O)CCOCCOCCOCCC(C)O 34a_100010982084_100012276601 [0,1,0,0,0,0|3,0,0]=4 5828 B17R0.14363 COC(=O)CCOCCOCCOCCC(C)O 7a_100010982084_100012276601 [0,1,0,0,0,0|3,0,0]=4 5829 B17R0.14363 COC(=O)COCCNCCCCCCC(C)C 2230a_100000211014_100000090808 [0,1,0,0,0,0|2,0,0]=3 5830 B17R0.14363 COC(=O)COCCNCCCCCCC(C)C 34a_100000211014_100000090808 [0,1,0,0,0,0|2,0,0]=3 5831 B17R0.14363 COC(=O)COCCOCCCCCNC(C)C 34a_100011629493_100000090808 [0,1,0,0,0,0|3,0,0]=4 5832 B17R0.14363 COC(=O)COCCOCCOCCCC(C)C 34a_100011023656_100011214892 [0,1,0,0,0,0|3,0,0]=4 5833 B17R0.14363 COC(=O)COCCOCCOCCCC(C)C 7a_100011023656_100011214892 [0,1,0,0,0,0|3,0,0]=4 5834 B17R0.14363 COC(=O)COCCOCCOCCCC(C)O 34a_100011023656_200000718107 [0,1,0,0,0,0|3,0,0]=4 5835 B17R0.14363 COC(=O)COCCOCCOCCCC(C)O 7a_100011023656_200000718107 [0,1,0,0,0,0|3,0,0]=4 5836 B17R0.14367 CCCCCCCCCCCCNS(=O)(=O)CC 270084a_100000210451_100000211323 [0,1,0,0,0,0|3,0,0]=4 5837 B17R0.14367 CCCCCCCCCCCCNS(=O)(=O)CC 274078a_100000210451_100000211323 [0,1,0,0,0,0|3,0,0]=4 5838 B17R0.14367 CCCCCCCCCCCCNS(=O)(=O)CC 40a_100000210451_100000053943 [0,1,0,0,0,0|3,0,0]=4 5839 B17R0.14367 CCCCCCCCCCCNCC(C)(C)OC 2230a_100000763424_100011215454 [0,1,0,0,0,0|2,0,1]=4 5840 B17R0.14367 CCCCCCCCCCCNCC(C)(C)OC 34a_200011215754_100000701081 [0,1,0,0,0,0|2,0,1]=4 5841 B17R0.14367 CCCCCCCCCCCOCC(C)(C)OC 34a_100000210809_100000701081 [0,1,0,0,0,0|2,0,1]=4 5842 B17R0.14367 CCCCCCCCCCCSCC(C)(C)OC 62a_100000701081_100011215454 [0,1,0,0,0,0|2,0,1]=4 5843 B17R0.14367 CCCCCCCCCCNCCS(=O)(=O)CC 2230a_100000684558_100000756660 [0,1,0,0,0,0|3,0,0]=4 5844 B17R0.14367 CCCCCCCCCCNCCS(=O)(=O)CC 2230a_100000751051_100000210320 [0,1,0,0,0,0|3,0,0]=4 5845 B17R0.14367 CCCCCCCCCCNCCS(=O)(=O)CC 34a_100000684558_100000756660 [0,1,0,0,0,0|3,0,0]=4 5846 B17R0.14367 CCCCCCCCCCNCCS(=O)(=O)CC 34a_100000751051_100000210320 [0,1,0,0,0,0|3,0,0]=4 5847 B17R0.14367 CCCCCCCCCCNCCS(=O)(=O)NC 2230a_100000710037_100000210320 [0,1,0,0,0,0|3,0,0]=4 5848 B17R0.14367 CCCCCCCCCCNCCS(=O)(=O)NC 34a_100000710037_100000210320 [0,1,0,0,0,0|3,0,0]=4 5849 B17R0.14367 CCCCCCCCCCOCCC(C)(C)OC 7a_100000699976_100000210320 [0,1,0,0,0,0|2,0,1]=4 5850 B17R0.14367 CCCCCCCCCCOCCS(=O)(=O)CC 34a_100000210711_100000756660 [0,1,0,0,0,0|3,0,0]=4 5851 B17R0.14367 CCCCCCCCCCOCCS(=O)(=O)CC 34a_200011216379_100000210320 [0,1,0,0,0,0|3,0,0]=4 5852 B17R0.14367 CCCCCCCCCCOCCS(=O)(=O)CC 7a_100000210711_100000756660 [0,1,0,0,0,0|3,0,0]=4 5853 B17R0.14367 CCCCCCCCCCOCCS(=O)(=O)CC 7a_200011216379_100000210320 [0,1,0,0,0,0|3,0,0]=4 5854 B17R0.14367 CCCCCCCCCCSCCS(=O)(=O)CC 62a_100000756660_100000210320 [0,1,0,0,0,0|3,0,0]=4 5855 B17R1.11 C=C1CCC(CC1)COCCCCCCCC 34a_100000074039_100000210759 [0,0,0,1,0,0|3,0,0]=4 5856 B17R1.11 C=C1CCC(CC1)NCCCCCCCCC 270004a_100000212291_100010272673 [0,0,0,1,0,0|3,0,0]=4 5857 B17R1.11 C=C1CCN(CC1)CCCCCCCCCC 2230a_100000752442_100000210320 [0,0,0,1,0,0|3,0,0]=4 5858 B17R1.11 C=C1CCN(CC1)CCCCCCCCCC 269982a_100000752442_100000210320 [0,0,0,1,0,0|3,0,0]=4 5859 B17R1.11 C=C1CCN(CC1)CCCCCCCCCC 34a_100000752442_100000210320 [0,0,0,1,0,0|3,0,0]=4 5860 B17R1.11 CCCCCCCCCCN1CC=C(CC1)C 2230a_100000693516_100000210320 [0,0,0,1,0,0|3,0,0]=4 5861 B17R1.11 CCCCCCCCCCN1CC=C(CC1)C 269982a_100000693516_100000210320 [0,0,0,1,0,0|3,0,0]=4 5862 B17R1.11 CCCCCCCCCCN1CC=C(CC1)C 34a_100000693516_100000210320 [0,0,0,1,0,0|3,0,0]=4 5863 B17R1.11 CCCCCCCCCCN1CCS(=O)CC1 2230a_100000752083_100000210320 [0,0,0,1,0,0|3,0,0]=4 5864 B17R1.11 CCCCCCCCCCN1CCS(=O)CC1 269982a_100000752083_100000210320 [0,0,0,1,0,0|3,0,0]=4 5865 B17R1.11 CCCCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100011214924 [0,0,0,1,0,0|2,0,0]=3 5866 B17R1.11 CCCCCCCCCNC1CCC(=O)NC1 34a_100000748762_100011214924 [0,0,0,1,0,0|2,0,0]=3 5867 B17R1.11 CCCCCCCCCOC1CCC(=O)CC1 34a_100000764474_100011214924 [0,0,0,1,0,0|2,0,0]=3 5868 B17R1.11 CCCCCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210328 [0,0,0,1,0,0|2,0,0]=3 5869 B17R1.11 CCCCCCCCCOC1CCC(=O)NC1 34a_100000079199_100011214924 [0,0,0,1,0,0|2,0,0]=3 5870 B17R1.11 CCCCCCCCCOC1CNC(=O)NC1 34a_100000080929_100011214924 [0,0,0,1,0,0|3,0,0]=4 5871 B17R1.11 CCCCCCCCOCC1CCC(=O)CC1 34a_100000062911_100000210759 [0,0,0,1,0,0|2,0,0]=3 5872 B17R1.11 COCCCCCCOCC1CCC(=O)CC1 34a_100000062911_100011998445 [0,0,0,1,0,0|3,0,0]=4 5873 B17R1.11 O=C1CCC(CC1)COCCCCCCCO 34a_100000062911_100000760002 [0,0,0,1,0,0|3,0,0]=4 5874 B17R1.11 O=C1CCC(CC1)OCCCCCCCCO 34a_100000764474_100000033203 [0,0,0,1,0,0|3,0,0]=4 5875 B17R1.11 O=C1CCC(CC1)OCCCCCCCCO 7a_100000764474_100000033203 [0,0,0,1,0,0|3,0,0]=4 5876 B17R1.11 O=C1CCC(CN1)NCCCCCCCCO 2230a_100000748762_100000033203 [0,0,0,1,0,0|3,0,0]=4 5877 B17R1.11 O=C1CCC(CN1)NCCCCCCCCO 34a_100000748762_100000033203 [0,0,0,1,0,0|3,0,0]=4 5878 B17R1.11 O=C1CCC(CN1)OCCCCCCCCO 34a_100000079199_100000033203 [0,0,0,1,0,0|3,0,0]=4 5879 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100011214924 [0,0,0,1,0,0|3,0,0]=4 5880 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210670 [0,0,0,1,0,0|3,0,0]=4 5881 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 34a_100000750721_100011214924 [0,0,0,1,0,0|3,0,0]=4 5882 B17R1.23 CCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210681 [0,0,0,1,0,0|2,0,0]=3 5883 B17R1.23 CCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210614 [0,0,0,1,0,0|2,0,0]=3 5884 B17R1.23 CCCCOCCNCC1CCCC(=O)N1C 2230a_200010383782_100000743108 [0,0,0,1,0,0|3,0,0]=4 5885 B17R1.23 CCCCOCCNCC1CCCC(=O)N1C 34a_200010383782_100000743108 [0,0,0,1,0,0|3,0,0]=4 5886 B17R1.23 CN1C(=O)CCCC1CNCCCCCCF 2230a_200010383782_100015922095 [0,0,0,1,0,0|3,0,0]=4 5887 B17R1.23 CN1C(=O)CCCC1CNCCCCCCF 34a_200010383782_100015922095 [0,0,0,1,0,0|3,0,0]=4 5888 B17R1.23 CN1C(=O)CCCC1CNCCCCCCO 2230a_200010383782_100000766143 [0,0,0,1,0,0|3,0,0]=4 5889 B17R1.23 CN1C(=O)CCCC1CNCCCCCCO 34a_200010383782_100000766143 [0,0,0,1,0,0|3,0,0]=4 5890 B17R1.323 CCCCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210314 [0,0,0,1,0,0|2,0,0]=3 5891 B17R1.323 CCCCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210314 [0,0,0,1,0,0|2,0,0]=3 5892 B17R1.323 CCCCOCN1CCOCC1CC(=O)OC 2230a_100000731486_100011995733 [0,0,0,1,0,0|3,0,0]=4 5893 B17R1.323 CCCCOCN1CCOCC1CC(=O)OC 34a_100000731486_100011995733 [0,0,0,1,0,0|3,0,0]=4 5894 B17R1.323 CCCOCCN1CCOCC1CC(=O)OC 2230a_100000731486_100011215938 [0,0,0,1,0,0|3,0,0]=4 5895 B17R1.323 CCCOCCN1CCOCC1CC(=O)OC 34a_100000731486_100011215938 [0,0,0,1,0,0|3,0,0]=4 5896 B17R1.323 CCOCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100012232248 [0,0,0,1,0,0|3,0,0]=4 5897 B17R1.323 CCOCCCN1CCOCC1CC(=O)OC 34a_100000731486_100012232248 [0,0,0,1,0,0|3,0,0]=4 5898 B17R1.323 COC(=O)CC1COCCN1CCCCCF 2230a_100000731486_100000729378 [0,0,0,1,0,0|3,0,0]=4 5899 B17R1.323 COC(=O)CC1COCCN1CCCCCF 34a_100000731486_100000729378 [0,0,0,1,0,0|3,0,0]=4 5900 B17R1.323 COC(=O)CC1COCCN1CCCCCO 2230a_100000731486_100000746330 [0,0,0,1,0,0|3,0,0]=4 5901 B17R1.323 COC(=O)CC1COCCN1CCCCCO 34a_100000731486_100000746330 [0,0,0,1,0,0|3,0,0]=4 5902 B17R1.323 COCCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000730899 [0,0,0,1,0,0|3,0,0]=4 5903 B17R1.323 COCCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000755781 [0,0,0,1,0,0|3,0,0]=4 5904 B17R1.347 CCCC1CCCCC1NCCCC(=O)NC 269862a_100000740002_100011218038 [0,0,0,1,0,0|2,0,0]=3 5905 B17R1.347 CCCC1CCCCC1NCCCC(=O)NC 270004a_100000740002_100011218038 [0,0,0,1,0,0|2,0,0]=3 5906 B17R1.347 CCCC1CCCCC1NCCNC(=O)CC 269862a_100132302217_100011218038 [0,0,0,1,0,0|3,0,0]=4 5907 B17R1.347 CCCC1CCCCC1NCCNC(=O)CC 270004a_100132302217_100011218038 [0,0,0,1,0,0|3,0,0]=4 5908 B17R1.347 CCCC1CCCCC1NCCNC(=O)NC 269862a_100015205895_100011218038 [0,0,0,1,0,0|3,0,0]=4 5909 B17R1.347 CCCC1CCCCC1OC/C=C/C(=O)OC 34a_100011217265_100000742655 [0,0,0,1,0,0|1,0,2]=4 5910 B17R1.347 CCCC1CCCCC1OC/C=C/C(=O)OC 7a_100011217265_100000742655 [0,0,0,1,0,0|1,0,2]=4 5911 B17R1.347 CCCC1CCCCC1OCCCC(=O)NC 34a_100011217265_100000741757 [0,0,0,1,0,0|2,0,0]=3 5912 B17R1.347 CCCC1CCCCC1OCCCC(=O)NC 7a_100011217265_100000741757 [0,0,0,1,0,0|2,0,0]=3 5913 B17R1.347 CCCC1CCCCC1OCCCC(=O)OC 34a_100011217265_100000742333 [0,0,0,1,0,0|1,0,0]=2 5914 B17R1.347 CCCC1CCCCC1OCCCC(=O)OC 7a_100011217265_100011218270 [0,0,0,1,0,0|1,0,0]=2 5915 B17R1.347 CCCC1CCCCC1OCCOC(=O)NC 34a_100011217265_200011997002 [0,0,0,1,0,0|3,0,0]=4 5916 B17R1.347 CCCC1CCCCC1OCCOC(=O)NC 7a_100011217265_200011997002 [0,0,0,1,0,0|3,0,0]=4 5917 B17R1.347 CCCC1CCCCN1CCCCC(=O)OC 2230a_100000701414_100000204269 [0,0,0,1,0,0|1,0,0]=2 5918 B17R1.347 CCCC1CCCCN1CCCCC(=O)OC 269982a_100000701414_100000204269 [0,0,0,1,0,0|1,0,0]=2 5919 B17R1.347 CCCC1CCCCN1CCCCC(=O)OC 34a_100000701414_100000204269 [0,0,0,1,0,0|1,0,0]=2 5920 B17R1.347 CCCC1CCCCN1CCOCC(=O)OC 2230a_100000701414_100000090808 [0,0,0,1,0,0|2,0,0]=3 5921 B17R1.347 CCCC1CCCCN1CCOCC(=O)OC 34a_100000701414_100000090808 [0,0,0,1,0,0|2,0,0]=3 5922 B17R1.347 CCCC1COCCN1CCCCC(=O)OC 2230a_102495339903_100000204269 [0,0,0,1,0,0|2,0,0]=3 5923 B17R1.347 CCCC1COCCN1CCCCC(=O)OC 269982a_102495339903_100000204269 [0,0,0,1,0,0|2,0,0]=3 5924 B17R1.347 CCCC1COCCN1CCCCC(=O)OC 34a_102495339903_100000204269 [0,0,0,1,0,0|2,0,0]=3 5925 B17R1.347 CCCC1COCCN1CCOCC(=O)OC 2230a_102495339903_100000090808 [0,0,0,1,0,0|3,0,0]=4 5926 B17R1.347 CCCC1COCCN1CCOCC(=O)OC 34a_102495339903_100000090808 [0,0,0,1,0,0|3,0,0]=4 5927 B17R1.347 CCOC1CCCCC1NCCCC(=O)NC 270004a_100000740002_200000031474 [0,0,0,1,0,0|3,0,0]=4 5928 B17R1.347 COC(=O)CCCCN1CCCCC1CC#N 2230a_100000133382_100000204269 [0,0,0,1,0,0|2,0,1]=4 5929 B17R1.347 COC(=O)CCCCN1CCCCC1CC#N 34a_100000133382_100000204269 [0,0,0,1,0,0|2,0,1]=4 5930 B17R1.347 COC(=O)CCCCN1CCCCC1CCO 2230a_100000211664_100000204269 [0,0,0,1,0,0|2,0,0]=3 5931 B17R1.347 COC(=O)CCCCN1CCCCC1CCO 269982a_100000211664_100000204269 [0,0,0,1,0,0|2,0,0]=3 5932 B17R1.347 COC(=O)CCCCN1CCCCC1CCO 34a_100000211664_100000204269 [0,0,0,1,0,0|2,0,0]=3 5933 B17R1.347 COC(=O)CCOCC1CCCCN1CCN 34a_100011473795_100000742370 [0,0,0,1,0,0|3,0,0]=4 5934 B17R1.347 COC(=O)COCCN1CCCCC1CCO 2230a_100000211664_100000090808 [0,0,0,1,0,0|3,0,0]=4 5935 B17R1.347 COC(=O)COCCN1CCCCC1CCO 34a_100000211664_100000090808 [0,0,0,1,0,0|3,0,0]=4 5936 B17R1.347 COCC1CCCCN1CCCCC(=O)OC 2230a_100015184032_100000204269 [0,0,0,1,0,0|2,0,0]=3 5937 B17R1.347 COCC1CCCCN1CCCCC(=O)OC 269982a_100015184032_100000204269 [0,0,0,1,0,0|2,0,0]=3 5938 B17R1.347 COCC1CCCCN1CCCCC(=O)OC 34a_100015184032_100000204269 [0,0,0,1,0,0|2,0,0]=3 5939 B17R1.347 COCC1CCCCN1CCOCC(=O)OC 2230a_100015184032_100000090808 [0,0,0,1,0,0|3,0,0]=4 5940 B17R1.347 COCC1CCCCN1CCOCC(=O)OC 34a_100015184032_100000090808 [0,0,0,1,0,0|3,0,0]=4 5941 B17R1.347 COC[C@H]1COCCN1CCCCC(=O)OC 2230a_100016989928_100000204269 [0,0,0,1,0,0|3,0,0]=4 5942 B17R1.347 COC[C@H]1COCCN1CCCCC(=O)OC 269982a_100016989928_100000204269 [0,0,0,1,0,0|3,0,0]=4 5943 B17R1.347 COC[C@H]1COCCN1CCCCC(=O)OC 34a_100016989928_100000204269 [0,0,0,1,0,0|3,0,0]=4 5944 B17R1.361 CCCN1CCCC1COCCCC(=O)NC 34a_200000694710_100000741757 [0,0,0,1,0,0|3,0,0]=4 5945 B17R1.361 CCCN1CCCC1COCCCC(=O)NC 7a_200000694710_100000741757 [0,0,0,1,0,0|3,0,0]=4 5946 B17R1.361 CCCN1CCCC1COCCCC(=O)OC 34a_200000694710_100000742333 [0,0,0,1,0,0|2,0,0]=3 5947 B17R1.361 CCCN1CCCC1COCCCC(=O)OC 7a_200000694710_100011218270 [0,0,0,1,0,0|2,0,0]=3 5948 B17R1.361 COC[C@@H]1CCCN1CCCCCC(=O)OC 2230a_100020646714_100009816466 [0,0,0,1,0,0|2,0,0]=3 5949 B17R1.361 COC[C@@H]1CCCN1CCCCCC(=O)OC 269982a_100020646714_100009816466 [0,0,0,1,0,0|2,0,0]=3 5950 B17R1.361 COC[C@@H]1CCCN1CCCCCC(=O)OC 34a_100020646714_100009816466 [0,0,0,1,0,0|2,0,0]=3 5951 B17R1.1158 CCC(=O)CCCCCCOC1CCCCO1 1458a_100000210414_100000033462 [0,0,0,1,0,0|3,0,0]=4 5952 B17R1.1158 CCC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000747405 [0,0,0,1,0,0|3,0,0]=4 5953 B17R1.1158 CCC(=O)NCCNCCCC1CCCCC1 34a_100132302217_100011713725 [0,0,0,1,0,0|3,0,0]=4 5954 B17R1.1158 CCC(=O)NCCOCCCC1CCCCC1 34a_200000158885_100011713725 [0,0,0,1,0,0|3,0,0]=4 5955 B17R1.1158 CCC(=O)NCCOCCCC1CCCCC1 7a_200000158885_100011713725 [0,0,0,1,0,0|3,0,0]=4 5956 B17R1.1158 CCC(=O)OCCOCCCC1CCCCC1 7a_200000031056_100011713725 [0,0,0,1,0,0|3,0,0]=4 5957 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 2230a_100000740002_100011713725 [0,0,0,1,0,0|2,0,0]=3 5958 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100000741757 [0,0,0,1,0,0|2,0,0]=3 5959 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 34a_100000740002_100011713725 [0,0,0,1,0,0|2,0,0]=3 5960 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100000741757 [0,0,0,1,0,0|2,0,0]=3 5961 B17R1.1158 CNC(=O)CCCNCCCN1CCCCC1 2230a_100000740002_100000690320 [0,0,0,1,0,0|3,0,0]=4 5962 B17R1.1158 CNC(=O)CCCNCCCN1CCCCC1 34a_100000740002_100000690320 [0,0,0,1,0,0|3,0,0]=4 5963 B17R1.1158 CNC(=O)CCCNCCOC1CCCCC1 2230a_100000740002_100011211530 [0,0,0,1,0,0|3,0,0]=4 5964 B17R1.1158 CNC(=O)CCCNCCOC1CCCCC1 34a_100000740002_100011211530 [0,0,0,1,0,0|3,0,0]=4 5965 B17R1.1158 CNC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100000741757 [0,0,0,1,0,0|3,0,0]=4 5966 B17R1.1158 CNC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100000741757 [0,0,0,1,0,0|2,0,0]=3 5967 B17R1.1158 CNC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100000741757 [0,0,0,1,0,0|2,0,0]=3 5968 B17R1.1158 CNC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100000741757 [0,0,0,1,0,0|3,0,0]=4 5969 B17R1.1158 CNC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100000741757 [0,0,0,1,0,0|3,0,0]=4 5970 B17R1.1158 CNC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100000741757 [0,0,0,1,0,0|3,0,0]=4 5971 B17R1.1158 CNC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100000741757 [0,0,0,1,0,0|3,0,0]=4 5972 B17R1.1158 CNC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100000741757 [0,0,0,1,0,0|3,0,0]=4 5973 B17R1.1158 CNC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100000741757 [0,0,0,1,0,0|3,0,0]=4 5974 B17R1.1158 CNC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100000741757 [0,0,0,1,0,0|3,0,0]=4 5975 B17R1.1158 CNC(=O)CCCSCCCC1CCCCC1 62a_100000741757_100011713725 [0,0,0,1,0,0|2,0,0]=3 5976 B17R1.1158 CNC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100000741757 [0,0,0,1,0,0|2,0,0]=3 5977 B17R1.1158 CNC(=O)CCCSCCCN1CCCCC1 62a_100000741757_100000007876 [0,0,0,1,0,0|3,0,0]=4 5978 B17R1.1158 CNC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100000741757 [0,0,0,1,0,0|3,0,0]=4 5979 B17R1.1158 CNC(=O)CCCSCCOC1CCCCC1 62a_100000741757_100011211530 [0,0,0,1,0,0|3,0,0]=4 5980 B17R1.1158 CNC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100000741757 [0,0,0,1,0,0|3,0,0]=4 5981 B17R1.1158 CNC(=O)CCNCCCOC1CCCCC1 34a_100000205933_100012179268 [0,0,0,1,0,0|3,0,0]=4 5982 B17R1.1158 CNC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100012179268 [0,0,0,1,0,0|2,0,0]=3 5983 B17R1.1158 CNC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737683 [0,0,0,1,0,0|2,0,0]=3 5984 B17R1.1158 CNC(=O)CCOCCCCC1CCNCC1 34a_100016989291_100012179268 [0,0,0,1,0,0|3,0,0]=4 5985 B17R1.1158 CNC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000183359 [0,0,0,1,0,0|3,0,0]=4 5986 B17R1.1158 CNC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000183359 [0,0,0,1,0,0|3,0,0]=4 5987 B17R1.1158 CNC(=O)NCCNCCCC1CCCCC1 34a_100015205895_100011713725 [0,0,0,1,0,0|3,0,0]=4 5988 B17R1.1158 CNC(=O)OCCNCCCC1CCCCC1 34a_100011211642_200011997002 [0,0,0,1,0,0|3,0,0]=4 5989 B17R1.1158 CNC(=O)OCCOCCCC1CCCCC1 34a_100000198086_200011997002 [0,0,0,1,0,0|3,0,0]=4 5990 B17R1.1158 CNC(=O)OCCOCCCC1CCCCC1 7a_100000198086_200011997002 [0,0,0,1,0,0|3,0,0]=4 5991 B17R1.1158 CNC(=O)OCCSCCCC1CCCCC1 62a_100011713725_200011997002 [0,0,0,1,0,0|3,0,0]=4 5992 B17R1.1158 CNC(=O)OCCSCCCC1CCCCC1 62a_200011997002_100011713725 [0,0,0,1,0,0|3,0,0]=4 5993 B17R1.1158 COC(=O)/C=C/CNCCCC1CCCCC1 2230a_100011211642_100000742655 [0,0,0,1,0,0|1,0,2]=4 5994 B17R1.1158 COC(=O)/C=C/CNCCCC1CCCCC1 34a_100011211642_100000742655 [0,0,0,1,0,0|1,0,2]=4 5995 B17R1.1158 COC(=O)/C=C/COCCCC1CCCCC1 34a_100000198086_100000742655 [0,0,0,1,0,0|1,0,2]=4 5996 B17R1.1158 COC(=O)/C=C/COCCCC1CCCCC1 7a_100000198086_100000742655 [0,0,0,1,0,0|1,0,2]=4 5997 B17R1.1158 COC(=O)/C=C/CSCCCC1CCCCC1 62a_100000742655_100011713725 [0,0,0,1,0,0|1,0,2]=4 5998 B17R1.1158 COC(=O)/C=C/CSCCCC1CCCCC1 62a_100011713725_100000742655 [0,0,0,1,0,0|1,0,2]=4 5999 B17R1.1158 COC(=O)CCCC=NNCC1CCCCC1 4a_100000740227_100000094087 [0,0,0,1,0,0|2,0,1]=4 6000 B17R1.1158 COC(=O)CCCCC=NNC1CCCCC1 4a_100000709804_100000052768 [0,0,0,1,0,0|2,0,1]=4 6001 B17R1.1158 COC(=O)CCCCCCCN1CC=CCC1 2230a_100000698166_100010004213 [0,0,0,1,0,0|1,0,2]=4 6002 B17R1.1158 COC(=O)CCCCCCCN1CC=CCC1 269982a_100000698166_100010004213 [0,0,0,1,0,0|1,0,2]=4 6003 B17R1.1158 COC(=O)CCCCCCCN1CC=CCC1 34a_100000698166_100010004213 [0,0,0,1,0,0|1,0,2]=4 6004 B17R1.1158 COC(=O)CCCCCCCN1CCCOC1 2230a_100000131196_100010004213 [0,0,0,1,0,0|2,0,0]=3 6005 B17R1.1158 COC(=O)CCCCCCCN1CCCOC1 269982a_100000131196_100010004213 [0,0,0,1,0,0|2,0,0]=3 6006 B17R1.1158 COC(=O)CCCCCCCN1CCCOC1 34a_100000131196_100010004213 [0,0,0,1,0,0|2,0,0]=3 6007 B17R1.1158 COC(=O)CCCCCCCN1CCOCC1 2230a_100015191051_100010004213 [0,0,0,1,0,0|2,0,0]=3 6008 B17R1.1158 COC(=O)CCCCCCCN1CCOCC1 269982a_100015191051_100010004213 [0,0,0,1,0,0|2,0,0]=3 6009 B17R1.1158 COC(=O)CCCCCCCN1CCOCC1 34a_100015191051_100010004213 [0,0,0,1,0,0|2,0,0]=3 6010 B17R1.1158 COC(=O)CCCCCCCN1CCSCC1 2230a_100000737611_100010004213 [0,0,0,1,0,0|2,0,0]=3 6011 B17R1.1158 COC(=O)CCCCCCCN1CCSCC1 269982a_100000737611_100010004213 [0,0,0,1,0,0|2,0,0]=3 6012 B17R1.1158 COC(=O)CCCCCCNC1CCCCC1 2230a_100000182618_100009815986 [0,0,0,1,0,0|1,0,0]=2 6013 B17R1.1158 COC(=O)CCCCCCNC1CCCCC1 34a_100000182618_100009815986 [0,0,0,1,0,0|1,0,0]=2 6014 B17R1.1158 COC(=O)CCCCCCNC1CCCOC1 2230a_100000719290_100009815986 [0,0,0,1,0,0|2,0,0]=3 6015 B17R1.1158 COC(=O)CCCCCCNC1CCCOC1 34a_100000719290_100009815986 [0,0,0,1,0,0|2,0,0]=3 6016 B17R1.1158 COC(=O)CCCCCCNC1CCOCC1 2230a_100000741149_100009815986 [0,0,0,1,0,0|2,0,0]=3 6017 B17R1.1158 COC(=O)CCCCCCNC1CCOCC1 34a_100000741149_100009815986 [0,0,0,1,0,0|2,0,0]=3 6018 B17R1.1158 COC(=O)CCCCCCNC1CCSCC1 2230a_100000748639_100009815986 [0,0,0,1,0,0|2,0,0]=3 6019 B17R1.1158 COC(=O)CCCCCCNC1CCSCC1 34a_100000748639_100009815986 [0,0,0,1,0,0|2,0,0]=3 6020 B17R1.1158 COC(=O)CCCCCCOC1C=CCCC1 34a_100011215024_100009815986 [0,0,0,1,0,0|1,0,2]=4 6021 B17R1.1158 COC(=O)CCCCCCOC1C=CCCC1 7a_100009863599_100000751183 [0,0,0,1,0,0|1,0,2]=4 6022 B17R1.1158 COC(=O)CCCCCCOC1CC=CCC1 34a_100000073881_100009815986 [0,0,0,1,0,0|1,0,2]=4 6023 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 34a_100000210231_100009815986 [0,0,0,1,0,0|1,0,0]=2 6024 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 34a_100009863599_100000210327 [0,0,0,1,0,0|1,0,0]=2 6025 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 7a_100000210231_100009815986 [0,0,0,1,0,0|1,0,0]=2 6026 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 7a_100009863599_100000210327 [0,0,0,1,0,0|1,0,0]=2 6027 B17R1.1158 COC(=O)CCCCCCOC1CCCCO1 34a_100000033831_100009815986 [0,0,0,1,0,0|2,0,0]=3 6028 B17R1.1158 COC(=O)CCCCCCOC1CCCOC1 34a_100000754041_100009815986 [0,0,0,1,0,0|2,0,0]=3 6029 B17R1.1158 COC(=O)CCCCCCOC1CCCOC1 34a_100009863599_100000693364 [0,0,0,1,0,0|2,0,0]=3 6030 B17R1.1158 COC(=O)CCCCCCOC1CCCOC1 7a_100009863599_100000693364 [0,0,0,1,0,0|2,0,0]=3 6031 B17R1.1158 COC(=O)CCCCCCOC1CCCSC1 7a_100015962668_100009815986 [0,0,0,1,0,0|2,0,0]=3 6032 B17R1.1158 COC(=O)CCCCCCOC1CCOCC1 34a_100000744328_100009815986 [0,0,0,1,0,0|2,0,0]=3 6033 B17R1.1158 COC(=O)CCCCCCOC1CCOCC1 7a_100009863599_100000686592 [0,0,0,1,0,0|2,0,0]=3 6034 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 34a_100000731022_100009815986 [0,0,0,1,0,0|2,0,0]=3 6035 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 34a_100009863599_100000069128 [0,0,0,1,0,0|2,0,0]=3 6036 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 7a_100000731022_100009815986 [0,0,0,1,0,0|2,0,0]=3 6037 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 7a_100009863599_100011500858 [0,0,0,1,0,0|2,0,0]=3 6038 B17R1.1158 COC(=O)CCCCCCSC1C=CCCC1 62a_100000751183_100009815986 [0,0,0,1,0,0|1,0,2]=4 6039 B17R1.1158 COC(=O)CCCCCCSC1C=CCCC1 62a_100009815986_100000751183 [0,0,0,1,0,0|1,0,2]=4 6040 B17R1.1158 COC(=O)CCCCCCSC1CCCCC1 62a_100000210327_100009815986 [0,0,0,1,0,0|1,0,0]=2 6041 B17R1.1158 COC(=O)CCCCCCSC1CCCCC1 62a_100009815986_100000210327 [0,0,0,1,0,0|1,0,0]=2 6042 B17R1.1158 COC(=O)CCCCCCSC1CCCOC1 62a_100009815986_100000693364 [0,0,0,1,0,0|2,0,0]=3 6043 B17R1.1158 COC(=O)CCCCCCSC1CCOCC1 62a_100009815986_100011324220 [0,0,0,1,0,0|2,0,0]=3 6044 B17R1.1158 COC(=O)CCCCCCSC1CCSCC1 62a_100009815986_100000069128 [0,0,0,1,0,0|2,0,0]=3 6045 B17R1.1158 COC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_100009816466 [0,0,0,1,0,0|1,0,0]=2 6046 B17R1.1158 COC(=O)CCCCCNCC1CCCCC1 34a_100000210473_100009816466 [0,0,0,1,0,0|1,0,0]=2 6047 B17R1.1158 COC(=O)CCCCCNCC1CCCCO1 2230a_100000174945_100009816466 [0,0,0,1,0,0|2,0,0]=3 6048 B17R1.1158 COC(=O)CCCCCNCC1CCCCO1 34a_100000174945_100009816466 [0,0,0,1,0,0|2,0,0]=3 6049 B17R1.1158 COC(=O)CCCCCNCC1CCCOC1 2230a_100000720124_100009816466 [0,0,0,1,0,0|2,0,0]=3 6050 B17R1.1158 COC(=O)CCCCCNCC1CCCOC1 34a_100000720124_100009816466 [0,0,0,1,0,0|2,0,0]=3 6051 B17R1.1158 COC(=O)CCCCCNCC1CCOCC1 2230a_100000746373_100009816466 [0,0,0,1,0,0|2,0,0]=3 6052 B17R1.1158 COC(=O)CCCCCNCC1CCOCC1 34a_100000746373_100009816466 [0,0,0,1,0,0|2,0,0]=3 6053 B17R1.1158 COC(=O)CCCCCNCC1CCSCC1 2230a_100015188806_100009816466 [0,0,0,1,0,0|2,0,0]=3 6054 B17R1.1158 COC(=O)CCCCCNCC1CCSCC1 34a_100015188806_100009816466 [0,0,0,1,0,0|2,0,0]=3 6055 B17R1.1158 COC(=O)CCCCCNC[C@H]1COCCO1 2230a_100010981119_100009816466 [0,0,0,1,0,0|3,0,0]=4 6056 B17R1.1158 COC(=O)CCCCCNC[C@H]1COCCO1 34a_100010981119_100009816466 [0,0,0,1,0,0|3,0,0]=4 6057 B17R1.1158 COC(=O)CCCCCOCC1CC=CCC1 34a_100000210713_100009816466 [0,0,0,1,0,0|1,0,2]=4 6058 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 34a_100000074720_100000211423 [0,0,0,1,0,0|1,0,0]=2 6059 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 34a_100000212181_100009816466 [0,0,0,1,0,0|1,0,0]=2 6060 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 7a_100000074720_100000211423 [0,0,0,1,0,0|1,0,0]=2 6061 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 7a_100000212181_100009816466 [0,0,0,1,0,0|1,0,0]=2 6062 B17R1.1158 COC(=O)CCCCCOCC1CCCCN1 34a_100000210821_100009816466 [0,0,0,1,0,0|2,0,0]=3 6063 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 34a_100000074720_100000211543 [0,0,0,1,0,0|2,0,0]=3 6064 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 34a_100000211370_100009816466 [0,0,0,1,0,0|2,0,0]=3 6065 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 7a_100000074720_100000211543 [0,0,0,1,0,0|2,0,0]=3 6066 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 7a_100000211370_100009816466 [0,0,0,1,0,0|2,0,0]=3 6067 B17R1.1158 COC(=O)CCCCCOCC1CCCNC1 34a_100000211344_100009816466 [0,0,0,1,0,0|2,0,0]=3 6068 B17R1.1158 COC(=O)CCCCCOCC1CCCOC1 34a_100000074720_100000741521 [0,0,0,1,0,0|2,0,0]=3 6069 B17R1.1158 COC(=O)CCCCCOCC1CCCOC1 34a_100000741520_100009816466 [0,0,0,1,0,0|2,0,0]=3 6070 B17R1.1158 COC(=O)CCCCCOCC1CCCOC1 7a_100000074720_100000741521 [0,0,0,1,0,0|2,0,0]=3 6071 B17R1.1158 COC(=O)CCCCCOCC1CCNCC1 34a_100000738675_100009816466 [0,0,0,1,0,0|2,0,0]=3 6072 B17R1.1158 COC(=O)CCCCCOCC1CCOCC1 34a_100000074720_100000754603 [0,0,0,1,0,0|2,0,0]=3 6073 B17R1.1158 COC(=O)CCCCCOCC1CCOCC1 34a_100000749013_100009816466 [0,0,0,1,0,0|2,0,0]=3 6074 B17R1.1158 COC(=O)CCCCCOCC1CCOCC1 7a_100000074720_100000754603 [0,0,0,1,0,0|2,0,0]=3 6075 B17R1.1158 COC(=O)CCCCCOCC1CCSCC1 34a_100000070558_100009816466 [0,0,0,1,0,0|2,0,0]=3 6076 B17R1.1158 COC(=O)CCCCCOCC1CCSCC1 7a_100000070558_100009816466 [0,0,0,1,0,0|2,0,0]=3 6077 B17R1.1158 COC(=O)CCCCCOC[C@@H]1CNCCO1 34a_100015189573_100009816466 [0,0,0,1,0,0|3,0,0]=4 6078 B17R1.1158 COC(=O)CCCCCOC[C@@H]1COCCN1 34a_100000717676_100009816466 [0,0,0,1,0,0|3,0,0]=4 6079 B17R1.1158 COC(=O)CCCCCOC[C@H]1COCCO1 34a_100009875890_100009816466 [0,0,0,1,0,0|3,0,0]=4 6080 B17R1.1158 COC(=O)CCCCCSCC1CCCCC1 62a_100000211423_100009816466 [0,0,0,1,0,0|1,0,0]=2 6081 B17R1.1158 COC(=O)CCCCCSCC1CCCCC1 62a_100009816466_100000211423 [0,0,0,1,0,0|1,0,0]=2 6082 B17R1.1158 COC(=O)CCCCCSCC1CCCCO1 62a_100000211543_100009816466 [0,0,0,1,0,0|2,0,0]=3 6083 B17R1.1158 COC(=O)CCCCCSCC1CCCCO1 62a_100009816466_100000211543 [0,0,0,1,0,0|2,0,0]=3 6084 B17R1.1158 COC(=O)CCCCCSCC1CCCOC1 62a_100000741521_100009816466 [0,0,0,1,0,0|2,0,0]=3 6085 B17R1.1158 COC(=O)CCCCCSCC1CCCOC1 62a_100009816466_100000741521 [0,0,0,1,0,0|2,0,0]=3 6086 B17R1.1158 COC(=O)CCCCCSCC1CCOCC1 62a_100000754603_100009816466 [0,0,0,1,0,0|2,0,0]=3 6087 B17R1.1158 COC(=O)CCCCCSCC1CCOCC1 62a_100009816466_100000749018 [0,0,0,1,0,0|2,0,0]=3 6088 B17R1.1158 COC(=O)CCCCNCCC1=CCCCC1 2230a_100000212019_100000204269 [0,0,0,1,0,0|1,0,2]=4 6089 B17R1.1158 COC(=O)CCCCNCCC1=CCCCC1 34a_100000212019_100000204269 [0,0,0,1,0,0|1,0,2]=4 6090 B17R1.1158 COC(=O)CCCCNCCC1CCCCC1 2230a_100000738074_100000204269 [0,0,0,1,0,0|1,0,0]=2 6091 B17R1.1158 COC(=O)CCCCNCCC1CCCCC1 34a_100000738074_100000204269 [0,0,0,1,0,0|1,0,0]=2 6092 B17R1.1158 COC(=O)CCCCNCCC1CCCCO1 2230a_100015183643_100000204269 [0,0,0,1,0,0|2,0,0]=3 6093 B17R1.1158 COC(=O)CCCCNCCC1CCCCO1 34a_100015183643_100000204269 [0,0,0,1,0,0|2,0,0]=3 6094 B17R1.1158 COC(=O)CCCCNCCC1CCOCC1 2230a_100000755988_100000204269 [0,0,0,1,0,0|2,0,0]=3 6095 B17R1.1158 COC(=O)CCCCNCCC1CCOCC1 34a_100000755988_100000204269 [0,0,0,1,0,0|2,0,0]=3 6096 B17R1.1158 COC(=O)CCCCNCCN1CCSCC1 2230a_100000755026_100000204269 [0,0,0,1,0,0|3,0,0]=4 6097 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 34a_100000059025_100011209188 [0,0,0,1,0,0|1,0,0]=2 6098 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 34a_100011217863_100000204269 [0,0,0,1,0,0|1,0,0]=2 6099 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 7a_100000059025_100011273959 [0,0,0,1,0,0|1,0,0]=2 6100 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000204269 [0,0,0,1,0,0|1,0,0]=2 6101 B17R1.1158 COC(=O)CCCCOCCC1CCCCN1 34a_100000211664_100000204269 [0,0,0,1,0,0|2,0,0]=3 6102 B17R1.1158 COC(=O)CCCCOCCC1CCCNC1 34a_100000752241_100000204269 [0,0,0,1,0,0|2,0,0]=3 6103 B17R1.1158 COC(=O)CCCCOCCC1CCNCC1 34a_100015190746_100000204269 [0,0,0,1,0,0|2,0,0]=3 6104 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 34a_100000059025_100011934994 [0,0,0,1,0,0|2,0,0]=3 6105 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 34a_100011933979_100000204269 [0,0,0,1,0,0|2,0,0]=3 6106 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 7a_100000059025_100011934994 [0,0,0,1,0,0|2,0,0]=3 6107 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 7a_100011933979_100000204269 [0,0,0,1,0,0|2,0,0]=3 6108 B17R1.1158 COC(=O)CCCCOCCC1OCCCO1 34a_100000059025_100000764188 [0,0,0,1,0,0|3,0,0]=4 6109 B17R1.1158 COC(=O)CCCCOCCC1OCCCO1 7a_100000059025_100000764188 [0,0,0,1,0,0|3,0,0]=4 6110 B17R1.1158 COC(=O)CCCCOCCC1SCCCS1 34a_200011025297_100000204269 [0,0,0,1,0,0|3,0,0]=4 6111 B17R1.1158 COC(=O)CCCCOCCC1SCCCS1 7a_200011025297_100000204269 [0,0,0,1,0,0|3,0,0]=4 6112 B17R1.1158 COC(=O)CCCCOCCN1CCCCC1 34a_100000059025_100000739454 [0,0,0,1,0,0|2,0,0]=3 6113 B17R1.1158 COC(=O)CCCCOCCN1CCCCC1 7a_100000059025_100000739454 [0,0,0,1,0,0|2,0,0]=3 6114 B17R1.1158 COC(=O)CCCCOCCN1CCOCC1 7a_100000059025_100000211760 [0,0,0,1,0,0|3,0,0]=4 6115 B17R1.1158 COC(=O)CCCCOCCN1CCSCC1 7a_100000686052_100000204269 [0,0,0,1,0,0|3,0,0]=4 6116 B17R1.1158 COC(=O)CCCCOCC[C@@H]1CNCCN1 34a_100016989929_100000204269 [0,0,0,1,0,0|3,0,0]=4 6117 B17R1.1158 COC(=O)CCCCOCOC1CCCCC1 34a_100000059025_100011935260 [0,0,0,1,0,0|2,0,0]=3 6118 B17R1.1158 COC(=O)CCCCOCOC1CCCCC1 7a_100000059025_100011935260 [0,0,0,1,0,0|2,0,0]=3 6119 B17R1.1158 COC(=O)CCCCSCCC1CCCCC1 62a_100000204269_100012355289 [0,0,0,1,0,0|1,0,0]=2 6120 B17R1.1158 COC(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000204269 [0,0,0,1,0,0|1,0,0]=2 6121 B17R1.1158 COC(=O)CCCCSCCC1CCOCC1 62a_100000204269_100011934994 [0,0,0,1,0,0|2,0,0]=3 6122 B17R1.1158 COC(=O)CCCCSCCC1CCOCC1 62a_100011934994_100000204269 [0,0,0,1,0,0|2,0,0]=3 6123 B17R1.1158 COC(=O)CCCCSCCC1OCCCO1 62a_100000204269_100000764188 [0,0,0,1,0,0|3,0,0]=4 6124 B17R1.1158 COC(=O)CCCCSCCC1OCCCO1 62a_100000764188_100000204269 [0,0,0,1,0,0|3,0,0]=4 6125 B17R1.1158 COC(=O)CCCCSCCN1CCCCC1 62a_100000204269_100000739454 [0,0,0,1,0,0|2,0,0]=3 6126 B17R1.1158 COC(=O)CCCCSCCN1CCCCC1 62a_100000739454_100000204269 [0,0,0,1,0,0|2,0,0]=3 6127 B17R1.1158 COC(=O)CCCCSCCN1CCOCC1 62a_100000204269_100000211760 [0,0,0,1,0,0|3,0,0]=4 6128 B17R1.1158 COC(=O)CCCCSCOC1CCCCC1 62a_100000204269_100011935260 [0,0,0,1,0,0|2,0,0]=3 6129 B17R1.1158 COC(=O)CCCCSCOC1CCCCC1 62a_100011935260_100000204269 [0,0,0,1,0,0|2,0,0]=3 6130 B17R1.1158 COC(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100011218270 [0,0,0,1,0,0|1,0,0]=2 6131 B17R1.1158 COC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100000742333 [0,0,0,1,0,0|1,0,0]=2 6132 B17R1.1158 COC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100000742333 [0,0,0,1,0,0|2,0,0]=3 6133 B17R1.1158 COC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100000742333 [0,0,0,1,0,0|1,0,0]=2 6134 B17R1.1158 COC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100011218270 [0,0,0,1,0,0|1,0,0]=2 6135 B17R1.1158 COC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100000742333 [0,0,0,1,0,0|2,0,0]=3 6136 B17R1.1158 COC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100000742333 [0,0,0,1,0,0|2,0,0]=3 6137 B17R1.1158 COC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100000742333 [0,0,0,1,0,0|2,0,0]=3 6138 B17R1.1158 COC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100000742333 [0,0,0,1,0,0|2,0,0]=3 6139 B17R1.1158 COC(=O)CCCOCCCN1CCOCC1 34a_100000212840_100000742333 [0,0,0,1,0,0|3,0,0]=4 6140 B17R1.1158 COC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100000742333 [0,0,0,1,0,0|2,0,0]=3 6141 B17R1.1158 COC(=O)CCCOCCNC1CCOCC1 34a_100000708129_100000742333 [0,0,0,1,0,0|3,0,0]=4 6142 B17R1.1158 COC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100000742333 [0,0,0,1,0,0|2,0,0]=3 6143 B17R1.1158 COC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100011218270 [0,0,0,1,0,0|2,0,0]=3 6144 B17R1.1158 COC(=O)CCCOCCOC1CCCCO1 34a_100000034223_100000742333 [0,0,0,1,0,0|3,0,0]=4 6145 B17R1.1158 COC(=O)CCCOCCOC1CCCCO1 7a_100000034223_100011218270 [0,0,0,1,0,0|3,0,0]=4 6146 B17R1.1158 COC(=O)CCCSCCCC1CCCCC1 62a_100011218270_100011713725 [0,0,0,1,0,0|1,0,0]=2 6147 B17R1.1158 COC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100011218270 [0,0,0,1,0,0|1,0,0]=2 6148 B17R1.1158 COC(=O)CCCSCCCN1CCCCC1 62a_100011218270_100000007876 [0,0,0,1,0,0|2,0,0]=3 6149 B17R1.1158 COC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100011218270 [0,0,0,1,0,0|2,0,0]=3 6150 B17R1.1158 COC(=O)CCCSCCCN1CCOCC1 62a_100011218270_100000748698 [0,0,0,1,0,0|3,0,0]=4 6151 B17R1.1158 COC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100011218270 [0,0,0,1,0,0|2,0,0]=3 6152 B17R1.1158 COC(=O)CCCSCCOC1CCCCC1 62a_100011218270_100011211530 [0,0,0,1,0,0|2,0,0]=3 6153 B17R1.1158 COC(=O)CCCSCCOC1CCCCO1 62a_100000744793_100011218270 [0,0,0,1,0,0|3,0,0]=4 6154 B17R1.1158 COC(=O)CCCSCCOC1CCCCO1 62a_100011218270_100000744793 [0,0,0,1,0,0|3,0,0]=4 6155 B17R1.1158 COC(=O)CCNCCCOC1CCCCC1 34a_100000205933_100000742370 [0,0,0,1,0,0|2,0,0]=3 6156 B17R1.1158 COC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100000742370 [0,0,0,1,0,0|1,0,0]=2 6157 B17R1.1158 COC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000204255 [0,0,0,1,0,0|1,0,0]=2 6158 B17R1.1158 COC(=O)CCOCCCCC1CCNCC1 34a_100016989291_100000742370 [0,0,0,1,0,0|2,0,0]=3 6159 B17R1.1158 COC(=O)CCOCCCCN1CCOCC1 34a_100000723369_100000742370 [0,0,0,1,0,0|3,0,0]=4 6160 B17R1.1158 COC(=O)CCSCCCOC1CCCCO1 62a_100000204255_100000700653 [0,0,0,1,0,0|3,0,0]=4 6161 B17R1.1158 COC(=O)CCSCCCOC1CCCCO1 62a_100000700653_100000204255 [0,0,0,1,0,0|3,0,0]=4 6162 B17R1.1158 COC(=O)CNCCCCCN1CCOCC1 2230a_100015187005_100000747449 [0,0,0,1,0,0|3,0,0]=4 6163 B17R1.1158 COC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000747449 [0,0,0,1,0,0|2,0,0]=3 6164 B17R1.1158 COC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000747449 [0,0,0,1,0,0|2,0,0]=3 6165 B17R1.1158 COC(=O)COCCNCCC1CCCCC1 2230a_100000738074_100000090808 [0,0,0,1,0,0|2,0,0]=3 6166 B17R1.1158 COC(=O)COCCNCCC1CCCCC1 34a_100000738074_100000090808 [0,0,0,1,0,0|2,0,0]=3 6167 B17R1.1158 COC(=O)COCCNCCC1CCCCO1 2230a_100015183643_100000090808 [0,0,0,1,0,0|3,0,0]=4 6168 B17R1.1158 COC(=O)COCCNCCC1CCCCO1 34a_100015183643_100000090808 [0,0,0,1,0,0|3,0,0]=4 6169 B17R1.1158 COC(=O)COCCNCCC1CCOCC1 2230a_100000755988_100000090808 [0,0,0,1,0,0|3,0,0]=4 6170 B17R1.1158 COC(=O)COCCNCCC1CCOCC1 34a_100000755988_100000090808 [0,0,0,1,0,0|3,0,0]=4 6171 B17R1.1158 COC(=O)COCCOCCC1CCCCC1 34a_100011217863_100000090808 [0,0,0,1,0,0|2,0,0]=3 6172 B17R1.1158 COC(=O)COCCOCCC1CCCCC1 7a_100011217863_100000090808 [0,0,0,1,0,0|2,0,0]=3 6173 B17R1.1158 COC(=O)COCCOCCC1CCCCN1 34a_100000211664_100000090808 [0,0,0,1,0,0|3,0,0]=4 6174 B17R1.1158 COC(=O)COCCOCCC1CCCNC1 34a_100000752241_100000090808 [0,0,0,1,0,0|3,0,0]=4 6175 B17R1.1158 COC(=O)COCCOCCC1CCNCC1 34a_100015190746_100000090808 [0,0,0,1,0,0|3,0,0]=4 6176 B17R1.1158 COC(=O)COCCOCCC1CCOCC1 34a_100011933979_100000090808 [0,0,0,1,0,0|3,0,0]=4 6177 B17R1.1158 COC(=O)COCCOCCC1CCOCC1 7a_100011933979_100000090808 [0,0,0,1,0,0|3,0,0]=4 6178 B17R1.1158 COC(=O)COCCOCCN1CCCCC1 34a_200011409831_100000747449 [0,0,0,1,0,0|3,0,0]=4 6179 B17R1.1158 COC(=O)COCCOCCN1CCCCC1 7a_200011409831_100000747449 [0,0,0,1,0,0|3,0,0]=4 6180 B17R1.1158 COC(=O)COCCSCCC1CCCCC1 62a_100000090808_100012355289 [0,0,0,1,0,0|2,0,0]=3 6181 B17R1.1158 COC(=O)COCCSCCC1CCCCC1 62a_100012355289_100000090808 [0,0,0,1,0,0|2,0,0]=3 6182 B17R1.1158 COC(=O)COCCSCCC1CCOCC1 62a_100000090808_100011934994 [0,0,0,1,0,0|3,0,0]=4 6183 B17R1.1158 COC(=O)COCCSCCC1CCOCC1 62a_100011934994_100000090808 [0,0,0,1,0,0|3,0,0]=4 6184 B17R1.1158 COC(=O)COCCSCCN1CCCCC1 62a_100000090808_100000739454 [0,0,0,1,0,0|3,0,0]=4 6185 B17R1.1158 COC(=O)COCCSCCN1CCCCC1 62a_100000739454_100000090808 [0,0,0,1,0,0|3,0,0]=4 6186 B17R1.1158 COC(=O)COCCSCOC1CCCCC1 62a_100000090808_100011935260 [0,0,0,1,0,0|3,0,0]=4 6187 B17R1.1158 COC(=O)COCCSCOC1CCCCC1 62a_100011935260_100000090808 [0,0,0,1,0,0|3,0,0]=4 6188 B17R1.1158 COC(=O)CSCCCCOC1CCCCO1 62a_100000031530_100000747449 [0,0,0,1,0,0|3,0,0]=4 6189 B17R1.1158 COC(=O)CSCCCCOC1CCCCO1 62a_100000747449_100000031530 [0,0,0,1,0,0|3,0,0]=4 6190 B17R1.1158 COC(=O)NCCOCCCC1CCCCC1 34a_100000757965_100011713725 [0,0,0,1,0,0|2,0,0]=3 6191 B17R1.1158 COC(=O)NCCOCCCN1CCCCC1 34a_100000757965_100000690320 [0,0,0,1,0,0|3,0,0]=4 6192 B17R1.1158 COC(=O)NCCOCCOC1CCCCC1 34a_100000757965_100011211530 [0,0,0,1,0,0|3,0,0]=4 6193 B17R1.1158 COC(=O)OCCOCCCC1CCCCC1 34a_100010262106_100011713725 [0,0,0,1,0,0|2,0,0]=3 6194 B17R1.1158 COC(=O)OCCOCCCN1CCCCC1 34a_100010262106_100000690320 [0,0,0,1,0,0|3,0,0]=4 6195 B17R1.1158 COC(=O)OCCOCCOC1CCCCC1 34a_100010262106_100011211530 [0,0,0,1,0,0|3,0,0]=4 6196 B17R1.1158 NNC(=O)CCCOCCCC1CCCCC1 34a_100000211488_100011713725 [0,0,0,1,0,0|3,0,0]=4 6197 B17R1.1187 COC(=O)CCCCOC1CCCCCC1=O 7a_100000059025_100000243696 [0,0,0,1,0,0|2,0,1]=4 6198 B17R1.1187 COC(=O)CCCCSC1CCCCCC1=O 62a_100000204269_100000243696 [0,0,0,1,0,0|2,0,1]=4 6199 B17R1.1187 COC(=O)CCCCSC1CCCCCC1=O 62a_100000243696_100000204269 [0,0,0,1,0,0|2,0,1]=4 6200 B17R1.1241 CCCCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100011215454 [0,0,0,1,0,0|2,0,0]=3 6201 B17R1.1241 CCCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210320 [0,0,0,1,0,0|2,0,0]=3 6202 B17R1.1241 CCCCCCCCCCNC1COC(=O)O1 34a_100000684558_100000032252 [0,0,0,1,0,0|2,0,0]=3 6203 B17R1.1241 CCCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210320 [0,0,0,1,0,0|2,0,0]=3 6204 B17R1.1241 CCCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210320 [0,0,0,1,0,0|2,0,0]=3 6205 B17R1.1241 CCCCCCCCCCOC1COC(=O)O1 34a_100000210711_100000032252 [0,0,0,1,0,0|2,0,0]=3 6206 B17R1.1241 CCCCCCCCCNCC1=CC(=O)OC1 34a_100000212291_100000716558 [0,0,0,1,0,0|1,0,2]=4 6207 B17R1.1241 CCCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100011214924 [0,0,0,1,0,0|2,0,0]=3 6208 B17R1.1241 CCCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100011214924 [0,0,0,1,0,0|2,0,0]=3 6209 B17R1.1241 CCCCCCCCCNCC1CNC(=O)O1 2230a_100000212291_100000181169 [0,0,0,1,0,0|3,0,0]=4 6210 B17R1.1241 CCCCCCCCCNCC1CNC(=O)O1 34a_100000212291_100000181169 [0,0,0,1,0,0|3,0,0]=4 6211 B17R1.1241 CCCCCCCCCNCC1COC(=O)O1 34a_100000212291_100000073702 [0,0,0,1,0,0|2,0,0]=3 6212 B17R1.1241 CCCCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000212291_100015189358 [0,0,0,1,0,0|3,0,0]=4 6213 B17R1.1241 CCCCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011214924 [0,0,0,1,0,0|3,0,0]=4 6214 B17R1.1241 CCCCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011214924 [0,0,0,1,0,0|3,0,0]=4 6215 B17R1.1241 CCCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000212291_100015307671 [0,0,0,1,0,0|2,0,0]=3 6216 B17R1.1241 CCCCCCCCCNC[C@H]1COC(=O)N1 34a_100000212291_100015307671 [0,0,0,1,0,0|2,0,0]=3 6217 B17R1.1241 CCCCCCCCCOCC1=CC(=O)OC1 34a_100000210712_100000716558 [0,0,0,1,0,0|1,0,2]=4 6218 B17R1.1241 CCCCCCCCCOCC1CCC(=O)N1 34a_100000737831_100011214924 [0,0,0,1,0,0|3,0,0]=4 6219 B17R1.1241 CCCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100011214924 [0,0,0,1,0,0|2,0,0]=3 6220 B17R1.1241 CCCCCCCCCOCC1CNC(=O)O1 34a_100000210712_100000181169 [0,0,0,1,0,0|3,0,0]=4 6221 B17R1.1241 CCCCCCCCCOCC1CNC(=O)O1 34a_100011315639_100011214924 [0,0,0,1,0,0|3,0,0]=4 6222 B17R1.1241 CCCCCCCCCOCC1CNC(=O)O1 7a_100000210712_100000181169 [0,0,0,1,0,0|3,0,0]=4 6223 B17R1.1241 CCCCCCCCCOCC1COC(=O)O1 34a_100000210712_100000073702 [0,0,0,1,0,0|2,0,0]=3 6224 B17R1.1241 CCCCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210712_100015189358 [0,0,0,1,0,0|3,0,0]=4 6225 B17R1.1241 CCCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210712_100015307671 [0,0,0,1,0,0|2,0,0]=3 6226 B17R1.1241 CCCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210712_100015307671 [0,0,0,1,0,0|2,0,0]=3 6227 B17R1.1241 CCCCCCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210670 [0,0,0,1,0,0|1,0,2]=4 6228 B17R1.1241 CCCCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210670 [0,0,0,1,0,0|3,0,0]=4 6229 B17R1.1241 CCCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210670 [0,0,0,1,0,0|2,0,0]=3 6230 B17R1.1241 CCCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210670 [0,0,0,1,0,0|3,0,0]=4 6231 B17R1.1241 CCCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210670 [0,0,0,1,0,0|2,0,0]=3 6232 B17R1.1241 CCCCCCCCOCCC1COS(=O)O1 7a_100000210232_100009840081 [0,0,0,1,0,0|3,0,0]=4 6233 B17R1.1241 CCCCCCCCSCCC1COS(=O)O1 62a_100000210759_100009840081 [0,0,0,1,0,0|3,0,0]=4 6234 B17R1.1241 CCCCCCOCCOCC1COC(=O)O1 34a_100000691444_100000073702 [0,0,0,1,0,0|3,0,0]=4 6235 B17R1.1241 CCCCCCOCCOC[C@H]1COC(=O)N1 34a_100000691444_100015307671 [0,0,0,1,0,0|3,0,0]=4 6236 B17R1.1241 CCCCCCOCCOC[C@H]1COC(=O)N1 7a_100000691444_100015307671 [0,0,0,1,0,0|3,0,0]=4 6237 B17R1.1241 CCCCNCCCCOCC1COC(=O)O1 34a_200011216965_100000073702 [0,0,0,1,0,0|3,0,0]=4 6238 B17R1.1241 CCCCNCCCCOC[C@H]1COC(=O)N1 34a_200011216965_100015307671 [0,0,0,1,0,0|3,0,0]=4 6239 B17R1.1241 CCCCOCCCCOCC1COC(=O)O1 34a_200000760531_100000073702 [0,0,0,1,0,0|3,0,0]=4 6240 B17R1.1241 CCCCOCCCCOC[C@H]1COC(=O)N1 34a_200000760531_100015307671 [0,0,0,1,0,0|3,0,0]=4 6241 B17R1.1241 CCCCOCCCCOC[C@H]1COC(=O)N1 7a_200000760531_100015307671 [0,0,0,1,0,0|3,0,0]=4 6242 B17R1.1241 NCCCCCCCCCOC1COC(=O)O1 34a_100000078944_100000032252 [0,0,0,1,0,0|3,0,0]=4 6243 B17R1.1241 NCCCCCCCCOCC1COC(=O)O1 34a_102515433106_100000073702 [0,0,0,1,0,0|3,0,0]=4 6244 B17R1.1241 NCCCCCCCCOC[C@H]1COC(=O)N1 34a_102515433106_100015307671 [0,0,0,1,0,0|3,0,0]=4 6245 B17R1.1241 O=C1CC(CN1)CNCCCCCCCCO 2230a_100016993742_100000033203 [0,0,0,1,0,0|3,0,0]=4 6246 B17R1.1241 O=C1CC(CN1)CNCCCCCCCCO 34a_100016993742_100000033203 [0,0,0,1,0,0|3,0,0]=4 6247 B17R1.1241 O=C1CC(CN1)COCCCCCCCCO 34a_100016041077_100000033203 [0,0,0,1,0,0|3,0,0]=4 6248 B17R1.1241 O=C1CC(CN1)NCCCCCCCCCO 2230a_100000697751_100009813782 [0,0,0,1,0,0|3,0,0]=4 6249 B17R1.1241 O=C1CC(CN1)OCCCCCCCCCO 34a_100000690082_100009813782 [0,0,0,1,0,0|3,0,0]=4 6250 B17R1.1241 O=C1CCC(C1)OCCCCCCCCCO 34a_100012614533_100009813782 [0,0,0,1,0,0|3,0,0]=4 6251 B17R1.1241 O=C1CN(CN1)CCCCCCCCCCO 2230a_200000708111_100009813290 [0,0,0,1,0,0|3,0,0]=4 6252 B17R1.1241 O=C1N[C@H](CO1)CNCCCCCCCCO 2230a_102515433106_100015307671 [0,0,0,1,0,0|3,0,0]=4 6253 B17R1.1241 O=C1N[C@H](CO1)CNCCCCCCCCO 34a_102515433106_100015307671 [0,0,0,1,0,0|3,0,0]=4 6254 B17R1.1241 O=C1N[C@H](CO1)COCCCCCCCCBr 34a_100009813846_100015307671 [0,0,0,1,0,0|3,0,0]=4 6255 B17R1.1241 O=C1N[C@H](CO1)COCCCCCCCCBr 7a_100009813846_100015307671 [0,0,0,1,0,0|3,0,0]=4 6256 B17R1.1241 O=C1N[C@H](CO1)COCCCCCCCCCl 34a_100000033203_100015307671 [0,0,0,1,0,0|3,0,0]=4 6257 B17R1.1241 O=C1N[C@H](CO1)COCCCCCCCCCl 7a_100000033203_100015307671 [0,0,0,1,0,0|3,0,0]=4 6258 B17R1.1241 O=C1N[C@H](CO1)CSCCCCCCCCO 62a_100000033203_100015307671 [0,0,0,1,0,0|3,0,0]=4 6259 B17R1.1241 O=C1N[C@H](CO1)CSCCCCCCCCO 62a_100015307671_100000033203 [0,0,0,1,0,0|3,0,0]=4 6260 B17R1.1241 O=C1OCC(O1)CNCCCCCCCCO 34a_102515433106_100000073702 [0,0,0,1,0,0|3,0,0]=4 6261 B17R1.1241 O=C1OCC(O1)COCCCCCCCCBr 34a_100009813846_100000073702 [0,0,0,1,0,0|3,0,0]=4 6262 B17R1.1241 O=C1OCC(O1)COCCCCCCCCCl 34a_100000033203_100000073702 [0,0,0,1,0,0|3,0,0]=4 6263 B17R1.1241 O=C1OCC(O1)CSCCCCCCCCO 62a_100000033203_100000073702 [0,0,0,1,0,0|3,0,0]=4 6264 B17R1.1241 O=C1OCC(O1)CSCCCCCCCCO 62a_100000073702_100000033203 [0,0,0,1,0,0|3,0,0]=4 6265 B17R1.1241 O=C1OCC(O1)NCCCCCCCCCO 34a_100000078944_100000032252 [0,0,0,1,0,0|3,0,0]=4 6266 B17R1.1241 O=C1OCC(O1)OCCCCCCCCCBr 34a_100009813782_100000032252 [0,0,0,1,0,0|3,0,0]=4 6267 B17R1.1241 O=C1OCC(O1)OCCCCCCCCCCl 34a_100009868337_100000032252 [0,0,0,1,0,0|3,0,0]=4 6268 B17R1.1241 O=C1OCC(O1)SCCCCCCCCCO 62a_100009813782_100000032252 [0,0,0,1,0,0|3,0,0]=4 6269 B17R1.1295 CNC(=O)CCCN1CCCCC1CCCO 2230a_100011934581_100000741757 [0,0,0,1,0,0|3,0,0]=4 6270 B17R1.1295 CNC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100000741757 [0,0,0,1,0,0|3,0,0]=4 6271 B17R1.1295 CNC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100000741757 [0,0,0,1,0,0|3,0,0]=4 6272 B17R1.1295 CNC(=O)CCCN1CCCCC1CCOC 2230a_100015186528_100000741757 [0,0,0,1,0,0|3,0,0]=4 6273 B17R1.1295 CNC(=O)CCCN1CCCCC1CCOC 269982a_100015186528_100000741757 [0,0,0,1,0,0|3,0,0]=4 6274 B17R1.1295 CNC(=O)CCCN1CCCCC1CCOC 34a_100015186528_100000741757 [0,0,0,1,0,0|3,0,0]=4 6275 B17R1.1295 COC(=O)CCCN1CCCCC1CCCO 2230a_100011934581_100011218270 [0,0,0,1,0,0|2,0,0]=3 6276 B17R1.1295 COC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100011218270 [0,0,0,1,0,0|2,0,0]=3 6277 B17R1.1295 COC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100000742333 [0,0,0,1,0,0|2,0,0]=3 6278 B17R1.1295 COC(=O)COCC1CCCCN1CCCN 34a_200011473794_100000747449 [0,0,0,1,0,0|3,0,0]=4 6279 B17R1.1295 COCCC1CCCCN1CCCC(=O)OC 2230a_100015186528_100011218270 [0,0,0,1,0,0|2,0,0]=3 6280 B17R1.1295 COCCC1CCCCN1CCCC(=O)OC 269982a_100015186528_100011218270 [0,0,0,1,0,0|2,0,0]=3 6281 B17R1.1295 COCCC1CCCCN1CCCC(=O)OC 34a_100015186528_100000742333 [0,0,0,1,0,0|2,0,0]=3 6282 B17R1.1338 CNC(=O)CCCNCCC1CCCCN1C 2230a_100000740002_100000211948 [0,0,0,1,0,0|3,0,0]=4 6283 B17R1.1338 CNC(=O)CCCNCCC1CCCCN1C 34a_100000740002_100000211948 [0,0,0,1,0,0|3,0,0]=4 6284 B17R1.1338 CNC(=O)CCCNCCN1CCCCC1C 2230a_100000739827_100000741757 [0,0,0,1,0,0|3,0,0]=4 6285 B17R1.1338 CNC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100000741757 [0,0,0,1,0,0|3,0,0]=4 6286 B17R1.1338 CNC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100000741757 [0,0,0,1,0,0|3,0,0]=4 6287 B17R1.1338 CNC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100000741757 [0,0,0,1,0,0|3,0,0]=4 6288 B17R1.1338 CNC(=O)CCCSCCC1CCCCN1C 62a_100000741757_100000211948 [0,0,0,1,0,0|3,0,0]=4 6289 B17R1.1338 CNC(=O)CCNCCCN1CCCCC1C 34a_100000212276_100012179268 [0,0,0,1,0,0|3,0,0]=4 6290 B17R1.1338 CNC(=O)CCOCCCN1CCCCC1C 34a_100000213889_100012179268 [0,0,0,1,0,0|3,0,0]=4 6291 B17R1.1338 CNC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000737683 [0,0,0,1,0,0|3,0,0]=4 6292 B17R1.1338 COC(=O)CCCCCCN1CCCCC1C 2230a_100000211376_100009815986 [0,0,0,1,0,0|1,0,0]=2 6293 B17R1.1338 COC(=O)CCCCCCN1CCCCC1C 269982a_100000211376_100009815986 [0,0,0,1,0,0|1,0,0]=2 6294 B17R1.1338 COC(=O)CCCCCCN1CCCCC1C 34a_100000211376_100009815986 [0,0,0,1,0,0|1,0,0]=2 6295 B17R1.1338 COC(=O)CCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100009815986 [0,0,0,1,0,0|2,0,0]=3 6296 B17R1.1338 COC(=O)CCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100009815986 [0,0,0,1,0,0|2,0,0]=3 6297 B17R1.1338 COC(=O)CCCCCCN1CCOC[C@@H]1C 34a_100009815349_100009815986 [0,0,0,1,0,0|2,0,0]=3 6298 B17R1.1338 COC(=O)CCCCCNC1CCCCC1C 2230a_100000211402_100009816466 [0,0,0,1,0,0|1,0,0]=2 6299 B17R1.1338 COC(=O)CCCCCNC1CCCCC1C 34a_100000211402_100009816466 [0,0,0,1,0,0|1,0,0]=2 6300 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009816466 [0,0,0,1,0,0|2,0,0]=3 6301 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009816466 [0,0,0,1,0,0|2,0,0]=3 6302 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100009816466 [0,0,0,1,0,0|3,0,0]=4 6303 B17R1.1338 COC(=O)CCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100009816466 [0,0,0,1,0,0|3,0,0]=4 6304 B17R1.1338 COC(=O)CCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100009816466 [0,0,0,1,0,0|3,0,0]=4 6305 B17R1.1338 COC(=O)CCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100009816466 [0,0,0,1,0,0|3,0,0]=4 6306 B17R1.1338 COC(=O)CCCCCOC1CCCCC1=O 34a_100000074720_100000754470 [0,0,0,1,0,0|2,0,1]=4 6307 B17R1.1338 COC(=O)CCCCCOC1CCCCC1=O 34a_100011214950_100009816466 [0,0,0,1,0,0|2,0,1]=4 6308 B17R1.1338 COC(=O)CCCCCOC1CCCCC1=O 7a_100000074720_100000204591 [0,0,0,1,0,0|2,0,1]=4 6309 B17R1.1338 COC(=O)CCCCCOC1CCCCC1C 34a_100000211207_100009816466 [0,0,0,1,0,0|1,0,0]=2 6310 B17R1.1338 COC(=O)CCCCCOC1CCCCC1C 7a_100000211207_100009816466 [0,0,0,1,0,0|1,0,0]=2 6311 B17R1.1338 COC(=O)CCCCCOC1CCCCC1Cl 34a_100000038908_100009816466 [0,0,0,1,0,0|2,0,0]=3 6312 B17R1.1338 COC(=O)CCCCCOC1CCCCC1Cl 7a_100000038908_100009816466 [0,0,0,1,0,0|2,0,0]=3 6313 B17R1.1338 COC(=O)CCCCCOC1CCCCC1F 34a_100000074720_100015423560 [0,0,0,1,0,0|2,0,0]=3 6314 B17R1.1338 COC(=O)CCCCCOC1CCCCC1O 34a_100000074720_100000038908 [0,0,0,1,0,0|2,0,0]=3 6315 B17R1.1338 COC(=O)CCCCCOC1CCNCC1C 34a_100011998114_100009816466 [0,0,0,1,0,0|2,0,0]=3 6316 B17R1.1338 COC(=O)CCCCCOC1CNCCC1C 34a_100000696640_100009816466 [0,0,0,1,0,0|2,0,0]=3 6317 B17R1.1338 COC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009816466 [0,0,0,1,0,0|2,0,0]=3 6318 B17R1.1338 COC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100009816466 [0,0,0,1,0,0|2,0,0]=3 6319 B17R1.1338 COC(=O)CCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100009816466 [0,0,0,1,0,0|3,0,0]=4 6320 B17R1.1338 COC(=O)CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100009816466 [0,0,0,1,0,0|2,0,0]=3 6321 B17R1.1338 COC(=O)CCCCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100009816466 [0,0,0,1,0,0|3,0,0]=4 6322 B17R1.1338 COC(=O)CCCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100009816466 [0,0,0,1,0,0|3,0,0]=4 6323 B17R1.1338 COC(=O)CCCCCSC1CCCCC1=O 62a_100000204591_100009816466 [0,0,0,1,0,0|2,0,1]=4 6324 B17R1.1338 COC(=O)CCCCCSC1CCCCC1=O 62a_100009816466_100000204591 [0,0,0,1,0,0|2,0,1]=4 6325 B17R1.1338 COC(=O)CCCCCSC1CCCCC1F 62a_100009816466_100015423560 [0,0,0,1,0,0|2,0,0]=3 6326 B17R1.1338 COC(=O)CCCCCSC1CCCCC1F 62a_100015423560_100009816466 [0,0,0,1,0,0|2,0,0]=3 6327 B17R1.1338 COC(=O)CCCCCSC1CCCCC1O 62a_100000038908_100009816466 [0,0,0,1,0,0|2,0,0]=3 6328 B17R1.1338 COC(=O)CCCCCSC1CCCCC1O 62a_100009816466_100000038908 [0,0,0,1,0,0|2,0,0]=3 6329 B17R1.1338 COC(=O)CCCCNCC1CCCCC1O 34a_100011216029_100000204269 [0,0,0,1,0,0|2,0,0]=3 6330 B17R1.1338 COC(=O)CCCCNCC1CCCCN1C 34a_100011228421_100000204269 [0,0,0,1,0,0|2,0,0]=3 6331 B17R1.1338 COC(=O)CCCCOCC1CC=CCC1C 34a_100000211322_100000204269 [0,0,0,1,0,0|1,0,2]=4 6332 B17R1.1338 COC(=O)CCCCOCC1CCCCC1=O 34a_100009861125_100000204269 [0,0,0,1,0,0|2,0,1]=4 6333 B17R1.1338 COC(=O)CCCCOCC1CCCCC1=O 7a_100009861125_100000204269 [0,0,0,1,0,0|2,0,1]=4 6334 B17R1.1338 COC(=O)CCCCOCC1CCCCN1C 34a_100000059025_100015186950 [0,0,0,1,0,0|2,0,0]=3 6335 B17R1.1338 COC(=O)CCCCOCC1CCCCN1C 34a_100000225079_100000204269 [0,0,0,1,0,0|2,0,0]=3 6336 B17R1.1338 COC(=O)CCCCOCC1CCCCN1C 7a_100000059025_100015185383 [0,0,0,1,0,0|2,0,0]=3 6337 B17R1.1338 COC(=O)CCCCOCC1COCCC1N 34a_214813039666_100000204269 [0,0,0,1,0,0|3,0,0]=4 6338 B17R1.1338 COC(=O)CCCCOCC1COCCN1C 34a_100013547906_100000204269 [0,0,0,1,0,0|3,0,0]=4 6339 B17R1.1338 COC(=O)CCCCSCC1CCCCN1C 62a_100000204269_100015185383 [0,0,0,1,0,0|2,0,0]=3 6340 B17R1.1338 COC(=O)CCCCSCC1CCCCN1C 62a_100015185383_100000204269 [0,0,0,1,0,0|2,0,0]=3 6341 B17R1.1338 COC(=O)CCCNCCN1CCCCC1C 2230a_100000739827_100011218270 [0,0,0,1,0,0|2,0,0]=3 6342 B17R1.1338 COC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100000742333 [0,0,0,1,0,0|2,0,0]=3 6343 B17R1.1338 COC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100000742333 [0,0,0,1,0,0|2,0,0]=3 6344 B17R1.1338 COC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100011218270 [0,0,0,1,0,0|2,0,0]=3 6345 B17R1.1338 COC(=O)CCCSCCC1CCCCN1C 62a_100011218270_100000211948 [0,0,0,1,0,0|2,0,0]=3 6346 B17R1.1338 COC(=O)CCNCCCN1CCCCC1C 34a_100000212276_100000742370 [0,0,0,1,0,0|2,0,0]=3 6347 B17R1.1338 COC(=O)CCOCCCN1CCCCC1C 34a_100000213889_100000742370 [0,0,0,1,0,0|2,0,0]=3 6348 B17R1.1338 COC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000204255 [0,0,0,1,0,0|2,0,0]=3 6349 B17R1.1338 COC(=O)COCCNCC1CCCCC1O 34a_100011216029_100000090808 [0,0,0,1,0,0|3,0,0]=4 6350 B17R1.1338 COC(=O)COCCNCC1CCCCN1C 34a_100011228421_100000090808 [0,0,0,1,0,0|3,0,0]=4 6351 B17R1.1338 COC(=O)COCCOCC1CCCCN1C 34a_100000225079_100000090808 [0,0,0,1,0,0|3,0,0]=4 6352 B17R1.1338 COC(=O)COCCSCC1CCCCN1C 62a_100000090808_100015185383 [0,0,0,1,0,0|3,0,0]=4 6353 B17R1.1338 COC(=O)COCCSCC1CCCCN1C 62a_100015185383_100000090808 [0,0,0,1,0,0|3,0,0]=4 6354 B17R1.1338 COC(=O)NCCOCCC1CCCCN1C 34a_100000757965_100000211948 [0,0,0,1,0,0|3,0,0]=4 6355 B17R1.1338 COC(=O)OCCOCCC1CCCCN1C 34a_100010262106_100000211948 [0,0,0,1,0,0|3,0,0]=4 6356 B17R1.1377 CNC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100000741757 [0,0,0,1,0,0|3,0,0]=4 6357 B17R1.1377 COC(=O)CCCCCCCCN1CC=CC1 269982a_100015195280_100010282707 [0,0,0,1,0,0|1,0,2]=4 6358 B17R1.1377 COC(=O)CCCCCCCCN1CCCC1 2230a_100000188435_100010282707 [0,0,0,1,0,0|1,0,0]=2 6359 B17R1.1377 COC(=O)CCCCCCCCN1CCCC1 269982a_100000188435_100010282707 [0,0,0,1,0,0|1,0,0]=2 6360 B17R1.1377 COC(=O)CCCCCCCCN1CCSC1 2230a_100011215254_100010282707 [0,0,0,1,0,0|2,0,0]=3 6361 B17R1.1377 COC(=O)CCCCCCCCN1CCSC1 269982a_100011215254_100010282707 [0,0,0,1,0,0|2,0,0]=3 6362 B17R1.1377 COC(=O)CCCCCCCNC1CC=CC1 2230a_100015188752_100010004213 [0,0,0,1,0,0|1,0,2]=4 6363 B17R1.1377 COC(=O)CCCCCCCNC1CCCC1 2230a_100000211070_100010004213 [0,0,0,1,0,0|1,0,0]=2 6364 B17R1.1377 COC(=O)CCCCCCCNC1CCCC1 34a_100000211070_100010004213 [0,0,0,1,0,0|1,0,0]=2 6365 B17R1.1377 COC(=O)CCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100010004213 [0,0,0,1,0,0|2,0,0]=3 6366 B17R1.1377 COC(=O)CCCCCCCN[C@H]1CCOC1 2230a_100015188467_100010004213 [0,0,0,1,0,0|2,0,0]=3 6367 B17R1.1377 COC(=O)CCCCCCCN[C@H]1CCOC1 34a_100015188467_100010004213 [0,0,0,1,0,0|2,0,0]=3 6368 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 34a_100000210269_100010004213 [0,0,0,1,0,0|1,0,0]=2 6369 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 34a_100011022521_100000179811 [0,0,0,1,0,0|1,0,0]=2 6370 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 7a_100000210269_100010004213 [0,0,0,1,0,0|1,0,0]=2 6371 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 7a_100011022521_100000179811 [0,0,0,1,0,0|1,0,0]=2 6372 B17R1.1377 COC(=O)CCCCCCCOC1CCCO1 34a_100000085407_100010004213 [0,0,0,1,0,0|2,0,0]=3 6373 B17R1.1377 COC(=O)CCCCCCCOC1CCOC1 34a_100011022521_100000690089 [0,0,0,1,0,0|2,0,0]=3 6374 B17R1.1377 COC(=O)CCCCCCCOC1CCOC1 7a_100011022521_100000731011 [0,0,0,1,0,0|2,0,0]=3 6375 B17R1.1377 COC(=O)CCCCCCCOC1CCSC1 7a_100011232664_100010004213 [0,0,0,1,0,0|2,0,0]=3 6376 B17R1.1377 COC(=O)CCCCCCCO[C@H]1CCOC1 34a_100000717292_100010004213 [0,0,0,1,0,0|2,0,0]=3 6377 B17R1.1377 COC(=O)CCCCCCCSC1CCCC1 62a_100010004213_100000179811 [0,0,0,1,0,0|1,0,0]=2 6378 B17R1.1377 COC(=O)CCCCCCCSC1CCCC1 62a_100011217020_100010004213 [0,0,0,1,0,0|1,0,0]=2 6379 B17R1.1377 COC(=O)CCCCCCCSC1CCOC1 62a_100010004213_100000690089 [0,0,0,1,0,0|2,0,0]=3 6380 B17R1.1377 COC(=O)CCCCCCNCC1CCCC1 2230a_100000737975_100009815986 [0,0,0,1,0,0|1,0,0]=2 6381 B17R1.1377 COC(=O)CCCCCCNCC1CCCC1 34a_100000737975_100009815986 [0,0,0,1,0,0|1,0,0]=2 6382 B17R1.1377 COC(=O)CCCCCCNCC1CCOC1 2230a_100000737293_100009815986 [0,0,0,1,0,0|2,0,0]=3 6383 B17R1.1377 COC(=O)CCCCCCNCC1CCOC1 34a_100000737293_100009815986 [0,0,0,1,0,0|2,0,0]=3 6384 B17R1.1377 COC(=O)CCCCCCNCC1OCCO1 2230a_100000036311_100009815986 [0,0,0,1,0,0|3,0,0]=4 6385 B17R1.1377 COC(=O)CCCCCCNCC1OCCO1 34a_100000036311_100009815986 [0,0,0,1,0,0|3,0,0]=4 6386 B17R1.1377 COC(=O)CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009815986 [0,0,0,1,0,0|2,0,0]=3 6387 B17R1.1377 COC(=O)CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100009815986 [0,0,0,1,0,0|2,0,0]=3 6388 B17R1.1377 COC(=O)CCCCCCOCC1CC=CC1 34a_100000688395_100009815986 [0,0,0,1,0,0|1,0,2]=4 6389 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 34a_100000742336_100009815986 [0,0,0,1,0,0|1,0,0]=2 6390 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 34a_100009863599_100000740388 [0,0,0,1,0,0|1,0,0]=2 6391 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 7a_100000742336_100009815986 [0,0,0,1,0,0|1,0,0]=2 6392 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 7a_100009863599_100000740388 [0,0,0,1,0,0|1,0,0]=2 6393 B17R1.1377 COC(=O)CCCCCCOCC1CCCO1 34a_100000210270_100009815986 [0,0,0,1,0,0|2,0,0]=3 6394 B17R1.1377 COC(=O)CCCCCCOCC1CCCO1 7a_100000210270_100009815986 [0,0,0,1,0,0|2,0,0]=3 6395 B17R1.1377 COC(=O)CCCCCCOCC1CCCO1 7a_100009863599_100000203698 [0,0,0,1,0,0|2,0,0]=3 6396 B17R1.1377 COC(=O)CCCCCCOCC1CCNC1 34a_100000748654_100009815986 [0,0,0,1,0,0|2,0,0]=3 6397 B17R1.1377 COC(=O)CCCCCCOCC1CCOC1 34a_100000740260_100009815986 [0,0,0,1,0,0|2,0,0]=3 6398 B17R1.1377 COC(=O)CCCCCCOCC1CCOC1 34a_100009863599_100011261433 [0,0,0,1,0,0|2,0,0]=3 6399 B17R1.1377 COC(=O)CCCCCCOCC1CCOC1 7a_100009863599_100000702531 [0,0,0,1,0,0|2,0,0]=3 6400 B17R1.1377 COC(=O)CCCCCCOCC1COCO1 34a_100011216627_100009815986 [0,0,0,1,0,0|3,0,0]=4 6401 B17R1.1377 COC(=O)CCCCCCOCC1OCCO1 34a_100000087154_100009815986 [0,0,0,1,0,0|3,0,0]=4 6402 B17R1.1377 COC(=O)CCCCCCOCC1OCCO1 34a_100009863599_100000755774 [0,0,0,1,0,0|3,0,0]=4 6403 B17R1.1377 COC(=O)CCCCCCOCC1OCCO1 7a_100009863599_100000755774 [0,0,0,1,0,0|3,0,0]=4 6404 B17R1.1377 COC(=O)CCCCCCOC[C@H]1CCCN1 34a_100000745186_100009815986 [0,0,0,1,0,0|2,0,0]=3 6405 B17R1.1377 COC(=O)CCCCCCSCC1CCCC1 62a_100000740388_100009815986 [0,0,0,1,0,0|1,0,0]=2 6406 B17R1.1377 COC(=O)CCCCCCSCC1CCCC1 62a_100009815986_100000740388 [0,0,0,1,0,0|1,0,0]=2 6407 B17R1.1377 COC(=O)CCCCCCSCC1CCCO1 62a_100000203698_100009815986 [0,0,0,1,0,0|2,0,0]=3 6408 B17R1.1377 COC(=O)CCCCCCSCC1CCCO1 62a_100009815986_100000203698 [0,0,0,1,0,0|2,0,0]=3 6409 B17R1.1377 COC(=O)CCCCCCSCC1CCOC1 62a_100000702531_100009815986 [0,0,0,1,0,0|2,0,0]=3 6410 B17R1.1377 COC(=O)CCCCCCSCC1CCOC1 62a_100009815986_100000702531 [0,0,0,1,0,0|2,0,0]=3 6411 B17R1.1377 COC(=O)CCCCCCSCC1OCCO1 62a_100000755774_100009815986 [0,0,0,1,0,0|3,0,0]=4 6412 B17R1.1377 COC(=O)CCCCCCSCC1OCCO1 62a_100009815986_100000755774 [0,0,0,1,0,0|3,0,0]=4 6413 B17R1.1377 COC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100009816466 [0,0,0,1,0,0|1,0,0]=2 6414 B17R1.1377 COC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100009816466 [0,0,0,1,0,0|1,0,0]=2 6415 B17R1.1377 COC(=O)CCCCCNCCC1OCCO1 2230a_100000034215_100009816466 [0,0,0,1,0,0|3,0,0]=4 6416 B17R1.1377 COC(=O)CCCCCNCCC1OCCO1 34a_100000034215_100009816466 [0,0,0,1,0,0|3,0,0]=4 6417 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 34a_100000074720_100000760354 [0,0,0,1,0,0|1,0,0]=2 6418 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100009816466 [0,0,0,1,0,0|1,0,0]=2 6419 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 7a_100000074720_100000760354 [0,0,0,1,0,0|1,0,0]=2 6420 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100009816466 [0,0,0,1,0,0|1,0,0]=2 6421 B17R1.1377 COC(=O)CCCCCOCCC1CCNC1 34a_100016987287_100009816466 [0,0,0,1,0,0|2,0,0]=3 6422 B17R1.1377 COC(=O)CCCCCOCCC1CCOC1 34a_100011879284_100009816466 [0,0,0,1,0,0|2,0,0]=3 6423 B17R1.1377 COC(=O)CCCCCOCCC1OCCO1 34a_100000074720_100000740749 [0,0,0,1,0,0|3,0,0]=4 6424 B17R1.1377 COC(=O)CCCCCOCCC1OCCO1 7a_100000074720_100000740749 [0,0,0,1,0,0|3,0,0]=4 6425 B17R1.1377 COC(=O)CCCCCOCCN1CCCC1 7a_100000074720_100000004467 [0,0,0,1,0,0|2,0,0]=3 6426 B17R1.1377 COC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100009816466 [0,0,0,1,0,0|1,0,0]=2 6427 B17R1.1377 COC(=O)CCCCCSCCC1CCCC1 62a_100009816466_100000760354 [0,0,0,1,0,0|1,0,0]=2 6428 B17R1.1377 COC(=O)CCCCCSCCC1OCCO1 62a_100009816466_100000740749 [0,0,0,1,0,0|3,0,0]=4 6429 B17R1.1377 COC(=O)CCCCCSCCN1CCCC1 62a_100000700749_100009816466 [0,0,0,1,0,0|2,0,0]=3 6430 B17R1.1377 COC(=O)CCCCCSCCN1CCCC1 62a_100009816466_100000004467 [0,0,0,1,0,0|2,0,0]=3 6431 B17R1.1377 COC(=O)CCCCNCCCC1CCCC1 2230a_100000736752_100000204269 [0,0,0,1,0,0|1,0,0]=2 6432 B17R1.1377 COC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100000204269 [0,0,0,1,0,0|1,0,0]=2 6433 B17R1.1377 COC(=O)CCCCNCCOC1CCCC1 34a_100000741755_100000204269 [0,0,0,1,0,0|2,0,0]=3 6434 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 34a_100000059025_100011713738 [0,0,0,1,0,0|1,0,0]=2 6435 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100000204269 [0,0,0,1,0,0|1,0,0]=2 6436 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 7a_100000059025_100011713738 [0,0,0,1,0,0|1,0,0]=2 6437 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000204269 [0,0,0,1,0,0|1,0,0]=2 6438 B17R1.1377 COC(=O)CCCCOCCCC1OCCO1 34a_100000059025_100009861162 [0,0,0,1,0,0|3,0,0]=4 6439 B17R1.1377 COC(=O)CCCCOCCCC1OCCO1 34a_100009871617_100000204269 [0,0,0,1,0,0|3,0,0]=4 6440 B17R1.1377 COC(=O)CCCCOCCCC1OCCO1 7a_100000059025_100000042513 [0,0,0,1,0,0|3,0,0]=4 6441 B17R1.1377 COC(=O)CCCCOCCCC1OCCO1 7a_100009871617_100000204269 [0,0,0,1,0,0|3,0,0]=4 6442 B17R1.1377 COC(=O)CCCCOCCCN1CCCC1 34a_100000059025_100016991639 [0,0,0,1,0,0|2,0,0]=3 6443 B17R1.1377 COC(=O)CCCCOCCCN1CCCC1 7a_100000059025_100011445909 [0,0,0,1,0,0|2,0,0]=3 6444 B17R1.1377 COC(=O)CCCCOCCNC1CCCC1 34a_200000200444_100000204269 [0,0,0,1,0,0|2,0,0]=3 6445 B17R1.1377 COC(=O)CCCCOCCOC1CCCC1 34a_100000738311_100000204269 [0,0,0,1,0,0|2,0,0]=3 6446 B17R1.1377 COC(=O)CCCCOCCOC1CCCC1 7a_100000738311_100000204269 [0,0,0,1,0,0|2,0,0]=3 6447 B17R1.1377 COC(=O)CCCCSCCCC1CCCC1 62a_100000204269_100011713738 [0,0,0,1,0,0|1,0,0]=2 6448 B17R1.1377 COC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000204269 [0,0,0,1,0,0|1,0,0]=2 6449 B17R1.1377 COC(=O)CCCCSCCCC1OCCO1 62a_100000204269_100000042513 [0,0,0,1,0,0|3,0,0]=4 6450 B17R1.1377 COC(=O)CCCCSCCCN1CCCC1 62a_100000204269_100011445909 [0,0,0,1,0,0|2,0,0]=3 6451 B17R1.1377 COC(=O)CCCCSCCCN1CCCC1 62a_100016991639_100000204269 [0,0,0,1,0,0|2,0,0]=3 6452 B17R1.1377 COC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100000742333 [0,0,0,1,0,0|2,0,0]=3 6453 B17R1.1377 COC(=O)CCCSCCCCC1OCCO1 62a_100011218270_100000034956 [0,0,0,1,0,0|3,0,0]=4 6454 B17R1.1377 COC(=O)CCOCCCCOC1CCCO1 34a_100011018183_100000742370 [0,0,0,1,0,0|3,0,0]=4 6455 B17R1.1377 COC(=O)CCOCCCCOC1CCCO1 7a_100011018183_100000204255 [0,0,0,1,0,0|3,0,0]=4 6456 B17R1.1377 COC(=O)COCCNCCCC1CCCC1 2230a_100000736752_100000090808 [0,0,0,1,0,0|2,0,0]=3 6457 B17R1.1377 COC(=O)COCCNCCCC1CCCC1 34a_100000736752_100000090808 [0,0,0,1,0,0|2,0,0]=3 6458 B17R1.1377 COC(=O)COCCNCCOC1CCCC1 34a_100000741755_100000090808 [0,0,0,1,0,0|3,0,0]=4 6459 B17R1.1377 COC(=O)COCCOCCCC1CCCC1 34a_100011215328_100000090808 [0,0,0,1,0,0|2,0,0]=3 6460 B17R1.1377 COC(=O)COCCOCCCC1CCCC1 7a_100011215328_100000090808 [0,0,0,1,0,0|2,0,0]=3 6461 B17R1.1377 COC(=O)COCCOCCNC1CCCC1 34a_200000200444_100000090808 [0,0,0,1,0,0|3,0,0]=4 6462 B17R1.1377 COC(=O)COCCOCCOC1CCCC1 34a_100000738311_100000090808 [0,0,0,1,0,0|3,0,0]=4 6463 B17R1.1377 COC(=O)COCCOCCOC1CCCC1 34a_100011023656_100000179811 [0,0,0,1,0,0|3,0,0]=4 6464 B17R1.1377 COC(=O)COCCOCCOC1CCCC1 7a_100000738311_100000090808 [0,0,0,1,0,0|3,0,0]=4 6465 B17R1.1377 COC(=O)COCCOCCOC1CCCC1 7a_100011023656_100000179811 [0,0,0,1,0,0|3,0,0]=4 6466 B17R1.1377 COC(=O)COCCSCCCC1CCCC1 62a_100000090808_100011713738 [0,0,0,1,0,0|2,0,0]=3 6467 B17R1.1377 COC(=O)COCCSCCCC1CCCC1 62a_100011713738_100000090808 [0,0,0,1,0,0|2,0,0]=3 6468 B17R1.1377 COC(=O)COCCSCCCN1CCCC1 62a_100000090808_100011445909 [0,0,0,1,0,0|3,0,0]=4 6469 B17R1.1377 COC(=O)COCCSCCCN1CCCC1 62a_100016991639_100000090808 [0,0,0,1,0,0|3,0,0]=4 6470 B17R1.1420 C#CC1CCCCN1CCCCCC(=O)OC 2230a_200020621307_100009816466 [0,0,0,1,0,0|1,0,2]=4 6471 B17R1.1420 C#CC1CCCCN1CCCCCC(=O)OC 269982a_200020621307_100009816466 [0,0,0,1,0,0|1,0,2]=4 6472 B17R1.1420 C#CC1CCCCN1CCCCCC(=O)OC 34a_200020621307_100009816466 [0,0,0,1,0,0|1,0,2]=4 6473 B17R1.1420 CCC1CCCCC1OCCCCC(=O)OC 34a_100000210738_100000204269 [0,0,0,1,0,0|1,0,0]=2 6474 B17R1.1420 CCC1CCCCC1OCCCCC(=O)OC 7a_100000210738_100000204269 [0,0,0,1,0,0|1,0,0]=2 6475 B17R1.1420 CCC1CCCCC1OCCOCC(=O)OC 34a_100000210738_100000090808 [0,0,0,1,0,0|2,0,0]=3 6476 B17R1.1420 CCC1CCCCC1OCCOCC(=O)OC 7a_100000210738_100000090808 [0,0,0,1,0,0|2,0,0]=3 6477 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC 2230a_100000210034_100009816466 [0,0,0,1,0,0|1,0,0]=2 6478 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC 269982a_100000210034_100009816466 [0,0,0,1,0,0|1,0,0]=2 6479 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC 34a_100000210034_100009816466 [0,0,0,1,0,0|1,0,0]=2 6480 B17R1.1420 CCC1CCCCN1CCCNCC(=O)NC 34a_100011191702_100000183359 [0,0,0,1,0,0|3,0,0]=4 6481 B17R1.1420 CCC1CCCCN1CCCNCC(=O)OC 34a_100011191702_100000747449 [0,0,0,1,0,0|2,0,0]=3 6482 B17R1.1420 CCC1CCCCN1CCNCCC(=O)NC 2230a_100000755458_100000737683 [0,0,0,1,0,0|3,0,0]=4 6483 B17R1.1420 CCC1CCCCN1CCNCCC(=O)NC 34a_100000755458_100012179268 [0,0,0,1,0,0|3,0,0]=4 6484 B17R1.1420 CCC1CCCCN1CCNCCC(=O)OC 2230a_100000755458_100000204255 [0,0,0,1,0,0|2,0,0]=3 6485 B17R1.1420 CCC1CCCCN1CCNCCC(=O)OC 34a_100000755458_100000742370 [0,0,0,1,0,0|2,0,0]=3 6486 B17R1.1420 CCN1CCCCC1CNCCCC(=O)NC 2230a_100000754393_100000741757 [0,0,0,1,0,0|3,0,0]=4 6487 B17R1.1420 CCN1CCCCC1CNCCCC(=O)NC 34a_100000754393_100000741757 [0,0,0,1,0,0|3,0,0]=4 6488 B17R1.1420 CCN1CCCCC1CNCCCC(=O)OC 2230a_100000754393_100011218270 [0,0,0,1,0,0|2,0,0]=3 6489 B17R1.1420 CCN1CCCCC1CNCCCC(=O)OC 34a_100000754393_100000742333 [0,0,0,1,0,0|2,0,0]=3 6490 B17R1.1420 CCN1CCCCC1COCCCC(=O)NC 34a_100000225091_100000741757 [0,0,0,1,0,0|3,0,0]=4 6491 B17R1.1420 CCN1CCCCC1COCCCC(=O)NC 7a_100000225091_100000741757 [0,0,0,1,0,0|3,0,0]=4 6492 B17R1.1420 CCN1CCCCC1COCCCC(=O)OC 34a_100000225091_100000742333 [0,0,0,1,0,0|2,0,0]=3 6493 B17R1.1420 CCN1CCCCC1COCCCC(=O)OC 7a_100000225091_100011218270 [0,0,0,1,0,0|2,0,0]=3 6494 B17R1.1420 CC[C@H]1COCCN1CCCCCC(=O)OC 2230a_100016988097_100009816466 [0,0,0,1,0,0|2,0,0]=3 6495 B17R1.1420 CC[C@H]1COCCN1CCCCCC(=O)OC 269982a_100016988097_100009816466 [0,0,0,1,0,0|2,0,0]=3 6496 B17R1.1420 CC[C@H]1COCCN1CCCCCC(=O)OC 34a_100016988097_100009816466 [0,0,0,1,0,0|2,0,0]=3 6497 B17R1.1420 CN[C@@H]1CCCC[C@H]1OCCCCC(=O)OC 34a_100000708425_100000204269 [0,0,0,1,0,0|2,0,0]=3 6498 B17R1.1420 CN[C@@H]1CCCC[C@H]1OCCOCC(=O)OC 34a_100000708425_100000090808 [0,0,0,1,0,0|3,0,0]=4 6499 B17R1.1420 COC(=O)CCCCCN1CCCCC1C#N 34a_100016989756_100009816466 [0,0,0,1,0,0|2,0,1]=4 6500 B17R1.1420 COC(=O)CCCCCN1CCCCC1CO 2230a_100000210821_100009816466 [0,0,0,1,0,0|2,0,0]=3 6501 B17R1.1420 COC(=O)CCCCCN1CCCCC1CO 269982a_100000210821_100009816466 [0,0,0,1,0,0|2,0,0]=3 6502 B17R1.1420 COC(=O)CCCCCN1CCCCC1CO 34a_100000210821_100009816466 [0,0,0,1,0,0|2,0,0]=3 6503 B17R1.1420 COC(=O)CCCCCN1CCOC[C@H]1CO 2230a_100000717676_100009816466 [0,0,0,1,0,0|3,0,0]=4 6504 B17R1.1420 COC(=O)CCCCCN1CCOC[C@H]1CO 269982a_100000717676_100009816466 [0,0,0,1,0,0|3,0,0]=4 6505 B17R1.1420 COC(=O)CCCCCN1CCOC[C@H]1CO 34a_100000717676_100009816466 [0,0,0,1,0,0|3,0,0]=4 6506 B17R1.1420 COC(=O)CCCCNC1CCCCC1OC 34a_100011208099_100000204269 [0,0,0,1,0,0|2,0,0]=3 6507 B17R1.1420 COC(=O)CCCCNC1CCOCC1CO 2230a_214813039666_100000204269 [0,0,0,1,0,0|3,0,0]=4 6508 B17R1.1420 COC(=O)CCCCNC1CCOCC1CO 34a_214813039666_100000204269 [0,0,0,1,0,0|3,0,0]=4 6509 B17R1.1420 COC(=O)CCCCOC1CCCCC1CN 34a_100011216029_100000204269 [0,0,0,1,0,0|2,0,0]=3 6510 B17R1.1420 COC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000204269 [0,0,0,1,0,0|2,0,0]=3 6511 B17R1.1420 COC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000204269 [0,0,0,1,0,0|2,0,0]=3 6512 B17R1.1420 COC(=O)CCNCCN1CCCCC1CO 2230a_100011473795_100000204255 [0,0,0,1,0,0|3,0,0]=4 6513 B17R1.1420 COC(=O)CCNCCN1CCCCC1CO 34a_100011473795_100000742370 [0,0,0,1,0,0|3,0,0]=4 6514 B17R1.1420 COC(=O)CNCCCN1CCCCC1CO 34a_200011473794_100000747449 [0,0,0,1,0,0|3,0,0]=4 6515 B17R1.1420 COC(=O)COCCNC1CCCCC1OC 34a_100011208099_100000090808 [0,0,0,1,0,0|3,0,0]=4 6516 B17R1.1420 COC(=O)COCCOC1CCCCC1CN 34a_100011216029_100000090808 [0,0,0,1,0,0|3,0,0]=4 6517 B17R1.1420 COC(=O)COCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000090808 [0,0,0,1,0,0|3,0,0]=4 6518 B17R1.1420 COC(=O)COCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000090808 [0,0,0,1,0,0|3,0,0]=4 6519 B17R1.1504 CCCCCC1CCCC1NCCC(=O)NC 269862a_100000738227_200000198059 [0,0,0,1,0,0|2,0,0]=3 6520 B17R1.1504 CCCCCC1CCCC1NCCC(=O)NC 270004a_100000738227_200000198059 [0,0,0,1,0,0|2,0,0]=3 6521 B17R1.4157 C#CCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100012094781 [0,0,0,1,0,0|1,0,2]=4 6522 B17R1.4157 C#CCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100012094781 [0,0,0,1,0,0|1,0,2]=4 6523 B17R1.4157 C#CCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100012094781 [0,0,0,1,0,0|1,0,2]=4 6524 B17R1.4157 C#CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100010269958 [0,0,0,1,0,0|1,0,2]=4 6525 B17R1.4157 C#CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100010269958 [0,0,0,1,0,0|1,0,2]=4 6526 B17R1.4157 C=CCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000700193 [0,0,0,1,0,0|1,0,2]=4 6527 B17R1.4157 C=CCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000700193 [0,0,0,1,0,0|1,0,2]=4 6528 B17R1.4157 C=CCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000700193 [0,0,0,1,0,0|1,0,2]=4 6529 B17R1.4157 C=CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011215482 [0,0,0,1,0,0|1,0,2]=4 6530 B17R1.4157 C=CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011215482 [0,0,0,1,0,0|1,0,2]=4 6531 B17R1.4157 CC/C=C\CCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100015370543 [0,0,0,1,0,0|1,0,2]=4 6532 B17R1.4157 CC/C=C\CCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100015370543 [0,0,0,1,0,0|1,0,2]=4 6533 B17R1.4157 CCCCCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210681 [0,0,0,1,0,0|2,0,0]=3 6534 B17R1.4157 CCCCCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210681 [0,0,0,1,0,0|2,0,0]=3 6535 B17R1.4157 CCCCCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210614 [0,0,0,1,0,0|2,0,0]=3 6536 B17R1.4157 CCCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210681 [0,0,0,1,0,0|1,0,0]=2 6537 B17R1.4157 CCCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210681 [0,0,0,1,0,0|1,0,0]=2 6538 B17R1.4157 CCCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210614 [0,0,0,1,0,0|1,0,0]=2 6539 B17R1.4157 CCCCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210681 [0,0,0,1,0,0|2,0,0]=3 6540 B17R1.4157 CCCCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210614 [0,0,0,1,0,0|2,0,0]=3 6541 B17R1.4157 CCCCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210314 [0,0,0,1,0,0|2,0,0]=3 6542 B17R1.4157 CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210314 [0,0,0,1,0,0|1,0,0]=2 6543 B17R1.4157 CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210314 [0,0,0,1,0,0|1,0,0]=2 6544 B17R1.4157 CCCCCNN=C1CCCCC1C(=O)OC 4a_100000694160_100011215843 [0,0,0,1,0,0|2,0,1]=4 6545 B17R1.4157 CCCCOCCN1CCCCC1C(=O)NC 2230a_100011209383_100000743108 [0,0,0,1,0,0|3,0,0]=4 6546 B17R1.4157 CCCCOCCN1CCCCC1C(=O)NC 269982a_100011209383_100000743108 [0,0,0,1,0,0|3,0,0]=4 6547 B17R1.4157 CCCCOCCN1CCCCC1C(=O)NC 34a_100011209383_100000743108 [0,0,0,1,0,0|3,0,0]=4 6548 B17R1.4157 CCCCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100000743108 [0,0,0,1,0,0|2,0,0]=3 6549 B17R1.4157 CCCCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100000743108 [0,0,0,1,0,0|2,0,0]=3 6550 B17R1.4157 CCCCOCCN1CCCCC1C(=O)OC 34a_100000734855_100000743108 [0,0,0,1,0,0|2,0,0]=3 6551 B17R1.4157 CCCCOCCN1CCOCC1C(=O)OC 2230a_100000765174_100000743108 [0,0,0,1,0,0|3,0,0]=4 6552 B17R1.4157 CCCCOCCN1CCOCC1C(=O)OC 34a_100000765174_100000743108 [0,0,0,1,0,0|3,0,0]=4 6553 B17R1.4157 CCCCOCOC1CCNCC1C(=O)OC 34a_200103168510_100011995733 [0,0,0,1,0,0|3,0,0]=4 6554 B17R1.4157 CCCCOCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011995733 [0,0,0,1,0,0|2,0,0]=3 6555 B17R1.4157 CCCOCCOC1CCNCC1C(=O)OC 34a_200103168510_100011215938 [0,0,0,1,0,0|3,0,0]=4 6556 B17R1.4157 CCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011215938 [0,0,0,1,0,0|2,0,0]=3 6557 B17R1.4157 CCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011215938 [0,0,0,1,0,0|2,0,0]=3 6558 B17R1.4157 CCOCCCOC1CCNCC1C(=O)OC 34a_200103168510_100012232248 [0,0,0,1,0,0|3,0,0]=4 6559 B17R1.4157 CCOCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100012232248 [0,0,0,1,0,0|2,0,0]=3 6560 B17R1.4157 CCOCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100012232248 [0,0,0,1,0,0|2,0,0]=3 6561 B17R1.4157 CNC(=O)C1CCCCN1CCCCCCF 2230a_100011209383_100015922095 [0,0,0,1,0,0|3,0,0]=4 6562 B17R1.4157 CNC(=O)C1CCCCN1CCCCCCF 269982a_100011209383_100015922095 [0,0,0,1,0,0|3,0,0]=4 6563 B17R1.4157 CNC(=O)C1CCCCN1CCCCCCF 34a_100011209383_100015922095 [0,0,0,1,0,0|3,0,0]=4 6564 B17R1.4157 CNC(=O)C1CCCCN1CCCCCCO 2230a_100011209383_100000766143 [0,0,0,1,0,0|3,0,0]=4 6565 B17R1.4157 CNC(=O)C1CCCCN1CCCCCCO 269982a_100011209383_100000766143 [0,0,0,1,0,0|3,0,0]=4 6566 B17R1.4157 CNC(=O)C1CCCCN1CCCCCCO 34a_100011209383_100000766143 [0,0,0,1,0,0|3,0,0]=4 6567 B17R1.4157 COC(=O)C1CCCCN1CCCCCC#N 2230a_100000734855_100009813376 [0,0,0,1,0,0|2,0,1]=4 6568 B17R1.4157 COC(=O)C1CCCCN1CCCCCC#N 269982a_100000734855_100009813376 [0,0,0,1,0,0|2,0,1]=4 6569 B17R1.4157 COC(=O)C1CCCCN1CCCCCC=O 2230a_100000734855_100000139337 [0,0,0,1,0,0|2,0,1]=4 6570 B17R1.4157 COC(=O)C1CCCCN1CCCCCC=O 269982a_100000734855_100000139337 [0,0,0,1,0,0|2,0,1]=4 6571 B17R1.4157 COC(=O)C1CCCCN1CCCCCCF 2230a_100000734855_100015922095 [0,0,0,1,0,0|2,0,0]=3 6572 B17R1.4157 COC(=O)C1CCCCN1CCCCCCF 269982a_100000734855_100015922095 [0,0,0,1,0,0|2,0,0]=3 6573 B17R1.4157 COC(=O)C1CCCCN1CCCCCCF 34a_100000734855_100015922095 [0,0,0,1,0,0|2,0,0]=3 6574 B17R1.4157 COC(=O)C1CCCCN1CCCCCCO 2230a_100000734855_100000766143 [0,0,0,1,0,0|2,0,0]=3 6575 B17R1.4157 COC(=O)C1CCCCN1CCCCCCO 269982a_100000734855_100000766143 [0,0,0,1,0,0|2,0,0]=3 6576 B17R1.4157 COC(=O)C1CCCCN1CCCCCCO 34a_100000734855_100000766143 [0,0,0,1,0,0|2,0,0]=3 6577 B17R1.4157 COC(=O)C1CNCCC1OCCCCCF 34a_200103168510_100000729378 [0,0,0,1,0,0|3,0,0]=4 6578 B17R1.4157 COC(=O)C1CNCCC1OCCCCCO 34a_200103168510_100000746330 [0,0,0,1,0,0|3,0,0]=4 6579 B17R1.4157 COC(=O)C1COCCN1CCCCCCF 2230a_100000765174_100015922095 [0,0,0,1,0,0|3,0,0]=4 6580 B17R1.4157 COC(=O)C1COCCN1CCCCCCF 34a_100000765174_100015922095 [0,0,0,1,0,0|3,0,0]=4 6581 B17R1.4157 COC(=O)C1COCCN1CCCCCCO 2230a_100000765174_100000766143 [0,0,0,1,0,0|3,0,0]=4 6582 B17R1.4157 COC(=O)C1COCCN1CCCCCCO 34a_100000765174_100000766143 [0,0,0,1,0,0|3,0,0]=4 6583 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCC#N 7a_100015709673_100000211819 [0,0,0,1,0,0|2,0,1]=4 6584 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCC=O 7a_100015709673_100000139335 [0,0,0,1,0,0|2,0,1]=4 6585 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCF 34a_100015709673_100000729378 [0,0,0,1,0,0|2,0,0]=3 6586 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCF 7a_100015709673_100000729378 [0,0,0,1,0,0|2,0,0]=3 6587 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCO 34a_100015709673_100000746330 [0,0,0,1,0,0|2,0,0]=3 6588 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCO 7a_100015709673_100000746330 [0,0,0,1,0,0|2,0,0]=3 6589 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCOCCO 34a_100015709673_100000692535 [0,0,0,1,0,0|3,0,0]=4 6590 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCOCCO 7a_100015709673_100011215305 [0,0,0,1,0,0|3,0,0]=4 6591 B17R1.4157 COCCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000755781 [0,0,0,1,0,0|3,0,0]=4 6592 B17R1.4157 COCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000755781 [0,0,0,1,0,0|2,0,0]=3 6593 B17R1.4157 COCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000730899 [0,0,0,1,0,0|2,0,0]=3 6594 B17R1.4157 COCCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100000695917 [0,0,0,1,0,0|3,0,0]=4 6595 B17R1.4157 COCCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100000695917 [0,0,0,1,0,0|3,0,0]=4 6596 B17R1.4157 COCCOCCN1CCCCC1C(=O)OC 34a_100000734855_100000695917 [0,0,0,1,0,0|3,0,0]=4 6597 B17R1.4167 C#CCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100012094781 [0,0,0,1,0,0|1,0,2]=4 6598 B17R1.4167 C#CCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100012094781 [0,0,0,1,0,0|1,0,2]=4 6599 B17R1.4167 C#CCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100012094781 [0,0,0,1,0,0|1,0,2]=4 6600 B17R1.4167 C=CCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000700193 [0,0,0,1,0,0|1,0,2]=4 6601 B17R1.4167 C=CCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000700193 [0,0,0,1,0,0|1,0,2]=4 6602 B17R1.4167 C=CCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000700193 [0,0,0,1,0,0|1,0,2]=4 6603 B17R1.4167 CCCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210681 [0,0,0,1,0,0|1,0,0]=2 6604 B17R1.4167 CCCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210681 [0,0,0,1,0,0|1,0,0]=2 6605 B17R1.4167 CCCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210614 [0,0,0,1,0,0|1,0,0]=2 6606 B17R1.4167 CCCCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000743108 [0,0,0,1,0,0|2,0,0]=3 6607 B17R1.4167 CCCCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000743108 [0,0,0,1,0,0|2,0,0]=3 6608 B17R1.4167 CCCCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000743108 [0,0,0,1,0,0|2,0,0]=3 6609 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCC#N 2230a_100025726698_100009813376 [0,0,0,1,0,0|2,0,1]=4 6610 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCC#N 269982a_100025726698_100009813376 [0,0,0,1,0,0|2,0,1]=4 6611 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCC=O 2230a_100025726698_100000139337 [0,0,0,1,0,0|2,0,1]=4 6612 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCC=O 269982a_100025726698_100000139337 [0,0,0,1,0,0|2,0,1]=4 6613 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCF 2230a_100025726698_100015922095 [0,0,0,1,0,0|2,0,0]=3 6614 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCF 269982a_100025726698_100015922095 [0,0,0,1,0,0|2,0,0]=3 6615 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCF 34a_100025726698_100015922095 [0,0,0,1,0,0|2,0,0]=3 6616 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCO 2230a_100025726698_100000766143 [0,0,0,1,0,0|2,0,0]=3 6617 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCO 269982a_100025726698_100000766143 [0,0,0,1,0,0|2,0,0]=3 6618 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCO 34a_100025726698_100000766143 [0,0,0,1,0,0|2,0,0]=3 6619 B17R1.4167 COCCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000695917 [0,0,0,1,0,0|3,0,0]=4 6620 B17R1.4167 COCCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000695917 [0,0,0,1,0,0|3,0,0]=4 6621 B17R1.4167 COCCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000695917 [0,0,0,1,0,0|3,0,0]=4 6622 B17R1.5249 CCCCCCCCCCCNC1CCC1=O 34a_200011215754_100009892977 [0,0,0,1,0,0|2,0,0]=3 6623 B17R1.5249 CCCCCCCCCCCOC1CCC1=O 34a_100000210809_100009892977 [0,0,0,1,0,0|2,0,0]=3 6624 B17R1.5249 CCCCCCCCCCCOC1CCC1=O 7a_100000210809_100009892977 [0,0,0,1,0,0|2,0,0]=3 6625 B17R1.5249 CCCCCCCCCCCSC1CCC1=O 62a_100009892977_100011215454 [0,0,0,1,0,0|2,0,0]=3 6626 B17R1.5249 CCCCCCCCCNCCC1CCC1=O 2230a_100000212291_200016118888 [0,0,0,1,0,0|2,0,0]=3 6627 B17R1.5249 CCCCCCCCCOCCC1CCC1=O 7a_100000210712_200016118888 [0,0,0,1,0,0|2,0,0]=3 6628 B17R1.5249 CCCCCCCCCSCCC1CCC1=O 62a_200016118888_100000210670 [0,0,0,1,0,0|2,0,0]=3 6629 B17R1.5249 CCCCCCOCCOCCC1CCC1=O 7a_100000691444_200016118888 [0,0,0,1,0,0|3,0,0]=4 6630 B17R1.5249 CCCCOCCCCOCCC1CCC1=O 7a_200000760531_200016118888 [0,0,0,1,0,0|3,0,0]=4 6631 B17R1.5249 NCCCCCCCCCCOC1CCC1=O 34a_100000066964_100009892977 [0,0,0,1,0,0|3,0,0]=4 6632 B17R1.5249 O=C1CCC1CCNCCCCCCCCO 2230a_102515433106_200016118888 [0,0,0,1,0,0|3,0,0]=4 6633 B17R1.5249 O=C1CCC1CCOCCCCCCCCBr 7a_100009813846_200016118888 [0,0,0,1,0,0|3,0,0]=4 6634 B17R1.5249 O=C1CCC1CCOCCCCCCCCCl 7a_100000033203_200016118888 [0,0,0,1,0,0|3,0,0]=4 6635 B17R1.5249 O=C1CCC1CCSCCCCCCCCO 62a_100000033203_200016118888 [0,0,0,1,0,0|3,0,0]=4 6636 B17R1.5249 O=C1CCC1CCSCCCCCCCCO 62a_200016118888_100000033203 [0,0,0,1,0,0|3,0,0]=4 6637 B17R1.5249 O=C1CCC1NCCCCCCCCCCO 34a_100000066964_100009892977 [0,0,0,1,0,0|3,0,0]=4 6638 B17R1.5249 O=C1CCC1OCCCCCCCCCCBr 34a_100009813290_100009892977 [0,0,0,1,0,0|3,0,0]=4 6639 B17R1.5249 O=C1CCC1OCCCCCCCCCCBr 7a_100009813290_100009892977 [0,0,0,1,0,0|3,0,0]=4 6640 B17R1.5249 O=C1CCC1OCCCCCCCCCCCl 34a_200000033068_100009892977 [0,0,0,1,0,0|3,0,0]=4 6641 B17R1.5249 O=C1CCC1OCCCCCCCCCCCl 7a_200000033068_100009892977 [0,0,0,1,0,0|3,0,0]=4 6642 B17R1.5249 O=C1CCC1SCCCCCCCCCCO 62a_100009813290_100009892977 [0,0,0,1,0,0|3,0,0]=4 6643 B17R1.5249 O=C1CCC1SCCCCCCCCCCO 62a_100009892977_200000033068 [0,0,0,1,0,0|3,0,0]=4 6644 B17R1.5256 CCCCC1C=CCN1CCCCC(=O)OC 2230a_100015184376_100000204269 [0,0,0,1,0,0|1,0,2]=4 6645 B17R1.5256 CCCCC1C=CCN1CCCCC(=O)OC 269982a_100015184376_100000204269 [0,0,0,1,0,0|1,0,2]=4 6646 B17R1.5256 CCCCC1C=CCN1CCCCC(=O)OC 34a_100015184376_100000204269 [0,0,0,1,0,0|1,0,2]=4 6647 B17R1.5256 CCCCC1CCCC1NCCCC(=O)NC 269862a_100000740002_100000750825 [0,0,0,1,0,0|2,0,0]=3 6648 B17R1.5256 CCCCC1CCCC1NCCCC(=O)NC 270004a_100000740002_100000750825 [0,0,0,1,0,0|2,0,0]=3 6649 B17R1.5256 CCCCC1CCCC1NCCNC(=O)CC 269862a_100132302217_100000750825 [0,0,0,1,0,0|3,0,0]=4 6650 B17R1.5256 CCCCC1CCCC1NCCNC(=O)CC 270004a_100132302217_100000750825 [0,0,0,1,0,0|3,0,0]=4 6651 B17R1.5256 CCCCC1CCCC1NCCNC(=O)NC 269862a_100015205895_100000750825 [0,0,0,1,0,0|3,0,0]=4 6652 B17R1.7892 CCCCCCCCCCCCCN1CCC1 269982a_100000754969_100000210684 [0,0,0,1,0,0|3,0,0]=4 6653 B17R1.7892 CCCCCCCCCCCNCC1CCO1 2230a_200011215754_100000103362 [0,0,0,1,0,0|2,0,1]=4 6654 B17R1.7892 CCCCCCCCCCCNCC1CCO1 34a_200011215754_100000103362 [0,0,0,1,0,0|2,0,1]=4 6655 B17R1.7892 CCCCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011215454 [0,0,0,1,0,0|2,0,1]=4 6656 B17R1.7892 CCCCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100011215454 [0,0,0,1,0,0|2,0,1]=4 6657 B17R1.7892 CCCCCCCCCCCOCC1CCO1 34a_100000039022_100011215454 [0,0,0,1,0,0|2,0,1]=4 6658 B17R1.7892 CCCCCCCCCCCOCC1CCO1 34a_100000210809_100000103362 [0,0,0,1,0,0|2,0,1]=4 6659 B17R1.7892 CCCCCCCCCCCOCC1CCO1 7a_100000210809_100000103362 [0,0,0,1,0,0|2,0,1]=4 6660 B17R1.7892 CCCCCCCCCCCSCC1CCO1 62a_100000103362_100011215454 [0,0,0,1,0,0|2,0,1]=4 6661 B17R1.7908 C#CCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100012276617 [0,0,0,1,0,0|1,0,2]=4 6662 B17R1.7908 C#CCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100012276617 [0,0,0,1,0,0|1,0,2]=4 6663 B17R1.7908 C#CCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100012094781 [0,0,0,1,0,0|1,0,2]=4 6664 B17R1.7908 C#CCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100012094781 [0,0,0,1,0,0|1,0,2]=4 6665 B17R1.7908 C=CCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011215473 [0,0,0,1,0,0|1,0,2]=4 6666 B17R1.7908 C=CCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011215473 [0,0,0,1,0,0|1,0,2]=4 6667 B17R1.7908 C=CCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000700193 [0,0,0,1,0,0|1,0,2]=4 6668 B17R1.7908 C=CCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000700193 [0,0,0,1,0,0|1,0,2]=4 6669 B17R1.7908 CCCCCC#CCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100009816472 [0,0,0,1,0,0|1,0,2]=4 6670 B17R1.7908 CCCCCC#CCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100009816472 [0,0,0,1,0,0|1,0,2]=4 6671 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210759 [0,0,0,1,0,0|2,0,0]=3 6672 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210759 [0,0,0,1,0,0|2,0,0]=3 6673 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000210759 [0,0,0,1,0,0|2,0,0]=3 6674 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210759 [0,0,0,1,0,0|1,0,0]=2 6675 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210759 [0,0,0,1,0,0|1,0,0]=2 6676 B17R1.7908 CCCCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210759 [0,0,0,1,0,0|2,0,0]=3 6677 B17R1.7908 CCCCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210759 [0,0,0,1,0,0|2,0,0]=3 6678 B17R1.7908 CCCCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210759 [0,0,0,1,0,0|2,0,0]=3 6679 B17R1.7908 CCCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210614 [0,0,0,1,0,0|1,0,0]=2 6680 B17R1.7908 CCCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210614 [0,0,0,1,0,0|1,0,0]=2 6681 B17R1.7908 CCCCOCCOC1CCCC1C(=O)OC 34a_200000081814_100000743108 [0,0,0,1,0,0|2,0,0]=3 6682 B17R1.7908 CCCCOCCOC1CCCC1C(=O)OC 7a_200000081814_100000743108 [0,0,0,1,0,0|2,0,0]=3 6683 B17R1.7908 CCOCCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011211534 [0,0,0,1,0,0|3,0,0]=4 6684 B17R1.7908 CCOCCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011211534 [0,0,0,1,0,0|3,0,0]=4 6685 B17R1.7908 CNC(=O)[C@@H]1CCCN1CCCCCCCO 2230a_100015185040_100000760002 [0,0,0,1,0,0|3,0,0]=4 6686 B17R1.7908 CNC(=O)[C@@H]1CCCN1CCCCCCCO 269982a_100015185040_100000760002 [0,0,0,1,0,0|3,0,0]=4 6687 B17R1.7908 CNC(=O)[C@@H]1CCCN1CCCCCCCO 34a_100015185040_100000760002 [0,0,0,1,0,0|3,0,0]=4 6688 B17R1.7908 CNC(=O)[C@@H]1CCCN1CCCCCCOC 2230a_100015185040_100011998445 [0,0,0,1,0,0|3,0,0]=4 6689 B17R1.7908 CNC(=O)[C@@H]1CCCN1CCCCCCOC 269982a_100015185040_100011998445 [0,0,0,1,0,0|3,0,0]=4 6690 B17R1.7908 CNC(=O)[C@@H]1CCCN1CCCCCCOC 34a_100015185040_100011998445 [0,0,0,1,0,0|3,0,0]=4 6691 B17R1.7908 COC(=O)C1CCCC1OCCCCCC#N 7a_200000081814_100009813376 [0,0,0,1,0,0|2,0,1]=4 6692 B17R1.7908 COC(=O)C1CCCC1OCCCCCC=O 7a_200000081814_100000139337 [0,0,0,1,0,0|2,0,1]=4 6693 B17R1.7908 COC(=O)C1CCCC1OCCCCCCF 34a_200000081814_100015922095 [0,0,0,1,0,0|2,0,0]=3 6694 B17R1.7908 COC(=O)C1CCCC1OCCCCCCF 7a_200000081814_100015922095 [0,0,0,1,0,0|2,0,0]=3 6695 B17R1.7908 COC(=O)C1CCCC1OCCCCCCO 34a_200000081814_100000766143 [0,0,0,1,0,0|2,0,0]=3 6696 B17R1.7908 COC(=O)C1CCCC1OCCCCCCO 7a_200000081814_100000766143 [0,0,0,1,0,0|2,0,0]=3 6697 B17R1.7908 COC(=O)C1CSCN1CCCCCCCO 269982a_200000724679_100000760002 [0,0,0,1,0,0|3,0,0]=4 6698 B17R1.7908 COC(=O)C1SCCN1CCCCCCCO 2230a_100015296106_100000760002 [0,0,0,1,0,0|3,0,0]=4 6699 B17R1.7908 COC(=O)C1SCCN1CCCCCCCO 269982a_100015296106_100000760002 [0,0,0,1,0,0|3,0,0]=4 6700 B17R1.7908 COC(=O)[C@@H]1CCCN1CCCCCCC#N 2230a_100000752040_100009813337 [0,0,0,1,0,0|2,0,1]=4 6701 B17R1.7908 COC(=O)[C@@H]1CCCN1CCCCCCC#N 269982a_100000752040_100009813337 [0,0,0,1,0,0|2,0,1]=4 6702 B17R1.7908 COC(=O)[C@@H]1CCCN1CCCCCCCO 2230a_100000752040_100000760002 [0,0,0,1,0,0|2,0,0]=3 6703 B17R1.7908 COC(=O)[C@@H]1CCCN1CCCCCCCO 269982a_100000752040_100000760002 [0,0,0,1,0,0|2,0,0]=3 6704 B17R1.7908 COCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011998445 [0,0,0,1,0,0|2,0,0]=3 6705 B17R1.7908 COCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011998445 [0,0,0,1,0,0|2,0,0]=3 6706 B17R1.7908 COCCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100011998445 [0,0,0,1,0,0|3,0,0]=4 6707 B17R1.7908 COCCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100011998445 [0,0,0,1,0,0|3,0,0]=4 6708 B17R1.7908 COCCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100011998445 [0,0,0,1,0,0|3,0,0]=4 6709 B17R1.7908 COCCOCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011216529 [0,0,0,1,0,0|3,0,0]=4 6710 B17R1.7908 COCCOCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011216529 [0,0,0,1,0,0|3,0,0]=4 6711 B17R1.7908 COCCOCCOC1CCCC1C(=O)OC 34a_200000081814_100000695917 [0,0,0,1,0,0|3,0,0]=4 6712 B17R1.7908 COCCOCCOC1CCCC1C(=O)OC 7a_200000081814_100000695917 [0,0,0,1,0,0|3,0,0]=4 6713 B17R1.8476 CCCCNN=C1CCCCCC1C(=O)OC 4a_100025702795_100000183596 [0,0,0,1,0,0|2,0,1]=4 6714 B17R1.10629 CCCCCCCCCCCNCC1(CO1)C 34a_200011215754_100000760498 [0,0,0,1,0,0|2,0,1]=4 6715 B17R1.10629 CCCCCCCCCCCOCC1(CO1)C 34a_100000210809_100000760498 [0,0,0,1,0,0|2,0,1]=4 6716 B17R1.10629 CCCCCCCCCCCSCC1(CO1)C 62a_100000760498_100011215454 [0,0,0,1,0,0|2,0,1]=4 6717 B17R1.10688 CCCCCCCCCCCN1CC(C1)OC 269982a_100000755009_100011215454 [0,0,0,1,0,0|2,0,1]=4 6718 B17R1.10688 CCCCCCCCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100000210320 [0,0,0,1,0,0|2,0,1]=4 6719 B17R1.10851 CCCCCCCCCN1CCCC(C1)OC 2230a_100000695604_100011214924 [0,0,0,1,0,0|2,0,1]=4 6720 B17R1.10851 CCCCCCCCCN1CCCC(C1)OC 269982a_100000695604_100000210670 [0,0,0,1,0,0|2,0,1]=4 6721 B17R1.10851 CCCCCCCCCN1CCCC(C1)OC 34a_100000695604_100011214924 [0,0,0,1,0,0|2,0,1]=4 6722 B17R1.16941 CNC(=O)CCN1CCCCC1CCCOC 2230a_100011804088_100000737683 [0,0,0,1,0,0|3,0,0]=4 6723 B17R1.16941 CNC(=O)CCN1CCCCC1CCCOC 269982a_100011804088_100000737683 [0,0,0,1,0,0|3,0,0]=4 6724 B17R1.16941 CNC(=O)CCN1CCCCC1CCCOC 34a_100011804088_100012179268 [0,0,0,1,0,0|3,0,0]=4 6725 B17R1.16941 COCCCC1CCCCN1CCC(=O)OC 2230a_100011804088_100000204255 [0,0,0,1,0,0|2,0,0]=3 6726 B17R1.16941 COCCCC1CCCCN1CCC(=O)OC 269982a_100011804088_100000204255 [0,0,0,1,0,0|2,0,0]=3 6727 B17R1.16941 COCCCC1CCCCN1CCC(=O)OC 34a_100011804088_100000742370 [0,0,0,1,0,0|2,0,0]=3 6728 B17R1.17837 COCC1CCN1CCCCCCC(=O)OC 2230a_100015195929_100009815986 [0,0,0,1,0,0|2,0,0]=3 6729 B17R1.17837 COCC1CCN1CCCCCCC(=O)OC 269982a_100015195929_100009815986 [0,0,0,1,0,0|2,0,0]=3 6730 B17R1.17837 COCC1CCN1CCCCCCC(=O)OC 34a_100015195929_100009815986 [0,0,0,1,0,0|2,0,0]=3 6731 B17R1.23822 CCC(=O)C1CCCCCCCCCCC1=O 1458a_100000210414_200009990614 [0,0,0,1,0,0|2,0,1]=4 6732 B17R1.24151 COC(=O)CCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100010282707 [0,0,0,1,0,0|2,0,0]=3 6733 B17R1.24151 COC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100010282707 [0,0,0,1,0,0|2,0,0]=3 6734 B17R1.24151 COC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100010282707 [0,0,0,1,0,0|2,0,0]=3 6735 B17R1.24151 COC(=O)CCCCCCCOCC1CC1C 34a_100000744939_100010004213 [0,0,0,1,0,0|1,0,0]=2 6736 B17R1.24151 COC(=O)CCCCCCCOCC1CC1C 7a_100000744939_100010004213 [0,0,0,1,0,0|1,0,0]=2 6737 B17R1.24152 COC(=O)CCCCCCCCCN1CCC1 269982a_100000754969_100009813843 [0,0,0,1,0,0|1,0,0]=2 6738 B17R1.24152 COC(=O)CCCCCCCCNC1CCC1 2230a_100000749019_100010282707 [0,0,0,1,0,0|1,0,0]=2 6739 B17R1.24152 COC(=O)CCCCCCCCNC1CCC1 34a_100000749019_100010282707 [0,0,0,1,0,0|1,0,0]=2 6740 B17R1.24152 COC(=O)CCCCCCCCNC1COC1 2230a_100016991112_100010282707 [0,0,0,1,0,0|2,0,0]=3 6741 B17R1.24152 COC(=O)CCCCCCCCOC1CCC1 34a_100000035544_100000749161 [0,0,0,1,0,0|1,0,0]=2 6742 B17R1.24152 COC(=O)CCCCCCCCOC1CCC1 34a_100000748187_100010282707 [0,0,0,1,0,0|1,0,0]=2 6743 B17R1.24152 COC(=O)CCCCCCCCOC1COC1 34a_100000035544_100009818527 [0,0,0,1,0,0|2,0,0]=3 6744 B17R1.24152 COC(=O)CCCCCCCCOC1COC1 7a_100000035544_100009818527 [0,0,0,1,0,0|2,0,0]=3 6745 B17R1.24152 COC(=O)CCCCCCCCOC1CSC1 7a_100000072292_100010282707 [0,0,0,1,0,0|2,0,0]=3 6746 B17R1.24152 COC(=O)CCCCCCCCSC1CCC1 62a_100010282707_100000749161 [0,0,0,1,0,0|1,0,0]=2 6747 B17R1.24152 COC(=O)CCCCCCCCSC1COC1 62a_100010282707_100009818527 [0,0,0,1,0,0|2,0,0]=3 6748 B17R1.24152 COC(=O)CCCCCCCNCC1CCC1 2230a_100000738700_100010004213 [0,0,0,1,0,0|1,0,0]=2 6749 B17R1.24152 COC(=O)CCCCCCCNCC1CCC1 34a_100000738700_100010004213 [0,0,0,1,0,0|1,0,0]=2 6750 B17R1.24152 COC(=O)CCCCCCCNCC1COC1 2230a_100015281925_100010004213 [0,0,0,1,0,0|2,0,0]=3 6751 B17R1.24152 COC(=O)CCCCCCCNCC1COC1 34a_100015281925_100010004213 [0,0,0,1,0,0|2,0,0]=3 6752 B17R1.24152 COC(=O)CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100010004213 [0,0,0,1,0,0|2,0,0]=3 6753 B17R1.24152 COC(=O)CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100010004213 [0,0,0,1,0,0|2,0,0]=3 6754 B17R1.24152 COC(=O)CCCCCCCOCC1CCC1 34a_100000760304_100010004213 [0,0,0,1,0,0|1,0,0]=2 6755 B17R1.24152 COC(=O)CCCCCCCOCC1CCC1 34a_100011022521_100000763275 [0,0,0,1,0,0|1,0,0]=2 6756 B17R1.24152 COC(=O)CCCCCCCOCC1CCC1 7a_100011022521_100000763275 [0,0,0,1,0,0|1,0,0]=2 6757 B17R1.24152 COC(=O)CCCCCCCOCC1CCO1 34a_100000039022_100010004213 [0,0,0,1,0,0|2,0,0]=3 6758 B17R1.24152 COC(=O)CCCCCCCOCC1CCO1 34a_100011022521_100000103362 [0,0,0,1,0,0|2,0,0]=3 6759 B17R1.24152 COC(=O)CCCCCCCOCC1CCO1 7a_100011022521_100000103362 [0,0,0,1,0,0|2,0,0]=3 6760 B17R1.24152 COC(=O)CCCCCCCOCC1CNC1 34a_100016987283_100010004213 [0,0,0,1,0,0|2,0,0]=3 6761 B17R1.24152 COC(=O)CCCCCCCOCC1COC1 34a_100000060846_100010004213 [0,0,0,1,0,0|2,0,0]=3 6762 B17R1.24152 COC(=O)CCCCCCCOCC1COC1 34a_100011022521_100010264016 [0,0,0,1,0,0|2,0,0]=3 6763 B17R1.24152 COC(=O)CCCCCCCOCC1COC1 7a_100011022521_100010264016 [0,0,0,1,0,0|2,0,0]=3 6764 B17R1.24152 COC(=O)CCCCCCCSCC1CCC1 62a_100000763275_100010004213 [0,0,0,1,0,0|1,0,0]=2 6765 B17R1.24152 COC(=O)CCCCCCCSCC1CCC1 62a_100010004213_100000763275 [0,0,0,1,0,0|1,0,0]=2 6766 B17R1.24152 COC(=O)CCCCCCCSCC1CCO1 62a_100000103362_100010004213 [0,0,0,1,0,0|2,0,0]=3 6767 B17R1.24152 COC(=O)CCCCCCCSCC1CCO1 62a_100010004213_100000103362 [0,0,0,1,0,0|2,0,0]=3 6768 B17R1.24152 COC(=O)CCCCCCCSCC1COC1 62a_100010004213_100010264016 [0,0,0,1,0,0|2,0,0]=3 6769 B17R1.24152 COC(=O)CCCCCCCSCC1COC1 62a_100010264016_100010004213 [0,0,0,1,0,0|2,0,0]=3 6770 B17R1.24152 COC(=O)CCCCCCOCCC1COC1 34a_100009855314_100009815986 [0,0,0,1,0,0|2,0,0]=3 6771 B17R1.24152 COC(=O)CCOCCOCCOC1CCC1 34a_100010982084_100000749161 [0,0,0,1,0,0|3,0,0]=4 6772 B17R1.24152 COC(=O)COCCOCCOCC1CCC1 34a_100011023656_100000763275 [0,0,0,1,0,0|3,0,0]=4 6773 B17R1.24152 COC(=O)COCCOCCOCC1CCC1 7a_100011023656_100000763275 [0,0,0,1,0,0|3,0,0]=4 6774 B17R1.24253 CNC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000741757 [0,0,0,1,0,0|2,0,0]=3 6775 B17R1.24253 CNC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100000741757 [0,0,0,1,0,0|2,0,0]=3 6776 B17R1.24253 CNC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737683 [0,0,0,1,0,0|2,0,0]=3 6777 B17R1.24253 CNC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100012179268 [0,0,0,1,0,0|2,0,0]=3 6778 B17R1.24253 CNC(=O)OCCOCC1CCCCCCC1 34a_100011216312_200011997002 [0,0,0,1,0,0|3,0,0]=4 6779 B17R1.24253 CNC(=O)OCCOCC1CCCCCCC1 7a_100011216312_200011997002 [0,0,0,1,0,0|3,0,0]=4 6780 B17R1.24253 COC(=O)/C=C/COCC1CCCCCCC1 34a_100011216312_100000742655 [0,0,0,1,0,0|1,0,2]=4 6781 B17R1.24253 COC(=O)/C=C/COCC1CCCCCCC1 7a_100011216312_100000742655 [0,0,0,1,0,0|1,0,2]=4 6782 B17R1.24253 COC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100009816466 [0,0,0,1,0,0|1,0,0]=2 6783 B17R1.24253 COC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100009816466 [0,0,0,1,0,0|1,0,0]=2 6784 B17R1.24253 COC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100009816466 [0,0,0,1,0,0|1,0,0]=2 6785 B17R1.24253 COC(=O)CCCCNC1CCCCCCC1 2230a_100000211152_100000204269 [0,0,0,1,0,0|1,0,0]=2 6786 B17R1.24253 COC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100000204269 [0,0,0,1,0,0|1,0,0]=2 6787 B17R1.24253 COC(=O)CCCCOC1C=CCCCCC1 34a_100000688657_100000204269 [0,0,0,1,0,0|1,0,2]=4 6788 B17R1.24253 COC(=O)CCCCOC1CC/C=C\CCC1 34a_100000059025_100021000466 [0,0,0,1,0,0|1,0,2]=4 6789 B17R1.24253 COC(=O)CCCCOC1CC/C=C\CCC1 34a_100016989180_100000204269 [0,0,0,1,0,0|1,0,2]=4 6790 B17R1.24253 COC(=O)CCCCOC1CC/C=C\CCC1 7a_100000059025_100021000466 [0,0,0,1,0,0|1,0,2]=4 6791 B17R1.24253 COC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100000204269 [0,0,0,1,0,0|1,0,0]=2 6792 B17R1.24253 COC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000204269 [0,0,0,1,0,0|1,0,0]=2 6793 B17R1.24253 COC(=O)CCCCSC1CC/C=C\CCC1 62a_100000204269_100021000466 [0,0,0,1,0,0|1,0,2]=4 6794 B17R1.24253 COC(=O)CCCCSC1CC/C=C\CCC1 62a_100021000466_100000204269 [0,0,0,1,0,0|1,0,2]=4 6795 B17R1.24253 COC(=O)CCCNCC1CC/C=C\CCC1 2230a_100102730862_100011218270 [0,0,0,1,0,0|1,0,2]=4 6796 B17R1.24253 COC(=O)CCCNCC1CC/C=C\CCC1 34a_100102730862_100000742333 [0,0,0,1,0,0|1,0,2]=4 6797 B17R1.24253 COC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000742333 [0,0,0,1,0,0|1,0,0]=2 6798 B17R1.24253 COC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011218270 [0,0,0,1,0,0|1,0,0]=2 6799 B17R1.24253 COC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000204255 [0,0,0,1,0,0|1,0,0]=2 6800 B17R1.24253 COC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000742370 [0,0,0,1,0,0|1,0,0]=2 6801 B17R1.24253 COC(=O)COCCNC1CCCCCCC1 2230a_100000211152_100000090808 [0,0,0,1,0,0|2,0,0]=3 6802 B17R1.24253 COC(=O)COCCNC1CCCCCCC1 34a_100000211152_100000090808 [0,0,0,1,0,0|2,0,0]=3 6803 B17R1.24253 COC(=O)COCCOC1CCCCCCC1 34a_100000210054_100000090808 [0,0,0,1,0,0|2,0,0]=3 6804 B17R1.24253 COC(=O)COCCOC1CCCCCCC1 7a_100000210054_100000090808 [0,0,0,1,0,0|2,0,0]=3 6805 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100010004213 [0,0,0,1,0,0|1,0,0]=2 6806 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100010004213 [0,0,0,1,0,0|1,0,0]=2 6807 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100010004213 [0,0,0,1,0,0|1,0,0]=2 6808 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100010004213 [0,0,0,1,0,0|1,0,0]=2 6809 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@H]1C 34a_100015189458_100010004213 [0,0,0,1,0,0|1,0,0]=2 6810 B17R1.24374 COC(=O)CCCCCCCN1CCSC1C 2230a_200011216479_100010004213 [0,0,0,1,0,0|2,0,0]=3 6811 B17R1.24374 COC(=O)CCCCCCCN1CCSC1C 269982a_200011216479_100010004213 [0,0,0,1,0,0|2,0,0]=3 6812 B17R1.24374 COC(=O)CCCCCCCN1CCSC1C 34a_200011216479_100010004213 [0,0,0,1,0,0|2,0,0]=3 6813 B17R1.24374 COC(=O)CCCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100009815986 [0,0,0,1,0,0|3,0,0]=4 6814 B17R1.24374 COC(=O)CCCCCCOC1CCCC1=O 34a_100009863599_100000709159 [0,0,0,1,0,0|2,0,1]=4 6815 B17R1.24374 COC(=O)CCCCCCOC1CCCC1=O 34a_200000719330_100009815986 [0,0,0,1,0,0|2,0,1]=4 6816 B17R1.24374 COC(=O)CCCCCCOC1CCCC1=O 7a_100009863599_100000211823 [0,0,0,1,0,0|2,0,1]=4 6817 B17R1.24374 COC(=O)CCCCCCOC1CCCC1C 34a_100011216460_100009815986 [0,0,0,1,0,0|1,0,0]=2 6818 B17R1.24374 COC(=O)CCCCCCOC1CCCC1C 7a_100011216460_100009815986 [0,0,0,1,0,0|1,0,0]=2 6819 B17R1.24374 COC(=O)CCCCCCOC1COCC1O 34a_100009863599_200000725654 [0,0,0,1,0,0|3,0,0]=4 6820 B17R1.24374 COC(=O)CCCCCCOC1COCC1O 7a_100009863599_200000725654 [0,0,0,1,0,0|3,0,0]=4 6821 B17R1.24374 COC(=O)CCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009815986 [0,0,0,1,0,0|2,0,0]=3 6822 B17R1.24374 COC(=O)CCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009815986 [0,0,0,1,0,0|2,0,0]=3 6823 B17R1.24374 COC(=O)CCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009815986 [0,0,0,1,0,0|2,0,0]=3 6824 B17R1.24374 COC(=O)CCCCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100009815986 [0,0,0,1,0,0|3,0,0]=4 6825 B17R1.24374 COC(=O)CCCCCCSC1CCCC1=O 62a_100000211823_100009815986 [0,0,0,1,0,0|2,0,1]=4 6826 B17R1.24374 COC(=O)CCCCCCSC1CCCC1=O 62a_100009815986_100000211823 [0,0,0,1,0,0|2,0,1]=4 6827 B17R1.24374 COC(=O)CCCCCCSC1COCC1O 62a_100009815986_200000725654 [0,0,0,1,0,0|3,0,0]=4 6828 B17R1.24374 COC(=O)CCCCCCSC1COCC1O 62a_200000725654_100009815986 [0,0,0,1,0,0|3,0,0]=4 6829 B17R1.24374 COC(=O)CCCCCCS[C@@H]1CCC[C@H]1O 62a_100009815986_200016002552 [0,0,0,1,0,0|2,0,0]=3 6830 B17R1.24374 COC(=O)CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009815986 [0,0,0,1,0,0|2,0,0]=3 6831 B17R1.24374 COC(=O)CCCCCOCC1CCCN1C 34a_100000743107_100009816466 [0,0,0,1,0,0|2,0,0]=3 6832 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 34a_100000059025_100000005710 [0,0,0,1,0,0|2,0,0]=3 6833 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 34a_100011215177_100000204269 [0,0,0,1,0,0|2,0,0]=3 6834 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 7a_100000059025_100000005710 [0,0,0,1,0,0|2,0,0]=3 6835 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 7a_100011215177_100000204269 [0,0,0,1,0,0|2,0,0]=3 6836 B17R1.24374 COC(=O)CCCCSCCC1CCCN1C 62a_100000005710_100000204269 [0,0,0,1,0,0|2,0,0]=3 6837 B17R1.24374 COC(=O)CCCCSCCC1CCCN1C 62a_100000204269_100000005710 [0,0,0,1,0,0|2,0,0]=3 6838 B17R1.24374 COC(=O)COCCOCCC1CCCN1C 34a_100011215177_100000090808 [0,0,0,1,0,0|3,0,0]=4 6839 B17R1.24374 COC(=O)COCCOCCC1CCCN1C 7a_100011215177_100000090808 [0,0,0,1,0,0|3,0,0]=4 6840 B17R1.24374 COC(=O)COCCSCCC1CCCN1C 62a_100000005710_100000090808 [0,0,0,1,0,0|3,0,0]=4 6841 B17R1.24374 COC(=O)COCCSCCC1CCCN1C 62a_100000090808_100000005710 [0,0,0,1,0,0|3,0,0]=4 6842 B17R1.24379 COC(=O)CCCCCCCCN1CCC1C 269982a_100000755817_100010282707 [0,0,0,1,0,0|1,0,0]=2 6843 B17R1.24379 COC(=O)CCCCCCCCN1CCC1C 34a_100000755817_100010282707 [0,0,0,1,0,0|1,0,0]=2 6844 B17R1.24379 COC(=O)CCCCCCCOC1CCC1=O 34a_100011022521_100009892977 [0,0,0,1,0,0|2,0,1]=4 6845 B17R1.24379 COC(=O)CCCCCCCOC1CCC1=O 7a_100011022521_100009892977 [0,0,0,1,0,0|2,0,1]=4 6846 B17R1.24379 COC(=O)CCCCCCCSC1CCC1=O 62a_100009892977_100010004213 [0,0,0,1,0,0|2,0,1]=4 6847 B17R1.24379 COC(=O)CCCCCCCSC1CCC1=O 62a_100010004213_100009892977 [0,0,0,1,0,0|2,0,1]=4 6848 B17R1.24379 COC(=O)CCCCCOCCC1CCC1=O 7a_100000074720_200016118888 [0,0,0,1,0,0|2,0,1]=4 6849 B17R1.24379 COC(=O)CCCCCSCCC1CCC1=O 62a_100009816466_200016118888 [0,0,0,1,0,0|2,0,1]=4 6850 B17R1.24379 COC(=O)CCCCCSCCC1CCC1=O 62a_200016118888_100009816466 [0,0,0,1,0,0|2,0,1]=4 6851 B17R1.25096 CCCCCCC1CCCC1NCC(=O)NC 269862a_100000693194_100000189428 [0,0,0,1,0,0|2,0,0]=3 6852 B17R1.25096 CCCCCCC1CCCC1NCC(=O)NC 270004a_100000693194_100000189428 [0,0,0,1,0,0|2,0,0]=3 6853 B17R1.25096 CCCCCCC1CCCC1NC[C@@H](C)OC 269862a_100020591295_100000189428 [0,0,0,1,0,0|2,0,1]=4 6854 B17R1.25096 CCCCCCC1CCCC1NC[C@@H](C)OC 270004a_100020591295_100000189428 [0,0,0,1,0,0|2,0,1]=4 6855 B17R1.25273 C#CCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100153394163 [0,0,0,1,0,0|1,0,2]=4 6856 B17R1.25273 C#CCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100153394163 [0,0,0,1,0,0|1,0,2]=4 6857 B17R1.25273 C=CCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100012355270 [0,0,0,1,0,0|1,0,2]=4 6858 B17R1.25273 C=CCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100012355270 [0,0,0,1,0,0|1,0,2]=4 6859 B17R1.25273 CCCCC#CCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_200000047210 [0,0,0,1,0,0|1,0,2]=4 6860 B17R1.25273 CCCCC#CCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_200000047210 [0,0,0,1,0,0|1,0,2]=4 6861 B17R1.25273 CCCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011214924 [0,0,0,1,0,0|1,0,0]=2 6862 B17R1.25273 CCCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210670 [0,0,0,1,0,0|1,0,0]=2 6863 B17R1.25273 COC(=O)[C@@H]1CCN1CCCCCCCCO 2230a_102516456887_100000033203 [0,0,0,1,0,0|2,0,0]=3 6864 B17R1.25273 COC(=O)[C@@H]1CCN1CCCCCCCCO 269982a_102516456887_100000033203 [0,0,0,1,0,0|2,0,0]=3 6865 B17R1.25295 CCCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100011214924 [0,0,0,1,0,0|3,0,0]=4 6866 B17R1.25295 CCCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210670 [0,0,0,1,0,0|3,0,0]=4 6867 B17R1.26472 CCC(=O)NCCNC1CCCCCCCC1 270004a_100132302217_100000038600 [0,0,0,1,0,0|3,0,0]=4 6868 B17R1.26472 CNC(=O)CCCNC1CCCCCCCC1 270004a_100000740002_100000038600 [0,0,0,1,0,0|2,0,0]=3 6869 B17R1.26472 COC(=O)CCCCN1CCCCCCCC1 2230a_100000039187_100000204269 [0,0,0,1,0,0|1,0,0]=2 6870 B17R1.26472 COC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000204269 [0,0,0,1,0,0|1,0,0]=2 6871 B17R1.26472 COC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100000204269 [0,0,0,1,0,0|1,0,0]=2 6872 B17R1.26472 COC(=O)COCCN1CCCCCCCC1 2230a_100000039187_100000090808 [0,0,0,1,0,0|2,0,0]=3 6873 B17R1.26472 COC(=O)COCCN1CCCCCCCC1 34a_100000039187_100000090808 [0,0,0,1,0,0|2,0,0]=3 6874 B17R1.26506 CNC(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100000741757 [0,0,0,1,0,0|2,0,0]=3 6875 B17R1.26506 CNC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000741757 [0,0,0,1,0,0|2,0,0]=3 6876 B17R1.26506 CNC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100000741757 [0,0,0,1,0,0|3,0,0]=4 6877 B17R1.26506 CNC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100000741757 [0,0,0,1,0,0|3,0,0]=4 6878 B17R1.26506 CNC(=O)CCCSCCN1CCCCCC1 62a_100000741757_100000722644 [0,0,0,1,0,0|3,0,0]=4 6879 B17R1.26506 CNC(=O)CCOCCCN1CCCCCC1 34a_100102886287_100012179268 [0,0,0,1,0,0|3,0,0]=4 6880 B17R1.26506 CNC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000737683 [0,0,0,1,0,0|3,0,0]=4 6881 B17R1.26506 CNC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000183359 [0,0,0,1,0,0|3,0,0]=4 6882 B17R1.26506 CNC(=O)OCCNCCC1CCCCCC1 34a_100011532351_200011997002 [0,0,0,1,0,0|3,0,0]=4 6883 B17R1.26506 COC(=O)/C=C/CNCCC1CCCCCC1 2230a_100011532351_100000742655 [0,0,0,1,0,0|1,0,2]=4 6884 B17R1.26506 COC(=O)/C=C/CNCCC1CCCCCC1 34a_100011532351_100000742655 [0,0,0,1,0,0|1,0,2]=4 6885 B17R1.26506 COC(=O)CCCCCCN1CCCCCC1 2230a_100000185865_100009815986 [0,0,0,1,0,0|1,0,0]=2 6886 B17R1.26506 COC(=O)CCCCCCN1CCCCCC1 269982a_100000185865_100009815986 [0,0,0,1,0,0|1,0,0]=2 6887 B17R1.26506 COC(=O)CCCCCCN1CCCCCC1 34a_100000185865_100009815986 [0,0,0,1,0,0|1,0,0]=2 6888 B17R1.26506 COC(=O)CCCCCCN1CCCOCC1 2230a_100000685342_100009815986 [0,0,0,1,0,0|2,0,0]=3 6889 B17R1.26506 COC(=O)CCCCCCN1CCCOCC1 269982a_100000685342_100009815986 [0,0,0,1,0,0|2,0,0]=3 6890 B17R1.26506 COC(=O)CCCCCCN1CCCOCC1 34a_100000685342_100009815986 [0,0,0,1,0,0|2,0,0]=3 6891 B17R1.26506 COC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100009816466 [0,0,0,1,0,0|1,0,0]=2 6892 B17R1.26506 COC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100009816466 [0,0,0,1,0,0|1,0,0]=2 6893 B17R1.26506 COC(=O)CCCCCOC1CCCCCC1 34a_100000074720_100011217769 [0,0,0,1,0,0|1,0,0]=2 6894 B17R1.26506 COC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100009816466 [0,0,0,1,0,0|1,0,0]=2 6895 B17R1.26506 COC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100009816466 [0,0,0,1,0,0|1,0,0]=2 6896 B17R1.26506 COC(=O)CCCCCSC1CCCCCC1 62a_100009816466_100011217769 [0,0,0,1,0,0|1,0,0]=2 6897 B17R1.26506 COC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100009816466 [0,0,0,1,0,0|1,0,0]=2 6898 B17R1.26506 COC(=O)CCCCNCC1CCCCCC1 2230a_100015204231_100000204269 [0,0,0,1,0,0|1,0,0]=2 6899 B17R1.26506 COC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100000204269 [0,0,0,1,0,0|1,0,0]=2 6900 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 34a_100000059025_200000696569 [0,0,0,1,0,0|1,0,0]=2 6901 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100000204269 [0,0,0,1,0,0|1,0,0]=2 6902 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 7a_100000059025_200000696569 [0,0,0,1,0,0|1,0,0]=2 6903 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000204269 [0,0,0,1,0,0|1,0,0]=2 6904 B17R1.26506 COC(=O)CCCCOCC1CNCCOC1 34a_100103147999_100000204269 [0,0,0,1,0,0|3,0,0]=4 6905 B17R1.26506 COC(=O)CCCCSCC1CCCCCC1 62a_100000204269_200000696569 [0,0,0,1,0,0|1,0,0]=2 6906 B17R1.26506 COC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000204269 [0,0,0,1,0,0|1,0,0]=2 6907 B17R1.26506 COC(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100011218270 [0,0,0,1,0,0|1,0,0]=2 6908 B17R1.26506 COC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000742333 [0,0,0,1,0,0|1,0,0]=2 6909 B17R1.26506 COC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100000742333 [0,0,0,1,0,0|2,0,0]=3 6910 B17R1.26506 COC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100011218270 [0,0,0,1,0,0|2,0,0]=3 6911 B17R1.26506 COC(=O)CCCSCCN1CCCCCC1 62a_100011218270_100000722644 [0,0,0,1,0,0|2,0,0]=3 6912 B17R1.26506 COC(=O)CCOCCCN1CCCCCC1 34a_100102886287_100000742370 [0,0,0,1,0,0|2,0,0]=3 6913 B17R1.26506 COC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000204255 [0,0,0,1,0,0|2,0,0]=3 6914 B17R1.26506 COC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000747449 [0,0,0,1,0,0|2,0,0]=3 6915 B17R1.26506 COC(=O)COCCNCC1CCCCCC1 2230a_100015204231_100000090808 [0,0,0,1,0,0|2,0,0]=3 6916 B17R1.26506 COC(=O)COCCNCC1CCCCCC1 34a_100015204231_100000090808 [0,0,0,1,0,0|2,0,0]=3 6917 B17R1.26506 COC(=O)COCCOCC1CCCCCC1 34a_100000699130_100000090808 [0,0,0,1,0,0|2,0,0]=3 6918 B17R1.26506 COC(=O)COCCOCC1CCCCCC1 7a_100000699130_100000090808 [0,0,0,1,0,0|2,0,0]=3 6919 B17R1.26506 COC(=O)COCCSCC1CCCCCC1 62a_100000090808_200000696569 [0,0,0,1,0,0|2,0,0]=3 6920 B17R1.26506 COC(=O)COCCSCC1CCCCCC1 62a_200000696569_100000090808 [0,0,0,1,0,0|2,0,0]=3 6921 B17R1.26687 COC(=O)CCCCCCCCCNC1CC1 34a_100000212008_100009813843 [0,0,0,1,0,0|1,0,0]=2 6922 B17R1.26687 COC(=O)CCCCCCCCNCC1CC1 2230a_100000735609_100010282707 [0,0,0,1,0,0|1,0,0]=2 6923 B17R1.26687 COC(=O)CCCCCCCCNCC1CC1 34a_100000735609_100010282707 [0,0,0,1,0,0|1,0,0]=2 6924 B17R1.26687 COC(=O)CCCCCCCCOCC1CC1 34a_100000035544_100000742324 [0,0,0,1,0,0|1,0,0]=2 6925 B17R1.26687 COC(=O)CCCCCCCCOCC1CC1 34a_100000211283_100010282707 [0,0,0,1,0,0|1,0,0]=2 6926 B17R1.26687 COC(=O)CCCCCCCCOCC1CC1 7a_100000035544_100000742324 [0,0,0,1,0,0|1,0,0]=2 6927 B17R1.26687 COC(=O)CCCCCCCCOCC1CO1 34a_100000035544_102125554688 [0,0,0,1,0,0|2,0,0]=3 6928 B17R1.26687 COC(=O)CCCCCCCCOCC1CO1 7a_100000035544_102125554688 [0,0,0,1,0,0|2,0,0]=3 6929 B17R1.26687 COC(=O)CCCCCCCCOCC1CS1 7a_100000035544_100000031435 [0,0,0,1,0,0|2,0,0]=3 6930 B17R1.26687 COC(=O)CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100010282707 [0,0,0,1,0,0|2,0,0]=3 6931 B17R1.26687 COC(=O)CCCCCCCCOC[C@@H]1CO1 7a_100000035544_100000745022 [0,0,0,1,0,0|2,0,0]=3 6932 B17R1.26687 COC(=O)CCCCCCCCSCC1CC1 62a_100000756562_100010282707 [0,0,0,1,0,0|1,0,0]=2 6933 B17R1.26687 COC(=O)CCCCCCCCSCC1CC1 62a_100010282707_100000742324 [0,0,0,1,0,0|1,0,0]=2 6934 B17R1.26687 COC(=O)CCCCCCCCSCC1CO1 62a_100010282707_102125554688 [0,0,0,1,0,0|2,0,0]=3 6935 B17R1.26687 COC(=O)CCCCCCCCSCC1CO1 62a_102125554688_100010282707 [0,0,0,1,0,0|2,0,0]=3 6936 B17R1.26687 COC(=O)CCCCCCCCSCC1CS1 62a_100000031435_100010282707 [0,0,0,1,0,0|2,0,0]=3 6937 B17R1.26687 COC(=O)CCCCCCCCSCC1CS1 62a_100010282707_100000031435 [0,0,0,1,0,0|2,0,0]=3 6938 B17R1.26687 COC(=O)CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100010282707 [0,0,0,1,0,0|2,0,0]=3 6939 B17R1.26687 COC(=O)CCCCCCCCSC[C@@H]1CO1 62a_100010282707_100000745022 [0,0,0,1,0,0|2,0,0]=3 6940 B17R1.26687 COC(=O)CCCCCCCNCCC1CC1 34a_100000764129_100010004213 [0,0,0,1,0,0|1,0,0]=2 6941 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 34a_100000754188_100010004213 [0,0,0,1,0,0|1,0,0]=2 6942 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 34a_100011022521_100000694398 [0,0,0,1,0,0|1,0,0]=2 6943 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 7a_100000754188_100010004213 [0,0,0,1,0,0|1,0,0]=2 6944 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 7a_100011022521_100000764125 [0,0,0,1,0,0|1,0,0]=2 6945 B17R1.26687 COC(=O)CCCCCCCOCCC1CO1 34a_100011022521_100000732470 [0,0,0,1,0,0|2,0,0]=3 6946 B17R1.26687 COC(=O)CCCCCCCOCCC1CO1 7a_100011022521_100000732470 [0,0,0,1,0,0|2,0,0]=3 6947 B17R1.26687 COC(=O)CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100010004213 [0,0,0,1,0,0|2,0,0]=3 6948 B17R1.26687 COC(=O)CCCCCCCSCCC1CC1 62a_100000764125_100010004213 [0,0,0,1,0,0|1,0,0]=2 6949 B17R1.26687 COC(=O)CCCCCCCSCCC1CC1 62a_100010004213_100000764125 [0,0,0,1,0,0|1,0,0]=2 6950 B17R1.26687 COC(=O)CCCCCCCSCCC1CO1 62a_100000732470_100010004213 [0,0,0,1,0,0|2,0,0]=3 6951 B17R1.26687 COC(=O)CCCCCCCSCCC1CO1 62a_100010004213_100000732470 [0,0,0,1,0,0|2,0,0]=3 6952 B17R1.26687 COC(=O)CCCCCCOCC#CC1CC1 34a_100000083941_100009815986 [0,0,0,1,0,0|1,0,2]=4 6953 B17R1.26687 COC(=O)CCCCCCOCC#CC1CC1 34a_100009863599_100009895102 [0,0,0,1,0,0|1,0,2]=4 6954 B17R1.26687 COC(=O)CCCCCCOCC#CC1CC1 7a_100000083941_100009815986 [0,0,0,1,0,0|1,0,2]=4 6955 B17R1.26687 COC(=O)CCCCCCOCC#CC1CC1 7a_100009863599_100009895102 [0,0,0,1,0,0|1,0,2]=4 6956 B17R1.26687 COC(=O)CCCCCCOCCCC1CO1 34a_100009863599_100000733510 [0,0,0,1,0,0|2,0,0]=3 6957 B17R1.26687 COC(=O)CCCCCCOCCCC1CO1 7a_100009863599_100000733510 [0,0,0,1,0,0|2,0,0]=3 6958 B17R1.26687 COC(=O)CCCCCCOCCNC1CC1 34a_100000738766_100009815986 [0,0,0,1,0,0|2,0,0]=3 6959 B17R1.26687 COC(=O)CCCCCCSCC#CC1CC1 62a_100009815986_100009895102 [0,0,0,1,0,0|1,0,2]=4 6960 B17R1.26687 COC(=O)CCCCCCSCC#CC1CC1 62a_100009895102_100009815986 [0,0,0,1,0,0|1,0,2]=4 6961 B17R1.26687 COC(=O)CCCCCCSCCCC1CO1 62a_100000733510_100009815986 [0,0,0,1,0,0|2,0,0]=3 6962 B17R1.26687 COC(=O)CCCCCCSCCCC1CO1 62a_100009815986_100000733510 [0,0,0,1,0,0|2,0,0]=3 6963 B17R1.26687 COC(=O)CCCOCCCCOCC1CO1 34a_100010889290_100000742333 [0,0,0,1,0,0|3,0,0]=4 6964 B17R1.26687 COC(=O)CCCOCCCCOCC1CO1 7a_100010889290_100011218270 [0,0,0,1,0,0|3,0,0]=4 6965 B17R1.26687 COC(=O)CCOCCOCCOCC1CC1 34a_100010982084_100000742324 [0,0,0,1,0,0|3,0,0]=4 6966 B17R1.26687 COC(=O)CCOCCOCCOCC1CC1 7a_100010982084_100000742324 [0,0,0,1,0,0|3,0,0]=4 6967 B17R1.26687 COC(=O)COCCOCCOCCC1CC1 34a_100011023656_100000694398 [0,0,0,1,0,0|3,0,0]=4 6968 B17R1.26687 COC(=O)COCCOCCOCCC1CC1 7a_100011023656_100000764125 [0,0,0,1,0,0|3,0,0]=4 6969 B17R1.27002 CNC1CCCCCCCCCCCCCC1 270004a_106832991635_100000040017 [0,0,0,1,0,0|2,0,1]=4 6970 B17R1.27002 COC1CCCCCCCCCCCCCC1 34a_200000037640_200000210301 [0,0,0,1,0,0|1,0,1]=3 6971 B17R1.27002 COC1CCCCCCCCCCCCCC1 7a_200000037640_200000210301 [0,0,0,1,0,0|1,0,1]=3 6972 B17R1.27002 [13CH3]OC1CCCCCCCCCCCCCC1 34a_200000037640_200025704644 [0,0,0,1,0,0|1,0,1]=3 6973 B17R1.27002 [13CH3]OC1CCCCCCCCCCCCCC1 7a_200000037640_200025704644 [0,0,0,1,0,0|1,0,1]=3 6974 B17R1.27076 CCC1C=CCN1CCCCCCC(=O)OC 2230a_100000730860_100009815986 [0,0,0,1,0,0|1,0,2]=4 6975 B17R1.27076 CCC1C=CCN1CCCCCCC(=O)OC 269982a_100000730860_100009815986 [0,0,0,1,0,0|1,0,2]=4 6976 B17R1.27076 CCC1C=CCN1CCCCCCC(=O)OC 34a_100000730860_100009815986 [0,0,0,1,0,0|1,0,2]=4 6977 B17R1.27076 CCC1CCCN1CCCCCCC(=O)OC 2230a_100000754278_100009815986 [0,0,0,1,0,0|1,0,0]=2 6978 B17R1.27076 CCC1CCCN1CCCCCCC(=O)OC 269982a_100000754278_100009815986 [0,0,0,1,0,0|1,0,0]=2 6979 B17R1.27076 CCC1CCCN1CCCCCCC(=O)OC 34a_100000754278_100009815986 [0,0,0,1,0,0|1,0,0]=2 6980 B17R1.27076 CCN1CCCC1CNCCCCC(=O)OC 2230a_100000211693_100000204269 [0,0,0,1,0,0|2,0,0]=3 6981 B17R1.27076 CCN1CCCC1CNCCOCC(=O)OC 2230a_100000211693_100000090808 [0,0,0,1,0,0|3,0,0]=4 6982 B17R1.27076 CCN1CCC[C@@H]1COCCCCC(=O)OC 34a_100011739246_100000204269 [0,0,0,1,0,0|2,0,0]=3 6983 B17R1.27076 CCN1CCC[C@@H]1COCCCCC(=O)OC 7a_100011739246_100000204269 [0,0,0,1,0,0|2,0,0]=3 6984 B17R1.27076 CCN1CCC[C@@H]1COCCOCC(=O)OC 34a_100011739246_100000090808 [0,0,0,1,0,0|3,0,0]=4 6985 B17R1.27076 CCN1CCC[C@@H]1COCCOCC(=O)OC 7a_100011739246_100000090808 [0,0,0,1,0,0|3,0,0]=4 6986 B17R1.27076 COC(=O)CCCCCCN1CCCC1C#N 2230a_100000701862_100009815986 [0,0,0,1,0,0|2,0,1]=4 6987 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100009815986 [0,0,0,1,0,0|2,0,1]=4 6988 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100009815986 [0,0,0,1,0,0|2,0,1]=4 6989 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009815986 [0,0,0,1,0,0|2,0,0]=3 6990 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009815986 [0,0,0,1,0,0|2,0,0]=3 6991 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100009815986 [0,0,0,1,0,0|2,0,0]=3 6992 B17R1.27076 COC(=O)CCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100009816466 [0,0,0,1,0,0|2,0,1]=4 6993 B17R1.27076 COC(=O)CCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100009816466 [0,0,0,1,0,0|2,0,1]=4 6994 B17R1.29210 CCCCCCCCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210320 [0,0,0,1,0,0|2,0,1]=4 6995 B17R1.29210 CCCCCCCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210320 [0,0,0,1,0,0|2,0,1]=4 6996 B17R1.29214 C=CCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100011933949 [0,0,0,1,0,0|1,0,2]=4 6997 B17R1.29214 CCC#CCCCCCCN1CC1C(=O)OC 2230a_200009830135_200000036426 [0,0,0,1,0,0|1,0,2]=4 6998 B17R1.29214 CCCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100000210320 [0,0,0,1,0,0|1,0,0]=2 6999 B17R1.29214 COC(=O)C1CN1CCCCCCCCCO 2230a_200009830135_100009813782 [0,0,0,1,0,0|2,0,0]=3 7000 B17R1.180031 C=CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000185746 [0,0,0,1,0,0|2,0,1]=4 7001 B17R1.180031 C=CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_200121576911 [0,0,0,1,0,0|2,0,1]=4 7002 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210414 [0,0,0,1,0,0|2,0,0]=3 7003 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210414 [0,0,0,1,0,0|2,0,0]=3 7004 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210414 [0,0,0,1,0,0|2,0,0]=3 7005 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000210414 [0,0,0,1,0,0|2,0,0]=3 7006 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 2708a_100011194316_106832991635 [0,0,0,1,0,0|2,0,0]=3 7007 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 2708a_100102657272_100011194316 [0,0,0,1,0,0|2,0,0]=3 7008 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 273464a_100011194316_100102657272 [0,0,0,1,0,0|2,0,0]=3 7009 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 273464a_100102657272_100011194316 [0,0,0,1,0,0|2,0,0]=3 7010 B17R1.180031 O=C(CO)NC1CCCCCCCCCCC1 240690a_100011194316_100000210174 [0,0,0,1,0,0|3,0,0]=4 7011 B17R1.180031 O=C(CO)NC1CCCCCCCCCCC1 527a_100011194316_100000210174 [0,0,0,1,0,0|3,0,0]=4 7012 B14R0.392 C/C=C/CCOCCCCCCCCC 34a_100016278192_100011214924 [2,0,0,0,0,0|1,0,1]=4 7013 B14R0.392 C/C=C/CNCCCCCCCCCC 34a_100000684558_100102629194 [2,0,0,0,0,0|1,0,1]=4 7014 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100000210711_100102629194 [2,0,0,0,0,0|1,0,1]=4 7015 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100016270725_100000210320 [2,0,0,0,0,0|1,0,1]=4 7016 B14R0.392 C/C=C/COCCCCCCCCCC 7a_100000210711_100102629194 [2,0,0,0,0,0|1,0,1]=4 7017 B14R0.392 C/C=C/CSCCCCCCCCCC 62a_100102629194_100000210320 [2,0,0,0,0,0|1,0,1]=4 7018 B14R0.392 C=CCCCCCCCCCCCNC 2230a_106832991635_102130925996 [2,0,0,0,0,0|1,0,1]=4 7019 B14R0.392 C=CCCCCCCCCCCCNC 34a_100102657272_102130925996 [2,0,0,0,0,0|1,0,1]=4 7020 B14R0.392 C=CCCCCCCCCCCCNC 7a_106832991635_102130925996 [2,0,0,0,0,0|1,0,1]=4 7021 B14R0.392 C=CCCCCCCCCCCCOC 34a_100138415774_102130925996 [2,0,0,0,0,0|0,0,2]=4 7022 B14R0.392 C=CCCCCCCCCCCCSC 62a_102130925996_200000210301 [2,0,0,0,0,0|1,0,1]=4 7023 B14R0.392 C=CCCCCCCCCCCCSC 62a_200000210301_102130925996 [2,0,0,0,0,0|1,0,1]=4 7024 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_102130925996_200025704644 [2,0,0,0,0,0|1,0,1]=4 7025 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_200025704644_102130925996 [2,0,0,0,0,0|1,0,1]=4 7026 B14R0.392 C=CCCCCCCCCCCNCC 2230a_100015525214_100011093070 [2,0,0,0,0,0|1,0,1]=4 7027 B14R0.392 C=CCCCCCCCCCCOCC 34a_100121572206_100011093070 [2,0,0,0,0,0|1,0,1]=4 7028 B14R0.392 C=CCCCCCCCCCCSCC 62a_100000210202_100011093070 [2,0,0,0,0,0|1,0,1]=4 7029 B14R0.392 C=CCCCCCCCCCCSCC 62a_100011093070_100000210202 [2,0,0,0,0,0|1,0,1]=4 7030 B14R0.392 C=CCCCCCCCCCNCCC 2230a_100000081888_100000210303 [2,0,0,0,0,0|1,0,1]=4 7031 B14R0.392 C=CCCCCCCCCCNCCC 34a_100000081888_100000210303 [2,0,0,0,0,0|1,0,1]=4 7032 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000038209_100000210303 [2,0,0,0,0,0|1,0,1]=4 7033 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000210258_100009814027 [2,0,0,0,0,0|1,0,1]=4 7034 B14R0.392 C=CCCCCCCCCCOCCC 7a_100000038209_100000210303 [2,0,0,0,0,0|1,0,1]=4 7035 B14R0.392 C=CCCCCCCCCCSCCC 62a_100000210303_100009814027 [2,0,0,0,0,0|1,0,1]=4 7036 B14R0.392 C=CCCCCCCCCCSCCC 62a_100009814027_100000210303 [2,0,0,0,0,0|1,0,1]=4 7037 B14R0.392 C=CCCCCCCCCNCCCC 2230a_100000102301_100011933949 [2,0,0,0,0,0|1,0,1]=4 7038 B14R0.392 C=CCCCCCCCCNCCCC 7a_106832991798_100011933949 [2,0,0,0,0,0|1,0,1]=4 7039 B14R0.392 C=CCCCCCCCCOCCCC 34a_100000210227_100011933949 [2,0,0,0,0,0|1,0,1]=4 7040 B14R0.392 C=CCCCCCCCCOCCCC 34a_100011215194_100000210210 [2,0,0,0,0,0|1,0,1]=4 7041 B14R0.392 C=CCCCCCCCCOCCCC 7a_100000210227_100011933949 [2,0,0,0,0,0|1,0,1]=4 7042 B14R0.392 C=CCCCCCCCCOCCCC 7a_100011215194_100000210211 [2,0,0,0,0,0|1,0,1]=4 7043 B14R0.392 C=CCCCCCCCCSCCCC 62a_100000210211_100011933949 [2,0,0,0,0,0|1,0,1]=4 7044 B14R0.392 C=CCCCCCCCCSCCCC 62a_100011933949_100000210210 [2,0,0,0,0,0|1,0,1]=4 7045 B14R0.392 C=CCCCCCCCNCCCCC 2230a_100000209983_100012355270 [2,0,0,0,0,0|1,0,1]=4 7046 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000210253_100012355270 [2,0,0,0,0,0|1,0,1]=4 7047 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000730831_100000718602 [2,0,0,0,0,0|1,0,1]=4 7048 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000210253_100012355270 [2,0,0,0,0,0|1,0,1]=4 7049 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000730831_100000210326 [2,0,0,0,0,0|1,0,1]=4 7050 B14R0.392 C=CCCCCCCCSCCCCC 62a_100000210326_100012355270 [2,0,0,0,0,0|1,0,1]=4 7051 B14R0.392 C=CCCCCCCCSCCCCC 62a_100012355270_100000210326 [2,0,0,0,0,0|1,0,1]=4 7052 B14R0.392 C=CCCCCCCNCCCCCC 2230a_100000210581_100011215473 [2,0,0,0,0,0|1,0,1]=4 7053 B14R0.392 C=CCCCCCCOCCCCCC 34a_100000210259_100011215473 [2,0,0,0,0,0|1,0,1]=4 7054 B14R0.392 C=CCCCCCCOCCCCCC 34a_200011216477_100000210314 [2,0,0,0,0,0|1,0,1]=4 7055 B14R0.392 C=CCCCCCCOCCCCCC 7a_100000210259_100011215473 [2,0,0,0,0,0|1,0,1]=4 7056 B14R0.392 C=CCCCCCCOCCCCCC 7a_200011216477_100000210314 [2,0,0,0,0,0|1,0,1]=4 7057 B14R0.392 C=CCCCCCCSCCCCCC 62a_100000210314_100011215473 [2,0,0,0,0,0|1,0,1]=4 7058 B14R0.392 C=CCCCCCCSCCCCCC 62a_100011215473_100000210757 [2,0,0,0,0,0|1,0,1]=4 7059 B14R0.392 C=CCCCCCNCCCCCCC 2230a_100000229938_100000700193 [2,0,0,0,0,0|1,0,1]=4 7060 B14R0.392 C=CCCCCCOCCCCCCC 34a_100000210272_100000700193 [2,0,0,0,0,0|1,0,1]=4 7061 B14R0.392 C=CCCCCCOCCCCCCC 34a_100011216702_100000210614 [2,0,0,0,0,0|1,0,1]=4 7062 B14R0.392 C=CCCCCCOCCCCCCC 7a_100000210272_100000700193 [2,0,0,0,0,0|1,0,1]=4 7063 B14R0.392 C=CCCCCCOCCCCCCC 7a_100011216702_100000210614 [2,0,0,0,0,0|1,0,1]=4 7064 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000210614_100000700193 [2,0,0,0,0,0|1,0,1]=4 7065 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000700193_100000210316 [2,0,0,0,0,0|1,0,1]=4 7066 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000229939_100011215482 [2,0,0,0,0,0|1,0,1]=4 7067 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000703577_100000210759 [2,0,0,0,0,0|1,0,1]=4 7068 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000229939_100011215482 [2,0,0,0,0,0|1,0,1]=4 7069 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000703577_100000210759 [2,0,0,0,0,0|1,0,1]=4 7070 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000210232_100011215482 [2,0,0,0,0,0|1,0,1]=4 7071 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000766645_100000210759 [2,0,0,0,0,0|1,0,1]=4 7072 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000210232_100011215482 [2,0,0,0,0,0|1,0,1]=4 7073 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000766645_100000210759 [2,0,0,0,0,0|1,0,1]=4 7074 B14R0.392 C=CCCCCSCCCCCCCC 62a_100000210759_100011215482 [2,0,0,0,0,0|1,0,1]=4 7075 B14R0.392 C=CCCCCSCCCCCCCC 62a_100011215482_100000210317 [2,0,0,0,0,0|1,0,1]=4 7076 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000212291_100011713584 [2,0,0,0,0,0|1,0,1]=4 7077 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000700776_100011214924 [2,0,0,0,0,0|1,0,1]=4 7078 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000212291_100000757094 [2,0,0,0,0,0|1,0,1]=4 7079 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000700776_100011214924 [2,0,0,0,0,0|1,0,1]=4 7080 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000210712_100000757094 [2,0,0,0,0,0|1,0,1]=4 7081 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000758997_100011214924 [2,0,0,0,0,0|1,0,1]=4 7082 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000210712_100000757094 [2,0,0,0,0,0|1,0,1]=4 7083 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000758997_100000210328 [2,0,0,0,0,0|1,0,1]=4 7084 B14R0.392 C=CCCCSCCCCCCCCC 62a_100011713584_100000210670 [2,0,0,0,0,0|1,0,1]=4 7085 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100000684558_100000754431 [2,0,0,0,0,0|1,0,1]=4 7086 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100015191253_100000210320 [2,0,0,0,0,0|1,0,1]=4 7087 B14R0.392 C=CCCNCCCCCCCCCC 34a_100000684558_100000754431 [2,0,0,0,0,0|1,0,1]=4 7088 B14R0.392 C=CCCOCCCCCCCCCC 34a_100000210711_100000754431 [2,0,0,0,0,0|1,0,1]=4 7089 B14R0.392 C=CCCOCCCCCCCCCC 34a_100011205117_100000210320 [2,0,0,0,0,0|1,0,1]=4 7090 B14R0.392 C=CCCOCCCCCCCCCC 7a_100000210711_100000754431 [2,0,0,0,0,0|1,0,1]=4 7091 B14R0.392 C=CCCSCCCCCCCCCC 62a_100000754431_100000210320 [2,0,0,0,0,0|1,0,1]=4 7092 B14R0.392 C=CCNCCCCCCCCCCC 2230a_100020586998_100011215454 [2,0,0,0,0,0|1,0,1]=4 7093 B14R0.392 C=CCNCCCCCCCCCCC 2230a_200011215754_100000210623 [2,0,0,0,0,0|1,0,1]=4 7094 B14R0.392 C=CCNCCCCCCCCCCC 34a_200011215754_100015514636 [2,0,0,0,0,0|1,0,1]=4 7095 B14R0.392 C=CCOCCCCCCCCCCC 34a_100000210809_100015514636 [2,0,0,0,0,0|1,0,1]=4 7096 B14R0.392 C=CCOCCCCCCCCCCC 34a_200000210373_100011215454 [2,0,0,0,0,0|1,0,1]=4 7097 B14R0.392 C=CCOCCCCCCCCCCC 7a_100000210809_100015514636 [2,0,0,0,0,0|1,0,1]=4 7098 B14R0.392 C=CCSCCCCCCCCCCC 62a_100000210623_100011215454 [2,0,0,0,0,0|1,0,1]=4 7099 B14R0.392 CC=CCCCOCCCCCCCC 34a_100020645299_100000210759 [2,0,0,0,0,0|1,0,1]=4 7100 B14R0.392 CC=CCNCCCCCCCCCC 2230a_100000684558_100000070051 [2,0,0,0,0,0|1,0,1]=4 7101 B14R0.392 CC=CCNCCCCCCCCCC 34a_100000684558_100000070051 [2,0,0,0,0,0|1,0,1]=4 7102 B14R0.392 CC=CCOCCCCCCCCCC 34a_100000210711_100000070051 [2,0,0,0,0,0|1,0,1]=4 7103 B14R0.392 CC=CCOCCCCCCCCCC 7a_100000210711_100000070051 [2,0,0,0,0,0|1,0,1]=4 7104 B14R0.392 CC=CCSCCCCCCCCCC 62a_100000070051_100000210320 [2,0,0,0,0,0|1,0,1]=4 7105 B14R0.392 CCCCCCCCCC/C=C/COC 34a_200025761149_200000210301 [2,0,0,0,0,0|0,0,2]=4 7106 B14R0.392 CCCCCCCCCC/C=C/COC 7a_200025761149_200000210301 [2,0,0,0,0,0|0,0,2]=4 7107 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 34a_200025761149_200025704644 [2,0,0,0,0,0|0,0,2]=4 7108 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 7a_200025761149_200025704644 [2,0,0,0,0,0|0,0,2]=4 7109 B14R0.392 CCCCCCCCCCCCCNC 2230a_100011215765_200000210301 [2,0,0,0,0,0|1,0,0]=3 7110 B14R0.392 CCCCCCCCCCCCCNC 2230a_106832991635_100000210684 [2,0,0,0,0,0|1,0,0]=3 7111 B14R0.392 CCCCCCCCCCCCCNC 270004a_106832991635_200011215488 [2,0,0,0,0,0|1,0,0]=3 7112 B14R0.392 CCCCCCCCCCCCCNC 34a_100011215765_200000210301 [2,0,0,0,0,0|1,0,0]=3 7113 B14R0.392 CCCCCCCCCCCCCNC 34a_100102657272_100000210684 [2,0,0,0,0,0|1,0,0]=3 7114 B14R0.392 CCCCCCCCCCCCCNC 7a_106832991635_100000210684 [2,0,0,0,0,0|1,0,0]=3 7115 B14R0.392 CCCCCCCCCCCCCN[13CH3] 2230a_100011215765_200025704644 [2,0,0,0,0,0|1,0,0]=3 7116 B14R0.392 CCCCCCCCCCCCCN[13CH3] 34a_100011215765_200025704644 [2,0,0,0,0,0|1,0,0]=3 7117 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [2,0,0,0,0,0|0,0,0]=2 7118 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [2,0,0,0,0,0|0,0,0]=2 7119 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [2,0,0,0,0,0|0,0,0]=2 7120 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [2,0,0,0,0,0|0,0,0]=2 7121 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [2,0,0,0,0,0|0,0,0]=2 7122 B14R0.392 CCCCCCCCCCCCCSC 62a_200000210301_100011934334 [2,0,0,0,0,0|0,1,0]=3 7123 B14R0.392 CCCCCCCCCCCCCS[13CH3] 62a_200025704644_100011934334 [2,0,0,0,0,0|0,1,0]=3 7124 B14R0.392 CCCCCCCCCCCCNCC 2230a_100000210451_100000210202 [2,0,0,0,0,0|1,0,1]=4 7125 B14R0.392 CCCCCCCCCCCCNCC 2230a_100015525214_100011215052 [2,0,0,0,0,0|1,0,1]=4 7126 B14R0.392 CCCCCCCCCCCCNCC 270004a_100015525214_100011218549 [2,0,0,0,0,0|1,0,1]=4 7127 B14R0.392 CCCCCCCCCCCCNCC 34a_100000210451_100000210202 [2,0,0,0,0,0|1,0,1]=4 7128 B14R0.392 CCCCCCCCCCCCOCC 34a_100000210810_100000210202 [2,0,0,0,0,0|1,0,1]=4 7129 B14R0.392 CCCCCCCCCCCCOCC 34a_100121572206_100000759014 [2,0,0,0,0,0|1,0,1]=4 7130 B14R0.392 CCCCCCCCCCCCOCC 7a_100000210810_100000210202 [2,0,0,0,0,0|1,0,1]=4 7131 B14R0.392 CCCCCCCCCCCCSCC 62a_100000210202_100000759014 [2,0,0,0,0,0|1,0,1]=4 7132 B14R0.392 CCCCCCCCCCCNCC=O 2230a_200011215754_200015260668 [2,0,0,0,0,0|1,0,0]=3 7133 B14R0.392 CCCCCCCCCCCNCC=O 34a_200011215754_200009817547 [2,0,0,0,0,0|1,0,0]=3 7134 B14R0.392 CCCCCCCCCCCNCCC 2230a_200011215754_100000210303 [2,0,0,0,0,0|1,0,1]=4 7135 B14R0.392 CCCCCCCCCCCNCCC 34a_200011215754_100000210303 [2,0,0,0,0,0|1,0,1]=4 7136 B14R0.392 CCCCCCCCCCCNCCO 2230a_100016997473_100011215454 [2,0,0,0,0,0|1,0,1]=4 7137 B14R0.392 CCCCCCCCCCCNCCO 2230a_200011215754_100000211926 [2,0,0,0,0,0|1,0,1]=4 7138 B14R0.392 CCCCCCCCCCCNCCO 34a_100016990907_100011215454 [2,0,0,0,0,0|1,0,1]=4 7139 B14R0.392 CCCCCCCCCCCNCCO 34a_200011215754_100000211926 [2,0,0,0,0,0|1,0,1]=4 7140 B14R0.392 CCCCCCCCCCCNCOC 2230a_200011215754_100000766300 [2,0,0,0,0,0|1,0,0]=3 7141 B14R0.392 CCCCCCCCCCCNCSC 2230a_200011215754_100011218213 [2,0,0,0,0,0|1,1,0]=4 7142 B14R0.392 CCCCCCCCCCCNCSC 34a_200011215754_100011218213 [2,0,0,0,0,0|1,1,0]=4 7143 B14R0.392 CCCCCCCCCCCOCC=O 34a_100000210809_200009817547 [2,0,0,0,0,0|1,0,0]=3 7144 B14R0.392 CCCCCCCCCCCOCC=O 7a_100000210809_200015260668 [2,0,0,0,0,0|1,0,0]=3 7145 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210258_100011215454 [2,0,0,0,0,0|1,0,1]=4 7146 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210809_100000210303 [2,0,0,0,0,0|1,0,1]=4 7147 B14R0.392 CCCCCCCCCCCOCCC 7a_100000210809_100000210303 [2,0,0,0,0,0|1,0,1]=4 7148 B14R0.392 CCCCCCCCCCCOCCO 34a_100000210809_100000211926 [2,0,0,0,0,0|1,0,1]=4 7149 B14R0.392 CCCCCCCCCCCOCCO 7a_100000210809_100000211926 [2,0,0,0,0,0|1,0,1]=4 7150 B14R0.392 CCCCCCCCCCCOCSC 34a_100000210809_100011218213 [2,0,0,0,0,0|1,1,0]=4 7151 B14R0.392 CCCCCCCCCCCSCC=O 62a_200015260668_100011215454 [2,0,0,0,0,0|1,0,0]=3 7152 B14R0.392 CCCCCCCCCCCSCCC 62a_100000210303_100011215454 [2,0,0,0,0,0|1,0,1]=4 7153 B14R0.392 CCCCCCCCCCCSCCO 62a_100000211926_100011215454 [2,0,0,0,0,0|1,0,1]=4 7154 B14R0.392 CCCCCCCCCCCSCOC 62a_100000766300_100011215454 [2,0,0,0,0,0|1,0,0]=3 7155 B14R0.392 CCCCCCCCCCCSCSC 62a_100011218213_100011215454 [2,0,0,0,0,0|1,1,0]=4 7156 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000102301_100000210320 [2,0,0,0,0,0|1,0,1]=4 7157 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000684558_100000210211 [2,0,0,0,0,0|1,0,1]=4 7158 B14R0.392 CCCCCCCCCCNCCCC 34a_100000684558_100000210210 [2,0,0,0,0,0|1,0,1]=4 7159 B14R0.392 CCCCCCCCCCNCCCC 7a_106832991798_100000210320 [2,0,0,0,0,0|1,0,1]=4 7160 B14R0.392 CCCCCCCCCCNCCCO 2230a_100000684558_100000230001 [2,0,0,0,0,0|1,0,1]=4 7161 B14R0.392 CCCCCCCCCCNCCCO 34a_100000684558_100000230001 [2,0,0,0,0,0|1,0,1]=4 7162 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000209980_100000210320 [2,0,0,0,0,0|1,0,0]=3 7163 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000684558_100011201679 [2,0,0,0,0,0|1,0,0]=3 7164 B14R0.392 CCCCCCCCCCNCCOC 34a_100000684558_100011201679 [2,0,0,0,0,0|1,0,0]=3 7165 B14R0.392 CCCCCCCCCCNCCSC 2230a_100000684558_100000751147 [2,0,0,0,0,0|1,1,0]=4 7166 B14R0.392 CCCCCCCCCCNCCSC 2230a_100020590264_100000210320 [2,0,0,0,0,0|1,1,0]=4 7167 B14R0.392 CCCCCCCCCCNCCSC 34a_100000684558_100000212216 [2,0,0,0,0,0|1,1,0]=4 7168 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [2,0,0,0,0,0|1,0,1]=4 7169 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [2,0,0,0,0,0|1,0,1]=4 7170 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [2,0,0,0,0,0|1,0,1]=4 7171 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [2,0,0,0,0,0|1,0,1]=4 7172 B14R0.392 CCCCCCCCCCOCCCO 34a_100000210711_100000230001 [2,0,0,0,0,0|1,0,1]=4 7173 B14R0.392 CCCCCCCCCCOCCCO 7a_100000210711_100011215043 [2,0,0,0,0,0|1,0,1]=4 7174 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [2,0,0,0,0,0|1,0,0]=3 7175 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [2,0,0,0,0,0|1,0,0]=3 7176 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [2,0,0,0,0,0|1,0,0]=3 7177 B14R0.392 CCCCCCCCCCOCCON 34a_100000700252_100000210320 [2,0,0,0,0,0|2,0,0]=4 7178 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [2,0,0,0,0,0|1,1,0]=4 7179 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [2,0,0,0,0,0|1,1,0]=4 7180 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [2,0,0,0,0,0|1,1,0]=4 7181 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [2,0,0,0,0,0|1,1,0]=4 7182 B14R0.392 CCCCCCCCCCSCCCC 62a_100000210211_100000210320 [2,0,0,0,0,0|1,0,1]=4 7183 B14R0.392 CCCCCCCCCCSCCCO 62a_100011215043_100000210320 [2,0,0,0,0,0|1,0,1]=4 7184 B14R0.392 CCCCCCCCCCSCCOC 34a_100011628728_200000210301 [2,0,0,0,0,0|1,0,0]=3 7185 B14R0.392 CCCCCCCCCCSCCOC 62a_100000233755_100000210320 [2,0,0,0,0,0|1,0,0]=3 7186 B14R0.392 CCCCCCCCCCSCCOC 7a_100011628728_200000210301 [2,0,0,0,0,0|1,0,0]=3 7187 B14R0.392 CCCCCCCCCCSCCO[13CH3] 34a_100011628728_200025704644 [2,0,0,0,0,0|1,0,0]=3 7188 B14R0.392 CCCCCCCCCCSCCO[13CH3] 7a_100011628728_200025704644 [2,0,0,0,0,0|1,0,0]=3 7189 B14R0.392 CCCCCCCCCCSCCSC 62a_100000212216_100000210320 [2,0,0,0,0,0|1,1,0]=4 7190 B14R0.392 CCCCCCCCCNCCCC=O 2230a_100000212291_200011292268 [2,0,0,0,0,0|1,0,0]=3 7191 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000209983_100011214924 [2,0,0,0,0,0|1,0,1]=4 7192 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000212291_100000210326 [2,0,0,0,0,0|1,0,1]=4 7193 B14R0.392 CCCCCCCCCNCCCCC 34a_100000212291_100000718602 [2,0,0,0,0,0|1,0,1]=4 7194 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000212291_100000210776 [2,0,0,0,0,0|1,0,1]=4 7195 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000750430_100011214924 [2,0,0,0,0,0|1,0,1]=4 7196 B14R0.392 CCCCCCCCCNCCCCO 34a_100000212291_100011216708 [2,0,0,0,0,0|1,0,1]=4 7197 B14R0.392 CCCCCCCCCNCCCCO 34a_100000750430_100011214924 [2,0,0,0,0,0|1,0,1]=4 7198 B14R0.392 CCCCCCCCCNCCCOC 2230a_100000212291_100000740836 [2,0,0,0,0,0|1,0,0]=3 7199 B14R0.392 CCCCCCCCCNCCCOC 34a_100000212291_100000740836 [2,0,0,0,0,0|1,0,0]=3 7200 B14R0.392 CCCCCCCCCNCCCOC 34a_100150723488_100011214924 [2,0,0,0,0,0|1,0,0]=3 7201 B14R0.392 CCCCCCCCCNCCCSC 2230a_100000749238_100011214924 [2,0,0,0,0,0|1,1,0]=4 7202 B14R0.392 CCCCCCCCCOCCCC=O 7a_100000210712_200011292268 [2,0,0,0,0,0|1,0,0]=3 7203 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210253_100011214924 [2,0,0,0,0,0|1,0,1]=4 7204 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210712_100000718602 [2,0,0,0,0,0|1,0,1]=4 7205 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210253_100000210328 [2,0,0,0,0,0|1,0,1]=4 7206 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210712_100000210326 [2,0,0,0,0,0|1,0,1]=4 7207 B14R0.392 CCCCCCCCCOCCCCO 34a_100000210712_100011216708 [2,0,0,0,0,0|1,0,1]=4 7208 B14R0.392 CCCCCCCCCOCCCCO 7a_100000210712_100000210776 [2,0,0,0,0,0|1,0,1]=4 7209 B14R0.392 CCCCCCCCCOCCCNC 34a_100000213112_100011214924 [2,0,0,0,0,0|2,0,0]=4 7210 B14R0.392 CCCCCCCCCOCCCOC 34a_100000210712_100000740836 [2,0,0,0,0,0|1,0,0]=3 7211 B14R0.392 CCCCCCCCCOCCCOC 34a_100000740835_100011214924 [2,0,0,0,0,0|1,0,0]=3 7212 B14R0.392 CCCCCCCCCOCCCOC 7a_100000210712_100000740836 [2,0,0,0,0,0|1,0,0]=3 7213 B14R0.392 CCCCCCCCCOCCCSC 34a_100000690336_100011214924 [2,0,0,0,0,0|1,1,0]=4 7214 B14R0.392 CCCCCCCCCOCCCSC 7a_100000690336_100000210328 [2,0,0,0,0,0|1,1,0]=4 7215 B14R0.392 CCCCCCCCCSCCCC=O 62a_200011292268_100000210670 [2,0,0,0,0,0|1,0,0]=3 7216 B14R0.392 CCCCCCCCCSCCCCC 62a_100000210326_100000210670 [2,0,0,0,0,0|1,0,1]=4 7217 B14R0.392 CCCCCCCCCSCCCCO 62a_100000210776_100000210670 [2,0,0,0,0,0|1,0,1]=4 7218 B14R0.392 CCCCCCCCCSCCCOC 62a_100000709357_100000210670 [2,0,0,0,0,0|1,0,0]=3 7219 B14R0.392 CCCCCCCCNCCCCC=O 2230a_100000229939_100000139335 [2,0,0,0,0,0|1,0,0]=3 7220 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000210581_100000210759 [2,0,0,0,0,0|1,0,1]=4 7221 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000229939_100000210314 [2,0,0,0,0,0|1,0,1]=4 7222 B14R0.392 CCCCCCCCNCCCCCC 34a_100000229939_100000210314 [2,0,0,0,0,0|1,0,1]=4 7223 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000229939_100000746330 [2,0,0,0,0,0|1,0,1]=4 7224 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000762737_100000210759 [2,0,0,0,0,0|1,0,1]=4 7225 B14R0.392 CCCCCCCCNCCCCCO 34a_100000229939_100000746330 [2,0,0,0,0,0|1,0,1]=4 7226 B14R0.392 CCCCCCCCNCCCCCO 34a_100000762737_100000210759 [2,0,0,0,0,0|1,0,1]=4 7227 B14R0.392 CCCCCCCCNCCCCOC 2230a_100000229939_100000730899 [2,0,0,0,0,0|1,0,0]=3 7228 B14R0.392 CCCCCCCCNCCCCOC 34a_100000229939_100000755781 [2,0,0,0,0,0|1,0,0]=3 7229 B14R0.392 CCCCCCCCNCOCCOC 2230a_100000229939_100000231047 [2,0,0,0,0,0|2,0,0]=4 7230 B14R0.392 CCCCCCCCOCCCCC=O 7a_100000210232_100000139335 [2,0,0,0,0,0|1,0,0]=3 7231 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210232_100000210314 [2,0,0,0,0,0|1,0,1]=4 7232 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210259_100000210759 [2,0,0,0,0,0|1,0,1]=4 7233 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210232_100000210314 [2,0,0,0,0,0|1,0,1]=4 7234 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210259_100000210759 [2,0,0,0,0,0|1,0,1]=4 7235 B14R0.392 CCCCCCCCOCCCCCO 34a_100000210232_100000746330 [2,0,0,0,0,0|1,0,1]=4 7236 B14R0.392 CCCCCCCCOCCCCCO 7a_100000210232_100000746330 [2,0,0,0,0,0|1,0,1]=4 7237 B14R0.392 CCCCCCCCOCCCCOC 34a_100000210232_100000755781 [2,0,0,0,0,0|1,0,0]=3 7238 B14R0.392 CCCCCCCCOCCCCOC 34a_100000740925_100000210759 [2,0,0,0,0,0|1,0,0]=3 7239 B14R0.392 CCCCCCCCOCCCCOC 7a_100000210232_100000730899 [2,0,0,0,0,0|1,0,0]=3 7240 B14R0.392 CCCCCCCCOCCCCSC 34a_100011217163_100000210759 [2,0,0,0,0,0|1,1,0]=4 7241 B14R0.392 CCCCCCCCOCCCCSC 7a_100011217163_100000210759 [2,0,0,0,0,0|1,1,0]=4 7242 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000139335_100000210317 [2,0,0,0,0,0|1,0,0]=3 7243 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000210759_100000139335 [2,0,0,0,0,0|1,0,0]=3 7244 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210314_100000210317 [2,0,0,0,0,0|1,0,1]=4 7245 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210759_100000210757 [2,0,0,0,0,0|1,0,1]=4 7246 B14R0.392 CCCCCCCCSCCCCCO 62a_100000210759_100000746330 [2,0,0,0,0,0|1,0,1]=4 7247 B14R0.392 CCCCCCCCSCCCCCO 62a_100000746330_100000210317 [2,0,0,0,0,0|1,0,1]=4 7248 B14R0.392 CCCCCCCCSCCCCOC 62a_100000210759_100000730899 [2,0,0,0,0,0|1,0,0]=3 7249 B14R0.392 CCCCCCCCSCCCCOC 62a_100000730899_100000210317 [2,0,0,0,0,0|1,0,0]=3 7250 B14R0.392 CCCCCCCCSCOCCOC 62a_100000210759_100000231047 [2,0,0,0,0,0|2,0,0]=4 7251 B14R0.392 CCCCCCCCSCOCCOC 62a_100000231047_100000210317 [2,0,0,0,0,0|2,0,0]=4 7252 B14R0.392 CCCCCCCNCCCCCC=O 2230a_100000229938_100000139337 [2,0,0,0,0,0|1,0,0]=3 7253 B14R0.392 CCCCCCCNCCCCCCC 2230a_100000229938_100000210681 [2,0,0,0,0,0|1,0,1]=4 7254 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000229938_100000766143 [2,0,0,0,0,0|1,0,1]=4 7255 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000686447_100000210681 [2,0,0,0,0,0|1,0,1]=4 7256 B14R0.392 CCCCCCCNCCCCCCO 34a_100000686447_100000210614 [2,0,0,0,0,0|1,0,1]=4 7257 B14R0.392 CCCCCCCNCCCCCOC 2230a_100000747528_100000210681 [2,0,0,0,0,0|1,0,0]=3 7258 B14R0.392 CCCCCCCNCCCCCOC 34a_100000747528_100000210614 [2,0,0,0,0,0|1,0,0]=3 7259 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000229938_100000695917 [2,0,0,0,0,0|2,0,0]=4 7260 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000745349_100000210681 [2,0,0,0,0,0|2,0,0]=4 7261 B14R0.392 CCCCCCCNCCOCCOC 34a_100000745349_100000210614 [2,0,0,0,0,0|2,0,0]=4 7262 B14R0.392 CCCCCCCOCCCCCC=O 7a_100000210272_100000139337 [2,0,0,0,0,0|1,0,0]=3 7263 B14R0.392 CCCCCCCOCCCCCCC 34a_100000210272_100000210614 [2,0,0,0,0,0|1,0,1]=4 7264 B14R0.392 CCCCCCCOCCCCCCC 7a_100000210272_100000210614 [2,0,0,0,0,0|1,0,1]=4 7265 B14R0.392 CCCCCCCOCCCCCCO 34a_100000210272_100000766143 [2,0,0,0,0,0|1,0,1]=4 7266 B14R0.392 CCCCCCCOCCCCCCO 7a_100000210272_100000766143 [2,0,0,0,0,0|1,0,1]=4 7267 B14R0.392 CCCCCCCOCCCCCNC 34a_100000722520_100000210614 [2,0,0,0,0,0|2,0,0]=4 7268 B14R0.392 CCCCCCCOCCOCCOC 34a_100000210272_100000695917 [2,0,0,0,0,0|2,0,0]=4 7269 B14R0.392 CCCCCCCOCCOCCOC 34a_100011215163_100000210614 [2,0,0,0,0,0|2,0,0]=4 7270 B14R0.392 CCCCCCCOCCOCCOC 7a_100000210272_100000695917 [2,0,0,0,0,0|2,0,0]=4 7271 B14R0.392 CCCCCCCOCCOCCOC 7a_100011215163_100000210614 [2,0,0,0,0,0|2,0,0]=4 7272 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000139337_100000210316 [2,0,0,0,0,0|1,0,0]=3 7273 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000210614_100000139337 [2,0,0,0,0,0|1,0,0]=3 7274 B14R0.392 CCCCCCCSCCCCCCC 62a_100000210614_100000210316 [2,0,0,0,0,0|1,0,1]=4 7275 B14R0.392 CCCCCCCSCCCCCCO 62a_100000210614_100000766143 [2,0,0,0,0,0|1,0,1]=4 7276 B14R0.392 CCCCCCCSCCCCCCO 62a_100000766143_100000210316 [2,0,0,0,0,0|1,0,1]=4 7277 B14R0.392 CCCCCCCSCCOCCOC 62a_100000210614_100000695917 [2,0,0,0,0,0|2,0,0]=4 7278 B14R0.392 CCCCCCCSCCOCCOC 62a_100000695917_100000210316 [2,0,0,0,0,0|2,0,0]=4 7279 B14R0.392 CCCCCCNCCCCCCCO 2230a_100000210581_100000760002 [2,0,0,0,0,0|1,0,1]=4 7280 B14R0.392 CCCCCCNCCCCCCCO 2230a_100011996573_100000210314 [2,0,0,0,0,0|1,0,1]=4 7281 B14R0.392 CCCCCCNCCCCCCCO 34a_100011996573_100000210314 [2,0,0,0,0,0|1,0,1]=4 7282 B14R0.392 CCCCCCNCCCCCCOC 2230a_100000210581_100011998445 [2,0,0,0,0,0|1,0,0]=3 7283 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000206027_100000210314 [2,0,0,0,0,0|2,0,0]=4 7284 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000210581_100011216529 [2,0,0,0,0,0|2,0,0]=4 7285 B14R0.392 CCCCCCNCCCOCCOC 34a_100000206027_100000210314 [2,0,0,0,0,0|2,0,0]=4 7286 B14R0.392 CCCCCCOCCCCCCCO 34a_100000210259_100000760002 [2,0,0,0,0,0|1,0,1]=4 7287 B14R0.392 CCCCCCOCCCCCCCO 7a_100000210259_100000760002 [2,0,0,0,0,0|1,0,1]=4 7288 B14R0.392 CCCCCCOCCCCCCOC 34a_100000210259_100011998445 [2,0,0,0,0,0|1,0,0]=3 7289 B14R0.392 CCCCCCOCCCCCCOC 34a_200012092642_100000210314 [2,0,0,0,0,0|1,0,0]=3 7290 B14R0.392 CCCCCCOCCCCCCOC 7a_100000210259_100011998445 [2,0,0,0,0,0|1,0,0]=3 7291 B14R0.392 CCCCCCOCCCCCCOC 7a_200012092642_100000210314 [2,0,0,0,0,0|1,0,0]=3 7292 B14R0.392 CCCCCCOCCCOCCOC 34a_100000210259_100011216529 [2,0,0,0,0,0|2,0,0]=4 7293 B14R0.392 CCCCCCOCCCOCCOC 7a_100000210259_100011216529 [2,0,0,0,0,0|2,0,0]=4 7294 B14R0.392 CCCCCCOCCOCCCC=O 7a_100000691444_200011292268 [2,0,0,0,0,0|2,0,0]=4 7295 B14R0.392 CCCCCCOCCOCCCOC 34a_100000691444_100000740836 [2,0,0,0,0,0|2,0,0]=4 7296 B14R0.392 CCCCCCOCCOCCCOC 7a_100000691444_100000740836 [2,0,0,0,0,0|2,0,0]=4 7297 B14R0.392 CCCCCCSCCCCCCCO 62a_100000210314_100000760002 [2,0,0,0,0,0|1,0,1]=4 7298 B14R0.392 CCCCCCSCCCCCCCO 62a_100000760002_100000210757 [2,0,0,0,0,0|1,0,1]=4 7299 B14R0.392 CCCCCCSCCCCCCOC 62a_100000210314_100011998445 [2,0,0,0,0,0|1,0,0]=3 7300 B14R0.392 CCCCCCSCCCCCCOC 62a_100011998445_100000210757 [2,0,0,0,0,0|1,0,0]=3 7301 B14R0.392 CCCCCCSCCCOCCOC 62a_100000210314_100011216529 [2,0,0,0,0,0|2,0,0]=4 7302 B14R0.392 CCCCCCSCCCOCCOC 62a_100011216529_100000210757 [2,0,0,0,0,0|2,0,0]=4 7303 B14R0.392 CCCCCNCCCCCCCCO 2230a_100000209983_100000033203 [2,0,0,0,0,0|1,0,1]=4 7304 B14R0.392 CCCCCNCCCCCCCCO 2230a_102515433106_100000210326 [2,0,0,0,0,0|1,0,1]=4 7305 B14R0.392 CCCCCNCCCCCCCCO 34a_102515433106_100000718602 [2,0,0,0,0,0|1,0,1]=4 7306 B14R0.392 CCCCCNCCOCCCCOC 34a_100000224656_100000755781 [2,0,0,0,0,0|2,0,0]=4 7307 B14R0.392 CCCCCOCCCCCCCCO 34a_100000210253_100000033203 [2,0,0,0,0,0|1,0,1]=4 7308 B14R0.392 CCCCCOCCCCCCCCO 7a_100000210253_100000033203 [2,0,0,0,0,0|1,0,1]=4 7309 B14R0.392 CCCCCOCCCOCCCOC 34a_200011215475_100000718602 [2,0,0,0,0,0|2,0,0]=4 7310 B14R0.392 CCCCCOCCCOCCCOC 7a_200011215475_100000210326 [2,0,0,0,0,0|2,0,0]=4 7311 B14R0.392 CCCCCOCCOCCCCC=O 7a_100011215259_100000139335 [2,0,0,0,0,0|2,0,0]=4 7312 B14R0.392 CCCCCOCCOCCCCOC 34a_100011215259_100000755781 [2,0,0,0,0,0|2,0,0]=4 7313 B14R0.392 CCCCCOCCOCCCCOC 7a_100011215259_100000730899 [2,0,0,0,0,0|2,0,0]=4 7314 B14R0.392 CCCCCSCCCCCCCCO 62a_100000033203_100000210326 [2,0,0,0,0,0|1,0,1]=4 7315 B14R0.392 CCCCCSCCCCCCCCO 62a_100000210326_100000033203 [2,0,0,0,0,0|1,0,1]=4 7316 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000078944_100000210211 [2,0,0,0,0,0|1,0,1]=4 7317 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000102301_100009813782 [2,0,0,0,0,0|1,0,1]=4 7318 B14R0.392 CCCCNCCCCCCCCCO 34a_100000078944_100000210210 [2,0,0,0,0,0|1,0,1]=4 7319 B14R0.392 CCCCNCCCCCCCCCO 7a_106832991798_100009813782 [2,0,0,0,0,0|1,0,1]=4 7320 B14R0.392 CCCCNCCCCOCCCOC 34a_200011216965_100000740836 [2,0,0,0,0,0|2,0,0]=4 7321 B14R0.392 CCCCOCCCCCCCCCO 34a_100000210227_100009813782 [2,0,0,0,0,0|1,0,1]=4 7322 B14R0.392 CCCCOCCCCCCCCCO 7a_100000210227_100009813782 [2,0,0,0,0,0|1,0,1]=4 7323 B14R0.392 CCCCOCCCCOCCCC=O 7a_200000760531_200011292268 [2,0,0,0,0,0|2,0,0]=4 7324 B14R0.392 CCCCOCCCCOCCCOC 34a_200000760531_100000740836 [2,0,0,0,0,0|2,0,0]=4 7325 B14R0.392 CCCCOCCCCOCCCOC 7a_200000760531_100000740836 [2,0,0,0,0,0|2,0,0]=4 7326 B14R0.392 CCCCOCCCNCCCCC=O 2230a_200000211371_100000139335 [2,0,0,0,0,0|2,0,0]=4 7327 B14R0.392 CCCCOCCCNCCCCOC 2230a_200000211371_100000730899 [2,0,0,0,0,0|2,0,0]=4 7328 B14R0.392 CCCCOCCCNCCCCOC 34a_200000211371_100000755781 [2,0,0,0,0,0|2,0,0]=4 7329 B14R0.392 CCCCOCCCOCCCCC=O 7a_200011215613_100000139335 [2,0,0,0,0,0|2,0,0]=4 7330 B14R0.392 CCCCOCCCOCCCCOC 34a_200011215613_100000755781 [2,0,0,0,0,0|2,0,0]=4 7331 B14R0.392 CCCCOCCCOCCCCOC 7a_200011215613_100000730899 [2,0,0,0,0,0|2,0,0]=4 7332 B14R0.392 CCCCOCCNCCCCCOC 2230a_100000747528_100000743108 [2,0,0,0,0,0|2,0,0]=4 7333 B14R0.392 CCCCOCCNCCCCCOC 34a_100000747528_100000743108 [2,0,0,0,0,0|2,0,0]=4 7334 B14R0.392 CCCCOCCOCCCCCC=O 7a_100000210238_100000139337 [2,0,0,0,0,0|2,0,0]=4 7335 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000139337_100000743108 [2,0,0,0,0,0|2,0,0]=4 7336 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000743108_100000139337 [2,0,0,0,0,0|2,0,0]=4 7337 B14R0.392 CCCCOCOCCCCCCOC 34a_200012092642_100011995733 [2,0,0,0,0,0|2,0,0]=4 7338 B14R0.392 CCCCOCSCCCCCCOC 62a_100011995733_100011998445 [2,0,0,0,0,0|2,0,0]=4 7339 B14R0.392 CCCCOCSCCCCCCOC 62a_100011998445_100011995733 [2,0,0,0,0,0|2,0,0]=4 7340 B14R0.392 CCCCSCCCCCCCCCO 62a_100000210211_100009813782 [2,0,0,0,0,0|1,0,1]=4 7341 B14R0.392 CCCCSCCCCCCCCCO 62a_100009813782_100000210210 [2,0,0,0,0,0|1,0,1]=4 7342 B14R0.392 CCCCSCCNCCCCCC=O 2230a_100025743550_100000139337 [2,0,0,0,0,0|2,0,0]=4 7343 B14R0.392 CCCCSCCOCCCCCC=O 7a_200000230436_100000139337 [2,0,0,0,0,0|2,0,0]=4 7344 B14R0.392 CCCNCCCCCCCCCCO 2230a_100000066964_100000210303 [2,0,0,0,0,0|1,0,1]=4 7345 B14R0.392 CCCNCCCCCCCCCCO 34a_100000066964_100000210303 [2,0,0,0,0,0|1,0,1]=4 7346 B14R0.392 CCCOCCCCCCCCCCO 34a_100000210258_100009813290 [2,0,0,0,0,0|1,0,1]=4 7347 B14R0.392 CCCOCCCNCCCCCC=O 2230a_100011217757_100000139337 [2,0,0,0,0,0|2,0,0]=4 7348 B14R0.392 CCCOCCNCCCCCCOC 2230a_100161115042_100011998445 [2,0,0,0,0,0|2,0,0]=4 7349 B14R0.392 CCCOCCNCCCCCCOC 34a_100161115042_100011998445 [2,0,0,0,0,0|2,0,0]=4 7350 B14R0.392 CCCOCCOCCCCCCOC 34a_100000752267_100011998445 [2,0,0,0,0,0|2,0,0]=4 7351 B14R0.392 CCCOCCOCCCCCCOC 34a_200012092642_100011215938 [2,0,0,0,0,0|2,0,0]=4 7352 B14R0.392 CCCOCCOCCCCCCOC 7a_100000752267_100011998445 [2,0,0,0,0,0|2,0,0]=4 7353 B14R0.392 CCCOCCOCCCCCCOC 7a_200012092642_100011215938 [2,0,0,0,0,0|2,0,0]=4 7354 B14R0.392 CCCOCCSCCCCCCOC 62a_100011215938_100011998445 [2,0,0,0,0,0|2,0,0]=4 7355 B14R0.392 CCCOCCSCCCCCCOC 62a_100011998445_100011215938 [2,0,0,0,0,0|2,0,0]=4 7356 B14R0.392 CCCSCCCCCCCCCCO 62a_100000210303_200000033068 [2,0,0,0,0,0|1,0,1]=4 7357 B14R0.392 CCCSCCCCCCCCCCO 62a_100009813290_100000210303 [2,0,0,0,0,0|1,0,1]=4 7358 B14R0.392 CCCSCCNCCCCCCOC 2230a_100020603323_100011998445 [2,0,0,0,0,0|2,0,0]=4 7359 B14R0.392 CCCSCCOCCCCCCOC 34a_200000230433_100011998445 [2,0,0,0,0,0|2,0,0]=4 7360 B14R0.392 CCCSCCOCCCCCCOC 7a_200000230433_100011998445 [2,0,0,0,0,0|2,0,0]=4 7361 B14R0.392 CCNCCCCCCCCCCCO 2230a_100015525214_100009812471 [2,0,0,0,0,0|1,0,1]=4 7362 B14R0.392 CCOCCCCCCCCCCCO 34a_100121572206_100009812471 [2,0,0,0,0,0|1,0,1]=4 7363 B14R0.392 CCOCCCNCCCCCCOC 2230a_100000210961_100011998445 [2,0,0,0,0,0|2,0,0]=4 7364 B14R0.392 CCOCCCNCCCCCCOC 34a_100000210961_100011998445 [2,0,0,0,0,0|2,0,0]=4 7365 B14R0.392 CCOCCCOCCCCCCOC 34a_100000757476_100011998445 [2,0,0,0,0,0|2,0,0]=4 7366 B14R0.392 CCOCCCOCCCCCCOC 34a_200012092642_100012232248 [2,0,0,0,0,0|2,0,0]=4 7367 B14R0.392 CCOCCCOCCCCCCOC 7a_100000757476_100011998445 [2,0,0,0,0,0|2,0,0]=4 7368 B14R0.392 CCOCCCOCCCCCCOC 7a_200012092642_100012232248 [2,0,0,0,0,0|2,0,0]=4 7369 B14R0.392 CCOCCCSCCCCCCOC 62a_100011998445_100012232248 [2,0,0,0,0,0|2,0,0]=4 7370 B14R0.392 CCOCCCSCCCCCCOC 62a_100012232248_100011998445 [2,0,0,0,0,0|2,0,0]=4 7371 B14R0.392 CCSCCCCCCCCCCCO 62a_100009812471_100000210202 [2,0,0,0,0,0|1,0,1]=4 7372 B14R0.392 CCSCCCOCCCCCCOC 34a_100011216438_100011998445 [2,0,0,0,0,0|2,0,0]=4 7373 B14R0.392 CCSCCCOCCCCCCOC 7a_100011216438_100011998445 [2,0,0,0,0,0|2,0,0]=4 7374 B14R0.392 CNCCCCCCCCCCCCO 2230a_100000066677_200000210301 [2,0,0,0,0,0|1,0,1]=4 7375 B14R0.392 CNCCCCCCCCCCCCO 2230a_106832991635_100009813331 [2,0,0,0,0,0|1,0,1]=4 7376 B14R0.392 CNCCCCCCCCCCCCO 34a_100000066677_200000210301 [2,0,0,0,0,0|1,0,1]=4 7377 B14R0.392 CNCCCCCCCCCCCCO 34a_100102657272_100009813331 [2,0,0,0,0,0|1,0,1]=4 7378 B14R0.392 CNCCCCCCCCCCCCO 7a_106832991635_100009813331 [2,0,0,0,0,0|1,0,1]=4 7379 B14R0.392 COCCCCCCCCCCCCBr 34a_100009813331_200000210301 [2,0,0,0,0,0|1,0,0]=3 7380 B14R0.392 COCCCCCCCCCCCCBr 7a_100009813331_200000210301 [2,0,0,0,0,0|1,0,0]=3 7381 B14R0.392 COCCCCCCCCCCCCN 34a_100000066677_200000210301 [2,0,0,0,0,0|1,0,0]=3 7382 B14R0.392 COCCCCCCCCCCCCO 34a_100138415774_100009813331 [2,0,0,0,0,0|1,0,0]=3 7383 B14R0.392 COCCCCCCNCCCCCO 2230a_100000762737_100011998445 [2,0,0,0,0,0|2,0,0]=4 7384 B14R0.392 COCCCCCCNCCCCCO 34a_100000762737_100011998445 [2,0,0,0,0,0|2,0,0]=4 7385 B14R0.392 COCCCCCCOCCCCC=O 7a_200012092642_100000139335 [2,0,0,0,0,0|2,0,0]=4 7386 B14R0.392 COCCCCCCOCCCCCBr 34a_100000746331_100011998445 [2,0,0,0,0,0|2,0,0]=4 7387 B14R0.392 COCCCCCCOCCCCCBr 7a_100000746331_100011998445 [2,0,0,0,0,0|2,0,0]=4 7388 B14R0.392 COCCCCCCOCCCCCCl 34a_100000746330_100011998445 [2,0,0,0,0,0|2,0,0]=4 7389 B14R0.392 COCCCCCCOCCCCCCl 7a_100000746330_100011998445 [2,0,0,0,0,0|2,0,0]=4 7390 B14R0.392 COCCCCCCOCCCCCF 34a_200012092642_100000729378 [2,0,0,0,0,0|2,0,0]=4 7391 B14R0.392 COCCCCCCOCCCCCF 7a_200012092642_100000729378 [2,0,0,0,0,0|2,0,0]=4 7392 B14R0.392 COCCCCCCOCCCCCI 34a_200012148887_100011998445 [2,0,0,0,0,0|2,0,0]=4 7393 B14R0.392 COCCCCCCOCCCCCI 7a_200012148887_100011998445 [2,0,0,0,0,0|2,0,0]=4 7394 B14R0.392 COCCCCCCOCCCCCN 34a_100000762737_100011998445 [2,0,0,0,0,0|2,0,0]=4 7395 B14R0.392 COCCCCCCOCCCCCO 34a_100138415774_200132310570 [2,0,0,0,0,0|2,0,0]=4 7396 B14R0.392 COCCCCCCOCCCCCO 34a_200012092642_100000746330 [2,0,0,0,0,0|2,0,0]=4 7397 B14R0.392 COCCCCCCOCCCCCO 7a_200012092642_100000746330 [2,0,0,0,0,0|2,0,0]=4 7398 B14R0.392 COCCCCCCOCCCCOC 34a_100000740925_100011998445 [2,0,0,0,0,0|2,0,0]=4 7399 B14R0.392 COCCCCCCOCCCCOC 34a_200012092642_100000755781 [2,0,0,0,0,0|2,0,0]=4 7400 B14R0.392 COCCCCCCOCCCCOC 7a_200012092642_100000730899 [2,0,0,0,0,0|2,0,0]=4 7401 B14R0.392 COCCCCCCOCCCCSC 34a_100011217163_100011998445 [2,0,0,0,0,0|2,0,0]=4 7402 B14R0.392 COCCCCCCOCCCCSC 7a_100011217163_100011998445 [2,0,0,0,0,0|2,0,0]=4 7403 B14R0.392 COCCCCCCSCCCCC=O 62a_100000139335_100011998445 [2,0,0,0,0,0|2,0,0]=4 7404 B14R0.392 COCCCCCCSCCCCC=O 62a_100011998445_100000139335 [2,0,0,0,0,0|2,0,0]=4 7405 B14R0.392 COCCCCCCSCCCCCF 62a_100000729378_100011998445 [2,0,0,0,0,0|2,0,0]=4 7406 B14R0.392 COCCCCCCSCCCCCF 62a_100011998445_100000729378 [2,0,0,0,0,0|2,0,0]=4 7407 B14R0.392 COCCCCCCSCCCCCO 62a_100000746330_100011998445 [2,0,0,0,0,0|2,0,0]=4 7408 B14R0.392 COCCCCCCSCCCCCO 62a_100011998445_100000746330 [2,0,0,0,0,0|2,0,0]=4 7409 B14R0.392 COCCCCCCSCCCCOC 62a_100000730899_100011998445 [2,0,0,0,0,0|2,0,0]=4 7410 B14R0.392 COCCCCCCSCCCCOC 62a_100011998445_100000730899 [2,0,0,0,0,0|2,0,0]=4 7411 B14R0.392 COCCCCCNCCCCCC=O 2230a_100000747528_100000139337 [2,0,0,0,0,0|2,0,0]=4 7412 B14R0.392 COCCCCCNCCCCCCF 2230a_100000747528_100015922095 [2,0,0,0,0,0|2,0,0]=4 7413 B14R0.392 COCCCCCNCCCCCCF 34a_100000747528_100015922095 [2,0,0,0,0,0|2,0,0]=4 7414 B14R0.392 COCCCCCNCCCCCCO 2230a_100000747528_100000766143 [2,0,0,0,0,0|2,0,0]=4 7415 B14R0.392 COCCCCCNCCCCCCO 34a_100000747528_100000766143 [2,0,0,0,0,0|2,0,0]=4 7416 B14R0.392 COCCCCCOCCCCCCCl 34a_200132310570_200000210301 [2,0,0,0,0,0|2,0,0]=4 7417 B14R0.392 COCCCCCOCCCCCCCl 7a_200132310570_200000210301 [2,0,0,0,0,0|2,0,0]=4 7418 B14R0.392 COCCCCNCCCCCCCO 2230a_100011996573_100000730899 [2,0,0,0,0,0|2,0,0]=4 7419 B14R0.392 COCCCCNCCCCCCCO 34a_100011996573_100000755781 [2,0,0,0,0,0|2,0,0]=4 7420 B14R0.392 COCCCCOCCCCCCCBr 34a_100000760002_100000755781 [2,0,0,0,0,0|2,0,0]=4 7421 B14R0.392 COCCCCOCCCCCCCBr 7a_100000760002_100000730899 [2,0,0,0,0,0|2,0,0]=4 7422 B14R0.392 COCCCCOCCCCCCCN 34a_100011996573_100000755781 [2,0,0,0,0,0|2,0,0]=4 7423 B14R0.392 COCCCCOCCCCCCCO 34a_100000740925_100000760002 [2,0,0,0,0,0|2,0,0]=4 7424 B14R0.392 COCCCCSCCCCCCCO 62a_100000730899_100000760002 [2,0,0,0,0,0|2,0,0]=4 7425 B14R0.392 COCCCCSCCCCCCCO 62a_100000760002_100000730899 [2,0,0,0,0,0|2,0,0]=4 7426 B14R0.392 COCCCNCCCCCCCCO 2230a_102515433106_100000740836 [2,0,0,0,0,0|2,0,0]=4 7427 B14R0.392 COCCCNCCCCCCCCO 34a_100150723488_100000033203 [2,0,0,0,0,0|2,0,0]=4 7428 B14R0.392 COCCCNCCCCCCCCO 34a_102515433106_100000740836 [2,0,0,0,0,0|2,0,0]=4 7429 B14R0.392 COCCCOCCCCCCCCBr 34a_100009813846_100000740836 [2,0,0,0,0,0|2,0,0]=4 7430 B14R0.392 COCCCOCCCCCCCCBr 7a_100009813846_100000740836 [2,0,0,0,0,0|2,0,0]=4 7431 B14R0.392 COCCCOCCCCCCCCCl 34a_100000033203_100000740836 [2,0,0,0,0,0|2,0,0]=4 7432 B14R0.392 COCCCOCCCCCCCCCl 7a_100000033203_100000740836 [2,0,0,0,0,0|2,0,0]=4 7433 B14R0.392 COCCCOCCCCCCCCN 34a_102515433106_100000740836 [2,0,0,0,0,0|2,0,0]=4 7434 B14R0.392 COCCCOCCCCCCCCO 34a_100000740835_100000033203 [2,0,0,0,0,0|2,0,0]=4 7435 B14R0.392 COCCCSCCCCCCCCO 62a_100000033203_100000709357 [2,0,0,0,0,0|2,0,0]=4 7436 B14R0.392 COCCCSCCCCCCCCO 62a_100000709357_100000033203 [2,0,0,0,0,0|2,0,0]=4 7437 B14R0.392 COCCNCCCCCCCCCO 2230a_100000078944_100011201679 [2,0,0,0,0,0|2,0,0]=4 7438 B14R0.392 COCCNCCCCCCCCCO 2230a_100000209980_100009813782 [2,0,0,0,0,0|2,0,0]=4 7439 B14R0.392 COCCNCCCCCCCCCO 34a_100000078944_100011201679 [2,0,0,0,0,0|2,0,0]=4 7440 B14R0.392 COCCOCCCCCCCCCBr 34a_100009813782_100011201679 [2,0,0,0,0,0|2,0,0]=4 7441 B14R0.392 COCCOCCCCCCCCCBr 7a_100009813782_100000233755 [2,0,0,0,0,0|2,0,0]=4 7442 B14R0.392 COCCOCCCCCCCCCCl 34a_100009868337_100011201679 [2,0,0,0,0,0|2,0,0]=4 7443 B14R0.392 COCCOCCCCCCCCCCl 7a_100009868337_100000233755 [2,0,0,0,0,0|2,0,0]=4 7444 B14R0.392 COCCOCCCCCCCCCN 34a_100000078944_100011201679 [2,0,0,0,0,0|2,0,0]=4 7445 B14R0.392 COCCOCCCCCCCCCO 34a_100000210237_100009813782 [2,0,0,0,0,0|2,0,0]=4 7446 B14R0.392 COCCSCCCCCCCCCO 62a_100000233755_100009813782 [2,0,0,0,0,0|2,0,0]=4 7447 B14R0.392 COCCSCCCCCCCCCO 62a_100009813782_100000233755 [2,0,0,0,0,0|2,0,0]=4 7448 B14R0.392 COCNCCCCCCCCCCO 2230a_100000066964_100000766300 [2,0,0,0,0,0|2,0,0]=4 7449 B14R0.392 COCSCCCCCCCCCCO 62a_100000766300_200000033068 [2,0,0,0,0,0|2,0,0]=4 7450 B14R0.392 COCSCCCCCCCCCCO 62a_100009813290_100000766300 [2,0,0,0,0,0|2,0,0]=4 7451 B14R0.392 CSCCCCCCCCCCCCO 62a_100009813331_200000210301 [2,0,0,0,0,0|1,0,1]=4 7452 B14R0.392 NCCCCCCCCCCOCC=O 34a_100000066964_200009817547 [2,0,0,0,0,0|2,0,0]=4 7453 B14R0.392 O=CCCCCCNCCCCCCO 2230a_100000686447_100000139337 [2,0,0,0,0,0|2,0,0]=4 7454 B14R0.392 O=CCCCCCOCCCCCCBr 7a_100011215345_100000139337 [2,0,0,0,0,0|2,0,0]=4 7455 B14R0.392 O=CCCCCCOCCCCCCCl 7a_100000766143_100000139337 [2,0,0,0,0,0|2,0,0]=4 7456 B14R0.392 O=CCCCCCOCCCCCCF 7a_100000732779_100000139337 [2,0,0,0,0,0|2,0,0]=4 7457 B14R0.392 O=CCCCCCSCCCCCCF 62a_100000139337_100015922095 [2,0,0,0,0,0|2,0,0]=4 7458 B14R0.392 O=CCCCCCSCCCCCCF 62a_100015922095_100000139337 [2,0,0,0,0,0|2,0,0]=4 7459 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000139337_100000766143 [2,0,0,0,0,0|2,0,0]=4 7460 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000766143_100000139337 [2,0,0,0,0,0|2,0,0]=4 7461 B14R0.392 O=CCCCCNCCCCCCCO 2230a_100011996573_100000139335 [2,0,0,0,0,0|2,0,0]=4 7462 B14R0.392 O=CCCCCOCCCCCCCBr 7a_100000760002_100000139335 [2,0,0,0,0,0|2,0,0]=4 7463 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000139335_100000760002 [2,0,0,0,0,0|2,0,0]=4 7464 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000760002_100000139335 [2,0,0,0,0,0|2,0,0]=4 7465 B14R0.392 O=CCCCNCCCCCCCCO 2230a_102515433106_200011292268 [2,0,0,0,0,0|2,0,0]=4 7466 B14R0.392 O=CCCCOCCCCCCCCBr 7a_100009813846_200011292268 [2,0,0,0,0,0|2,0,0]=4 7467 B14R0.392 O=CCCCOCCCCCCCCCl 7a_100000033203_200011292268 [2,0,0,0,0,0|2,0,0]=4 7468 B14R0.392 O=CCCCSCCCCCCCCO 62a_100000033203_200011292268 [2,0,0,0,0,0|2,0,0]=4 7469 B14R0.392 O=CCCCSCCCCCCCCO 62a_200011292268_100000033203 [2,0,0,0,0,0|2,0,0]=4 7470 B14R0.392 O=CCNCCCCCCCCCCO 2230a_100000066964_200015260668 [2,0,0,0,0,0|2,0,0]=4 7471 B14R0.392 O=CCNCCCCCCCCCCO 34a_100000066964_200009817547 [2,0,0,0,0,0|2,0,0]=4 7472 B14R0.392 O=CCOCCCCCCCCCCBr 34a_100009813290_200009817547 [2,0,0,0,0,0|2,0,0]=4 7473 B14R0.392 O=CCOCCCCCCCCCCBr 7a_100009813290_200015260668 [2,0,0,0,0,0|2,0,0]=4 7474 B14R0.392 O=CCOCCCCCCCCCCCl 34a_200000033068_200009817547 [2,0,0,0,0,0|2,0,0]=4 7475 B14R0.392 O=CCOCCCCCCCCCCCl 7a_200000033068_200015260668 [2,0,0,0,0,0|2,0,0]=4 7476 B14R0.392 O=CCSCCCCCCCCCCO 62a_100009813290_200015260668 [2,0,0,0,0,0|2,0,0]=4 7477 B14R0.392 O=CCSCCCCCCCCCCO 62a_200015260668_200000033068 [2,0,0,0,0,0|2,0,0]=4 7478 B14R0.392 [13CH3]NCCCCCCCCCCCCO 2230a_100000066677_200025704644 [2,0,0,0,0,0|1,0,1]=4 7479 B14R0.392 [13CH3]NCCCCCCCCCCCCO 34a_100000066677_200025704644 [2,0,0,0,0,0|1,0,1]=4 7480 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 34a_100009813331_200025704644 [2,0,0,0,0,0|1,0,0]=3 7481 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 7a_100009813331_200025704644 [2,0,0,0,0,0|1,0,0]=3 7482 B14R0.392 [13CH3]OCCCCCCCCCCCCN 34a_100000066677_200025704644 [2,0,0,0,0,0|1,0,0]=3 7483 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 34a_200132310570_200025704644 [2,0,0,0,0,0|2,0,0]=4 7484 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 7a_200132310570_200025704644 [2,0,0,0,0,0|2,0,0]=4 7485 B14R0.392 [13CH3]SCCCCCCCCCCCCO 62a_100009813331_200025704644 [2,0,0,0,0,0|1,0,1]=4 7486 B14R0.337 C#CC(=O)CCCCCCCCCCC 1458a_100000211873_100011215454 [2,0,0,0,0,0|1,0,1]=4 7487 B14R0.337 C=CC(=O)CCCCCCCCCCC 1458a_100000185746_100011215454 [2,0,0,0,0,0|1,0,1]=4 7488 B14R0.337 CCC(=O)CCCCCCCCCCO 1458a_100000210414_100009813290 [2,0,0,0,0,0|2,0,0]=4 7489 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011215454 [2,0,0,0,0,0|1,0,0]=3 7490 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210736_100000210202 [2,0,0,0,0,0|1,0,0]=3 7491 B14R0.337 CCCCCCCCCCCC(=O)CF 1458a_100000210736_100015361967 [2,0,0,0,0,0|2,0,0]=4 7492 B14R0.337 CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215454 [2,0,0,0,0,0|2,0,0]=4 7493 B14R0.337 CCCCCCCCCCCC(=O)NC 11a_106832991635_100000210736 [2,0,0,0,0,0|1,0,0]=3 7494 B14R0.337 CCCCCCCCCCCC(=O)NC 1626a_100102657272_100000210736 [2,0,0,0,0,0|1,0,0]=3 7495 B14R0.337 CCCCCCCCCCCC(=O)NC 240690a_100102657272_100000210736 [2,0,0,0,0,0|1,0,0]=3 7496 B14R0.337 CCCCCCCCCCCC(C)OC 34a_100011217895_200000210301 [2,0,0,0,0,0|1,0,1]=4 7497 B14R0.337 CCCCCCCCCCCC(C)OC 7a_100011217895_200000210301 [2,0,0,0,0,0|1,0,1]=4 7498 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 34a_100011217895_200025704644 [2,0,0,0,0,0|1,0,1]=4 7499 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 7a_100011217895_200025704644 [2,0,0,0,0,0|1,0,1]=4 7500 B14R0.337 CCCCCCCCCCNC(=O)CC 11a_100000684558_100000210414 [2,0,0,0,0,0|2,0,0]=4 7501 B14R0.337 CCCCCCCCCCNC(=O)CC 1626a_100000684558_100000210414 [2,0,0,0,0,0|2,0,0]=4 7502 B14R0.337 CCCCCCCCCCNC(=O)CC 240690a_100000684558_100000210414 [2,0,0,0,0,0|2,0,0]=4 7503 B14R0.337 CCCCCCCCCCNC(=O)CC 527a_100000684558_100000210414 [2,0,0,0,0,0|2,0,0]=4 7504 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100000684558_106832991635 [2,0,0,0,0,0|2,0,0]=4 7505 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100102657272_100000684558 [2,0,0,0,0,0|2,0,0]=4 7506 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100000684558_100102657272 [2,0,0,0,0,0|2,0,0]=4 7507 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100102657272_100000684558 [2,0,0,0,0,0|2,0,0]=4 7508 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_100000684558_100102657272 [2,0,0,0,0,0|2,0,0]=4 7509 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_106832991638_100000684558 [2,0,0,0,0,0|2,0,0]=4 7510 B14R0.337 CCCCCCCCCNCC(=O)NC 2230a_100000212291_100000183359 [2,0,0,0,0,0|2,0,0]=4 7511 B14R0.337 CCCCCCCCCNCC(=O)NC 2230a_100000693194_100011214924 [2,0,0,0,0,0|2,0,0]=4 7512 B14R0.337 CCCCCCCCCNCC(=O)NC 34a_100000212291_100000183359 [2,0,0,0,0,0|2,0,0]=4 7513 B14R0.337 CCCCCCCCCNCC(=O)OC 2230a_100000212291_100000747449 [2,0,0,0,0,0|1,0,0]=3 7514 B14R0.337 CCCCCCCCCNCC(=O)OC 34a_100000212291_100000747449 [2,0,0,0,0,0|1,0,0]=3 7515 B14R0.337 CCCCCCCCCOCC(=O)CC 34a_100000725409_100011214924 [2,0,0,0,0,0|2,0,0]=4 7516 B14R0.337 CCCCCCCCCOCC(=O)CC 7a_100000210712_100000747405 [2,0,0,0,0,0|2,0,0]=4 7517 B14R0.337 CCCCCCCCCOCC(=O)NC 34a_100000210712_100000183359 [2,0,0,0,0,0|2,0,0]=4 7518 B14R0.337 CCCCCCCCCOCC(=O)NC 34a_100000750040_100011214924 [2,0,0,0,0,0|2,0,0]=4 7519 B14R0.337 CCCCCCCCCOCC(=O)NC 7a_100000210712_100000183359 [2,0,0,0,0,0|2,0,0]=4 7520 B14R0.337 CCCCCCCCCOCC(=O)OC 34a_100000210712_100000747449 [2,0,0,0,0,0|1,0,0]=3 7521 B14R0.337 CCCCCCCCCOCC(=O)OC 7a_100000210712_100000747449 [2,0,0,0,0,0|1,0,0]=3 7522 B14R0.337 CCCCCCCCCSCC(=O)CC 62a_100000747405_100000210670 [2,0,0,0,0,0|2,0,0]=4 7523 B14R0.337 CCCCCCCCCSCC(=O)NC 62a_100000183359_100000210670 [2,0,0,0,0,0|2,0,0]=4 7524 B14R0.337 CCCCCCCCCSCC(=O)OC 62a_100000747449_100000210670 [2,0,0,0,0,0|1,0,0]=3 7525 B14R0.337 CCCCCCCCNCCC(=O)NC 2230a_100000229939_100000737683 [2,0,0,0,0,0|2,0,0]=4 7526 B14R0.337 CCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210759 [2,0,0,0,0,0|2,0,0]=4 7527 B14R0.337 CCCCCCCCNCCC(=O)NC 34a_100000229939_100012179268 [2,0,0,0,0,0|2,0,0]=4 7528 B14R0.337 CCCCCCCCNCCC(=O)NC 34a_100000738227_100000210759 [2,0,0,0,0,0|2,0,0]=4 7529 B14R0.337 CCCCCCCCNCCC(=O)OC 2230a_100000229939_100000204255 [2,0,0,0,0,0|1,0,0]=3 7530 B14R0.337 CCCCCCCCNCCC(=O)OC 34a_100000229939_100000742370 [2,0,0,0,0,0|1,0,0]=3 7531 B14R0.337 CCCCCCCCOCCC(=O)NC 34a_100000210232_100012179268 [2,0,0,0,0,0|2,0,0]=4 7532 B14R0.337 CCCCCCCCOCCC(=O)NC 34a_100000754576_100000210759 [2,0,0,0,0,0|2,0,0]=4 7533 B14R0.337 CCCCCCCCOCCC(=O)NC 7a_100000210232_100000737683 [2,0,0,0,0,0|2,0,0]=4 7534 B14R0.337 CCCCCCCCOCCC(=O)OC 34a_100000210232_100000742370 [2,0,0,0,0,0|1,0,0]=3 7535 B14R0.337 CCCCCCCCOCCC(=O)OC 7a_100000210232_100000204255 [2,0,0,0,0,0|1,0,0]=3 7536 B14R0.337 CCCCCCCCSCCC(=O)NC 62a_100000210759_100000737683 [2,0,0,0,0,0|2,0,0]=4 7537 B14R0.337 CCCCCCCCSCCC(=O)NC 62a_100000737683_100000210317 [2,0,0,0,0,0|2,0,0]=4 7538 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000204255_100000210317 [2,0,0,0,0,0|1,0,0]=3 7539 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000210759_100000204255 [2,0,0,0,0,0|1,0,0]=3 7540 B14R0.337 CCCCCCCCSCOC(=O)OC 62a_100000210759_100000139417 [2,0,0,0,0,0|2,0,0]=4 7541 B14R0.337 CCCCCCCNCCCC(=O)NC 2230a_100000229938_100000741757 [2,0,0,0,0,0|2,0,0]=4 7542 B14R0.337 CCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210681 [2,0,0,0,0,0|2,0,0]=4 7543 B14R0.337 CCCCCCCNCCCC(=O)NC 34a_100000740002_100000210614 [2,0,0,0,0,0|2,0,0]=4 7544 B14R0.337 CCCCCCCNCCCC(=O)OC 2230a_100000229938_100011218270 [2,0,0,0,0,0|1,0,0]=3 7545 B14R0.337 CCCCCCCOCCCC(=O)NC 34a_100000210272_100000741757 [2,0,0,0,0,0|2,0,0]=4 7546 B14R0.337 CCCCCCCOCCCC(=O)NC 7a_100000210272_100000741757 [2,0,0,0,0,0|2,0,0]=4 7547 B14R0.337 CCCCCCCOCCCC(=O)OC 34a_100000210272_100000742333 [2,0,0,0,0,0|1,0,0]=3 7548 B14R0.337 CCCCCCCOCCCC(=O)OC 7a_100000210272_100011218270 [2,0,0,0,0,0|1,0,0]=3 7549 B14R0.337 CCCCCCCOCCNC(=O)OC 34a_100000757965_100000210614 [2,0,0,0,0,0|2,0,0]=4 7550 B14R0.337 CCCCCCCOCCOC(=O)OC 34a_100010262106_100000210614 [2,0,0,0,0,0|2,0,0]=4 7551 B14R0.337 CCCCCCCSCCCC(=O)NC 62a_100000210614_100000741757 [2,0,0,0,0,0|2,0,0]=4 7552 B14R0.337 CCCCCCCSCCCC(=O)NC 62a_100000741757_100000210316 [2,0,0,0,0,0|2,0,0]=4 7553 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100000210614_100011218270 [2,0,0,0,0,0|1,0,0]=3 7554 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100011218270_100000210316 [2,0,0,0,0,0|1,0,0]=3 7555 B14R0.337 CCCCCCNCCCCC(=O)OC 2230a_100000210581_100000204269 [2,0,0,0,0,0|1,0,0]=3 7556 B14R0.337 CCCCCCNCCOCC(=O)OC 2230a_100000210581_100000090808 [2,0,0,0,0,0|2,0,0]=4 7557 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000059025_100000210314 [2,0,0,0,0,0|1,0,0]=3 7558 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000210259_100000204269 [2,0,0,0,0,0|1,0,0]=3 7559 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000059025_100000210314 [2,0,0,0,0,0|1,0,0]=3 7560 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000210259_100000204269 [2,0,0,0,0,0|1,0,0]=3 7561 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000210259_100000090808 [2,0,0,0,0,0|2,0,0]=4 7562 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000691444_100000747449 [2,0,0,0,0,0|2,0,0]=4 7563 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000210259_100000090808 [2,0,0,0,0,0|2,0,0]=4 7564 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000691444_100000747449 [2,0,0,0,0,0|2,0,0]=4 7565 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000204269_100000210757 [2,0,0,0,0,0|1,0,0]=3 7566 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000210314_100000204269 [2,0,0,0,0,0|1,0,0]=3 7567 B14R0.337 CCCCCCSCCOCC(=O)OC 62a_100000090808_100000210757 [2,0,0,0,0,0|2,0,0]=4 7568 B14R0.337 CCCCCCSCCOCC(=O)OC 62a_100000210314_100000090808 [2,0,0,0,0,0|2,0,0]=4 7569 B14R0.337 CCCCCNCCCCCC(=O)OC 2230a_100000209983_100009816466 [2,0,0,0,0,0|1,0,0]=3 7570 B14R0.337 CCCCCNCCOCCC(=O)OC 34a_100000224656_100000742370 [2,0,0,0,0,0|2,0,0]=4 7571 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000074720_100000718602 [2,0,0,0,0,0|1,0,0]=3 7572 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000210253_100009816466 [2,0,0,0,0,0|1,0,0]=3 7573 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000074720_100000210326 [2,0,0,0,0,0|1,0,0]=3 7574 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000210253_100009816466 [2,0,0,0,0,0|1,0,0]=3 7575 B14R0.337 CCCCCOCCOCCC(=O)OC 34a_100011215259_100000742370 [2,0,0,0,0,0|2,0,0]=4 7576 B14R0.337 CCCCCOCCOCCC(=O)OC 7a_100011215259_100000204255 [2,0,0,0,0,0|2,0,0]=4 7577 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100000210326_100009816466 [2,0,0,0,0,0|1,0,0]=3 7578 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100009816466_100000210326 [2,0,0,0,0,0|1,0,0]=3 7579 B14R0.337 CCCCNCCCCCCC(=O)OC 2230a_100000102301_100009815986 [2,0,0,0,0,0|1,0,0]=3 7580 B14R0.337 CCCCNCCCCCCC(=O)OC 7a_106832991798_100009815986 [2,0,0,0,0,0|1,0,0]=3 7581 B14R0.337 CCCCNCCCCOCC(=O)OC 34a_200011216965_100000747449 [2,0,0,0,0,0|2,0,0]=4 7582 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100000210227_100009815986 [2,0,0,0,0,0|1,0,0]=3 7583 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100009863599_100000210210 [2,0,0,0,0,0|1,0,0]=3 7584 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100000210227_100009815986 [2,0,0,0,0,0|1,0,0]=3 7585 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100009863599_100000210211 [2,0,0,0,0,0|1,0,0]=3 7586 B14R0.337 CCCCOCCCCOCC(=O)OC 34a_200000760531_100000747449 [2,0,0,0,0,0|2,0,0]=4 7587 B14R0.337 CCCCOCCCCOCC(=O)OC 7a_200000760531_100000747449 [2,0,0,0,0,0|2,0,0]=4 7588 B14R0.337 CCCCOCCCNCCC(=O)OC 2230a_200000211371_100000204255 [2,0,0,0,0,0|2,0,0]=4 7589 B14R0.337 CCCCOCCCNCCC(=O)OC 34a_200000211371_100000742370 [2,0,0,0,0,0|2,0,0]=4 7590 B14R0.337 CCCCOCCCOCCC(=O)OC 34a_200011215613_100000742370 [2,0,0,0,0,0|2,0,0]=4 7591 B14R0.337 CCCCOCCCOCCC(=O)OC 7a_200011215613_100000204255 [2,0,0,0,0,0|2,0,0]=4 7592 B14R0.337 CCCCOCCOCCCC(=O)OC 34a_100000210238_100000742333 [2,0,0,0,0,0|2,0,0]=4 7593 B14R0.337 CCCCOCCOCCCC(=O)OC 7a_100000210238_100011218270 [2,0,0,0,0,0|2,0,0]=4 7594 B14R0.337 CCCCOCCSCCCC(=O)OC 62a_100000743108_100011218270 [2,0,0,0,0,0|2,0,0]=4 7595 B14R0.337 CCCCOCCSCCCC(=O)OC 62a_100011218270_100000743108 [2,0,0,0,0,0|2,0,0]=4 7596 B14R0.337 CCCCOCOCCCCC(=O)OC 34a_100000059025_100011995733 [2,0,0,0,0,0|2,0,0]=4 7597 B14R0.337 CCCCOCSCCCCC(=O)OC 62a_100000204269_100011995733 [2,0,0,0,0,0|2,0,0]=4 7598 B14R0.337 CCCCOCSCCCCC(=O)OC 62a_100011995733_100000204269 [2,0,0,0,0,0|2,0,0]=4 7599 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100000210211_100009815986 [2,0,0,0,0,0|1,0,0]=3 7600 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100009815986_100000210210 [2,0,0,0,0,0|1,0,0]=3 7601 B14R0.337 CCCCSCCNCCCC(=O)OC 2230a_100025743550_100011218270 [2,0,0,0,0,0|2,0,0]=4 7602 B14R0.337 CCCCSCCOCCCC(=O)OC 34a_200000230436_100000742333 [2,0,0,0,0,0|2,0,0]=4 7603 B14R0.337 CCCCSCCOCCCC(=O)OC 7a_200000230436_100011218270 [2,0,0,0,0,0|2,0,0]=4 7604 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100000210258_100010004213 [2,0,0,0,0,0|1,0,0]=3 7605 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100011022521_100000210303 [2,0,0,0,0,0|1,0,0]=3 7606 B14R0.337 CCCOCCCCCCCC(=O)OC 7a_100011022521_100000210303 [2,0,0,0,0,0|1,0,0]=3 7607 B14R0.337 CCCOCCCNCCCC(=O)OC 2230a_100011217757_100011218270 [2,0,0,0,0,0|2,0,0]=4 7608 B14R0.337 CCCOCCCNCCCC(=O)OC 34a_100011217757_100000742333 [2,0,0,0,0,0|2,0,0]=4 7609 B14R0.337 CCCOCCNCCCCC(=O)OC 2230a_100161115042_100000204269 [2,0,0,0,0,0|2,0,0]=4 7610 B14R0.337 CCCOCCNCCCCC(=O)OC 34a_100161115042_100000204269 [2,0,0,0,0,0|2,0,0]=4 7611 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000059025_100011215938 [2,0,0,0,0,0|2,0,0]=4 7612 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000752267_100000204269 [2,0,0,0,0,0|2,0,0]=4 7613 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000059025_100011215938 [2,0,0,0,0,0|2,0,0]=4 7614 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000752267_100000204269 [2,0,0,0,0,0|2,0,0]=4 7615 B14R0.337 CCCOCCSCCCCC(=O)OC 62a_100000204269_100011215938 [2,0,0,0,0,0|2,0,0]=4 7616 B14R0.337 CCCOCCSCCCCC(=O)OC 62a_100011215938_100000204269 [2,0,0,0,0,0|2,0,0]=4 7617 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100000210303_100010004213 [2,0,0,0,0,0|1,0,0]=3 7618 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100010004213_100000210303 [2,0,0,0,0,0|1,0,0]=3 7619 B14R0.337 CCCSCCNCCCCC(=O)OC 2230a_100020603323_100000204269 [2,0,0,0,0,0|2,0,0]=4 7620 B14R0.337 CCCSCCOCCCCC(=O)OC 34a_200000230433_100000204269 [2,0,0,0,0,0|2,0,0]=4 7621 B14R0.337 CCCSCCOCCCCC(=O)OC 7a_200000230433_100000204269 [2,0,0,0,0,0|2,0,0]=4 7622 B14R0.337 CCNCCCCCCCCC(=O)OC 2230a_100015525214_100010282707 [2,0,0,0,0,0|1,0,0]=3 7623 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100000035544_100000210202 [2,0,0,0,0,0|1,0,0]=3 7624 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100121572206_100010282707 [2,0,0,0,0,0|1,0,0]=3 7625 B14R0.337 CCOCCCCCCCCC(=O)OC 7a_100000035544_100000210202 [2,0,0,0,0,0|1,0,0]=3 7626 B14R0.337 CCOCCCNCCCCC(=O)OC 2230a_100000210961_100000204269 [2,0,0,0,0,0|2,0,0]=4 7627 B14R0.337 CCOCCCNCCCCC(=O)OC 34a_100000210961_100000204269 [2,0,0,0,0,0|2,0,0]=4 7628 B14R0.337 CCOCCCOCCCCC(=O)OC 34a_100000059025_100012232248 [2,0,0,0,0,0|2,0,0]=4 7629 B14R0.337 CCOCCCOCCCCC(=O)OC 34a_100000757476_100000204269 [2,0,0,0,0,0|2,0,0]=4 7630 B14R0.337 CCOCCCOCCCCC(=O)OC 7a_100000059025_100012232248 [2,0,0,0,0,0|2,0,0]=4 7631 B14R0.337 CCOCCCOCCCCC(=O)OC 7a_100000757476_100000204269 [2,0,0,0,0,0|2,0,0]=4 7632 B14R0.337 CCOCCCSCCCCC(=O)OC 62a_100000204269_100012232248 [2,0,0,0,0,0|2,0,0]=4 7633 B14R0.337 CCOCCCSCCCCC(=O)OC 62a_100012232248_100000204269 [2,0,0,0,0,0|2,0,0]=4 7634 B14R0.337 CCOCCNCCCCCC(=O)OC 2230a_102516460346_100009816466 [2,0,0,0,0,0|2,0,0]=4 7635 B14R0.337 CCOCCNCCCCCC(=O)OC 34a_102516460346_100009816466 [2,0,0,0,0,0|2,0,0]=4 7636 B14R0.337 CCOCCOCCCCCC(=O)OC 34a_100000074720_100000210147 [2,0,0,0,0,0|2,0,0]=4 7637 B14R0.337 CCOCCOCCCCCC(=O)OC 34a_100000210136_100009816466 [2,0,0,0,0,0|2,0,0]=4 7638 B14R0.337 CCOCCOCCCCCC(=O)OC 7a_100000074720_100011215890 [2,0,0,0,0,0|2,0,0]=4 7639 B14R0.337 CCOCCOCCCCCC(=O)OC 7a_100000210136_100009816466 [2,0,0,0,0,0|2,0,0]=4 7640 B14R0.337 CCOCCSCCCCCC(=O)OC 62a_100000210147_100009816466 [2,0,0,0,0,0|2,0,0]=4 7641 B14R0.337 CCOCCSCCCCCC(=O)OC 62a_100009816466_100011215890 [2,0,0,0,0,0|2,0,0]=4 7642 B14R0.337 CCOCSCCCCCCC(=O)OC 62a_100000739092_100009815986 [2,0,0,0,0,0|2,0,0]=4 7643 B14R0.337 CCOCSCCCCCCC(=O)OC 62a_100009815986_100000739092 [2,0,0,0,0,0|2,0,0]=4 7644 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100000210202_100010282707 [2,0,0,0,0,0|1,0,0]=3 7645 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100010282707_100000210202 [2,0,0,0,0,0|1,0,0]=3 7646 B14R0.337 CCSCCCOCCCCC(=O)OC 34a_100011216438_100000204269 [2,0,0,0,0,0|2,0,0]=4 7647 B14R0.337 CCSCCCOCCCCC(=O)OC 7a_100011216438_100000204269 [2,0,0,0,0,0|2,0,0]=4 7648 B14R0.337 CCSCCNCCCCCC(=O)OC 2230a_100000106463_100009816466 [2,0,0,0,0,0|2,0,0]=4 7649 B14R0.337 CCSCCOCCCCCC(=O)OC 34a_100000074720_100000757381 [2,0,0,0,0,0|2,0,0]=4 7650 B14R0.337 CCSCCOCCCCCC(=O)OC 34a_100000212035_100009816466 [2,0,0,0,0,0|2,0,0]=4 7651 B14R0.337 CCSCCOCCCCCC(=O)OC 7a_100000074720_100000757381 [2,0,0,0,0,0|2,0,0]=4 7652 B14R0.337 CCSCCOCCCCCC(=O)OC 7a_100000212035_100009816466 [2,0,0,0,0,0|2,0,0]=4 7653 B14R0.337 CCSCCSCCCCCC(=O)OC 62a_100000757381_100009816466 [2,0,0,0,0,0|2,0,0]=4 7654 B14R0.337 CCSCCSCCCCCC(=O)OC 62a_100009816466_100000757381 [2,0,0,0,0,0|2,0,0]=4 7655 B14R0.337 CNC(=O)CCCCCCCCCCO 240690a_100102657272_200000016029 [2,0,0,0,0,0|2,0,0]=4 7656 B14R0.337 CNCCCCCCCCCC(=O)OC 2230a_106832991635_100009813843 [2,0,0,0,0,0|1,0,0]=3 7657 B14R0.337 CNCCCCCCCCCC(=O)OC 34a_100102657272_100009813843 [2,0,0,0,0,0|1,0,0]=3 7658 B14R0.337 CNCCCCCCCCCC(=O)OC 7a_106832991635_100009813843 [2,0,0,0,0,0|1,0,0]=3 7659 B14R0.337 CNCCCCCOCCCC(=O)OC 34a_100000722520_100000742333 [2,0,0,0,0,0|2,0,0]=4 7660 B14R0.337 CNCCCOCCCCCC(=O)OC 34a_100000213112_100009816466 [2,0,0,0,0,0|2,0,0]=4 7661 B14R0.337 COC(=O)CCCCCCCCCSC 62a_200000210301_100009813843 [2,0,0,0,0,0|1,0,0]=3 7662 B14R0.337 COC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009813843 [2,0,0,0,0,0|1,0,0]=3 7663 B14R0.337 COC(=O)CCCCCCCCOCF 34a_100000035544_100015361967 [2,0,0,0,0,0|2,0,0]=4 7664 B14R0.337 COC(=O)CCCCCCCCOCF 7a_100000035544_100015361967 [2,0,0,0,0,0|2,0,0]=4 7665 B14R0.337 COC(=O)CCCCCCCCSCF 62a_100010282707_100015361967 [2,0,0,0,0,0|2,0,0]=4 7666 B14R0.337 COC(=O)CCCCCCCCSCF 62a_100015361967_100010282707 [2,0,0,0,0,0|2,0,0]=4 7667 B14R0.337 COC(=O)CCCCCCCNCCF 34a_100000724931_100010004213 [2,0,0,0,0,0|2,0,0]=4 7668 B14R0.337 COC(=O)CCCCCCCNCCO 2230a_100016997473_100010004213 [2,0,0,0,0,0|2,0,0]=4 7669 B14R0.337 COC(=O)CCCCCCCNCCO 34a_100016990907_100010004213 [2,0,0,0,0,0|2,0,0]=4 7670 B14R0.337 COC(=O)CCCCCCCOCCBr 34a_100000211926_100010004213 [2,0,0,0,0,0|2,0,0]=4 7671 B14R0.337 COC(=O)CCCCCCCOCCF 34a_100011022521_100011217306 [2,0,0,0,0,0|2,0,0]=4 7672 B14R0.337 COC(=O)CCCCCCCOCCF 7a_100011022521_100011217306 [2,0,0,0,0,0|2,0,0]=4 7673 B14R0.337 COC(=O)CCCCCCCOCCN 34a_100000210304_100010004213 [2,0,0,0,0,0|2,0,0]=4 7674 B14R0.337 COC(=O)CCCCCCCOCCO 34a_100011022521_100000211926 [2,0,0,0,0,0|2,0,0]=4 7675 B14R0.337 COC(=O)CCCCCCCOCCO 7a_100011022521_100000211926 [2,0,0,0,0,0|2,0,0]=4 7676 B14R0.337 COC(=O)CCCCCCCOCSC 34a_100011022521_100011218213 [2,0,0,0,0,0|2,0,0]=4 7677 B14R0.337 COC(=O)CCCCCCCSCCF 62a_100010004213_100011217306 [2,0,0,0,0,0|2,0,0]=4 7678 B14R0.337 COC(=O)CCCCCCCSCCF 62a_100011217306_100010004213 [2,0,0,0,0,0|2,0,0]=4 7679 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100000211926_100010004213 [2,0,0,0,0,0|2,0,0]=4 7680 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100010004213_100000211926 [2,0,0,0,0,0|2,0,0]=4 7681 B14R0.337 COC(=O)CCCCCCCSCSC 62a_100010004213_100011218213 [2,0,0,0,0,0|2,0,0]=4 7682 B14R0.337 COC(=O)CCCCCCCSCSC 62a_100011218213_100010004213 [2,0,0,0,0,0|2,0,0]=4 7683 B14R0.337 COC(=O)CCCCCCNCCCF 2230a_100015189416_100009815986 [2,0,0,0,0,0|2,0,0]=4 7684 B14R0.337 COC(=O)CCCCCCNCCCF 34a_100015189416_100009815986 [2,0,0,0,0,0|2,0,0]=4 7685 B14R0.337 COC(=O)CCCCCCNCCSC 2230a_100020590264_100009815986 [2,0,0,0,0,0|2,0,0]=4 7686 B14R0.337 COC(=O)CCCCCCOCCCBr 34a_100011217188_100009815986 [2,0,0,0,0,0|2,0,0]=4 7687 B14R0.337 COC(=O)CCCCCCOCCCCl 34a_100000230001_100009815986 [2,0,0,0,0,0|2,0,0]=4 7688 B14R0.337 COC(=O)CCCCCCOCCCF 34a_100000759539_100009815986 [2,0,0,0,0,0|2,0,0]=4 7689 B14R0.337 COC(=O)CCCCCCOCCCF 34a_100009863599_100011934791 [2,0,0,0,0,0|2,0,0]=4 7690 B14R0.337 COC(=O)CCCCCCOCCCF 7a_100009863599_100011934791 [2,0,0,0,0,0|2,0,0]=4 7691 B14R0.337 COC(=O)CCCCCCOCCCN 34a_100000182051_100009815986 [2,0,0,0,0,0|2,0,0]=4 7692 B14R0.337 COC(=O)CCCCCCOCCCO 34a_100009863599_100000230001 [2,0,0,0,0,0|2,0,0]=4 7693 B14R0.337 COC(=O)CCCCCCOCCCO 7a_100009863599_100011215043 [2,0,0,0,0,0|2,0,0]=4 7694 B14R0.337 COC(=O)CCCCCCOCCSC 34a_100000230434_100009815986 [2,0,0,0,0,0|2,0,0]=4 7695 B14R0.337 COC(=O)CCCCCCOCCSC 34a_100009863599_100000212216 [2,0,0,0,0,0|2,0,0]=4 7696 B14R0.337 COC(=O)CCCCCCOCCSC 7a_100000230434_100009815986 [2,0,0,0,0,0|2,0,0]=4 7697 B14R0.337 COC(=O)CCCCCCOCCSC 7a_100009863599_100000212216 [2,0,0,0,0,0|2,0,0]=4 7698 B14R0.337 COC(=O)CCCCCCSCCCF 62a_100009815986_100011934791 [2,0,0,0,0,0|2,0,0]=4 7699 B14R0.337 COC(=O)CCCCCCSCCCF 62a_100011934791_100009815986 [2,0,0,0,0,0|2,0,0]=4 7700 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100009815986_100011215043 [2,0,0,0,0,0|2,0,0]=4 7701 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100011215043_100009815986 [2,0,0,0,0,0|2,0,0]=4 7702 B14R0.337 COC(=O)CCCCCCSCCSC 62a_100000212216_100009815986 [2,0,0,0,0,0|2,0,0]=4 7703 B14R0.337 COC(=O)CCCCCCSCCSC 62a_100009815986_100000751147 [2,0,0,0,0,0|2,0,0]=4 7704 B14R0.337 COC(=O)CCCCCNCCCCO 2230a_100000750430_100009816466 [2,0,0,0,0,0|2,0,0]=4 7705 B14R0.337 COC(=O)CCCCCNCCCCO 34a_100000750430_100009816466 [2,0,0,0,0,0|2,0,0]=4 7706 B14R0.337 COC(=O)CCCCCNCCCSC 2230a_100000749238_100009816466 [2,0,0,0,0,0|2,0,0]=4 7707 B14R0.337 COC(=O)CCCCCOCCCCBr 34a_100011216708_100009816466 [2,0,0,0,0,0|2,0,0]=4 7708 B14R0.337 COC(=O)CCCCCOCCCCCl 34a_100000210776_100009816466 [2,0,0,0,0,0|2,0,0]=4 7709 B14R0.337 COC(=O)CCCCCOCCCCCl 7a_100000210776_100009816466 [2,0,0,0,0,0|2,0,0]=4 7710 B14R0.337 COC(=O)CCCCCOCCCCF 34a_100000074720_100000729493 [2,0,0,0,0,0|2,0,0]=4 7711 B14R0.337 COC(=O)CCCCCOCCCCF 34a_100011995726_100009816466 [2,0,0,0,0,0|2,0,0]=4 7712 B14R0.337 COC(=O)CCCCCOCCCCF 7a_100000074720_100000729493 [2,0,0,0,0,0|2,0,0]=4 7713 B14R0.337 COC(=O)CCCCCOCCCCF 7a_100011995726_100009816466 [2,0,0,0,0,0|2,0,0]=4 7714 B14R0.337 COC(=O)CCCCCOCCCCI 34a_200012148704_100009816466 [2,0,0,0,0,0|2,0,0]=4 7715 B14R0.337 COC(=O)CCCCCOCCCCN 34a_100000750430_100009816466 [2,0,0,0,0,0|2,0,0]=4 7716 B14R0.337 COC(=O)CCCCCOCCCCO 34a_100000074720_100011216708 [2,0,0,0,0,0|2,0,0]=4 7717 B14R0.337 COC(=O)CCCCCOCCCCO 7a_100000074720_100000210776 [2,0,0,0,0,0|2,0,0]=4 7718 B14R0.337 COC(=O)CCCCCOCCCSC 34a_100000690336_100009816466 [2,0,0,0,0,0|2,0,0]=4 7719 B14R0.337 COC(=O)CCCCCOCCCSC 7a_100000690336_100009816466 [2,0,0,0,0,0|2,0,0]=4 7720 B14R0.337 COC(=O)CCCCCSCCCCF 62a_100000729493_100009816466 [2,0,0,0,0,0|2,0,0]=4 7721 B14R0.337 COC(=O)CCCCCSCCCCF 62a_100009816466_100000729493 [2,0,0,0,0,0|2,0,0]=4 7722 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100000210776_100009816466 [2,0,0,0,0,0|2,0,0]=4 7723 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100009816466_100000210776 [2,0,0,0,0,0|2,0,0]=4 7724 B14R0.337 COC(=O)CCCCNCCCCCO 2230a_100000762737_100000204269 [2,0,0,0,0,0|2,0,0]=4 7725 B14R0.337 COC(=O)CCCCNCCCCCO 34a_100000762737_100000204269 [2,0,0,0,0,0|2,0,0]=4 7726 B14R0.337 COC(=O)CCCCOCCCCCBr 34a_100000746331_100000204269 [2,0,0,0,0,0|2,0,0]=4 7727 B14R0.337 COC(=O)CCCCOCCCCCBr 7a_100000746331_100000204269 [2,0,0,0,0,0|2,0,0]=4 7728 B14R0.337 COC(=O)CCCCOCCCCCCl 34a_100000746330_100000204269 [2,0,0,0,0,0|2,0,0]=4 7729 B14R0.337 COC(=O)CCCCOCCCCCCl 7a_100000746330_100000204269 [2,0,0,0,0,0|2,0,0]=4 7730 B14R0.337 COC(=O)CCCCOCCCCCF 34a_100000059025_100000729378 [2,0,0,0,0,0|2,0,0]=4 7731 B14R0.337 COC(=O)CCCCOCCCCCF 7a_100000059025_100000729378 [2,0,0,0,0,0|2,0,0]=4 7732 B14R0.337 COC(=O)CCCCOCCCCCI 34a_200012148887_100000204269 [2,0,0,0,0,0|2,0,0]=4 7733 B14R0.337 COC(=O)CCCCOCCCCCI 7a_200012148887_100000204269 [2,0,0,0,0,0|2,0,0]=4 7734 B14R0.337 COC(=O)CCCCOCCCCCN 34a_100000762737_100000204269 [2,0,0,0,0,0|2,0,0]=4 7735 B14R0.337 COC(=O)CCCCOCCCCCO 34a_100000059025_100000746330 [2,0,0,0,0,0|2,0,0]=4 7736 B14R0.337 COC(=O)CCCCOCCCCCO 7a_100000059025_100000746330 [2,0,0,0,0,0|2,0,0]=4 7737 B14R0.337 COC(=O)CCCCOCCCCSC 34a_100011217163_100000204269 [2,0,0,0,0,0|2,0,0]=4 7738 B14R0.337 COC(=O)CCCCOCCCCSC 7a_100011217163_100000204269 [2,0,0,0,0,0|2,0,0]=4 7739 B14R0.337 COC(=O)CCCCSCCCCCF 62a_100000204269_100000729378 [2,0,0,0,0,0|2,0,0]=4 7740 B14R0.337 COC(=O)CCCCSCCCCCF 62a_100000729378_100000204269 [2,0,0,0,0,0|2,0,0]=4 7741 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000204269_100000746330 [2,0,0,0,0,0|2,0,0]=4 7742 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000746330_100000204269 [2,0,0,0,0,0|2,0,0]=4 7743 B14R0.337 COC(=O)CCCNCCCCCCO 2230a_100000686447_100011218270 [2,0,0,0,0,0|2,0,0]=4 7744 B14R0.337 COC(=O)CCCNCCCCCCO 34a_100000686447_100000742333 [2,0,0,0,0,0|2,0,0]=4 7745 B14R0.337 COC(=O)CCCOCCCCCCBr 34a_100011215345_100000742333 [2,0,0,0,0,0|2,0,0]=4 7746 B14R0.337 COC(=O)CCCOCCCCCCBr 7a_100011215345_100011218270 [2,0,0,0,0,0|2,0,0]=4 7747 B14R0.337 COC(=O)CCCOCCCCCCCl 34a_100000766143_100000742333 [2,0,0,0,0,0|2,0,0]=4 7748 B14R0.337 COC(=O)CCCOCCCCCCCl 7a_100000766143_100011218270 [2,0,0,0,0,0|2,0,0]=4 7749 B14R0.337 COC(=O)CCCOCCCCCCF 34a_100000732779_100000742333 [2,0,0,0,0,0|2,0,0]=4 7750 B14R0.337 COC(=O)CCCOCCCCCCF 7a_100000732779_100011218270 [2,0,0,0,0,0|2,0,0]=4 7751 B14R0.337 COC(=O)CCCOCCCCCCN 34a_100000686447_100000742333 [2,0,0,0,0,0|2,0,0]=4 7752 B14R0.337 COC(=O)CCCSCCCCCCF 62a_100011218270_100015922095 [2,0,0,0,0,0|2,0,0]=4 7753 B14R0.337 COC(=O)CCCSCCCCCCF 62a_100015922095_100011218270 [2,0,0,0,0,0|2,0,0]=4 7754 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100000766143_100011218270 [2,0,0,0,0,0|2,0,0]=4 7755 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100011218270_100000766143 [2,0,0,0,0,0|2,0,0]=4 7756 B14R0.337 COC(=O)CCNCCCCCCCO 2230a_100011996573_100000204255 [2,0,0,0,0,0|2,0,0]=4 7757 B14R0.337 COC(=O)CCNCCCCCCCO 34a_100011996573_100000742370 [2,0,0,0,0,0|2,0,0]=4 7758 B14R0.337 COC(=O)CCOCCCCCCCBr 34a_100000760002_100000742370 [2,0,0,0,0,0|2,0,0]=4 7759 B14R0.337 COC(=O)CCOCCCCCCCBr 7a_100000760002_100000204255 [2,0,0,0,0,0|2,0,0]=4 7760 B14R0.337 COC(=O)CCOCCCCCCCN 34a_100011996573_100000742370 [2,0,0,0,0,0|2,0,0]=4 7761 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000204255_100000760002 [2,0,0,0,0,0|2,0,0]=4 7762 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000760002_100000204255 [2,0,0,0,0,0|2,0,0]=4 7763 B14R0.337 COC(=O)CNCCCCCCCCO 2230a_102515433106_100000747449 [2,0,0,0,0,0|2,0,0]=4 7764 B14R0.337 COC(=O)CNCCCCCCCCO 34a_102515433106_100000747449 [2,0,0,0,0,0|2,0,0]=4 7765 B14R0.337 COC(=O)COCCCCCCCCBr 34a_100009813846_100000747449 [2,0,0,0,0,0|2,0,0]=4 7766 B14R0.337 COC(=O)COCCCCCCCCBr 7a_100009813846_100000747449 [2,0,0,0,0,0|2,0,0]=4 7767 B14R0.337 COC(=O)COCCCCCCCCCl 34a_100000033203_100000747449 [2,0,0,0,0,0|2,0,0]=4 7768 B14R0.337 COC(=O)COCCCCCCCCCl 7a_100000033203_100000747449 [2,0,0,0,0,0|2,0,0]=4 7769 B14R0.337 COC(=O)COCCCCCCCCN 34a_102515433106_100000747449 [2,0,0,0,0,0|2,0,0]=4 7770 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000033203_100000747449 [2,0,0,0,0,0|2,0,0]=4 7771 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000747449_100000033203 [2,0,0,0,0,0|2,0,0]=4 7772 B14R0.337 COCCCCCCCCCC(=O)OC 34a_100138415774_100009813843 [2,0,0,0,0,0|1,0,0]=3 7773 B14R0.337 COCCCCCCOCCC(=O)OC 34a_200012092642_100000742370 [2,0,0,0,0,0|2,0,0]=4 7774 B14R0.337 COCCCCCCOCCC(=O)OC 7a_200012092642_100000204255 [2,0,0,0,0,0|2,0,0]=4 7775 B14R0.337 COCCCCCCSCCC(=O)OC 62a_100000204255_100011998445 [2,0,0,0,0,0|2,0,0]=4 7776 B14R0.337 COCCCCCCSCCC(=O)OC 62a_100011998445_100000204255 [2,0,0,0,0,0|2,0,0]=4 7777 B14R0.337 COCCCCCNCCCC(=O)OC 2230a_100000747528_100011218270 [2,0,0,0,0,0|2,0,0]=4 7778 B14R0.337 COCCCCCNCCCC(=O)OC 34a_100000747528_100000742333 [2,0,0,0,0,0|2,0,0]=4 7779 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000059025_100000755781 [2,0,0,0,0,0|2,0,0]=4 7780 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000740925_100000204269 [2,0,0,0,0,0|2,0,0]=4 7781 B14R0.337 COCCCCOCCCCC(=O)OC 7a_100000059025_100000730899 [2,0,0,0,0,0|2,0,0]=4 7782 B14R0.337 COCCCCSCCCCC(=O)OC 62a_100000204269_100000730899 [2,0,0,0,0,0|2,0,0]=4 7783 B14R0.337 COCCCCSCCCCC(=O)OC 62a_100000730899_100000204269 [2,0,0,0,0,0|2,0,0]=4 7784 B14R0.337 COCCCNCCCCCC(=O)OC 34a_100150723488_100009816466 [2,0,0,0,0,0|2,0,0]=4 7785 B14R0.337 COCCCOCCCCCC(=O)OC 34a_100000074720_100000740836 [2,0,0,0,0,0|2,0,0]=4 7786 B14R0.337 COCCCOCCCCCC(=O)OC 34a_100000740835_100009816466 [2,0,0,0,0,0|2,0,0]=4 7787 B14R0.337 COCCCOCCCCCC(=O)OC 7a_100000074720_100000740836 [2,0,0,0,0,0|2,0,0]=4 7788 B14R0.337 COCCCSCCCCCC(=O)OC 62a_100000709357_100009816466 [2,0,0,0,0,0|2,0,0]=4 7789 B14R0.337 COCCCSCCCCCC(=O)OC 62a_100009816466_100000709357 [2,0,0,0,0,0|2,0,0]=4 7790 B14R0.337 COCCNCCCCCCC(=O)OC 2230a_100000209980_100009815986 [2,0,0,0,0,0|2,0,0]=4 7791 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100000210237_100009815986 [2,0,0,0,0,0|2,0,0]=4 7792 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100009863599_100011201679 [2,0,0,0,0,0|2,0,0]=4 7793 B14R0.337 COCCOCCCCCCC(=O)OC 7a_100009863599_100000233755 [2,0,0,0,0,0|2,0,0]=4 7794 B14R0.337 COCCSCCCCCCC(=O)OC 62a_100000233755_100009815986 [2,0,0,0,0,0|2,0,0]=4 7795 B14R0.337 COCCSCCCCCCC(=O)OC 62a_100009815986_100000233755 [2,0,0,0,0,0|2,0,0]=4 7796 B14R0.337 COCSCCCCCCCC(=O)OC 62a_100000766300_100010004213 [2,0,0,0,0,0|2,0,0]=4 7797 B14R0.337 COCSCCCCCCCC(=O)OC 62a_100010004213_100000766300 [2,0,0,0,0,0|2,0,0]=4 7798 B14R0.394 C=C(C)CCNCCCCCCCCC 2230a_100000212291_100000730704 [2,0,0,0,0,0|2,0,0]=4 7799 B14R0.394 C=C(C)CCNCCCCCCCCC 34a_100000212291_100000730704 [2,0,0,0,0,0|2,0,0]=4 7800 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000210712_100000730704 [2,0,0,0,0,0|2,0,0]=4 7801 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000764851_100011214924 [2,0,0,0,0,0|2,0,0]=4 7802 B14R0.394 C=C(C)CCOCCCCCCCCC 7a_100000210712_100000730704 [2,0,0,0,0,0|2,0,0]=4 7803 B14R0.394 C=C(C)CCSCCCCCCCCC 62a_100000730704_100000210670 [2,0,0,0,0,0|2,0,0]=4 7804 B14R0.394 C=C(C)CNCCCCCCCCCC 2230a_100000684558_100000748629 [2,0,0,0,0,0|2,0,0]=4 7805 B14R0.394 C=C(C)CNCCCCCCCCCC 34a_100000684558_100000748629 [2,0,0,0,0,0|2,0,0]=4 7806 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210245_100000210320 [2,0,0,0,0,0|2,0,0]=4 7807 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210711_100000748629 [2,0,0,0,0,0|2,0,0]=4 7808 B14R0.394 C=C(C)COCCCCCCCCCC 7a_100000210711_100000748629 [2,0,0,0,0,0|2,0,0]=4 7809 B14R0.394 C=C(C)CSCCCCCCCCCC 62a_100000748629_100000210320 [2,0,0,0,0,0|2,0,0]=4 7810 B14R0.394 C=CCCCCCCCCCCC(=O)C 1458a_100000070787_100011093070 [2,0,0,0,0,0|0,0,2]=4 7811 B14R0.394 CC(=O)CCCCCCCCCCCO 1458a_100000070787_100009812471 [2,0,0,0,0,0|1,0,0]=3 7812 B14R0.394 CC(=O)CCCCNCCCCCCO 34a_100000686447_100009817362 [2,0,0,0,0,0|2,0,0]=4 7813 B14R0.394 CC(=O)CCCCOCCCCCCBr 34a_100011215345_100009817362 [2,0,0,0,0,0|2,0,0]=4 7814 B14R0.394 CC(=O)CCCCOCCCCCCBr 7a_100011215345_100000735457 [2,0,0,0,0,0|2,0,0]=4 7815 B14R0.394 CC(=O)CCCCOCCCCCCCl 34a_100000766143_100009817362 [2,0,0,0,0,0|2,0,0]=4 7816 B14R0.394 CC(=O)CCCCOCCCCCCCl 7a_100000766143_100000735457 [2,0,0,0,0,0|2,0,0]=4 7817 B14R0.394 CC(=O)CCCCOCCCCCCF 34a_100000732779_100009817362 [2,0,0,0,0,0|2,0,0]=4 7818 B14R0.394 CC(=O)CCCCOCCCCCCF 7a_100000732779_100000735457 [2,0,0,0,0,0|2,0,0]=4 7819 B14R0.394 CC(=O)CCCCOCCCCCCN 34a_100000686447_100009817362 [2,0,0,0,0,0|2,0,0]=4 7820 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100000735457_100015922095 [2,0,0,0,0,0|2,0,0]=4 7821 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100015922095_100000735457 [2,0,0,0,0,0|2,0,0]=4 7822 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000735457_100000766143 [2,0,0,0,0,0|2,0,0]=4 7823 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000766143_100000735457 [2,0,0,0,0,0|2,0,0]=4 7824 B14R0.394 CC(=O)CCCNCCCCCCCO 34a_100011996573_100000685027 [2,0,0,0,0,0|2,0,0]=4 7825 B14R0.394 CC(=O)CCCOCCCCCCCBr 34a_100000760002_100000685027 [2,0,0,0,0,0|2,0,0]=4 7826 B14R0.394 CC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215641 [2,0,0,0,0,0|2,0,0]=4 7827 B14R0.394 CC(=O)CCCOCCCCCCCN 34a_100011996573_100000685027 [2,0,0,0,0,0|2,0,0]=4 7828 B14R0.394 CC(=O)CCCOCCCCCCCO 34a_100000759063_100000760002 [2,0,0,0,0,0|2,0,0]=4 7829 B14R0.394 CC(=O)CCCOCCCCCCCO 7a_100000759063_100000760002 [2,0,0,0,0,0|2,0,0]=4 7830 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100000760002_100011215641 [2,0,0,0,0,0|2,0,0]=4 7831 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100011215641_100000760002 [2,0,0,0,0,0|2,0,0]=4 7832 B14R0.394 CC(=O)CCOCCCCCCCCBr 7a_100009813846_100000053229 [2,0,0,0,0,0|2,0,0]=4 7833 B14R0.394 CC(=O)CCOCCCCCCCCCl 7a_100000033203_100000053229 [2,0,0,0,0,0|2,0,0]=4 7834 B14R0.394 CC(=O)CCOCCCCCCCCO 34a_100000759926_100000033203 [2,0,0,0,0,0|2,0,0]=4 7835 B14R0.394 CC(=O)CCOCCCCCCCCO 7a_100000759926_100000033203 [2,0,0,0,0,0|2,0,0]=4 7836 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000033203_100000053229 [2,0,0,0,0,0|2,0,0]=4 7837 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000053229_100000033203 [2,0,0,0,0,0|2,0,0]=4 7838 B14R0.394 CC(=O)COCCCCCCCCCO 34a_100000211253_100009813782 [2,0,0,0,0,0|2,0,0]=4 7839 B14R0.394 CC(=O)NCCCCCCCCCCO 240690a_100000066964_100015343762 [2,0,0,0,0,0|2,0,0]=4 7840 B14R0.394 CCCCC#CCCCCCCC(=O)C 1458a_100000070787_200000043322 [2,0,0,0,0,0|0,0,2]=4 7841 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100000070787_100000759014 [2,0,0,0,0,0|0,0,0]=2 7842 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100011215791_200000210301 [2,0,0,0,0,0|0,0,0]=2 7843 B14R0.394 CCCCCCCCCCCCC(=O)[13CH3] 1458a_100011215791_200025704644 [2,0,0,0,0,0|0,0,0]=2 7844 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100000227908_200000210301 [2,0,0,0,0,0|2,0,0]=4 7845 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100102631434_100011215052 [2,0,0,0,0,0|2,0,0]=4 7846 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100000227908_200000210301 [2,0,0,0,0,0|2,0,0]=4 7847 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100102631434_100000759014 [2,0,0,0,0,0|2,0,0]=4 7848 B14R0.394 CCCCCCCCCCCCN(C)C 270004a_100102631434_100011218549 [2,0,0,0,0,0|2,0,0]=4 7849 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 2230a_100000227908_200025704644 [2,0,0,0,0,0|2,0,0]=4 7850 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 269982a_100000227908_200025704644 [2,0,0,0,0,0|2,0,0]=4 7851 B14R0.394 CCCCCCCCCCCNC(=O)C 11a_200011215754_100015343762 [2,0,0,0,0,0|1,0,0]=3 7852 B14R0.394 CCCCCCCCCCCNC(=O)C 1626a_200011215754_100015343762 [2,0,0,0,0,0|1,0,0]=3 7853 B14R0.394 CCCCCCCCCCCNC(=O)C 240690a_200011215754_100015343762 [2,0,0,0,0,0|1,0,0]=3 7854 B14R0.394 CCCCCCCCCCCNC(=O)C 527a_200011215754_100103153847 [2,0,0,0,0,0|1,0,0]=3 7855 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000684558_100000747473 [2,0,0,0,0,0|2,0,0]=4 7856 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210320 [2,0,0,0,0,0|2,0,0]=4 7857 B14R0.394 CCCCCCCCCCNCC(=O)N 34a_100000684558_100000187820 [2,0,0,0,0,0|2,0,0]=4 7858 B14R0.394 CCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210320 [2,0,0,0,0,0|1,0,0]=3 7859 B14R0.394 CCCCCCCCCCNCC(=O)[O-] 34a_100000684558_100020667443 [2,0,0,0,0,0|1,0,1]=4 7860 B14R0.394 CCCCCCCCCCOCC(=O)C 34a_100000211253_100000210320 [2,0,0,0,0,0|1,0,0]=3 7861 B14R0.394 CCCCCCCCCCOCC(=O)N 34a_100000210711_100000187820 [2,0,0,0,0,0|2,0,0]=4 7862 B14R0.394 CCCCCCCCCCOCC(=O)N 7a_100000210711_100000187820 [2,0,0,0,0,0|2,0,0]=4 7863 B14R0.394 CCCCCCCCCCOCC(=O)[O-] 34a_100000210711_100020667443 [2,0,0,0,0,0|1,0,1]=4 7864 B14R0.394 CCCCCCCCCCSCC(=O)N 62a_100000747473_100000210320 [2,0,0,0,0,0|2,0,0]=4 7865 B14R0.394 CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210320 [2,0,0,0,0,0|1,0,1]=4 7866 B14R0.394 CCCCCCCCCNCCC(=O)N 2230a_100000212291_100000744528 [2,0,0,0,0,0|2,0,0]=4 7867 B14R0.394 CCCCCCCCCNCCC(=O)N 34a_100000212291_100000731001 [2,0,0,0,0,0|2,0,0]=4 7868 B14R0.394 CCCCCCCCCNCOC(=O)C 34a_100000212291_100009813279 [2,0,0,0,0,0|2,0,0]=4 7869 B14R0.394 CCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210670 [2,0,0,0,0,0|2,0,0]=4 7870 B14R0.394 CCCCCCCCCOCCC(=O)C 34a_100000759926_100011214924 [2,0,0,0,0,0|1,0,0]=3 7871 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000210712_100000053229 [2,0,0,0,0,0|1,0,0]=3 7872 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000759926_100000210328 [2,0,0,0,0,0|1,0,0]=3 7873 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000210712_100000731001 [2,0,0,0,0,0|2,0,0]=4 7874 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000757172_100011214924 [2,0,0,0,0,0|2,0,0]=4 7875 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000210712_100000744528 [2,0,0,0,0,0|2,0,0]=4 7876 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000757172_100000210328 [2,0,0,0,0,0|2,0,0]=4 7877 B14R0.394 CCCCCCCCCOCOC(=O)C 34a_100000210712_100009813279 [2,0,0,0,0,0|2,0,0]=4 7878 B14R0.394 CCCCCCCCCSCCC(=O)C 62a_100000053229_100000210670 [2,0,0,0,0,0|1,0,0]=3 7879 B14R0.394 CCCCCCCCCSCCC(=O)N 62a_100000744528_100000210670 [2,0,0,0,0,0|2,0,0]=4 7880 B14R0.394 CCCCCCCCCSCOC(=O)C 62a_100000076356_100000210670 [2,0,0,0,0,0|2,0,0]=4 7881 B14R0.394 CCCCCCCCNCCCC(=O)C 34a_100000229939_100000685027 [2,0,0,0,0,0|1,0,0]=3 7882 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000229939_100102525003 [2,0,0,0,0,0|2,0,0]=4 7883 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000739312_100000210759 [2,0,0,0,0,0|2,0,0]=4 7884 B14R0.394 CCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210759 [2,0,0,0,0,0|2,0,0]=4 7885 B14R0.394 CCCCCCCCNCCNC(=O)C 2230a_100000209853_100000210759 [2,0,0,0,0,0|2,0,0]=4 7886 B14R0.394 CCCCCCCCNCCNC(=O)C 2230a_100000229939_100000189650 [2,0,0,0,0,0|2,0,0]=4 7887 B14R0.394 CCCCCCCCNCCOC(=O)C 34a_100000229939_100009814007 [2,0,0,0,0,0|2,0,0]=4 7888 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000210232_100000685027 [2,0,0,0,0,0|1,0,0]=3 7889 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000759063_100000210759 [2,0,0,0,0,0|1,0,0]=3 7890 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000210232_100011215641 [2,0,0,0,0,0|1,0,0]=3 7891 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000759063_100000210759 [2,0,0,0,0,0|1,0,0]=3 7892 B14R0.394 CCCCCCCCOCCCC(=O)N 34a_100000210232_100102525003 [2,0,0,0,0,0|2,0,0]=4 7893 B14R0.394 CCCCCCCCOCCCC(=O)N 7a_100000210232_100102525003 [2,0,0,0,0,0|2,0,0]=4 7894 B14R0.394 CCCCCCCCOCCNC(=O)C 34a_100000158858_100000210759 [2,0,0,0,0,0|2,0,0]=4 7895 B14R0.394 CCCCCCCCOCCNC(=O)C 7a_100000210232_100000189650 [2,0,0,0,0,0|2,0,0]=4 7896 B14R0.394 CCCCCCCCOCCOC(=O)C 34a_100000210232_100009814007 [2,0,0,0,0,0|2,0,0]=4 7897 B14R0.394 CCCCCCCCOCCOC(=O)C 7a_100000210232_100009814007 [2,0,0,0,0,0|2,0,0]=4 7898 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100000210759_100011215641 [2,0,0,0,0,0|1,0,0]=3 7899 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100011215641_100000210317 [2,0,0,0,0,0|1,0,0]=3 7900 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100000210759_100102525003 [2,0,0,0,0,0|2,0,0]=4 7901 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100102525003_100000210317 [2,0,0,0,0,0|2,0,0]=4 7902 B14R0.394 CCCCCCCCSCCNC(=O)C 62a_100000189650_100000210317 [2,0,0,0,0,0|2,0,0]=4 7903 B14R0.394 CCCCCCCCSCCNC(=O)C 62a_100000210759_100000189650 [2,0,0,0,0,0|2,0,0]=4 7904 B14R0.394 CCCCCCCCSCCOC(=O)C 62a_100000210759_100009814007 [2,0,0,0,0,0|2,0,0]=4 7905 B14R0.394 CCCCCCCCSCCOC(=O)C 62a_100009814007_100000210317 [2,0,0,0,0,0|2,0,0]=4 7906 B14R0.394 CCCCCCCNCCCCC(=O)N 34a_100000696515_100000210614 [2,0,0,0,0,0|2,0,0]=4 7907 B14R0.394 CCCCCCCNCCCNC(=O)C 34a_100000736810_100000210614 [2,0,0,0,0,0|2,0,0]=4 7908 B14R0.394 CCCCCCCNCCCSC(=O)C 2230a_100000229938_100000038929 [2,0,0,0,0,0|2,0,0]=4 7909 B14R0.394 CCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210614 [2,0,0,0,0,0|2,0,0]=4 7910 B14R0.394 CCCCCCCOCCCCC(=O)C 34a_100000210272_100009817362 [2,0,0,0,0,0|1,0,0]=3 7911 B14R0.394 CCCCCCCOCCCCC(=O)C 7a_100000210272_100000735457 [2,0,0,0,0,0|1,0,0]=3 7912 B14R0.394 CCCCCCCOCCCCC(=O)N 34a_100012022536_100000210614 [2,0,0,0,0,0|2,0,0]=4 7913 B14R0.394 CCCCCCCOCCCCC(=O)N 7a_100012022536_100000210614 [2,0,0,0,0,0|2,0,0]=4 7914 B14R0.394 CCCCCCCOCCCNC(=O)C 34a_100000752032_100000210614 [2,0,0,0,0,0|2,0,0]=4 7915 B14R0.394 CCCCCCCOCCCOC(=O)C 34a_100000210272_100000042594 [2,0,0,0,0,0|2,0,0]=4 7916 B14R0.394 CCCCCCCOCCCOC(=O)C 7a_100000210272_100000042594 [2,0,0,0,0,0|2,0,0]=4 7917 B14R0.394 CCCCCCCOCCCSC(=O)C 34a_100000210272_100000038929 [2,0,0,0,0,0|2,0,0]=4 7918 B14R0.394 CCCCCCCOCCCSC(=O)C 7a_100000210272_100000038929 [2,0,0,0,0,0|2,0,0]=4 7919 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000210614_100000735457 [2,0,0,0,0,0|1,0,0]=3 7920 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000735457_100000210316 [2,0,0,0,0,0|1,0,0]=3 7921 B14R0.394 CCCCCCCSCCCOC(=O)C 62a_100000042594_100000210316 [2,0,0,0,0,0|2,0,0]=4 7922 B14R0.394 CCCCCCCSCCCOC(=O)C 62a_100000210614_100000042594 [2,0,0,0,0,0|2,0,0]=4 7923 B14R0.394 CCCCCCCSCCCSC(=O)C 62a_100000038929_100000210316 [2,0,0,0,0,0|2,0,0]=4 7924 B14R0.394 CCCCCCCSCCCSC(=O)C 62a_100000210614_100000038929 [2,0,0,0,0,0|2,0,0]=4 7925 B14R0.394 CCCCCCNCCCCCC(=O)N 2230a_100000210581_100009817443 [2,0,0,0,0,0|2,0,0]=4 7926 B14R0.394 CCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210314 [2,0,0,0,0,0|2,0,0]=4 7927 B14R0.394 CCCCCCNCCCCNC(=O)C 34a_200011368371_100000210314 [2,0,0,0,0,0|2,0,0]=4 7928 B14R0.394 CCCCCCNCCCCSC(=O)C 2230a_100000210581_200010402107 [2,0,0,0,0,0|2,0,0]=4 7929 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000123541_100000210314 [2,0,0,0,0,0|2,0,0]=4 7930 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000210259_100009817443 [2,0,0,0,0,0|2,0,0]=4 7931 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000123541_100000210314 [2,0,0,0,0,0|2,0,0]=4 7932 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000210259_100009817443 [2,0,0,0,0,0|2,0,0]=4 7933 B14R0.394 CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210314 [2,0,0,0,0,0|1,0,1]=4 7934 B14R0.394 CCCCCCOCCCCOC(=O)C 34a_100000073216_100000210314 [2,0,0,0,0,0|2,0,0]=4 7935 B14R0.394 CCCCCCOCCCCOC(=O)C 34a_100000210259_100000033659 [2,0,0,0,0,0|2,0,0]=4 7936 B14R0.394 CCCCCCOCCCCOC(=O)C 7a_100000073216_100000210314 [2,0,0,0,0,0|2,0,0]=4 7937 B14R0.394 CCCCCCOCCCCOC(=O)C 7a_100000210259_100000033659 [2,0,0,0,0,0|2,0,0]=4 7938 B14R0.394 CCCCCCOCCCCSC(=O)C 34a_100000210259_200010402107 [2,0,0,0,0,0|2,0,0]=4 7939 B14R0.394 CCCCCCOCCCCSC(=O)C 7a_100000210259_200010402107 [2,0,0,0,0,0|2,0,0]=4 7940 B14R0.394 CCCCCCOCCOCCC(=O)C 7a_100000691444_100000053229 [2,0,0,0,0,0|2,0,0]=4 7941 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100000210314_100009817443 [2,0,0,0,0,0|2,0,0]=4 7942 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100009817443_100000210757 [2,0,0,0,0,0|2,0,0]=4 7943 B14R0.394 CCCCCCSCCCCOC(=O)C 62a_100000033659_100000210757 [2,0,0,0,0,0|2,0,0]=4 7944 B14R0.394 CCCCCCSCCCCOC(=O)C 62a_100000210314_100000033659 [2,0,0,0,0,0|2,0,0]=4 7945 B14R0.394 CCCCCCSCCCCSC(=O)C 62a_100000210314_200010402107 [2,0,0,0,0,0|2,0,0]=4 7946 B14R0.394 CCCCCCSCCCCSC(=O)C 62a_200010402107_100000210757 [2,0,0,0,0,0|2,0,0]=4 7947 B14R0.394 CCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210326 [2,0,0,0,0,0|2,0,0]=4 7948 B14R0.394 CCCCCNCCCCCNC(=O)C 34a_200012022750_100000718602 [2,0,0,0,0,0|2,0,0]=4 7949 B14R0.394 CCCCCNCCCCCOC(=O)C 2230a_100000209983_100009813381 [2,0,0,0,0,0|2,0,0]=4 7950 B14R0.394 CCCCCNCCOCCCC(=O)C 34a_100000224656_100000685027 [2,0,0,0,0,0|2,0,0]=4 7951 B14R0.394 CCCCCOCCCCCOC(=O)C 34a_100000210253_100000033007 [2,0,0,0,0,0|2,0,0]=4 7952 B14R0.394 CCCCCOCCCCCOC(=O)C 7a_100000210253_100000033007 [2,0,0,0,0,0|2,0,0]=4 7953 B14R0.394 CCCCCOCCOCCCC(=O)C 34a_100011215259_100000685027 [2,0,0,0,0,0|2,0,0]=4 7954 B14R0.394 CCCCCOCCOCCCC(=O)C 7a_100011215259_100011215641 [2,0,0,0,0,0|2,0,0]=4 7955 B14R0.394 CCCCCSCCCCCOC(=O)C 62a_100000033007_100000210326 [2,0,0,0,0,0|2,0,0]=4 7956 B14R0.394 CCCCCSCCCCCOC(=O)C 62a_100000210326_100000033007 [2,0,0,0,0,0|2,0,0]=4 7957 B14R0.394 CCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210211 [2,0,0,0,0,0|2,0,0]=4 7958 B14R0.394 CCCCNCCCCCCNC(=O)C 34a_200011996284_100000210210 [2,0,0,0,0,0|2,0,0]=4 7959 B14R0.394 CCCCOCCCCOCCC(=O)C 7a_200000760531_100000053229 [2,0,0,0,0,0|2,0,0]=4 7960 B14R0.394 CCCCOCCCNCCCC(=O)C 34a_200000211371_100000685027 [2,0,0,0,0,0|2,0,0]=4 7961 B14R0.394 CCCCOCCCOCCCC(=O)C 34a_200011215613_100000685027 [2,0,0,0,0,0|2,0,0]=4 7962 B14R0.394 CCCCOCCCOCCCC(=O)C 7a_200011215613_100011215641 [2,0,0,0,0,0|2,0,0]=4 7963 B14R0.394 CCCCOCCOCCCCC(=O)C 34a_100000210238_100009817362 [2,0,0,0,0,0|2,0,0]=4 7964 B14R0.394 CCCCOCCOCCCCC(=O)C 7a_100000210238_100000735457 [2,0,0,0,0,0|2,0,0]=4 7965 B14R0.394 CCCCOCCSCCCCC(=O)C 62a_100000735457_100000743108 [2,0,0,0,0,0|2,0,0]=4 7966 B14R0.394 CCCCOCCSCCCCC(=O)C 62a_100000743108_100000735457 [2,0,0,0,0,0|2,0,0]=4 7967 B14R0.394 CCCCSCCOCCCCC(=O)C 34a_200000230436_100009817362 [2,0,0,0,0,0|2,0,0]=4 7968 B14R0.394 CCCCSCCOCCCCC(=O)C 7a_200000230436_100000735457 [2,0,0,0,0,0|2,0,0]=4 7969 B14R0.394 CCCOCCCNCCCCC(=O)C 34a_100011217757_100009817362 [2,0,0,0,0,0|2,0,0]=4 7970 B14R0.394 CNCCCCCCCCCCC(=O)N 2230a_106832991635_200010167045 [2,0,0,0,0,0|2,0,0]=4 7971 B14R0.394 CNCCCCCCCCCCC(=O)N 34a_100102657272_200010167045 [2,0,0,0,0,0|2,0,0]=4 7972 B14R0.394 CNCCCCCCCCCCC(=O)N 7a_106832991635_200010167045 [2,0,0,0,0,0|2,0,0]=4 7973 B14R0.394 CNCCCCCOCCCCC(=O)C 34a_100000722520_100009817362 [2,0,0,0,0,0|2,0,0]=4 7974 B14R0.394 COCCCCCCCCCCC(=O)N 34a_100138415774_200010167045 [2,0,0,0,0,0|2,0,0]=4 7975 B14R0.394 COCCCCCCOCCCC(=O)C 34a_100000759063_100011998445 [2,0,0,0,0,0|2,0,0]=4 7976 B14R0.394 COCCCCCCOCCCC(=O)C 34a_200012092642_100000685027 [2,0,0,0,0,0|2,0,0]=4 7977 B14R0.394 COCCCCCCOCCCC(=O)C 7a_100000759063_100011998445 [2,0,0,0,0,0|2,0,0]=4 7978 B14R0.394 COCCCCCCOCCCC(=O)C 7a_200012092642_100011215641 [2,0,0,0,0,0|2,0,0]=4 7979 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011215641_100011998445 [2,0,0,0,0,0|2,0,0]=4 7980 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011998445_100011215641 [2,0,0,0,0,0|2,0,0]=4 7981 B14R0.394 COCCCCCNCCCCC(=O)C 34a_100000747528_100009817362 [2,0,0,0,0,0|2,0,0]=4 7982 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200000210301_200010167045 [2,0,0,0,0,0|2,0,0]=4 7983 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200010167045_200000210301 [2,0,0,0,0,0|2,0,0]=4 7984 B14R0.394 O=C(O)CNCCCCCCCCCO 269956a_100016091260_100009813782 [2,0,0,0,0,0|2,0,0]=4 7985 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200010167045_200025704644 [2,0,0,0,0,0|2,0,0]=4 7986 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200025704644_200010167045 [2,0,0,0,0,0|2,0,0]=4 7987 B16R0.61 C/C=C/C(C)OCCCCCCCCCCC 34a_200102604097_100011215454 [1,1,0,0,0,0|2,0,0]=4 7988 B16R0.61 CC=CC(=O)CCCCCCCCCCCC 1458a_100000210699_100000759014 [1,1,0,0,0,0|1,0,1]=4 7989 B16R0.61 CCCC(C)CCCOCCCCCCOC 34a_100011713154_100011998445 [1,1,0,0,0,0|1,0,1]=4 7990 B16R0.61 CCCC(C)CCCOCCCCCCOC 7a_100011713154_100011998445 [1,1,0,0,0,0|1,0,1]=4 7991 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [1,1,0,0,0,0|0,0,2]=4 7992 B16R0.61 CCCCCCCCCCCCC(C)COC 34a_100000724949_200000210301 [1,1,0,0,0,0|0,0,1]=3 7993 B16R0.61 CCCCCCCCCCCCC(C)COC 7a_100000724949_200000210301 [1,1,0,0,0,0|0,0,1]=3 7994 B16R0.61 CCCCCCCCCCCCC(C)CO[13CH3] 34a_100000724949_200025704644 [1,1,0,0,0,0|0,0,1]=3 7995 B16R0.61 CCCCCCCCCCCCC(C)CO[13CH3] 7a_100000724949_200025704644 [1,1,0,0,0,0|0,0,1]=3 7996 B16R0.61 CCCCCCCCCCCCC(C)NCC 2230a_100015525214_200011217028 [1,1,0,0,0,0|2,0,0]=4 7997 B16R0.61 CCCCCCCCCCCCC(C)NCC 270004a_100015525214_100011219199 [1,1,0,0,0,0|2,0,0]=4 7998 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_100121572206_200011217028 [1,1,0,0,0,0|2,0,0]=4 7999 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_200011215752_100000210202 [1,1,0,0,0,0|2,0,0]=4 8000 B16R0.61 CCCCCCCCCCCCC(C)OCC 7a_200011215752_100000210202 [1,1,0,0,0,0|2,0,0]=4 8001 B16R0.61 CCCCCCCCCCCCN(C)COC 2230a_100000227908_100000766300 [1,1,0,0,0,0|1,0,1]=4 8002 B16R0.61 CCCCCCCCCCCCN(C)COC 269982a_100000227908_100000766300 [1,1,0,0,0,0|1,0,1]=4 8003 B16R0.61 CCCCCCCCCCCNC(C)COC 2230a_200011215754_100000765312 [1,1,0,0,0,0|1,0,1]=4 8004 B16R0.61 CCCCCCCCCCCNC(C)COC 270004a_200011215754_100000749346 [1,1,0,0,0,0|1,0,1]=4 8005 B16R0.61 CCCCCCCCCCCNC(C)COC 34a_200011215754_100000765312 [1,1,0,0,0,0|1,0,1]=4 8006 B16R0.61 CCCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100011215454 [1,1,0,0,0,0|1,0,1]=4 8007 B16R0.61 CCCCCCCCCCCOC(C)COC 34a_100000210809_100000765312 [1,1,0,0,0,0|1,0,1]=4 8008 B16R0.61 CCCCCCCCCCCOC(C)COC 7a_100000210809_100000765312 [1,1,0,0,0,0|1,0,1]=4 8009 B16R0.61 CCCCCCCCCCCO[C@H](C)COC 34a_100011934205_100011215454 [1,1,0,0,0,0|1,0,1]=4 8010 B16R0.61 CCCCCCCCCCCSC(C)COC 62a_100000765312_100011215454 [1,1,0,0,0,0|1,0,1]=4 8011 B16R0.61 CCCCCCCCCCNCC(O)COC 2230a_100000756049_100000210320 [1,1,0,0,0,0|1,0,1]=4 8012 B16R0.61 CCCCCCCCCCNCC(O)COC 34a_100000684558_100011215053 [1,1,0,0,0,0|1,0,1]=4 8013 B16R0.61 CCCCCCCCCCNCC(O)COC 34a_100000756049_100000210320 [1,1,0,0,0,0|1,0,1]=4 8014 B16R0.61 CCCCCCCCCCOCC(N)COC 34a_100000724102_100000210320 [1,1,0,0,0,0|1,0,1]=4 8015 B16R0.61 CCCCCCCCCCOCC(O)COC 34a_100000210711_100011215053 [1,1,0,0,0,0|1,0,1]=4 8016 B16R0.61 CCCCCCCCCCOCC(O)COC 7a_100000210711_100011215053 [1,1,0,0,0,0|1,0,1]=4 8017 B16R0.61 CCCCCCCCCCSCC(O)COC 62a_100011215053_100000210320 [1,1,0,0,0,0|1,0,1]=4 8018 B16R0.68 C/C=C/COC(C)CCCCCCCCCC 34a_100011215000_100102629194 [1,1,0,0,0,0|2,0,0]=4 8019 B16R0.68 C/C=C/COC(C)CCCCCCCCCC 7a_100011215000_100102629194 [1,1,0,0,0,0|2,0,0]=4 8020 B16R0.68 CC=CCOC(C)CCCCCCCCCC 34a_100011215000_100000070051 [1,1,0,0,0,0|2,0,0]=4 8021 B16R0.68 CC=CCOC(C)CCCCCCCCCC 7a_100011215000_100000070051 [1,1,0,0,0,0|2,0,0]=4 8022 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000210375_100000740836 [1,1,0,0,0,0|0,0,2]=4 8023 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210319 [1,1,0,0,0,0|0,0,2]=4 8024 B16R0.68 CCCCCCCCCCC(C)NCCOC 270004a_100000209980_200011219864 [1,1,0,0,0,0|1,0,1]=4 8025 B16R0.68 CCCCCCCCCCC(C)OCCOC 34a_100011215000_100011201679 [1,1,0,0,0,0|1,0,1]=4 8026 B16R0.68 CCCCCCCCCCC(C)OCCOC 7a_100011215000_100000233755 [1,1,0,0,0,0|1,0,1]=4 8027 B16R0.68 CCCCCCCCCCN(C)CCCOC 2230a_100000207566_100000740836 [1,1,0,0,0,0|1,0,1]=4 8028 B16R0.68 CCCCCCCCCCN(C)CCCOC 2230a_100000224831_100000210320 [1,1,0,0,0,0|1,0,1]=4 8029 B16R0.68 CCCCCCCCCCN(C)CCCOC 269982a_100000207566_100000740836 [1,1,0,0,0,0|1,0,1]=4 8030 B16R0.68 CCCCCCCCCCN(C)CCCOC 269982a_100000224831_100000210320 [1,1,0,0,0,0|1,0,1]=4 8031 B16R0.68 CCCCCCCCCOC(C)CCCOC 34a_200011539412_100011214924 [1,1,0,0,0,0|1,0,1]=4 8032 B16R0.68 CCCCCCCCCOC(C)CCCOC 7a_200011539412_100000210328 [1,1,0,0,0,0|1,0,1]=4 8033 B16R0.136 CCCCCCCC(=O)CCCCCCOC 1458a_100000211969_100011998445 [1,1,0,0,0,0|0,0,2]=4 8034 B16R0.136 CCCCCCCC(C)NCCCCCOC 2230a_100000747528_200011218727 [1,1,0,0,0,0|1,0,1]=4 8035 B16R0.136 CCCCCCCC(C)NCCCCCOC 270004a_100000747528_100000210596 [1,1,0,0,0,0|1,0,1]=4 8036 B16R0.136 CCCCCCCC(C)NCCCCCOC 34a_100000747528_200011218727 [1,1,0,0,0,0|1,0,1]=4 8037 B16R0.136 CCCCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210759 [1,1,0,0,0,0|0,0,2]=4 8038 B16R0.136 CCCCCCCCC(C)CNCCCOC 270004a_100150723488_100011995885 [1,1,0,0,0,0|1,0,1]=4 8039 B16R0.136 CCCCCCCCC(C)COCCCOC 34a_200012125181_100000740836 [1,1,0,0,0,0|1,0,1]=4 8040 B16R0.136 CCCCCCCCC(C)COCCCOC 7a_200012125181_100000740836 [1,1,0,0,0,0|1,0,1]=4 8041 B16R0.136 CCCCCCCCC(C)OCCCCOC 34a_100000210740_100000755781 [1,1,0,0,0,0|1,0,1]=4 8042 B16R0.136 CCCCCCCCC(C)OCCCCOC 7a_100000210740_100000730899 [1,1,0,0,0,0|1,0,1]=4 8043 B16R0.136 CCCCCCCN(C)CCCCCCOC 2230a_100000228206_100011998445 [1,1,0,0,0,0|1,0,1]=4 8044 B16R0.136 CCCCCCCN(C)CCCCCCOC 269982a_100000228206_100011998445 [1,1,0,0,0,0|1,0,1]=4 8045 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000070787_100011215471 [1,1,0,0,0,0|1,0,1]=4 8046 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000297455_200000210301 [1,1,0,0,0,0|1,0,1]=4 8047 B16R0.274 CCCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000297455_200025704644 [1,1,0,0,0,0|1,0,1]=4 8048 B16R0.274 CCCCCCCCCCCCCCN(C)C 2230a_100102631434_100011215471 [1,1,0,0,0,0|1,0,1]=4 8049 B16R0.274 CCCCCCCCCCCCCCN(C)C 269982a_100102631434_100011215471 [1,1,0,0,0,0|1,0,1]=4 8050 B16R0.274 CCCCCCCCCCCCCCN(C)C 270004a_100102631434_200011216147 [1,1,0,0,0,0|1,0,1]=4 8051 B16R0.274 CCCCCCCCCCCCCNC(=O)C 11a_100011215765_100015343762 [1,1,0,0,0,0|2,0,0]=4 8052 B16R0.274 CCCCCCCCCCCCCNC(=O)C 1626a_100011215765_100015343762 [1,1,0,0,0,0|2,0,0]=4 8053 B16R0.274 CCCCCCCCCCCCCNC(=O)C 240690a_100011215765_100015343762 [1,1,0,0,0,0|2,0,0]=4 8054 B16R0.274 CCCCCCCCCCCCCNC(=O)C 527a_100011215765_100103153847 [1,1,0,0,0,0|2,0,0]=4 8055 B16R0.274 CCCCCCCCCCCCCNC(C)C 2230a_100011215765_100000210206 [1,1,0,0,0,0|2,0,0]=4 8056 B16R0.274 CCCCCCCCCCCCCNC(C)C 2230a_100138425928_100000210684 [1,1,0,0,0,0|2,0,0]=4 8057 B16R0.274 CCCCCCCCCCCCCNC(C)C 34a_100011215765_100000210206 [1,1,0,0,0,0|2,0,0]=4 8058 B16R0.274 CCCCCCCCCCCCCNC(C)C 34a_100138425928_100000210684 [1,1,0,0,0,0|2,0,0]=4 8059 B16R0.274 CCCCCCCCCCCCCOC(C)C 34a_100000185773_100000210206 [1,1,0,0,0,0|2,0,0]=4 8060 B16R0.274 CCCCCCCCCCCCCOC(C)C 34a_100000212225_100000210684 [1,1,0,0,0,0|2,0,0]=4 8061 B16R0.274 CCCCCCCCCCCCCOC(C)C 7a_100000185773_100000210206 [1,1,0,0,0,0|2,0,0]=4 8062 B16R0.274 CCCCCCCCCCCNCC=C(C)C 2230a_200011215754_100000761012 [1,1,0,0,0,0|2,0,0]=4 8063 B16R0.274 CCCCCCCCCCCNCC=C(C)C 34a_100000718196_100011215454 [1,1,0,0,0,0|2,0,0]=4 8064 B16R0.274 CCCCCCCCCCCNCC=C(C)C 34a_200011215754_100000761012 [1,1,0,0,0,0|2,0,0]=4 8065 B16R0.274 CCCCCCCCCCCOCC=C(C)C 34a_100000210809_100000761012 [1,1,0,0,0,0|2,0,0]=4 8066 B16R0.274 CCCCCCCCCCCOCC=C(C)C 34a_100000753907_100011215454 [1,1,0,0,0,0|2,0,0]=4 8067 B16R0.274 CCCCCCCCCCCOCC=C(C)C 7a_100000210809_100000761012 [1,1,0,0,0,0|2,0,0]=4 8068 B16R0.274 CCCCCCCCCCNCCC=C(C)C 2230a_100000684558_100011217483 [1,1,0,0,0,0|2,0,0]=4 8069 B16R0.274 CCCCCCCCCCNCCC=C(C)C 34a_100000684558_100011217483 [1,1,0,0,0,0|2,0,0]=4 8070 B16R0.274 CCCCCCCCCCOCCC=C(C)C 34a_100000210711_100011217483 [1,1,0,0,0,0|2,0,0]=4 8071 B16R0.274 CCCCCCCCCCOCCC=C(C)C 7a_100000210711_100011217483 [1,1,0,0,0,0|2,0,0]=4 8072 B16R0.274 COCCCCCCNCCCCCC(C)C 2230a_100011290863_100011998445 [1,1,0,0,0,0|1,0,1]=4 8073 B16R0.274 COCCCCCCNCCCCCC(C)C 34a_100011290863_100011998445 [1,1,0,0,0,0|1,0,1]=4 8074 B16R0.274 COCCCCCCOCCCCCC(C)C 34a_100011995859_100011998445 [1,1,0,0,0,0|1,0,1]=4 8075 B16R0.274 COCCCCCCOCCCCCC(C)C 34a_200012092642_100000210682 [1,1,0,0,0,0|1,0,1]=4 8076 B16R0.274 COCCCCCCOCCCCCC(C)C 7a_100011995859_100011998445 [1,1,0,0,0,0|1,0,1]=4 8077 B16R0.274 COCCCCCCOCCCCCC(C)C 7a_200012092642_100000210682 [1,1,0,0,0,0|1,0,1]=4 8078 B16R0.274 COCCCCCCSCCCCCC(C)C 62a_100000210682_100011998445 [1,1,0,0,0,0|1,0,1]=4 8079 B16R0.274 COCCCCCCSCCCCCC(C)C 62a_100011998445_100000210682 [1,1,0,0,0,0|1,0,1]=4 8080 B16R0.274 COCCCCOCCCCCCCC(C)C 34a_200000210741_100000755781 [1,1,0,0,0,0|1,0,1]=4 8081 B16R0.274 COCCCCOCCCCCCCC(C)C 7a_200000210741_100000730899 [1,1,0,0,0,0|1,0,1]=4 8082 B16R0.303 C/C=C/CCOCCCCCCCCCCC 34a_100016278192_100011215454 [1,1,0,0,0,0|1,0,0]=3 8083 B16R0.303 C/C=C/CCOCCCCCCCCCCO 34a_100016278192_100009813290 [1,1,0,0,0,0|2,0,0]=4 8084 B16R0.303 C/C=C/CNCCCCCCCCCCCC 34a_100000210451_100102629194 [1,1,0,0,0,0|1,0,0]=3 8085 B16R0.303 C/C=C/COCCCCCCCCCCCBr 34a_100009812471_100102629194 [1,1,0,0,0,0|2,0,0]=4 8086 B16R0.303 C/C=C/COCCCCCCCCCCCBr 7a_100009812471_100102629194 [1,1,0,0,0,0|2,0,0]=4 8087 B16R0.303 C/C=C/COCCCCCCCCCCCC 34a_100000210810_100102629194 [1,1,0,0,0,0|1,0,0]=3 8088 B16R0.303 C/C=C/COCCCCCCCCCCCC 34a_100016270725_100000759014 [1,1,0,0,0,0|1,0,0]=3 8089 B16R0.303 C/C=C/COCCCCCCCCCCCC 7a_100000210810_100102629194 [1,1,0,0,0,0|1,0,0]=3 8090 B16R0.303 C/C=C/COCCCCCCCCCCCO 34a_100016270725_100009812471 [1,1,0,0,0,0|2,0,0]=4 8091 B16R0.303 C/C=C/COCCCCCCCCCOCC 34a_100009875440_100102629194 [1,1,0,0,0,0|2,0,0]=4 8092 B16R0.303 C/C=C/COCCCCCCCCCOCC 7a_100009875440_100102629194 [1,1,0,0,0,0|2,0,0]=4 8093 B16R0.303 C/C=C/CSCCCCCCCCCCCO 62a_100009812471_100102629194 [1,1,0,0,0,0|2,0,0]=4 8094 B16R0.303 C=CCCCCCCCCCCCCCOC 34a_100138415774_102495333938 [1,1,0,0,0,0|0,0,2]=4 8095 B16R0.303 CC#CCCOCCCCCCCCCCC 34a_100000750427_100011215454 [1,1,0,0,0,0|1,0,1]=4 8096 B16R0.303 CC#CCNCCCCCCCCCCCC 2230a_100000210451_100000748600 [1,1,0,0,0,0|1,0,1]=4 8097 B16R0.303 CC#CCNCCCCCCCCCCCC 2230a_100000685387_100011215052 [1,1,0,0,0,0|1,0,1]=4 8098 B16R0.303 CC#CCNCCCCCCCCCCCC 34a_100000210451_100000748600 [1,1,0,0,0,0|1,0,1]=4 8099 B16R0.303 CC#CCNCCCCCCCCCCCC 34a_100000685387_100000759014 [1,1,0,0,0,0|1,0,1]=4 8100 B16R0.303 CC#CCOCCCCCCCCCCCC 34a_100000210810_100000748600 [1,1,0,0,0,0|1,0,1]=4 8101 B16R0.303 CC#CCOCCCCCCCCCCCC 34a_100000761923_100000759014 [1,1,0,0,0,0|1,0,1]=4 8102 B16R0.303 CC#CCOCCCCCCCCCCCC 7a_100000210810_100000748600 [1,1,0,0,0,0|1,0,1]=4 8103 B16R0.303 CC#CCSCCCCCCCCCCCC 62a_100000748600_100000759014 [1,1,0,0,0,0|1,0,1]=4 8104 B16R0.303 CC/C=C/CCCCCCCCCCOCC 34a_200025759790_100000210202 [1,1,0,0,0,0|1,0,1]=4 8105 B16R0.303 CC/C=C/CCCCCCCCCCOCC 7a_200025759790_100000210202 [1,1,0,0,0,0|1,0,1]=4 8106 B16R0.303 CC/C=C/CCCOCCCCCCCCC 34a_100016287902_100011214924 [1,1,0,0,0,0|1,0,1]=4 8107 B16R0.303 CC/C=C/CCCOCCCCCCCCC 7a_100016287902_100000210328 [1,1,0,0,0,0|1,0,1]=4 8108 B16R0.303 CC/C=C\CCCCCCCNCCCCC 269862a_100000209983_200025770492 [1,1,0,0,0,0|1,0,1]=4 8109 B16R0.303 CC/C=C\CCCCCNCCCCCCC 269862a_100000229938_100016288537 [1,1,0,0,0,0|1,0,1]=4 8110 B16R0.303 CC/C=C\CCCCCOCCCCCCC 34a_100016268722_100000210614 [1,1,0,0,0,0|1,0,1]=4 8111 B16R0.303 CC/C=C\CCCCCOCCCCCCC 7a_100016268722_100000210614 [1,1,0,0,0,0|1,0,1]=4 8112 B16R0.303 CC/C=C\CCCCOCCCCCCCC 34a_100016287862_100000210759 [1,1,0,0,0,0|1,0,1]=4 8113 B16R0.303 CC/C=C\CCCCOCCCCCCCC 7a_100016287862_100000210759 [1,1,0,0,0,0|1,0,1]=4 8114 B16R0.303 CC/C=C\CCNCCCCCCCCCC 2230a_100000684558_100015370543 [1,1,0,0,0,0|1,0,1]=4 8115 B16R0.303 CC/C=C\CCNCCCCCCCCCC 34a_100000684558_100015370543 [1,1,0,0,0,0|1,0,1]=4 8116 B16R0.303 CC/C=C\CCOCCCCCCCCCC 34a_100000210711_100015370543 [1,1,0,0,0,0|1,0,1]=4 8117 B16R0.303 CC/C=C\CCOCCCCCCCCCC 34a_100016288707_100000210320 [1,1,0,0,0,0|1,0,1]=4 8118 B16R0.303 CC/C=C\CCOCCCCCCCCCC 7a_100000210711_100015370543 [1,1,0,0,0,0|1,0,1]=4 8119 B16R0.303 CC/C=C\CCOCCCCCCCCCC 7a_100016288707_100000210320 [1,1,0,0,0,0|1,0,1]=4 8120 B16R0.303 CC/C=C\CNCCCCCCCCCCC 2230a_200011215754_100103147603 [1,1,0,0,0,0|1,0,1]=4 8121 B16R0.303 CC/C=C\CNCCCCCCCCCCC 34a_200011215754_100103147603 [1,1,0,0,0,0|1,0,1]=4 8122 B16R0.303 CC/C=C\COCCCCCCCCCCC 34a_100000210809_100103147603 [1,1,0,0,0,0|1,0,1]=4 8123 B16R0.303 CC/C=C\COCCCCCCCCCCC 34a_100016268518_100011215454 [1,1,0,0,0,0|1,0,1]=4 8124 B16R0.303 CC/C=C\COCCCCCCCCCCC 7a_100000210809_100103147603 [1,1,0,0,0,0|1,0,1]=4 8125 B16R0.303 CC=C=CCCOCCCCCCCCCC 34a_100011020354_100000210320 [1,1,0,0,0,0|2,0,0]=4 8126 B16R0.303 CC=CCCCOCCCCCCCCCC 34a_100020645299_100000210320 [1,1,0,0,0,0|1,0,0]=3 8127 B16R0.303 CC=CCCCOCCCCCCCCCO 34a_100020645299_100009813782 [1,1,0,0,0,0|2,0,0]=4 8128 B16R0.303 CC=CCNCCCCCCCCCCCC 2230a_100000210451_100000070051 [1,1,0,0,0,0|1,0,0]=3 8129 B16R0.303 CC=CCNCCCCCCCCCCCC 34a_100000210451_100000070051 [1,1,0,0,0,0|1,0,0]=3 8130 B16R0.303 CC=CCOCCCCCCCCCCCBr 34a_100009812471_100000070051 [1,1,0,0,0,0|2,0,0]=4 8131 B16R0.303 CC=CCOCCCCCCCCCCCBr 7a_100009812471_100000070051 [1,1,0,0,0,0|2,0,0]=4 8132 B16R0.303 CC=CCOCCCCCCCCCCCC 34a_100000210810_100000070051 [1,1,0,0,0,0|1,0,0]=3 8133 B16R0.303 CC=CCOCCCCCCCCCCCC 7a_100000210810_100000070051 [1,1,0,0,0,0|1,0,0]=3 8134 B16R0.303 CC=CCOCCCCCCCCCOCC 34a_100009875440_100000070051 [1,1,0,0,0,0|2,0,0]=4 8135 B16R0.303 CC=CCOCCCCCCCCCOCC 7a_100009875440_100000070051 [1,1,0,0,0,0|2,0,0]=4 8136 B16R0.303 CC=CCSCCCCCCCCCCCO 62a_100009812471_100000070051 [1,1,0,0,0,0|2,0,0]=4 8137 B16R0.303 CCCCCCCCCCCCCCCNC 2230a_106832991635_100000210322 [1,1,0,0,0,0|1,0,1]=4 8138 B16R0.303 CCCCCCCCCCCCCCCNC 2230a_200000297553_200000210301 [1,1,0,0,0,0|1,0,1]=4 8139 B16R0.303 CCCCCCCCCCCCCCCNC 270004a_106832991635_100012088177 [1,1,0,0,0,0|1,0,1]=4 8140 B16R0.303 CCCCCCCCCCCCCCCNC 34a_100102657272_100000210322 [1,1,0,0,0,0|1,0,1]=4 8141 B16R0.303 CCCCCCCCCCCCCCCNC 34a_200000297553_200000210301 [1,1,0,0,0,0|1,0,1]=4 8142 B16R0.303 CCCCCCCCCCCCCCCNC 7a_106832991635_100000210322 [1,1,0,0,0,0|1,0,1]=4 8143 B16R0.303 CCCCCCCCCCCCCCCN[13CH3] 2230a_200000297553_200025704644 [1,1,0,0,0,0|1,0,1]=4 8144 B16R0.303 CCCCCCCCCCCCCCCN[13CH3] 34a_200000297553_200025704644 [1,1,0,0,0,0|1,0,1]=4 8145 B16R0.303 CCCCCCCCCCCCCCCOC 34a_100000272386_200000210301 [1,1,0,0,0,0|0,0,1]=3 8146 B16R0.303 CCCCCCCCCCCCCCCOC 34a_100138415774_100000210322 [1,1,0,0,0,0|0,0,1]=3 8147 B16R0.303 CCCCCCCCCCCCCCCOC 7a_100000272386_200000210301 [1,1,0,0,0,0|0,0,1]=3 8148 B16R0.303 CCCCCCCCCCCCCCCO[13CH3] 34a_100000272386_200025704644 [1,1,0,0,0,0|0,0,1]=3 8149 B16R0.303 CCCCCCCCCCCCCCCO[13CH3] 7a_100000272386_200025704644 [1,1,0,0,0,0|0,0,1]=3 8150 B16R0.303 CCCCCCCCCCCCCCNCC 2230a_100011217771_100000210202 [1,1,0,0,0,0|1,0,1]=4 8151 B16R0.303 CCCCCCCCCCCCCCNCC 2230a_100015525214_100011215471 [1,1,0,0,0,0|1,0,1]=4 8152 B16R0.303 CCCCCCCCCCCCCCNCC 270004a_100015525214_200011216147 [1,1,0,0,0,0|1,0,1]=4 8153 B16R0.303 CCCCCCCCCCCCCCNCC 34a_100011217771_100000210202 [1,1,0,0,0,0|1,0,1]=4 8154 B16R0.303 CCCCCCCCCCCCCCNCF 34a_100011217771_100015361967 [1,1,0,0,0,0|1,0,1]=4 8155 B16R0.303 CCCCCCCCCCCCCCOCC 34a_100000210739_100000210202 [1,1,0,0,0,0|0,0,1]=3 8156 B16R0.303 CCCCCCCCCCCCCCOCC 34a_100121572206_100011215471 [1,1,0,0,0,0|0,0,1]=3 8157 B16R0.303 CCCCCCCCCCCCCCOCC 7a_100000210739_100000210202 [1,1,0,0,0,0|0,0,1]=3 8158 B16R0.303 CCCCCCCCCCCCCCOCF 34a_100000210739_100015361967 [1,1,0,0,0,0|0,0,1]=3 8159 B16R0.303 CCCCCCCCCCCCCCOCF 7a_100000210739_100015361967 [1,1,0,0,0,0|0,0,1]=3 8160 B16R0.303 CCCCCCCCCCCCCNCCC 2230a_100011215765_100000210303 [1,1,0,0,0,0|1,0,1]=4 8161 B16R0.303 CCCCCCCCCCCCCNCCC 270004a_100020643023_200011215488 [1,1,0,0,0,0|1,0,1]=4 8162 B16R0.303 CCCCCCCCCCCCCNCCC 34a_100011215765_100000210303 [1,1,0,0,0,0|1,0,1]=4 8163 B16R0.303 CCCCCCCCCCCCCNCCF 2230a_100011215765_100011217306 [1,1,0,0,0,0|2,0,0]=4 8164 B16R0.303 CCCCCCCCCCCCCNCCF 34a_100000724931_100000210684 [1,1,0,0,0,0|2,0,0]=4 8165 B16R0.303 CCCCCCCCCCCCCNCCF 34a_100011215765_100011217306 [1,1,0,0,0,0|2,0,0]=4 8166 B16R0.303 CCCCCCCCCCCCCNCCO 2230a_100011215765_100000211926 [1,1,0,0,0,0|2,0,0]=4 8167 B16R0.303 CCCCCCCCCCCCCNCCO 2230a_100016997473_100000210684 [1,1,0,0,0,0|2,0,0]=4 8168 B16R0.303 CCCCCCCCCCCCCNCCO 270004a_100000210304_200011215488 [1,1,0,0,0,0|2,0,0]=4 8169 B16R0.303 CCCCCCCCCCCCCNCCO 34a_100011215765_100000211926 [1,1,0,0,0,0|2,0,0]=4 8170 B16R0.303 CCCCCCCCCCCCCNCCO 34a_100016990907_100000210684 [1,1,0,0,0,0|2,0,0]=4 8171 B16R0.303 CCCCCCCCCCCCCNCOC 2230a_100011215765_100000766300 [1,1,0,0,0,0|0,0,1]=3 8172 B16R0.303 CCCCCCCCCCCCCNCSC 2230a_100011215765_100011218213 [1,1,0,0,0,0|0,1,1]=4 8173 B16R0.303 CCCCCCCCCCCCCNCSC 34a_100011215765_100011218213 [1,1,0,0,0,0|0,1,1]=4 8174 B16R0.303 CCCCCCCCCCCCCOCCBr 34a_100000211926_100000210684 [1,1,0,0,0,0|2,0,0]=4 8175 B16R0.303 CCCCCCCCCCCCCOCCC 34a_100000185773_100000210303 [1,1,0,0,0,0|1,0,1]=4 8176 B16R0.303 CCCCCCCCCCCCCOCCC 34a_100000210258_100000210684 [1,1,0,0,0,0|1,0,1]=4 8177 B16R0.303 CCCCCCCCCCCCCOCCC 7a_100000185773_100000210303 [1,1,0,0,0,0|1,0,1]=4 8178 B16R0.303 CCCCCCCCCCCCCOCCF 34a_100000185773_100011217306 [1,1,0,0,0,0|2,0,0]=4 8179 B16R0.303 CCCCCCCCCCCCCOCCF 7a_100000185773_100011217306 [1,1,0,0,0,0|2,0,0]=4 8180 B16R0.303 CCCCCCCCCCCCCOCCN 34a_100000210304_100000210684 [1,1,0,0,0,0|2,0,0]=4 8181 B16R0.303 CCCCCCCCCCCCCOCCO 34a_100000185773_100000211926 [1,1,0,0,0,0|2,0,0]=4 8182 B16R0.303 CCCCCCCCCCCCCOCCO 7a_100000185773_100000211926 [1,1,0,0,0,0|2,0,0]=4 8183 B16R0.303 CCCCCCCCCCCCCOCSC 34a_100000185773_100011218213 [1,1,0,0,0,0|0,1,1]=4 8184 B16R0.303 CCCCCCCCCCCCCSCCO 62a_100000211926_100011934334 [1,1,0,0,0,0|2,0,0]=4 8185 B16R0.303 CCCCCCCCCCCCCSCOC 62a_100000766300_100011934334 [1,1,0,0,0,0|0,0,1]=3 8186 B16R0.303 CCCCCCCCCCCCNCCCC 2230a_100000102301_100011215052 [1,1,0,0,0,0|1,0,1]=4 8187 B16R0.303 CCCCCCCCCCCCNCCCC 2230a_100000210451_100000210211 [1,1,0,0,0,0|1,0,1]=4 8188 B16R0.303 CCCCCCCCCCCCNCCCC 270004a_100000102301_100011218549 [1,1,0,0,0,0|1,0,1]=4 8189 B16R0.303 CCCCCCCCCCCCNCCCC 34a_100000210451_100000210210 [1,1,0,0,0,0|1,0,1]=4 8190 B16R0.303 CCCCCCCCCCCCNCCCC 7a_106832991798_100000759014 [1,1,0,0,0,0|1,0,1]=4 8191 B16R0.303 CCCCCCCCCCCCNCCOC 2230a_100000209980_100011215052 [1,1,0,0,0,0|0,0,1]=3 8192 B16R0.303 CCCCCCCCCCCCNCCOC 2230a_100000210451_100011201679 [1,1,0,0,0,0|0,0,1]=3 8193 B16R0.303 CCCCCCCCCCCCNCCOC 270004a_100000209980_100011218549 [1,1,0,0,0,0|0,0,1]=3 8194 B16R0.303 CCCCCCCCCCCCNCCOC 34a_100000210451_100011201679 [1,1,0,0,0,0|0,0,1]=3 8195 B16R0.303 CCCCCCCCCCCCNCCSC 2230a_100000210451_100000751147 [1,1,0,0,0,0|0,1,1]=4 8196 B16R0.303 CCCCCCCCCCCCNCCSC 2230a_100020590264_100011215052 [1,1,0,0,0,0|0,1,1]=4 8197 B16R0.303 CCCCCCCCCCCCNCCSC 270004a_100020590264_100011218549 [1,1,0,0,0,0|0,1,1]=4 8198 B16R0.303 CCCCCCCCCCCCNCCSC 34a_100000210451_100000212216 [1,1,0,0,0,0|0,1,1]=4 8199 B16R0.303 CCCCCCCCCCCCOCCCC 34a_100000210227_100000759014 [1,1,0,0,0,0|1,0,1]=4 8200 B16R0.303 CCCCCCCCCCCCOCCCC 34a_100000210810_100000210210 [1,1,0,0,0,0|1,0,1]=4 8201 B16R0.303 CCCCCCCCCCCCOCCCC 7a_100000210227_100000759014 [1,1,0,0,0,0|1,0,1]=4 8202 B16R0.303 CCCCCCCCCCCCOCCCC 7a_100000210810_100000210211 [1,1,0,0,0,0|1,0,1]=4 8203 B16R0.303 CCCCCCCCCCCCOCCOC 34a_100000210237_100000759014 [1,1,0,0,0,0|0,0,1]=3 8204 B16R0.303 CCCCCCCCCCCCOCCOC 34a_100000210810_100011201679 [1,1,0,0,0,0|0,0,1]=3 8205 B16R0.303 CCCCCCCCCCCCOCCOC 7a_100000210810_100000233755 [1,1,0,0,0,0|0,0,1]=3 8206 B16R0.303 CCCCCCCCCCCCOCCON 34a_100000700252_100000759014 [1,1,0,0,0,0|1,0,1]=4 8207 B16R0.303 CCCCCCCCCCCCOCCSC 34a_100000210810_100000212216 [1,1,0,0,0,0|0,1,1]=4 8208 B16R0.303 CCCCCCCCCCCCOCCSC 34a_100000230434_100000759014 [1,1,0,0,0,0|0,1,1]=4 8209 B16R0.303 CCCCCCCCCCCCOCCSC 7a_100000210810_100000212216 [1,1,0,0,0,0|0,1,1]=4 8210 B16R0.303 CCCCCCCCCCCCOCCSC 7a_100000230434_100000759014 [1,1,0,0,0,0|0,1,1]=4 8211 B16R0.303 CCCCCCCCCCCCSCCOC 34a_100005618841_200000210301 [1,1,0,0,0,0|0,0,1]=3 8212 B16R0.303 CCCCCCCCCCCCSCCOC 62a_100000233755_100000759014 [1,1,0,0,0,0|0,0,1]=3 8213 B16R0.303 CCCCCCCCCCCCSCCOC 7a_100005618841_200000210301 [1,1,0,0,0,0|0,0,1]=3 8214 B16R0.303 CCCCCCCCCCCCSCCO[13CH3] 34a_100005618841_200025704644 [1,1,0,0,0,0|0,0,1]=3 8215 B16R0.303 CCCCCCCCCCCCSCCO[13CH3] 7a_100005618841_200025704644 [1,1,0,0,0,0|0,0,1]=3 8216 B16R0.303 CCCCCCCCCCCCSCOCC 62a_100000739092_100000759014 [1,1,0,0,0,0|1,0,1]=4 8217 B16R0.303 CCCCCCCCCCCNCCCCC 2230a_100000209983_100011215454 [1,1,0,0,0,0|1,0,1]=4 8218 B16R0.303 CCCCCCCCCCCNCCCCC 2230a_200011215754_100000210326 [1,1,0,0,0,0|1,0,1]=4 8219 B16R0.303 CCCCCCCCCCCNCCCCC 34a_200011215754_100000718602 [1,1,0,0,0,0|1,0,1]=4 8220 B16R0.303 CCCCCCCCCCCNCCCOC 2230a_200011215754_100000740836 [1,1,0,0,0,0|0,0,1]=3 8221 B16R0.303 CCCCCCCCCCCNCCCOC 34a_100150723488_100011215454 [1,1,0,0,0,0|0,0,1]=3 8222 B16R0.303 CCCCCCCCCCCNCCCOC 34a_200011215754_100000740836 [1,1,0,0,0,0|0,0,1]=3 8223 B16R0.303 CCCCCCCCCCCNCCCSC 2230a_100000749238_100011215454 [1,1,0,0,0,0|0,1,1]=4 8224 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_102516460346_100011215454 [1,1,0,0,0,0|1,0,1]=4 8225 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_200011215754_100011215890 [1,1,0,0,0,0|1,0,1]=4 8226 B16R0.303 CCCCCCCCCCCNCCOCC 34a_102516460346_100011215454 [1,1,0,0,0,0|1,0,1]=4 8227 B16R0.303 CCCCCCCCCCCNCCOCC 34a_200011215754_100000210147 [1,1,0,0,0,0|1,0,1]=4 8228 B16R0.303 CCCCCCCCCCCNCCSCC 2230a_100000106463_100011215454 [1,1,0,0,0,0|2,0,0]=4 8229 B16R0.303 CCCCCCCCCCCNCCSCC 2230a_200011215754_100000757381 [1,1,0,0,0,0|2,0,0]=4 8230 B16R0.303 CCCCCCCCCCCNCCSCC 34a_200011215754_100000757381 [1,1,0,0,0,0|2,0,0]=4 8231 B16R0.303 CCCCCCCCCCCOCCCCC 34a_100000210253_100011215454 [1,1,0,0,0,0|1,0,1]=4 8232 B16R0.303 CCCCCCCCCCCOCCCCC 34a_100000210809_100000718602 [1,1,0,0,0,0|1,0,1]=4 8233 B16R0.303 CCCCCCCCCCCOCCCCC 7a_100000210253_100011215454 [1,1,0,0,0,0|1,0,1]=4 8234 B16R0.303 CCCCCCCCCCCOCCCCC 7a_100000210809_100000210326 [1,1,0,0,0,0|1,0,1]=4 8235 B16R0.303 CCCCCCCCCCCOCCCNC 34a_100000213112_100011215454 [1,1,0,0,0,0|1,0,1]=4 8236 B16R0.303 CCCCCCCCCCCOCCCOC 34a_100000210809_100000740836 [1,1,0,0,0,0|0,0,1]=3 8237 B16R0.303 CCCCCCCCCCCOCCCOC 34a_100000740835_100011215454 [1,1,0,0,0,0|0,0,1]=3 8238 B16R0.303 CCCCCCCCCCCOCCCOC 7a_100000210809_100000740836 [1,1,0,0,0,0|0,0,1]=3 8239 B16R0.303 CCCCCCCCCCCOCCCSC 34a_100000690336_100011215454 [1,1,0,0,0,0|0,1,1]=4 8240 B16R0.303 CCCCCCCCCCCOCCCSC 7a_100000690336_100011215454 [1,1,0,0,0,0|0,1,1]=4 8241 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210136_100011215454 [1,1,0,0,0,0|1,0,1]=4 8242 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210809_100000210147 [1,1,0,0,0,0|1,0,1]=4 8243 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100010166600_100000210202 [1,1,0,0,0,0|1,0,1]=4 8244 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210136_100011215454 [1,1,0,0,0,0|1,0,1]=4 8245 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210809_100011215890 [1,1,0,0,0,0|1,0,1]=4 8246 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100010166600_100000210202 [1,1,0,0,0,0|1,0,1]=4 8247 B16R0.303 CCCCCCCCCCCOCCOCF 34a_100010166600_100015361967 [1,1,0,0,0,0|1,0,1]=4 8248 B16R0.303 CCCCCCCCCCCOCCOCF 7a_100010166600_100015361967 [1,1,0,0,0,0|1,0,1]=4 8249 B16R0.303 CCCCCCCCCCCOCCSCC 34a_100000210809_100000757381 [1,1,0,0,0,0|2,0,0]=4 8250 B16R0.303 CCCCCCCCCCCOCCSCC 34a_100000212035_100011215454 [1,1,0,0,0,0|2,0,0]=4 8251 B16R0.303 CCCCCCCCCCCOCCSCC 7a_100000210809_100000757381 [1,1,0,0,0,0|2,0,0]=4 8252 B16R0.303 CCCCCCCCCCCOCCSCC 7a_100000212035_100011215454 [1,1,0,0,0,0|2,0,0]=4 8253 B16R0.303 CCCCCCCCCCCSCCCOC 62a_100000709357_100011215454 [1,1,0,0,0,0|0,0,1]=3 8254 B16R0.303 CCCCCCCCCCCSCCOCC 62a_100000210147_100011215454 [1,1,0,0,0,0|1,0,1]=4 8255 B16R0.303 CCCCCCCCCCNCCCCCC 2230a_100000210581_100000210320 [1,1,0,0,0,0|1,0,1]=4 8256 B16R0.303 CCCCCCCCCCNCCCCCC 2230a_100000684558_100000210314 [1,1,0,0,0,0|1,0,1]=4 8257 B16R0.303 CCCCCCCCCCNCCCCCC 34a_100000684558_100000210314 [1,1,0,0,0,0|1,0,1]=4 8258 B16R0.303 CCCCCCCCCCNCCCCOC 2230a_100000684558_100000730899 [1,1,0,0,0,0|0,0,1]=3 8259 B16R0.303 CCCCCCCCCCNCCCCOC 34a_100000684558_100000755781 [1,1,0,0,0,0|0,0,1]=3 8260 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000210961_100000210320 [1,1,0,0,0,0|1,0,1]=4 8261 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000684558_100012232248 [1,1,0,0,0,0|1,0,1]=4 8262 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000210961_100000210320 [1,1,0,0,0,0|1,0,1]=4 8263 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000684558_100012232248 [1,1,0,0,0,0|1,0,1]=4 8264 B16R0.303 CCCCCCCCCCNCOCCOC 2230a_100000684558_100000231047 [1,1,0,0,0,0|1,0,1]=4 8265 B16R0.303 CCCCCCCCCCOCCCCCC 34a_100000210259_100000210320 [1,1,0,0,0,0|1,0,1]=4 8266 B16R0.303 CCCCCCCCCCOCCCCCC 34a_100000210711_100000210314 [1,1,0,0,0,0|1,0,1]=4 8267 B16R0.303 CCCCCCCCCCOCCCCCC 7a_100000210259_100000210320 [1,1,0,0,0,0|1,0,1]=4 8268 B16R0.303 CCCCCCCCCCOCCCCCC 7a_100000210711_100000210314 [1,1,0,0,0,0|1,0,1]=4 8269 B16R0.303 CCCCCCCCCCOCCCCOC 34a_100000210711_100000755781 [1,1,0,0,0,0|0,0,1]=3 8270 B16R0.303 CCCCCCCCCCOCCCCOC 34a_100000740925_100000210320 [1,1,0,0,0,0|0,0,1]=3 8271 B16R0.303 CCCCCCCCCCOCCCCOC 34a_200010776780_200000210301 [1,1,0,0,0,0|0,0,1]=3 8272 B16R0.303 CCCCCCCCCCOCCCCOC 7a_100000210711_100000730899 [1,1,0,0,0,0|0,0,1]=3 8273 B16R0.303 CCCCCCCCCCOCCCCOC 7a_200010776780_200000210301 [1,1,0,0,0,0|0,0,1]=3 8274 B16R0.303 CCCCCCCCCCOCCCCO[13CH3] 34a_200010776780_200025704644 [1,1,0,0,0,0|0,0,1]=3 8275 B16R0.303 CCCCCCCCCCOCCCCO[13CH3] 7a_200010776780_200025704644 [1,1,0,0,0,0|0,0,1]=3 8276 B16R0.303 CCCCCCCCCCOCCCCSC 34a_100011217163_100000210320 [1,1,0,0,0,0|0,1,1]=4 8277 B16R0.303 CCCCCCCCCCOCCCCSC 7a_100011217163_100000210320 [1,1,0,0,0,0|0,1,1]=4 8278 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000210711_100012232248 [1,1,0,0,0,0|1,0,1]=4 8279 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000757476_100000210320 [1,1,0,0,0,0|1,0,1]=4 8280 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000210711_100012232248 [1,1,0,0,0,0|1,0,1]=4 8281 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000757476_100000210320 [1,1,0,0,0,0|1,0,1]=4 8282 B16R0.303 CCCCCCCCCCOCCCSCC 34a_100011216438_100000210320 [1,1,0,0,0,0|2,0,0]=4 8283 B16R0.303 CCCCCCCCCCOCCCSCC 7a_100011216438_100000210320 [1,1,0,0,0,0|2,0,0]=4 8284 B16R0.303 CCCCCCCCCCSCCCCOC 62a_100000730899_100000210320 [1,1,0,0,0,0|0,0,1]=3 8285 B16R0.303 CCCCCCCCCCSCCCOCC 62a_100012232248_100000210320 [1,1,0,0,0,0|1,0,1]=4 8286 B16R0.303 CCCCCCCCCCSCOCCOC 62a_100000231047_100000210320 [1,1,0,0,0,0|1,0,1]=4 8287 B16R0.303 CCCCCCCCCNCCCCCCC 2230a_100000212291_100000210681 [1,1,0,0,0,0|1,0,1]=4 8288 B16R0.303 CCCCCCCCCNCCCCCCC 2230a_100000229938_100011214924 [1,1,0,0,0,0|1,0,1]=4 8289 B16R0.303 CCCCCCCCCNCCCCCCC 34a_100000212291_100000210614 [1,1,0,0,0,0|1,0,1]=4 8290 B16R0.303 CCCCCCCCCNCCCCCOC 2230a_100000747528_100011214924 [1,1,0,0,0,0|0,0,1]=3 8291 B16R0.303 CCCCCCCCCNCCCCCOC 34a_100000747528_100011214924 [1,1,0,0,0,0|0,0,1]=3 8292 B16R0.303 CCCCCCCCCNCCOCCOC 2230a_100000212291_100000695917 [1,1,0,0,0,0|1,0,1]=4 8293 B16R0.303 CCCCCCCCCNCCOCCOC 2230a_100000745349_100011214924 [1,1,0,0,0,0|1,0,1]=4 8294 B16R0.303 CCCCCCCCCNCCOCCOC 34a_100000212291_100000695917 [1,1,0,0,0,0|1,0,1]=4 8295 B16R0.303 CCCCCCCCCNCCOCCOC 34a_100000745349_100011214924 [1,1,0,0,0,0|1,0,1]=4 8296 B16R0.303 CCCCCCCCCOCCCCCCC 34a_100000210272_100011214924 [1,1,0,0,0,0|1,0,1]=4 8297 B16R0.303 CCCCCCCCCOCCCCCCC 34a_100000210712_100000210614 [1,1,0,0,0,0|1,0,1]=4 8298 B16R0.303 CCCCCCCCCOCCCCCCC 7a_100000210272_100000210328 [1,1,0,0,0,0|1,0,1]=4 8299 B16R0.303 CCCCCCCCCOCCCCCCC 7a_100000210712_100000210614 [1,1,0,0,0,0|1,0,1]=4 8300 B16R0.303 CCCCCCCCCOCCCCCNC 34a_100000722520_100011214924 [1,1,0,0,0,0|1,0,1]=4 8301 B16R0.303 CCCCCCCCCOCCOCCOC 34a_100000210712_100000695917 [1,1,0,0,0,0|1,0,1]=4 8302 B16R0.303 CCCCCCCCCOCCOCCOC 34a_100011215163_100011214924 [1,1,0,0,0,0|1,0,1]=4 8303 B16R0.303 CCCCCCCCCOCCOCCOC 7a_100000210712_100000695917 [1,1,0,0,0,0|1,0,1]=4 8304 B16R0.303 CCCCCCCCCOCCOCCOC 7a_100011215163_100000210328 [1,1,0,0,0,0|1,0,1]=4 8305 B16R0.303 CCCCCCCCCSCCOCCOC 62a_100000695917_100000210670 [1,1,0,0,0,0|1,0,1]=4 8306 B16R0.303 CCCCCCCCNCCCCCCCC 2230a_100000229939_100000210759 [1,1,0,0,0,0|1,0,1]=4 8307 B16R0.303 CCCCCCCCNCCCCCCCC 34a_100000229939_100000210759 [1,1,0,0,0,0|1,0,1]=4 8308 B16R0.303 CCCCCCCCNCCCCCCOC 2230a_100000229939_100011998445 [1,1,0,0,0,0|0,0,1]=3 8309 B16R0.303 CCCCCCCCNCCCCCCOC 34a_100000229939_100011998445 [1,1,0,0,0,0|0,0,1]=3 8310 B16R0.303 CCCCCCCCNCCCOCCOC 2230a_100000206027_100000210759 [1,1,0,0,0,0|1,0,1]=4 8311 B16R0.303 CCCCCCCCNCCCOCCOC 2230a_100000229939_100011216529 [1,1,0,0,0,0|1,0,1]=4 8312 B16R0.303 CCCCCCCCNCCCOCCOC 34a_100000206027_100000210759 [1,1,0,0,0,0|1,0,1]=4 8313 B16R0.303 CCCCCCCCNCCCOCCOC 34a_100000229939_100011216529 [1,1,0,0,0,0|1,0,1]=4 8314 B16R0.303 CCCCCCCCOCCCCCCCC 34a_100000210232_100000210759 [1,1,0,0,0,0|1,0,1]=4 8315 B16R0.303 CCCCCCCCOCCCCCCCC 7a_100000210232_100000210759 [1,1,0,0,0,0|1,0,1]=4 8316 B16R0.303 CCCCCCCCOCCCCCCOC 34a_100000210232_100011998445 [1,1,0,0,0,0|0,0,1]=3 8317 B16R0.303 CCCCCCCCOCCCCCCOC 34a_200012092642_100000210759 [1,1,0,0,0,0|0,0,1]=3 8318 B16R0.303 CCCCCCCCOCCCCCCOC 7a_100000210232_100011998445 [1,1,0,0,0,0|0,0,1]=3 8319 B16R0.303 CCCCCCCCOCCCCCCOC 7a_200012092642_100000210759 [1,1,0,0,0,0|0,0,1]=3 8320 B16R0.303 CCCCCCCCOCCCOCCOC 34a_100000210232_100011216529 [1,1,0,0,0,0|1,0,1]=4 8321 B16R0.303 CCCCCCCCOCCCOCCOC 7a_100000210232_100011216529 [1,1,0,0,0,0|1,0,1]=4 8322 B16R0.303 CCCCCCCCSCCCCCCOC 62a_100000210759_100011998445 [1,1,0,0,0,0|0,0,1]=3 8323 B16R0.303 CCCCCCCCSCCCCCCOC 62a_100011998445_100000210317 [1,1,0,0,0,0|0,0,1]=3 8324 B16R0.303 CCCCCCCCSCCCOCCOC 62a_100000210759_100011216529 [1,1,0,0,0,0|1,0,1]=4 8325 B16R0.303 CCCCCCCCSCCCOCCOC 62a_100011216529_100000210317 [1,1,0,0,0,0|1,0,1]=4 8326 B16R0.303 CCCCCCCOCCCOCCCOC 34a_200011215475_100000210614 [1,1,0,0,0,0|1,0,1]=4 8327 B16R0.303 CCCCCCCOCCCOCCCOC 7a_200011215475_100000210614 [1,1,0,0,0,0|1,0,1]=4 8328 B16R0.303 CCCCCNCCOCCCCCCOC 34a_100000224656_100011998445 [1,1,0,0,0,0|1,0,1]=4 8329 B16R0.303 CCCCCOCCOCCCCCCOC 34a_100011215259_100011998445 [1,1,0,0,0,0|1,0,1]=4 8330 B16R0.303 CCCCCOCCOCCCCCCOC 7a_100011215259_100011998445 [1,1,0,0,0,0|1,0,1]=4 8331 B16R0.303 CCCCOCCCCCCCCCOCC 34a_100009875440_100000210210 [1,1,0,0,0,0|1,0,1]=4 8332 B16R0.303 CCCCOCCCCCCCCCOCC 7a_100009875440_100000210211 [1,1,0,0,0,0|1,0,1]=4 8333 B16R0.303 CCCCOCCCNCCCCCCOC 2230a_200000211371_100011998445 [1,1,0,0,0,0|1,0,1]=4 8334 B16R0.303 CCCCOCCCNCCCCCCOC 34a_200000211371_100011998445 [1,1,0,0,0,0|1,0,1]=4 8335 B16R0.303 CCCCOCCCOCCCCCCOC 34a_200011215613_100011998445 [1,1,0,0,0,0|1,0,1]=4 8336 B16R0.303 CCCCOCCCOCCCCCCOC 7a_200011215613_100011998445 [1,1,0,0,0,0|1,0,1]=4 8337 B16R0.303 CCNCCCCCCCCCCCCCO 2230a_100015525214_100009812470 [1,1,0,0,0,0|2,0,0]=4 8338 B16R0.303 CCOCCCCCCCCCCCCCBr 34a_100009812470_100000210202 [1,1,0,0,0,0|1,0,1]=4 8339 B16R0.303 CCOCCCCCCCCCCCCCBr 7a_100009812470_100000210202 [1,1,0,0,0,0|1,0,1]=4 8340 B16R0.303 CCOCCCCCCCCCCCCCO 34a_100121572206_100009812470 [1,1,0,0,0,0|1,0,1]=4 8341 B16R0.303 CCOCCCCCCCCCOCCOC 34a_100009875440_100011201679 [1,1,0,0,0,0|1,0,1]=4 8342 B16R0.303 CCOCCCCCCCCCOCCOC 7a_100009875440_100000233755 [1,1,0,0,0,0|1,0,1]=4 8343 B16R0.303 CCSCCCCCCCCCCCCCO 62a_100009812470_100000210202 [1,1,0,0,0,0|2,0,0]=4 8344 B16R0.303 CNCCCCCCCCCCCCCCO 2230a_106832991635_100009828009 [1,1,0,0,0,0|1,0,1]=4 8345 B16R0.303 CNCCCCCCCCCCCCCCO 34a_100102657272_100009828009 [1,1,0,0,0,0|1,0,1]=4 8346 B16R0.303 CNCCCCCCCCCCCCCCO 7a_106832991635_100009828009 [1,1,0,0,0,0|1,0,1]=4 8347 B16R0.303 COCCCCCCCCCCCCCCBr 34a_100009828009_200000210301 [1,1,0,0,0,0|0,0,1]=3 8348 B16R0.303 COCCCCCCCCCCCCCCBr 7a_100009828009_200000210301 [1,1,0,0,0,0|0,0,1]=3 8349 B16R0.303 COCCCCCCCCCCCCCCO 34a_100138415774_100009828009 [1,1,0,0,0,0|0,0,1]=3 8350 B16R0.303 COCCCCCCNCCCCCCCO 2230a_100011996573_100011998445 [1,1,0,0,0,0|1,0,1]=4 8351 B16R0.303 COCCCCCCNCCCCCCCO 34a_100011996573_100011998445 [1,1,0,0,0,0|1,0,1]=4 8352 B16R0.303 COCCCCCCOCCCCCCCBr 34a_100000760002_100011998445 [1,1,0,0,0,0|1,0,1]=4 8353 B16R0.303 COCCCCCCOCCCCCCCBr 7a_100000760002_100011998445 [1,1,0,0,0,0|1,0,1]=4 8354 B16R0.303 COCCCCCCOCCCCCCCN 34a_100011996573_100011998445 [1,1,0,0,0,0|1,0,1]=4 8355 B16R0.303 COCCCCCCOCCCCCCCO 34a_200012092642_100000760002 [1,1,0,0,0,0|1,0,1]=4 8356 B16R0.303 COCCCCCCOCCCCCCCO 7a_200012092642_100000760002 [1,1,0,0,0,0|1,0,1]=4 8357 B16R0.303 COCCCCCCOCCCCCCOC 34a_200012092642_100011998445 [1,1,0,0,0,0|1,0,1]=4 8358 B16R0.303 COCCCCCCOCCCCCCOC 7a_200012092642_100011998445 [1,1,0,0,0,0|1,0,1]=4 8359 B16R0.303 COCCCCCCSCCCCCCCO 62a_100000760002_100011998445 [1,1,0,0,0,0|1,0,1]=4 8360 B16R0.303 COCCCCCCSCCCCCCCO 62a_100011998445_100000760002 [1,1,0,0,0,0|1,0,1]=4 8361 B16R0.303 COCCCCCCSCCCCCCOC 62a_100011998445_100011998445 [1,1,0,0,0,0|1,0,1]=4 8362 B16R0.303 COCCCCCNCCCCCCCCO 2230a_100000747528_100000033203 [1,1,0,0,0,0|1,0,1]=4 8363 B16R0.303 COCCCCCNCCCCCCCCO 34a_100000747528_100000033203 [1,1,0,0,0,0|1,0,1]=4 8364 B16R0.303 COCCCCNCCCCCCCCCO 2230a_100000078944_100000730899 [1,1,0,0,0,0|1,0,1]=4 8365 B16R0.303 COCCCCNCCCCCCCCCO 34a_100000078944_100000755781 [1,1,0,0,0,0|1,0,1]=4 8366 B16R0.303 COCCCCOCCCCCCCCCBr 34a_100009813782_100000755781 [1,1,0,0,0,0|1,0,1]=4 8367 B16R0.303 COCCCCOCCCCCCCCCBr 7a_100009813782_100000730899 [1,1,0,0,0,0|1,0,1]=4 8368 B16R0.303 COCCCCOCCCCCCCCCCl 34a_100009868337_100000755781 [1,1,0,0,0,0|1,0,1]=4 8369 B16R0.303 COCCCCOCCCCCCCCCCl 7a_100009868337_100000730899 [1,1,0,0,0,0|1,0,1]=4 8370 B16R0.303 COCCCCOCCCCCCCCCN 34a_100000078944_100000755781 [1,1,0,0,0,0|1,0,1]=4 8371 B16R0.303 COCCCCOCCCCCCCCCO 34a_100000740925_100009813782 [1,1,0,0,0,0|1,0,1]=4 8372 B16R0.303 COCCCCSCCCCCCCCCO 62a_100000730899_100009813782 [1,1,0,0,0,0|1,0,1]=4 8373 B16R0.303 COCCCCSCCCCCCCCCO 62a_100009813782_100000730899 [1,1,0,0,0,0|1,0,1]=4 8374 B16R0.303 COCCCNCCCCCCCCCCO 2230a_100000066964_100000740836 [1,1,0,0,0,0|1,0,1]=4 8375 B16R0.303 COCCCNCCCCCCCCCCO 34a_100000066964_100000740836 [1,1,0,0,0,0|1,0,1]=4 8376 B16R0.303 COCCCNCCCCCCCCCCO 34a_100150723488_100009813290 [1,1,0,0,0,0|1,0,1]=4 8377 B16R0.303 COCCCOCCCCCCCCCCBr 34a_100009813290_100000740836 [1,1,0,0,0,0|1,0,1]=4 8378 B16R0.303 COCCCOCCCCCCCCCCBr 7a_100009813290_100000740836 [1,1,0,0,0,0|1,0,1]=4 8379 B16R0.303 COCCCOCCCCCCCCCCCl 34a_200000033068_100000740836 [1,1,0,0,0,0|1,0,1]=4 8380 B16R0.303 COCCCOCCCCCCCCCCCl 7a_200000033068_100000740836 [1,1,0,0,0,0|1,0,1]=4 8381 B16R0.303 COCCCOCCCCCCCCCCN 34a_100000066964_100000740836 [1,1,0,0,0,0|1,0,1]=4 8382 B16R0.303 COCCCOCCCCCCCCCCO 34a_100000740835_100009813290 [1,1,0,0,0,0|1,0,1]=4 8383 B16R0.303 COCCCSCCCCCCCCCCO 62a_100000709357_200000033068 [1,1,0,0,0,0|1,0,1]=4 8384 B16R0.303 COCCCSCCCCCCCCCCO 62a_100009813290_100000709357 [1,1,0,0,0,0|1,0,1]=4 8385 B16R0.303 COCCNCCCCCCCCCCCO 2230a_100000209980_100009812471 [1,1,0,0,0,0|1,0,1]=4 8386 B16R0.303 COCCOCCCCCCCCCCCBr 34a_100009812471_100011201679 [1,1,0,0,0,0|1,0,1]=4 8387 B16R0.303 COCCOCCCCCCCCCCCBr 7a_100009812471_100000233755 [1,1,0,0,0,0|1,0,1]=4 8388 B16R0.303 COCCOCCCCCCCCCCCO 34a_100000210237_100009812471 [1,1,0,0,0,0|1,0,1]=4 8389 B16R0.303 COCCSCCCCCCCCCCCO 62a_100009812471_100000233755 [1,1,0,0,0,0|1,0,1]=4 8390 B16R0.303 COCNCCCCCCCCCCCCO 2230a_100000066677_100000766300 [1,1,0,0,0,0|1,0,1]=4 8391 B16R0.303 COCSCCCCCCCCCCCCO 62a_100009813331_100000766300 [1,1,0,0,0,0|1,0,1]=4 8392 B16R0.303 FCOCCCCCCCCCCCCCBr 34a_100009812470_100015361967 [1,1,0,0,0,0|1,0,1]=4 8393 B16R0.303 FCOCCCCCCCCCCCCCBr 7a_100009812470_100015361967 [1,1,0,0,0,0|1,0,1]=4 8394 B16R0.303 [13CH3]OCCCCCCCCCCCCCCBr 34a_100009828009_200025704644 [1,1,0,0,0,0|0,0,1]=3 8395 B16R0.303 [13CH3]OCCCCCCCCCCCCCCBr 7a_100009828009_200025704644 [1,1,0,0,0,0|0,0,1]=3 8396 B16R0.661 C/C=C/CC(=O)CCCCCCCCCCC 1458a_100000210736_100102629194 [1,1,0,0,0,0|1,0,1]=4 8397 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000070051 [1,1,0,0,0,0|1,0,1]=4 8398 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100121576822_100011215454 [1,1,0,0,0,0|1,0,1]=4 8399 B16R0.661 CCCCC(C)CCCCOCCCCOC 34a_200011021034_100000755781 [1,1,0,0,0,0|1,0,1]=4 8400 B16R0.661 CCCCC(C)CCCCOCCCCOC 7a_200011021034_100000730899 [1,1,0,0,0,0|1,0,1]=4 8401 B16R0.661 CCCCCCCCCCCC(=O)C=COC 1458a_100016268678_100011215454 [1,1,0,0,0,0|0,0,2]=4 8402 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000210736_100000233755 [1,1,0,0,0,0|0,0,2]=4 8403 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100011215454 [1,1,0,0,0,0|0,0,2]=4 8404 B16R0.661 CCCCCCCCCCCN(C)CCOC 2230a_100000743101_100011215454 [1,1,0,0,0,0|1,0,1]=4 8405 B16R0.661 CCCCCCCCCCCN(C)CCOC 269982a_100000743101_100011215454 [1,1,0,0,0,0|1,0,1]=4 8406 B16R0.661 CCCCCCCCCCNC(C)CCOC 270004a_100000684558_100000742357 [1,1,0,0,0,0|1,0,1]=4 8407 B16R0.6603 CCCCCCC(C)CCOCCCCOC 34a_200011024964_100000755781 [1,1,0,0,0,0|1,0,1]=4 8408 B16R0.6603 CCCCCCC(C)CCOCCCCOC 7a_200011024964_100000730899 [1,1,0,0,0,0|1,0,1]=4 8409 B16R0.6603 CCCCCCC(C)NCCCCCCOC 2230a_100000210919_100011998445 [1,1,0,0,0,0|1,0,1]=4 8410 B16R0.6603 CCCCCCC(C)NCCCCCCOC 34a_100000210919_100011998445 [1,1,0,0,0,0|1,0,1]=4 8411 B16R0.6603 CCCCCCC(C)OCCCCCCOC 34a_100000210265_100011998445 [1,1,0,0,0,0|1,0,1]=4 8412 B16R0.6603 CCCCCCC(C)OCCCCCCOC 34a_200012092642_100011215978 [1,1,0,0,0,0|1,0,1]=4 8413 B16R0.6603 CCCCCCC(C)OCCCCCCOC 7a_100000210265_100011998445 [1,1,0,0,0,0|1,0,1]=4 8414 B16R0.6603 CCCCCCC(C)OCCCCCCOC 7a_200012092642_100011215978 [1,1,0,0,0,0|1,0,1]=4 8415 B16R0.6603 CCCCCCC(C)SCCCCCCOC 62a_100011215978_100011998445 [1,1,0,0,0,0|1,0,1]=4 8416 B16R0.6603 CCCCCCC(C)SCCCCCCOC 62a_100011998445_100011215978 [1,1,0,0,0,0|1,0,1]=4 8417 B16R0.6603 CCCCCCCCCC(=O)CCCCOC 1458a_100000210558_100000755781 [1,1,0,0,0,0|0,0,2]=4 8418 B16R0.6603 CCCCCCCCCC(C)CNCCOC 270004a_100000209980_200011218516 [1,1,0,0,0,0|1,0,1]=4 8419 B16R0.6603 CCCCCCCCCC(C)NCCCOC 270004a_100150723488_100011215753 [1,1,0,0,0,0|1,0,1]=4 8420 B16R0.6603 CCCCCCCCCC(C)OCCCOC 34a_100011218016_100000740836 [1,1,0,0,0,0|1,0,1]=4 8421 B16R0.6603 CCCCCCCCCC(C)OCCCOC 7a_100011218016_100000740836 [1,1,0,0,0,0|1,0,1]=4 8422 B16R0.6603 CCCCCCCCCN(C)CCCCOC 2230a_100000232482_100000730899 [1,1,0,0,0,0|1,0,1]=4 8423 B16R0.6603 CCCCCCCCCN(C)CCCCOC 269982a_100000232482_100000730899 [1,1,0,0,0,0|1,0,1]=4 8424 B16R0.7 CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210211 [1,1,0,0,0,0|0,0,1]=3 8425 B16R0.7 CCCCC(=O)CCCCCCCC(=O)OC 1458a_100000210183_100010004213 [1,1,0,0,0,0|0,0,1]=3 8426 B16R0.7 CCCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000210183 [1,1,0,0,0,0|1,0,1]=4 8427 B16R0.7 CCCCC(C)CCCCOCCC(=O)NC 34a_200011021034_100012179268 [1,1,0,0,0,0|2,0,0]=4 8428 B16R0.7 CCCCC(C)CCCCOCCC(=O)NC 7a_200011021034_100000737683 [1,1,0,0,0,0|2,0,0]=4 8429 B16R0.7 CCCCC(C)CCCCOCCC(=O)OC 34a_200011021034_100000742370 [1,1,0,0,0,0|1,0,0]=3 8430 B16R0.7 CCCCC(C)CCCCOCCC(=O)OC 7a_200011021034_100000204255 [1,1,0,0,0,0|1,0,0]=3 8431 B16R0.7 CCCCC(C)COCCCCCC(=O)OC 34a_100011995851_100009816466 [1,1,0,0,0,0|1,0,0]=3 8432 B16R0.7 CCCCC(C)COCCCCCC(=O)OC 7a_100011995851_100009816466 [1,1,0,0,0,0|1,0,0]=3 8433 B16R0.7 CCCCC(C)NCCCCCCC(=O)OC 2230a_100000126638_100009815986 [1,1,0,0,0,0|1,0,0]=3 8434 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 34a_100000687866_100009815986 [1,1,0,0,0,0|1,0,0]=3 8435 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 34a_100009863599_200011215066 [1,1,0,0,0,0|1,0,0]=3 8436 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 7a_100000687866_100009815986 [1,1,0,0,0,0|1,0,0]=3 8437 B16R0.7 CCCCC(C)OCCCCCCC(=O)OC 7a_100009863599_200011215066 [1,1,0,0,0,0|1,0,0]=3 8438 B16R0.7 CCCCC(C)SCCCCCCC(=O)OC 62a_100009815986_200011215066 [1,1,0,0,0,0|1,0,0]=3 8439 B16R0.7 CCCCC(C)SCCCCCCC(=O)OC 62a_200011215066_100009815986 [1,1,0,0,0,0|1,0,0]=3 8440 B16R0.7 CCCCN(C)CCCCCCCC(=O)OC 2230a_100000207549_100010004213 [1,1,0,0,0,0|1,0,0]=3 8441 B16R0.7 CCCCN(C)CCCCCCCC(=O)OC 269982a_100000207549_100010004213 [1,1,0,0,0,0|1,0,0]=3 8442 B16R0.7 CCCC[C@H](N)COCCCCCC(=O)OC 34a_100011934283_100009816466 [1,1,0,0,0,0|1,0,0]=3 8443 B16R0.7 CCCNC(=O)CCCCCCCC(=O)OC 11a_100020643023_100000033222 [1,1,0,0,0,0|1,0,1]=4 8444 B16R0.7 CCCNC(=O)CCCCCCCC(=O)OC 1626a_100020643023_100000033222 [1,1,0,0,0,0|1,0,1]=4 8445 B16R0.7 CCCNC(=O)CCCCCCCC(=O)OC 240690a_100020643023_100000033222 [1,1,0,0,0,0|1,0,1]=4 8446 B16R0.7 CCCOC(C)CNCCCCCC(=O)OC 2230a_100015185124_100009816466 [1,1,0,0,0,0|2,0,0]=4 8447 B16R0.7 CCCOC(C)CNCCCCCC(=O)OC 34a_100015185124_100009816466 [1,1,0,0,0,0|2,0,0]=4 8448 B16R0.7 CCOCC(=O)CCCCCCCC(=O)OC 1458a_100000211967_100010004213 [1,1,0,0,0,0|1,0,1]=4 8449 B16R0.7 CCOCC(C)OCCCCCCC(=O)OC 34a_100000718985_100009815986 [1,1,0,0,0,0|2,0,0]=4 8450 B16R0.7 CCOCC(C)OCCCCCCC(=O)OC 7a_100000718985_100009815986 [1,1,0,0,0,0|2,0,0]=4 8451 B16R0.7 CCOCC(O)CNCCCCCC(=O)OC 2230a_102515437182_100009816466 [1,1,0,0,0,0|2,0,0]=4 8452 B16R0.7 CCOCC(O)CNCCCCCC(=O)OC 34a_102515437182_100009816466 [1,1,0,0,0,0|2,0,0]=4 8453 B16R0.7 CCSCC(=O)CCCCCCCC(=O)OC 1458a_100000230394_100010004213 [1,1,0,0,0,0|1,0,1]=4 8454 B16R0.7 COC(=O)CCCCCCCC(=O)CCCF 1458a_100000033222_100011934791 [1,1,0,0,0,0|1,0,1]=4 8455 B16R0.7 COC(=O)CCCCCCCC(=O)CCCO 1458a_100000033222_100011215043 [1,1,0,0,0,0|1,0,1]=4 8456 B16R0.7 COC(=O)CCCCCCCC(=O)CCSC 1458a_100000033222_100000751147 [1,1,0,0,0,0|1,0,1]=4 8457 B16R0.7 COC(=O)CCCCCCCC(=O)CCSC 1458a_100000174002_100010004213 [1,1,0,0,0,0|1,0,1]=4 8458 B16R0.7 COC(=O)CCCCCCCN(C)CCCO 2230a_100000213112_100010004213 [1,1,0,0,0,0|2,0,0]=4 8459 B16R0.7 COC(=O)CCCCCCCN(C)CCCO 269982a_100000213112_100010004213 [1,1,0,0,0,0|2,0,0]=4 8460 B16R0.7 COC(=O)CCCCCCCN(C)CCSC 2230a_100000686725_100010004213 [1,1,0,0,0,0|2,0,0]=4 8461 B16R0.7 COC(=O)CCCCCCCN(C)CCSC 269982a_100000686725_100010004213 [1,1,0,0,0,0|2,0,0]=4 8462 B16R0.7 COC(=O)CCCCCCOC(C)CCCCl 34a_200000718107_100009815986 [1,1,0,0,0,0|2,0,0]=4 8463 B16R0.7 COC(=O)CCCCCCOC(C)CCCCl 7a_200000718107_100009815986 [1,1,0,0,0,0|2,0,0]=4 8464 B16R0.7 COC(=O)CCCCCNC[C@H](C)CCCO 2230a_100160569302_100009816466 [1,1,0,0,0,0|2,0,0]=4 8465 B16R0.7 COC(=O)CCCCCNC[C@H](C)CCCO 34a_100160569302_100009816466 [1,1,0,0,0,0|2,0,0]=4 8466 B16R0.7 COC(=O)CCCCCOC[C@@H](N)CCSC 34a_100011827619_100009816466 [1,1,0,0,0,0|2,0,0]=4 8467 B16R0.7 COCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000233755 [1,1,0,0,0,0|1,0,1]=4 8468 B16R0.7 COCCC(=O)CCCCCCCC(=O)OC 1458a_100000749529_100010004213 [1,1,0,0,0,0|1,0,1]=4 8469 B16R0.7 COCCN(C)CCCCCCCC(=O)OC 2230a_100000743101_100010004213 [1,1,0,0,0,0|2,0,0]=4 8470 B16R0.7 COCCN(C)CCCCCCCC(=O)OC 269982a_100000743101_100010004213 [1,1,0,0,0,0|2,0,0]=4 8471 B16R0.70 C=C(CNCCCCCCCCC)C(=O)OC 34a_100000212291_100009813391 [1,1,0,0,0,0|1,0,1]=4 8472 B16R0.70 C=C(COCCCCCCCCC)C(=O)OC 34a_100000210712_100009813391 [1,1,0,0,0,0|1,0,1]=4 8473 B16R0.70 C=C(CSCCCCCCCCC)C(=O)OC 62a_100009813391_100000210670 [1,1,0,0,0,0|1,0,1]=4 8474 B16R0.70 CCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100011215454 [1,1,0,0,0,0|1,0,1]=4 8475 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 11a_100000684558_100000024059 [1,1,0,0,0,0|1,0,1]=4 8476 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 1626a_100000684558_100000024059 [1,1,0,0,0,0|1,0,1]=4 8477 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 240690a_100000684558_100000024059 [1,1,0,0,0,0|1,0,1]=4 8478 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 527a_100000684558_100000024059 [1,1,0,0,0,0|1,0,1]=4 8479 B16R0.70 CCCCCCCCCCNC(C)C(=O)CC 2230a_100000684558_100000742827 [1,1,0,0,0,0|2,0,0]=4 8480 B16R0.70 CCCCCCCCCCNC(C)C(=O)NC 2230a_100000684558_100000731044 [1,1,0,0,0,0|2,0,0]=4 8481 B16R0.70 CCCCCCCCCCNC(C)C(=O)NC 34a_100000684558_100000731044 [1,1,0,0,0,0|2,0,0]=4 8482 B16R0.70 CCCCCCCCCCNC(C)C(=O)OC 2230a_100000684558_100000211248 [1,1,0,0,0,0|1,0,0]=3 8483 B16R0.70 CCCCCCCCCCNC(C)C(=O)OC 34a_100000684558_100000211248 [1,1,0,0,0,0|1,0,0]=3 8484 B16R0.70 CCCCCCCCCCNC(F)C(=O)NC 2230a_100000684558_100009813575 [1,1,0,0,0,0|2,0,0]=4 8485 B16R0.70 CCCCCCCCCCNC(F)C(=O)NC 34a_100000684558_100009813575 [1,1,0,0,0,0|2,0,0]=4 8486 B16R0.70 CCCCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210320 [1,1,0,0,0,0|2,0,0]=4 8487 B16R0.70 CCCCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100000210320 [1,1,0,0,0,0|2,0,0]=4 8488 B16R0.70 CCCCCCCCCCOC(C)C(=O)CC 7a_100000210711_100000742827 [1,1,0,0,0,0|2,0,0]=4 8489 B16R0.70 CCCCCCCCCCOC(C)C(=O)NC 34a_100000210711_100000731044 [1,1,0,0,0,0|2,0,0]=4 8490 B16R0.70 CCCCCCCCCCOC(C)C(=O)NC 7a_100000210711_100000209862 [1,1,0,0,0,0|2,0,0]=4 8491 B16R0.70 CCCCCCCCCCOC(C)C(=O)OC 34a_100000210711_100000211248 [1,1,0,0,0,0|1,0,0]=3 8492 B16R0.70 CCCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100000210320 [1,1,0,0,0,0|1,0,0]=3 8493 B16R0.70 CCCCCCCCCCOC(C)C(=O)OC 7a_100000210711_100000211248 [1,1,0,0,0,0|1,0,0]=3 8494 B16R0.70 CCCCCCCCCCOC(F)C(=O)NC 34a_100000210711_100009813575 [1,1,0,0,0,0|2,0,0]=4 8495 B16R0.70 CCCCCCCCCCOC(F)C(=O)NC 7a_100000210711_100009813575 [1,1,0,0,0,0|2,0,0]=4 8496 B16R0.70 CCCCCCCCCCSC(C)C(=O)CC 62a_100000742827_100000210320 [1,1,0,0,0,0|2,0,0]=4 8497 B16R0.70 CCCCCCCCCCSC(C)C(=O)NC 62a_100000209862_100000210320 [1,1,0,0,0,0|2,0,0]=4 8498 B16R0.70 CCCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100000210320 [1,1,0,0,0,0|1,0,0]=3 8499 B16R0.70 CCCCCCCCCCSC(F)C(=O)NC 62a_100009813575_100000210320 [1,1,0,0,0,0|2,0,0]=4 8500 B16R0.70 CCCCCCCCCNCC(=O)C(=O)OC 34a_100000212291_100011610305 [1,1,0,0,0,0|1,0,1]=4 8501 B16R0.70 CCCCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100011214924 [1,1,0,0,0,0|2,0,0]=4 8502 B16R0.70 CCCCCCCCCNCC(C)C(=O)NC 34a_100015187722_100011214924 [1,1,0,0,0,0|2,0,0]=4 8503 B16R0.70 CCCCCCCCCNCC(C)C(=O)OC 34a_100000212291_100000698445 [1,1,0,0,0,0|1,0,0]=3 8504 B16R0.70 CCCCCCCCCOCC(=O)C(=O)OC 34a_100000210712_100011610305 [1,1,0,0,0,0|1,0,1]=4 8505 B16R0.70 CCCCCCCCCOCC(C)C(=O)OC 34a_100000210712_100000698445 [1,1,0,0,0,0|1,0,0]=3 8506 B16R0.70 CCCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100011214924 [1,1,0,0,0,0|1,0,0]=3 8507 B16R0.70 CCCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210328 [1,1,0,0,0,0|1,0,0]=3 8508 B16R0.70 CCCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100011214924 [1,1,0,0,0,0|1,0,0]=3 8509 B16R0.70 CCCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011214924 [1,1,0,0,0,0|1,0,0]=3 8510 B16R0.70 CCCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210670 [1,1,0,0,0,0|1,0,1]=4 8511 B16R0.70 CCCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210670 [1,1,0,0,0,0|1,0,0]=3 8512 B16R0.70 CCCCCCCCNCCC(C)C(=O)OC 2230a_100000229939_100000034942 [1,1,0,0,0,0|1,0,0]=3 8513 B16R0.70 CCCCCCCCNCCC(C)C(=O)OC 34a_100000229939_100000034942 [1,1,0,0,0,0|1,0,0]=3 8514 B16R0.70 CCCCCCCCOCCC(C)C(=O)OC 34a_100000210232_100000034942 [1,1,0,0,0,0|1,0,0]=3 8515 B16R0.70 CCCCCCCCOCCC(C)C(=O)OC 7a_100000210232_100000034942 [1,1,0,0,0,0|1,0,0]=3 8516 B16R0.70 CCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210317 [1,1,0,0,0,0|1,0,0]=3 8517 B16R0.70 CCCCCCCCSCCC(C)C(=O)OC 62a_100000210759_100000034942 [1,1,0,0,0,0|1,0,0]=3 8518 B16R0.70 CCCCCCOCCOCC(C)C(=O)OC 34a_100000691444_100000698445 [1,1,0,0,0,0|2,0,0]=4 8519 B16R0.70 CCCCCNCCOCCC(C)C(=O)OC 34a_100000224656_100000034942 [1,1,0,0,0,0|2,0,0]=4 8520 B16R0.70 CCCCCOCCOCCC(C)C(=O)OC 34a_100011215259_100000034942 [1,1,0,0,0,0|2,0,0]=4 8521 B16R0.70 CCCCCOCCOCCC(C)C(=O)OC 7a_100011215259_100000034942 [1,1,0,0,0,0|2,0,0]=4 8522 B16R0.70 CCCCNCCCCOCC(C)C(=O)OC 34a_200011216965_100000698445 [1,1,0,0,0,0|2,0,0]=4 8523 B16R0.70 CCCCOCCCCOCC(C)C(=O)OC 34a_200000760531_100000698445 [1,1,0,0,0,0|2,0,0]=4 8524 B16R0.70 CCCCOCCCNCCC(C)C(=O)OC 2230a_200000211371_100000034942 [1,1,0,0,0,0|2,0,0]=4 8525 B16R0.70 CCCCOCCCNCCC(C)C(=O)OC 34a_200000211371_100000034942 [1,1,0,0,0,0|2,0,0]=4 8526 B16R0.70 CCCCOCCCOCCC(C)C(=O)OC 34a_200011215613_100000034942 [1,1,0,0,0,0|2,0,0]=4 8527 B16R0.70 CCCCOCCCOCCC(C)C(=O)OC 7a_200011215613_100000034942 [1,1,0,0,0,0|2,0,0]=4 8528 B16R0.70 COC(=O)C(C)CCNCCCCCCCO 2230a_100011996573_100000034942 [1,1,0,0,0,0|2,0,0]=4 8529 B16R0.70 COC(=O)C(C)CCNCCCCCCCO 34a_100011996573_100000034942 [1,1,0,0,0,0|2,0,0]=4 8530 B16R0.70 COC(=O)C(C)CCOCCCCCCCBr 34a_100000760002_100000034942 [1,1,0,0,0,0|2,0,0]=4 8531 B16R0.70 COC(=O)C(C)CCOCCCCCCCBr 7a_100000760002_100000034942 [1,1,0,0,0,0|2,0,0]=4 8532 B16R0.70 COC(=O)C(C)CCOCCCCCCCN 34a_100011996573_100000034942 [1,1,0,0,0,0|2,0,0]=4 8533 B16R0.70 COC(=O)C(C)CCSCCCCCCCO 62a_100000034942_100000760002 [1,1,0,0,0,0|2,0,0]=4 8534 B16R0.70 COC(=O)C(C)CCSCCCCCCCO 62a_100000760002_100000034942 [1,1,0,0,0,0|2,0,0]=4 8535 B16R0.70 COC(=O)C(C)CNCCCCCCCCO 34a_102515433106_100000698445 [1,1,0,0,0,0|2,0,0]=4 8536 B16R0.70 COC(=O)C(C)COCCCCCCCCBr 34a_100009813846_100000698445 [1,1,0,0,0,0|2,0,0]=4 8537 B16R0.70 COC(=O)C(C)COCCCCCCCCCl 34a_100000033203_100000698445 [1,1,0,0,0,0|2,0,0]=4 8538 B16R0.70 COC(=O)C(C)COCCCCCCCCN 34a_102515433106_100000698445 [1,1,0,0,0,0|2,0,0]=4 8539 B16R0.70 COC(=O)C(C)COCCCCCCCCO 34a_100000749362_100000033203 [1,1,0,0,0,0|2,0,0]=4 8540 B16R0.70 COC(=O)C(C)COCCCCCCCCO 7a_100000749362_100000033203 [1,1,0,0,0,0|2,0,0]=4 8541 B16R0.70 COC(=O)C(C)CSCCCCCCCCO 62a_100000033203_100000698445 [1,1,0,0,0,0|2,0,0]=4 8542 B16R0.70 COC(=O)C(C)CSCCCCCCCCO 62a_100000698445_100000033203 [1,1,0,0,0,0|2,0,0]=4 8543 B16R0.70 COC(=O)C(C)NCCCCCCCCCO 2230a_100000078944_100000211248 [1,1,0,0,0,0|2,0,0]=4 8544 B16R0.70 COC(=O)C(C)NCCCCCCCCCO 34a_100000078944_100000211248 [1,1,0,0,0,0|2,0,0]=4 8545 B16R0.70 COC(=O)C(C)OCCCCCCCCCBr 34a_100009813782_100000211248 [1,1,0,0,0,0|2,0,0]=4 8546 B16R0.70 COC(=O)C(C)OCCCCCCCCCBr 7a_100009813782_100000211248 [1,1,0,0,0,0|2,0,0]=4 8547 B16R0.70 COC(=O)C(C)OCCCCCCCCCCl 34a_100009868337_100000211248 [1,1,0,0,0,0|2,0,0]=4 8548 B16R0.70 COC(=O)C(C)OCCCCCCCCCCl 7a_100009868337_100000211248 [1,1,0,0,0,0|2,0,0]=4 8549 B16R0.70 COC(=O)C(C)OCCCCCCCCCN 34a_100000078944_100000211248 [1,1,0,0,0,0|2,0,0]=4 8550 B16R0.70 COC(=O)C(C)OCCCCCCCCCO 34a_100011215400_100009813782 [1,1,0,0,0,0|2,0,0]=4 8551 B16R0.70 COC(=O)C(C)SCCCCCCCCCO 62a_100000211248_100009813782 [1,1,0,0,0,0|2,0,0]=4 8552 B16R0.70 COC(=O)C(C)SCCCCCCCCCO 62a_100009813782_100000211248 [1,1,0,0,0,0|2,0,0]=4 8553 B16R0.70 COC(=O)C(F)COCCCCCCCCO 34a_200009849844_100000033203 [1,1,0,0,0,0|2,0,0]=4 8554 B16R0.70 COC(=O)[C@H](N)COCCCCCCCCO 34a_100000003586_100000033203 [1,1,0,0,0,0|2,0,0]=4 8555 B16R0.70 COCCCCCCOCCC(C)C(=O)OC 34a_200012092642_100000034942 [1,1,0,0,0,0|2,0,0]=4 8556 B16R0.70 COCCCCCCOCCC(C)C(=O)OC 7a_200012092642_100000034942 [1,1,0,0,0,0|2,0,0]=4 8557 B16R0.70 COCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100011998445 [1,1,0,0,0,0|2,0,0]=4 8558 B16R0.70 COCCCCCCSCCC(C)C(=O)OC 62a_100011998445_100000034942 [1,1,0,0,0,0|2,0,0]=4 8559 B16R0.108 CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000211969_100000204269 [1,1,0,0,0,0|0,0,1]=3 8560 B16R0.108 CCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210614 [1,1,0,0,0,0|0,0,1]=3 8561 B16R0.108 CCCCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210614 [1,1,0,0,0,0|1,0,1]=4 8562 B16R0.108 CCCCCCCC(=O)CCOCC(=O)OC 1458a_100000211969_100000090808 [1,1,0,0,0,0|1,0,1]=4 8563 B16R0.108 CCCCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100000211969 [1,1,0,0,0,0|1,0,1]=4 8564 B16R0.108 CCCCCCCC(C)NCCCC(=O)NC 2230a_100000740002_200011218727 [1,1,0,0,0,0|2,0,0]=4 8565 B16R0.108 CCCCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100000210596 [1,1,0,0,0,0|2,0,0]=4 8566 B16R0.108 CCCCCCCC(C)NCCCC(=O)NC 34a_100000740002_200011218727 [1,1,0,0,0,0|2,0,0]=4 8567 B16R0.108 CCCCCCCC(C)OCCCC(=O)NC 34a_200011215852_100000741757 [1,1,0,0,0,0|2,0,0]=4 8568 B16R0.108 CCCCCCCC(C)OCCCC(=O)NC 7a_200011215852_100000741757 [1,1,0,0,0,0|2,0,0]=4 8569 B16R0.108 CCCCCCCC(C)OCCCC(=O)OC 34a_200011215852_100000742333 [1,1,0,0,0,0|1,0,0]=3 8570 B16R0.108 CCCCCCCC(C)OCCCC(=O)OC 7a_200011215852_100011218270 [1,1,0,0,0,0|1,0,0]=3 8571 B16R0.108 CCCCCCCC(C)OCCNC(=O)OC 34a_100000757965_200011218727 [1,1,0,0,0,0|2,0,0]=4 8572 B16R0.108 CCCCCCCC(C)OCCOC(=O)OC 34a_100010262106_200011218727 [1,1,0,0,0,0|2,0,0]=4 8573 B16R0.108 CCCCCCCC(C)SCCCC(=O)NC 62a_100000741757_200011218727 [1,1,0,0,0,0|2,0,0]=4 8574 B16R0.108 CCCCCCCC(C)SCCCC(=O)NC 62a_200011218727_100000741757 [1,1,0,0,0,0|2,0,0]=4 8575 B16R0.108 CCCCCCCC(C)SCCCC(=O)OC 62a_100011218270_200011218727 [1,1,0,0,0,0|1,0,0]=3 8576 B16R0.108 CCCCCCCC(C)SCCCC(=O)OC 62a_200011218727_100011218270 [1,1,0,0,0,0|1,0,0]=3 8577 B16R0.108 CCCCCCCN(C)CCCCC(=O)OC 2230a_100000228206_100000204269 [1,1,0,0,0,0|1,0,0]=3 8578 B16R0.108 CCCCCCCN(C)CCCCC(=O)OC 269982a_100000228206_100000204269 [1,1,0,0,0,0|1,0,0]=3 8579 B16R0.108 CCCCCCCN(C)CCOCC(=O)OC 2230a_100000228206_100000090808 [1,1,0,0,0,0|2,0,0]=4 8580 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 11a_100000210581_100000695723 [1,1,0,0,0,0|1,0,1]=4 8581 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 1626a_100000210581_100000695723 [1,1,0,0,0,0|1,0,1]=4 8582 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 240690a_100000210581_100000695723 [1,1,0,0,0,0|1,0,1]=4 8583 B16R0.108 CCCCCCNC(=O)CCCCC(=O)OC 527a_100000210581_100000695723 [1,1,0,0,0,0|1,0,1]=4 8584 B16R0.108 CCCCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000743108 [1,1,0,0,0,0|1,0,1]=4 8585 B16R0.108 COC(=O)CCCCC(=O)CCCCCCF 1458a_100000695723_100015922095 [1,1,0,0,0,0|1,0,1]=4 8586 B16R0.108 COC(=O)CCCCC(=O)CCCCCCO 1458a_100000695723_100000766143 [1,1,0,0,0,0|1,0,1]=4 8587 B16R0.108 COC(=O)CCCCC(=O)CCCCCCO 1458a_100011996774_100000204269 [1,1,0,0,0,0|1,0,1]=4 8588 B16R0.108 COCCCCCC(=O)CCCCC(=O)OC 1458a_100011935119_100000204269 [1,1,0,0,0,0|1,0,1]=4 8589 B16R0.164 CCC(=O)CCCCCCCCCC(=O)OC 1458a_100000210414_100009813843 [1,1,0,0,0,0|0,0,1]=3 8590 B16R0.164 CCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000210202 [1,1,0,0,0,0|0,0,1]=3 8591 B16R0.164 CCC(=O)COCCCCCCCC(=O)OC 34a_100000725409_100010004213 [1,1,0,0,0,0|1,0,1]=4 8592 B16R0.164 CCC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000747405 [1,1,0,0,0,0|1,0,1]=4 8593 B16R0.164 CCC(=O)CSCCCCCCCC(=O)OC 62a_100000747405_100010004213 [1,1,0,0,0,0|1,0,1]=4 8594 B16R0.164 CCC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000747405 [1,1,0,0,0,0|1,0,1]=4 8595 B16R0.164 CCC(C)CCCCCOCCCC(=O)NC 7a_200000035636_100000741757 [1,1,0,0,0,0|2,0,0]=4 8596 B16R0.164 CCC(C)CCCCCOCCCC(=O)OC 7a_200000035636_100011218270 [1,1,0,0,0,0|1,0,0]=3 8597 B16R0.164 CCC(C)CCCOCCCCCC(=O)OC 7a_100011216074_100009816466 [1,1,0,0,0,0|1,0,0]=3 8598 B16R0.164 CCC(C)CCNCCCCCCC(=O)OC 2230a_100020591266_100009815986 [1,1,0,0,0,0|1,0,0]=3 8599 B16R0.164 CCC(C)CCOCCCCCCC(=O)OC 7a_100011215188_100009815986 [1,1,0,0,0,0|1,0,0]=3 8600 B16R0.164 CCC(C)CNCCCCCCCC(=O)OC 2230a_100020588543_100010004213 [1,1,0,0,0,0|1,0,0]=3 8601 B16R0.164 CCC(C)COCCCCCCCC(=O)OC 34a_100011022521_100000748023 [1,1,0,0,0,0|1,0,0]=3 8602 B16R0.164 CCC(C)COCCCCCCCC(=O)OC 7a_100011022521_100000748023 [1,1,0,0,0,0|1,0,0]=3 8603 B16R0.164 CCC(C)CSCCCCCCCC(=O)OC 62a_100000748023_100010004213 [1,1,0,0,0,0|1,0,0]=3 8604 B16R0.164 CCC(C)CSCCCCCCCC(=O)OC 62a_100010004213_100000748023 [1,1,0,0,0,0|1,0,0]=3 8605 B16R0.164 CCC(C)NCCCCCCCCC(=O)OC 2230a_100000209981_100010282707 [1,1,0,0,0,0|1,0,0]=3 8606 B16R0.164 CCC(C)OCCCCCCCCC(=O)OC 34a_100000035544_100011215416 [1,1,0,0,0,0|1,0,0]=3 8607 B16R0.164 CCC(C)OCCCCCCCCC(=O)OC 7a_100000035544_100000758301 [1,1,0,0,0,0|1,0,0]=3 8608 B16R0.164 CCC(C)OCCCCCCCCC(=O)OC 7a_100000210228_100010282707 [1,1,0,0,0,0|1,0,0]=3 8609 B16R0.164 CCC(C)SCCCCCCCCC(=O)OC 62a_100000758301_100010282707 [1,1,0,0,0,0|1,0,0]=3 8610 B16R0.164 CCC(C)SCCCCCCCCC(=O)OC 62a_100010282707_100000758301 [1,1,0,0,0,0|1,0,0]=3 8611 B16R0.164 CCC(O)CNCCCCCCCC(=O)OC 2230a_100011218483_100010004213 [1,1,0,0,0,0|1,0,0]=3 8612 B16R0.164 CCC(O)COCCCCCCCC(=O)OC 34a_100011022521_100011218378 [1,1,0,0,0,0|1,0,0]=3 8613 B16R0.164 CCC(O)COCCCCCCCC(=O)OC 7a_100011022521_100011218378 [1,1,0,0,0,0|1,0,0]=3 8614 B16R0.164 CCC(O)CSCCCCCCCC(=O)OC 62a_100010004213_100011218378 [1,1,0,0,0,0|1,0,0]=3 8615 B16R0.164 CCC(O)CSCCCCCCCC(=O)OC 62a_100011218378_100010004213 [1,1,0,0,0,0|1,0,0]=3 8616 B16R0.164 CCN(C)CCCCCCCCCC(=O)OC 2230a_100000225621_100009813843 [1,1,0,0,0,0|1,0,0]=3 8617 B16R0.164 CCN(C)CCCCCCCCCC(=O)OC 269982a_100000225621_100009813843 [1,1,0,0,0,0|1,0,0]=3 8618 B16R0.164 CCN(C)CCCOCCCCCC(=O)OC 7a_100000074720_100015186262 [1,1,0,0,0,0|2,0,0]=4 8619 B16R0.164 CCN(C)CCCSCCCCCC(=O)OC 62a_100009816466_100015186262 [1,1,0,0,0,0|2,0,0]=4 8620 B16R0.164 CC[C@H](C)COCCCCCCCC(=O)OC 34a_100011022521_100009816398 [1,1,0,0,0,0|1,0,0]=3 8621 B16R0.164 CC[C@H](C)COCCCCCCCC(=O)OC 7a_100009816381_100010004213 [1,1,0,0,0,0|1,0,0]=3 8622 B16R0.164 CC[C@H](C)COCCCCCCCC(=O)OC 7a_100011022521_100009816398 [1,1,0,0,0,0|1,0,0]=3 8623 B16R0.164 CC[C@H](C)CSCCCCCCCC(=O)OC 62a_100009816398_100010004213 [1,1,0,0,0,0|1,0,0]=3 8624 B16R0.164 CC[C@H](C)CSCCCCCCCC(=O)OC 62a_100010004213_100009816398 [1,1,0,0,0,0|1,0,0]=3 8625 B16R0.164 CNC(=O)CCCCCCCCCC(=O)OC 11a_106832991635_100009997464 [1,1,0,0,0,0|1,0,1]=4 8626 B16R0.164 CNC(=O)CCCCCCCCCC(=O)OC 1626a_100102657272_100009997464 [1,1,0,0,0,0|1,0,1]=4 8627 B16R0.164 CNC(=O)CCCCCCCCCC(=O)OC 240690a_100102657272_100009997464 [1,1,0,0,0,0|1,0,1]=4 8628 B16R0.164 COC(=O)CCCCCCCCCC(=O)CF 1458a_100009997464_100015361967 [1,1,0,0,0,0|1,0,1]=4 8629 B16R0.164 COC(=O)CCCCCCCCCC(=O)CO 1458a_100000210174_100009813843 [1,1,0,0,0,0|1,0,1]=4 8630 B16R0.164 COC(=O)CCCCCCCCN[C@H](C)CO 2230a_100000737577_100010282707 [1,1,0,0,0,0|2,0,0]=4 8631 B16R0.164 COC(=O)CCCCCCCCOC(C)CF 34a_100016041109_100010282707 [1,1,0,0,0,0|2,0,0]=4 8632 B16R0.164 COC(=O)CCCCCCCCOC(C)CF 7a_100016041109_100010282707 [1,1,0,0,0,0|2,0,0]=4 8633 B16R0.164 COC(=O)CCCCCCCCOC(C)CN 34a_100000210904_100010282707 [1,1,0,0,0,0|2,0,0]=4 8634 B16R0.164 COC(=O)CCCCCCCCOC(C)CO 34a_100000035544_100012180447 [1,1,0,0,0,0|2,0,0]=4 8635 B16R0.164 COC(=O)CCCCCCCCOC(C)CO 7a_100000035544_100012180447 [1,1,0,0,0,0|2,0,0]=4 8636 B16R0.164 COC(=O)CCCCCCCCSC(C)CO 62a_100012180447_100010282707 [1,1,0,0,0,0|2,0,0]=4 8637 B16R0.164 COC(=O)CCCCCCCCSC(C)OC 62a_100009879195_100010282707 [1,1,0,0,0,0|2,0,0]=4 8638 B16R0.164 COC(=O)CCCCCCCCSC(C)OC 62a_100010282707_100009879195 [1,1,0,0,0,0|2,0,0]=4 8639 B16R0.164 COC(=O)CCCCCCCCS[C@H](C)CO 62a_100010282707_100016084084 [1,1,0,0,0,0|2,0,0]=4 8640 B16R0.164 COC(=O)CCCCCCCCS[C@H](C)CO 62a_100016084084_100010282707 [1,1,0,0,0,0|2,0,0]=4 8641 B16R0.164 COC(=O)CCCCCCCNCC(C)CO 34a_100000744482_100010004213 [1,1,0,0,0,0|2,0,0]=4 8642 B16R0.164 COC(=O)CCCCCCCNC[C@@H](C)OC 2230a_100020591295_100010004213 [1,1,0,0,0,0|2,0,0]=4 8643 B16R0.164 COC(=O)CCCCCCCNC[C@@H](F)CO 34a_100015665980_100010004213 [1,1,0,0,0,0|2,0,0]=4 8644 B16R0.164 COC(=O)CCCCCCCNC[C@H](O)CO 2230a_100020644852_100010004213 [1,1,0,0,0,0|2,0,0]=4 8645 B16R0.164 COC(=O)CCCCCCCOCC(C)CN 34a_100000744482_100010004213 [1,1,0,0,0,0|2,0,0]=4 8646 B16R0.164 COC(=O)CCCCCCCOCC(C)OC 34a_100000690652_100010004213 [1,1,0,0,0,0|2,0,0]=4 8647 B16R0.164 COC(=O)CCCCCCCOCC(Cl)CCl 34a_100000033668_100010004213 [1,1,0,0,0,0|2,0,0]=4 8648 B16R0.164 COC(=O)CCCCCCCOCC(O)CO 34a_100011022521_100011219619 [1,1,0,0,0,0|2,0,0]=4 8649 B16R0.164 COC(=O)CCCCCCCOCC(O)CO 7a_100011022521_100011219619 [1,1,0,0,0,0|2,0,0]=4 8650 B16R0.164 COC(=O)CCCCCCCOC[C@@H](C)CO 34a_100011022521_100000059175 [1,1,0,0,0,0|2,0,0]=4 8651 B16R0.164 COC(=O)CCCCCCCOC[C@@H](C)CO 7a_100011022521_100000059175 [1,1,0,0,0,0|2,0,0]=4 8652 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CF 34a_100011022521_100015614560 [1,1,0,0,0,0|2,0,0]=4 8653 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CF 7a_100011022521_100015614560 [1,1,0,0,0,0|2,0,0]=4 8654 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CO 34a_100011022521_100009815848 [1,1,0,0,0,0|2,0,0]=4 8655 B16R0.164 COC(=O)CCCCCCCOC[C@@H](O)CO 7a_100011022521_100009815848 [1,1,0,0,0,0|2,0,0]=4 8656 B16R0.164 COC(=O)CCCCCCCOC[C@H](F)CN 34a_100015665980_100010004213 [1,1,0,0,0,0|2,0,0]=4 8657 B16R0.164 COC(=O)CCCCCCCSCC(O)CO 62a_100010004213_100011219619 [1,1,0,0,0,0|2,0,0]=4 8658 B16R0.164 COC(=O)CCCCCCCSCC(O)CO 62a_100011219619_100010004213 [1,1,0,0,0,0|2,0,0]=4 8659 B16R0.164 COC(=O)CCCCCCCSC[C@@H](C)CO 62a_100000059175_100010004213 [1,1,0,0,0,0|2,0,0]=4 8660 B16R0.164 COC(=O)CCCCCCCSC[C@@H](C)CO 62a_100010004213_100000059175 [1,1,0,0,0,0|2,0,0]=4 8661 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CF 62a_100010004213_100015614560 [1,1,0,0,0,0|2,0,0]=4 8662 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CF 62a_100015614560_100010004213 [1,1,0,0,0,0|2,0,0]=4 8663 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CO 62a_100009815848_100010004213 [1,1,0,0,0,0|2,0,0]=4 8664 B16R0.164 COC(=O)CCCCCCCSC[C@@H](O)CO 62a_100010004213_100009815848 [1,1,0,0,0,0|2,0,0]=4 8665 B16R0.164 COC(=O)CCCCCCNCCC(C)CO 2230a_106354213184_100009815986 [1,1,0,0,0,0|2,0,0]=4 8666 B16R0.164 COC(=O)CCCCCCNCCC(C)CO 34a_106354213184_100009815986 [1,1,0,0,0,0|2,0,0]=4 8667 B16R0.164 COC(=O)CCCCCCOCCC(C)OC 7a_100000764861_100009815986 [1,1,0,0,0,0|2,0,0]=4 8668 B16R0.164 COC(=O)CCCCCOCCC[C@@H](C)CN 34a_100160569302_100009816466 [1,1,0,0,0,0|2,0,0]=4 8669 B16R0.165 C=C(C)CCOCCCCCCCC(=O)OC 34a_100000764851_100010004213 [1,1,0,0,0,0|1,0,1]=4 8670 B16R0.165 C=C(C)CCOCCCCCCCC(=O)OC 34a_100011022521_100000730704 [1,1,0,0,0,0|1,0,1]=4 8671 B16R0.165 C=C(C)CCOCCCCCCCC(=O)OC 7a_100011022521_100000730704 [1,1,0,0,0,0|1,0,1]=4 8672 B16R0.165 C=C(C)CCSCCCCCCCC(=O)OC 62a_100000730704_100010004213 [1,1,0,0,0,0|1,0,1]=4 8673 B16R0.165 C=C(C)CCSCCCCCCCC(=O)OC 62a_100010004213_100000730704 [1,1,0,0,0,0|1,0,1]=4 8674 B16R0.165 C=C(C)COCCCCCCCCC(=O)OC 34a_100000035544_100000748629 [1,1,0,0,0,0|1,0,1]=4 8675 B16R0.165 C=C(C)COCCCCCCCCC(=O)OC 34a_100000210245_100010282707 [1,1,0,0,0,0|1,0,1]=4 8676 B16R0.165 C=C(C)COCCCCCCCCC(=O)OC 7a_100000035544_100000748629 [1,1,0,0,0,0|1,0,1]=4 8677 B16R0.165 C=C(C)CSCCCCCCCCC(=O)OC 62a_100000748629_100010282707 [1,1,0,0,0,0|1,0,1]=4 8678 B16R0.165 C=C(C)CSCCCCCCCCC(=O)OC 62a_100010282707_100000211660 [1,1,0,0,0,0|1,0,1]=4 8679 B16R0.165 CNC(=O)CCCNCCCCCCC(C)C 2230a_100000211014_100000741757 [1,1,0,0,0,0|2,0,0]=4 8680 B16R0.165 CNC(=O)CCCNCCCCCCC(C)C 34a_100000211014_100000741757 [1,1,0,0,0,0|2,0,0]=4 8681 B16R0.165 CNC(=O)CCOCCCCCCCC(C)C 34a_200000210741_100012179268 [1,1,0,0,0,0|2,0,0]=4 8682 B16R0.165 CNC(=O)CCOCCCCCCCC(C)C 7a_200000210741_100000737683 [1,1,0,0,0,0|2,0,0]=4 8683 B16R0.165 COC(=O)CCCCCCCCCCC(=O)C 1458a_100000070787_100009812566 [1,1,0,0,0,0|0,0,1]=3 8684 B16R0.165 COC(=O)CCCCCCCCCCC(=O)C 1458a_100016987261_200000210301 [1,1,0,0,0,0|0,0,1]=3 8685 B16R0.165 COC(=O)CCCCCCCCCCC(=O)[13CH3] 1458a_100016987261_200025704644 [1,1,0,0,0,0|0,0,1]=3 8686 B16R0.165 COC(=O)CCCCCCCCCCN(C)C 2230a_100102631434_100009812566 [1,1,0,0,0,0|1,0,0]=3 8687 B16R0.165 COC(=O)CCCCCCCCCCN(C)C 269982a_100102631434_100009812566 [1,1,0,0,0,0|1,0,0]=3 8688 B16R0.165 COC(=O)CCCCCCCCCNC(C)C 2230a_100138425928_100009813843 [1,1,0,0,0,0|1,0,0]=3 8689 B16R0.165 COC(=O)CCCCCCCCCNC(C)C 34a_100138425928_100009813843 [1,1,0,0,0,0|1,0,0]=3 8690 B16R0.165 COC(=O)CCCCCCCCCOC(C)C 34a_100000212225_100009813843 [1,1,0,0,0,0|1,0,0]=3 8691 B16R0.165 COC(=O)CCCCCCCCCSC(C)C 62a_100000210206_100009813843 [1,1,0,0,0,0|1,0,0]=3 8692 B16R0.165 COC(=O)CCCCCCCCNCC(C)C 2230a_100000210953_100010282707 [1,1,0,0,0,0|1,0,0]=3 8693 B16R0.165 COC(=O)CCCCCCCCNCC(C)C 34a_100000210953_100010282707 [1,1,0,0,0,0|1,0,0]=3 8694 B16R0.165 COC(=O)CCCCCCCCNCC(C)O 2230a_100000210904_100010282707 [1,1,0,0,0,0|1,0,0]=3 8695 B16R0.165 COC(=O)CCCCCCCCNCC(C)O 34a_100000210904_100010282707 [1,1,0,0,0,0|1,0,0]=3 8696 B16R0.165 COC(=O)CCCCCCCCNCC(F)F 34a_100000765723_100010282707 [1,1,0,0,0,0|2,0,0]=4 8697 B16R0.165 COC(=O)CCCCCCCCOCC(=O)C 34a_100000211253_100010282707 [1,1,0,0,0,0|1,0,1]=4 8698 B16R0.165 COC(=O)CCCCCCCCOCC(C)Br 34a_100012180447_100010282707 [1,1,0,0,0,0|1,0,0]=3 8699 B16R0.165 COC(=O)CCCCCCCCOCC(C)C 34a_100000035544_100000210624 [1,1,0,0,0,0|1,0,0]=3 8700 B16R0.165 COC(=O)CCCCCCCCOCC(C)C 34a_100000210257_100010282707 [1,1,0,0,0,0|1,0,0]=3 8701 B16R0.165 COC(=O)CCCCCCCCOCC(C)C 7a_100000035544_100000210760 [1,1,0,0,0,0|1,0,0]=3 8702 B16R0.165 COC(=O)CCCCCCCCOCC(C)F 34a_100015925927_100010282707 [1,1,0,0,0,0|1,0,0]=3 8703 B16R0.165 COC(=O)CCCCCCCCOCC(C)O 34a_100000035544_100011218427 [1,1,0,0,0,0|1,0,0]=3 8704 B16R0.165 COC(=O)CCCCCCCCOCC(C)O 7a_100000035544_100011218427 [1,1,0,0,0,0|1,0,0]=3 8705 B16R0.165 COC(=O)CCCCCCCCOCC(F)F 34a_100000035544_100011934356 [1,1,0,0,0,0|2,0,0]=4 8706 B16R0.165 COC(=O)CCCCCCCCOCC(F)F 34a_100000743014_100010282707 [1,1,0,0,0,0|2,0,0]=4 8707 B16R0.165 COC(=O)CCCCCCCCOCC(F)F 7a_100000035544_100011934356 [1,1,0,0,0,0|2,0,0]=4 8708 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100010282707 [1,1,0,0,0,0|1,0,0]=3 8709 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)N 34a_100000737577_100010282707 [1,1,0,0,0,0|1,0,0]=3 8710 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)O 34a_100000035544_100009817552 [1,1,0,0,0,0|1,0,0]=3 8711 B16R0.165 COC(=O)CCCCCCCCOC[C@@H](C)O 7a_100000035544_100009817552 [1,1,0,0,0,0|1,0,0]=3 8712 B16R0.165 COC(=O)CCCCCCCCSCC(C)C 62a_100000210624_100010282707 [1,1,0,0,0,0|1,0,0]=3 8713 B16R0.165 COC(=O)CCCCCCCCSCC(C)C 62a_100010282707_100000210760 [1,1,0,0,0,0|1,0,0]=3 8714 B16R0.165 COC(=O)CCCCCCCCSCC(C)O 62a_100010282707_100011218427 [1,1,0,0,0,0|1,0,0]=3 8715 B16R0.165 COC(=O)CCCCCCCCSCC(C)O 62a_100011218427_100010282707 [1,1,0,0,0,0|1,0,0]=3 8716 B16R0.165 COC(=O)CCCCCCCCSCC(F)F 62a_100010282707_100011934356 [1,1,0,0,0,0|2,0,0]=4 8717 B16R0.165 COC(=O)CCCCCCCCSCC(F)F 62a_100011934356_100010282707 [1,1,0,0,0,0|2,0,0]=4 8718 B16R0.165 COC(=O)CCCCCCCCSC[C@@H](C)O 62a_100009817552_100010282707 [1,1,0,0,0,0|1,0,0]=3 8719 B16R0.165 COC(=O)CCCCCCCCSC[C@@H](C)O 62a_100010282707_100009817552 [1,1,0,0,0,0|1,0,0]=3 8720 B16R0.165 COC(=O)CCCCCCCNCCC(C)O 2230a_200000755665_100010004213 [1,1,0,0,0,0|1,0,0]=3 8721 B16R0.165 COC(=O)CCCCCCCOCCC(=O)C 34a_100000759926_100010004213 [1,1,0,0,0,0|1,0,1]=4 8722 B16R0.165 COC(=O)CCCCCCCOCCC(=O)C 7a_100000759926_100010004213 [1,1,0,0,0,0|1,0,1]=4 8723 B16R0.165 COC(=O)CCCCCCCOCCC(=O)C 7a_100011022521_100000053229 [1,1,0,0,0,0|1,0,1]=4 8724 B16R0.165 COC(=O)CCCCCCCOCCC(C)Br 34a_100009893172_100010004213 [1,1,0,0,0,0|1,0,0]=3 8725 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 34a_100000210254_100010004213 [1,1,0,0,0,0|1,0,0]=3 8726 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 34a_100011022521_100000210312 [1,1,0,0,0,0|1,0,0]=3 8727 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 7a_100000210254_100010004213 [1,1,0,0,0,0|1,0,0]=3 8728 B16R0.165 COC(=O)CCCCCCCOCCC(C)C 7a_100011022521_100000210626 [1,1,0,0,0,0|1,0,0]=3 8729 B16R0.165 COC(=O)CCCCCCCOCCC(C)O 34a_100011022521_100012276601 [1,1,0,0,0,0|1,0,0]=3 8730 B16R0.165 COC(=O)CCCCCCCOCCC(C)O 7a_100011022521_100012276601 [1,1,0,0,0,0|1,0,0]=3 8731 B16R0.165 COC(=O)CCCCCCCOCCC(F)F 34a_100103093639_100010004213 [1,1,0,0,0,0|2,0,0]=4 8732 B16R0.165 COC(=O)CCCCCCCOCCN(C)C 7a_100011022521_100000755713 [1,1,0,0,0,0|2,0,0]=4 8733 B16R0.165 COC(=O)CCCCCCCOCC[C@@H](C)N 34a_100000706166_100010004213 [1,1,0,0,0,0|1,0,0]=3 8734 B16R0.165 COC(=O)CCCCCCCOCOC(C)C 34a_100011022521_100000709892 [1,1,0,0,0,0|2,0,0]=4 8735 B16R0.165 COC(=O)CCCCCCCSCCC(=O)C 62a_100000053229_100010004213 [1,1,0,0,0,0|1,0,1]=4 8736 B16R0.165 COC(=O)CCCCCCCSCCC(=O)C 62a_100010004213_100000053229 [1,1,0,0,0,0|1,0,1]=4 8737 B16R0.165 COC(=O)CCCCCCCSCCC(C)C 62a_100000210312_100010004213 [1,1,0,0,0,0|1,0,0]=3 8738 B16R0.165 COC(=O)CCCCCCCSCCC(C)C 62a_100010004213_100000210312 [1,1,0,0,0,0|1,0,0]=3 8739 B16R0.165 COC(=O)CCCCCCCSCCC(C)O 62a_100010004213_100012276601 [1,1,0,0,0,0|1,0,0]=3 8740 B16R0.165 COC(=O)CCCCCCCSCCC(C)O 62a_100012276601_100010004213 [1,1,0,0,0,0|1,0,0]=3 8741 B16R0.165 COC(=O)CCCCCCCSCCN(C)C 62a_100010004213_100000755713 [1,1,0,0,0,0|2,0,0]=4 8742 B16R0.165 COC(=O)CCCCCCCSCOC(C)C 62a_100000709892_100010004213 [1,1,0,0,0,0|2,0,0]=4 8743 B16R0.165 COC(=O)CCCCCCCSCOC(C)C 62a_100010004213_100000709892 [1,1,0,0,0,0|2,0,0]=4 8744 B16R0.165 COC(=O)CCCCCCNCCCC(C)C 2230a_200000737386_100009815986 [1,1,0,0,0,0|1,0,0]=3 8745 B16R0.165 COC(=O)CCCCCCNCCCC(C)C 34a_200000737386_100009815986 [1,1,0,0,0,0|1,0,0]=3 8746 B16R0.165 COC(=O)CCCCCCNCCCS(=O)C 2230a_200000753449_100009815986 [1,1,0,0,0,0|2,0,0]=4 8747 B16R0.165 COC(=O)CCCCCCNCCOC(C)C 2230a_100000701111_100009815986 [1,1,0,0,0,0|2,0,0]=4 8748 B16R0.165 COC(=O)CCCCCCNCCOC(C)C 34a_100000701111_100009815986 [1,1,0,0,0,0|2,0,0]=4 8749 B16R0.165 COC(=O)CCCCCCNCCSC(C)C 2230a_100000731138_100009815986 [1,1,0,0,0,0|2,0,0]=4 8750 B16R0.165 COC(=O)CCCCCCNCCSC(C)C 34a_100000731138_100009815986 [1,1,0,0,0,0|2,0,0]=4 8751 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 34a_100000759063_100009815986 [1,1,0,0,0,0|1,0,1]=4 8752 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 34a_100009863599_100000685027 [1,1,0,0,0,0|1,0,1]=4 8753 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 7a_100000759063_100009815986 [1,1,0,0,0,0|1,0,1]=4 8754 B16R0.165 COC(=O)CCCCCCOCCCC(=O)C 7a_100009863599_100011215641 [1,1,0,0,0,0|1,0,1]=4 8755 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 34a_100000210774_100009815986 [1,1,0,0,0,0|1,0,0]=3 8756 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 34a_100009863599_100011214892 [1,1,0,0,0,0|1,0,0]=3 8757 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 7a_100000210774_100009815986 [1,1,0,0,0,0|1,0,0]=3 8758 B16R0.165 COC(=O)CCCCCCOCCCC(C)C 7a_100009863599_100011214892 [1,1,0,0,0,0|1,0,0]=3 8759 B16R0.165 COC(=O)CCCCCCOCCCC(C)O 34a_100009863599_200000718107 [1,1,0,0,0,0|1,0,0]=3 8760 B16R0.165 COC(=O)CCCCCCOCCCC(C)O 7a_100009863599_200000718107 [1,1,0,0,0,0|1,0,0]=3 8761 B16R0.165 COC(=O)CCCCCCOCCCN(C)C 7a_100009863599_100000757444 [1,1,0,0,0,0|2,0,0]=4 8762 B16R0.165 COC(=O)CCCCCCOCCNC(C)C 34a_100000224655_100009815986 [1,1,0,0,0,0|2,0,0]=4 8763 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 34a_100000211219_100009815986 [1,1,0,0,0,0|2,0,0]=4 8764 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 34a_100009863599_100000211751 [1,1,0,0,0,0|2,0,0]=4 8765 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 7a_100000211219_100009815986 [1,1,0,0,0,0|2,0,0]=4 8766 B16R0.165 COC(=O)CCCCCCOCCOC(C)C 7a_100009863599_100000211751 [1,1,0,0,0,0|2,0,0]=4 8767 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 34a_100009863599_100000730970 [1,1,0,0,0,0|2,0,0]=4 8768 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 34a_200011212901_100009815986 [1,1,0,0,0,0|2,0,0]=4 8769 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 7a_100009863599_100000730970 [1,1,0,0,0,0|2,0,0]=4 8770 B16R0.165 COC(=O)CCCCCCOCCSC(C)C 7a_200011212901_100009815986 [1,1,0,0,0,0|2,0,0]=4 8771 B16R0.165 COC(=O)CCCCCCSCCCC(=O)C 62a_100009815986_100011215641 [1,1,0,0,0,0|1,0,1]=4 8772 B16R0.165 COC(=O)CCCCCCSCCCC(=O)C 62a_100011215641_100009815986 [1,1,0,0,0,0|1,0,1]=4 8773 B16R0.165 COC(=O)CCCCCCSCCCC(C)C 62a_100009815986_100011214892 [1,1,0,0,0,0|1,0,0]=3 8774 B16R0.165 COC(=O)CCCCCCSCCCC(C)C 62a_100011214892_100009815986 [1,1,0,0,0,0|1,0,0]=3 8775 B16R0.165 COC(=O)CCCCCCSCCCC(C)O 62a_100009815986_200000718107 [1,1,0,0,0,0|1,0,0]=3 8776 B16R0.165 COC(=O)CCCCCCSCCCC(C)O 62a_200000718107_100009815986 [1,1,0,0,0,0|1,0,0]=3 8777 B16R0.165 COC(=O)CCCCCCSCCCN(C)C 62a_100009815986_100000757444 [1,1,0,0,0,0|2,0,0]=4 8778 B16R0.165 COC(=O)CCCCCCSCCOC(C)C 62a_100000211751_100009815986 [1,1,0,0,0,0|2,0,0]=4 8779 B16R0.165 COC(=O)CCCCCCSCCOC(C)C 62a_100009815986_100000211751 [1,1,0,0,0,0|2,0,0]=4 8780 B16R0.165 COC(=O)CCCCCCSCCSC(C)C 62a_100000730970_100009815986 [1,1,0,0,0,0|2,0,0]=4 8781 B16R0.165 COC(=O)CCCCCCSCCSC(C)C 62a_100009815986_100000730970 [1,1,0,0,0,0|2,0,0]=4 8782 B16R0.165 COC(=O)CCCCCNCCCOC(C)C 2230a_100000737246_100009816466 [1,1,0,0,0,0|2,0,0]=4 8783 B16R0.165 COC(=O)CCCCCNCCCOC(C)C 34a_100000737246_100009816466 [1,1,0,0,0,0|2,0,0]=4 8784 B16R0.165 COC(=O)CCCCCOCCCCC(=O)C 34a_100000074720_100009817362 [1,1,0,0,0,0|1,0,1]=4 8785 B16R0.165 COC(=O)CCCCCOCCCCC(=O)C 7a_100000074720_100000735457 [1,1,0,0,0,0|1,0,1]=4 8786 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 34a_100000074720_100011216152 [1,1,0,0,0,0|1,0,0]=3 8787 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 34a_100011214890_100009816466 [1,1,0,0,0,0|1,0,0]=3 8788 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 7a_100000074720_100011216152 [1,1,0,0,0,0|1,0,0]=3 8789 B16R0.165 COC(=O)CCCCCOCCCCC(C)C 7a_100011214890_100009816466 [1,1,0,0,0,0|1,0,0]=3 8790 B16R0.165 COC(=O)CCCCCOCCCNC(C)C 34a_100000182298_100009816466 [1,1,0,0,0,0|2,0,0]=4 8791 B16R0.165 COC(=O)CCCCCOCCNCC(C)C 34a_100015185251_100009816466 [1,1,0,0,0,0|2,0,0]=4 8792 B16R0.165 COC(=O)CCCCCOCCOCC(C)C 34a_100000703358_100009816466 [1,1,0,0,0,0|2,0,0]=4 8793 B16R0.165 COC(=O)CCCCCOCCOCC(C)C 7a_100000703358_100009816466 [1,1,0,0,0,0|2,0,0]=4 8794 B16R0.165 COC(=O)CCCCCOCCSCC(C)C 34a_200000230437_100009816466 [1,1,0,0,0,0|2,0,0]=4 8795 B16R0.165 COC(=O)CCCCCOCCSCC(C)C 7a_200000230437_100009816466 [1,1,0,0,0,0|2,0,0]=4 8796 B16R0.165 COC(=O)CCCCCSCCCCC(=O)C 62a_100000735457_100009816466 [1,1,0,0,0,0|1,0,1]=4 8797 B16R0.165 COC(=O)CCCCCSCCCCC(=O)C 62a_100009816466_100000735457 [1,1,0,0,0,0|1,0,1]=4 8798 B16R0.165 COC(=O)CCCCCSCCCCC(C)C 62a_100009816466_100011216152 [1,1,0,0,0,0|1,0,0]=3 8799 B16R0.165 COC(=O)CCCCCSCCCCC(C)C 62a_100011216152_100009816466 [1,1,0,0,0,0|1,0,0]=3 8800 B16R0.165 COC(=O)CCCCCSCCCCN(C)C 62a_100009816466_100000690147 [1,1,0,0,0,0|2,0,0]=4 8801 B16R0.165 COC(=O)CCCCNCCCCCC(C)C 2230a_100011290863_100000204269 [1,1,0,0,0,0|1,0,0]=3 8802 B16R0.165 COC(=O)CCCCNCCCCCC(C)C 34a_100011290863_100000204269 [1,1,0,0,0,0|1,0,0]=3 8803 B16R0.165 COC(=O)CCCCNCCCOCC(C)C 2230a_100000205972_100000204269 [1,1,0,0,0,0|2,0,0]=4 8804 B16R0.165 COC(=O)CCCCNCCCOCC(C)C 34a_100000205972_100000204269 [1,1,0,0,0,0|2,0,0]=4 8805 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 34a_100000059025_100000210682 [1,1,0,0,0,0|1,0,0]=3 8806 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 34a_100011995859_100000204269 [1,1,0,0,0,0|1,0,0]=3 8807 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 7a_100000059025_100000210682 [1,1,0,0,0,0|1,0,0]=3 8808 B16R0.165 COC(=O)CCCCOCCCCCC(C)C 7a_100011995859_100000204269 [1,1,0,0,0,0|1,0,0]=3 8809 B16R0.165 COC(=O)CCCCOCCCCNC(C)C 34a_100011521146_100000204269 [1,1,0,0,0,0|2,0,0]=4 8810 B16R0.165 COC(=O)CCCCSCCCCCC(C)C 62a_100000204269_100000210682 [1,1,0,0,0,0|1,0,0]=3 8811 B16R0.165 COC(=O)CCCCSCCCCCC(C)C 62a_100000210682_100000204269 [1,1,0,0,0,0|1,0,0]=3 8812 B16R0.165 COC(=O)CCCNCCCCCCC(C)C 2230a_100000211014_100011218270 [1,1,0,0,0,0|1,0,0]=3 8813 B16R0.165 COC(=O)CCCNCCCCCCC(C)C 34a_100000211014_100000742333 [1,1,0,0,0,0|1,0,0]=3 8814 B16R0.165 COC(=O)CCCOCCCCCNC(C)C 34a_100011629493_100000742333 [1,1,0,0,0,0|2,0,0]=4 8815 B16R0.165 COC(=O)CCOCCCCCCCC(C)C 34a_200000210741_100000742370 [1,1,0,0,0,0|1,0,0]=3 8816 B16R0.165 COC(=O)CCOCCCCCCCC(C)C 7a_200000210741_100000204255 [1,1,0,0,0,0|1,0,0]=3 8817 B16R0.165 COC(=O)COCCNCCCCCC(C)C 2230a_100011290863_100000090808 [1,1,0,0,0,0|2,0,0]=4 8818 B16R0.165 COC(=O)COCCNCCCCCC(C)C 34a_100011290863_100000090808 [1,1,0,0,0,0|2,0,0]=4 8819 B16R0.165 COC(=O)COCCOCCCCCC(C)C 34a_100011995859_100000090808 [1,1,0,0,0,0|2,0,0]=4 8820 B16R0.165 COC(=O)COCCOCCCCCC(C)C 7a_100011995859_100000090808 [1,1,0,0,0,0|2,0,0]=4 8821 B16R0.165 COC(=O)COCCSCCCCCC(C)C 62a_100000090808_100000210682 [1,1,0,0,0,0|2,0,0]=4 8822 B16R0.165 COC(=O)COCCSCCCCCC(C)C 62a_100000210682_100000090808 [1,1,0,0,0,0|2,0,0]=4 8823 B16R0.184 CCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210757 [1,1,0,0,0,0|0,0,1]=3 8824 B16R0.184 CCCCCCC(=O)CCCCCC(=O)OC 1458a_100102632555_100009816466 [1,1,0,0,0,0|0,0,1]=3 8825 B16R0.184 CCCCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100102632555 [1,1,0,0,0,0|1,0,1]=4 8826 B16R0.184 CCCCCCC(C)CCOCCC(=O)NC 34a_200011024964_100012179268 [1,1,0,0,0,0|2,0,0]=4 8827 B16R0.184 CCCCCCC(C)CCOCCC(=O)NC 7a_200011024964_100000737683 [1,1,0,0,0,0|2,0,0]=4 8828 B16R0.184 CCCCCCC(C)CCOCCC(=O)OC 34a_200011024964_100000742370 [1,1,0,0,0,0|1,0,0]=3 8829 B16R0.184 CCCCCCC(C)CCOCCC(=O)OC 7a_200011024964_100000204255 [1,1,0,0,0,0|1,0,0]=3 8830 B16R0.184 CCCCCCC(C)NCCCCC(=O)OC 2230a_100000210919_100000204269 [1,1,0,0,0,0|1,0,0]=3 8831 B16R0.184 CCCCCCC(C)NCCCCC(=O)OC 34a_100000210919_100000204269 [1,1,0,0,0,0|1,0,0]=3 8832 B16R0.184 CCCCCCC(C)NCCOCC(=O)OC 2230a_100000210919_100000090808 [1,1,0,0,0,0|2,0,0]=4 8833 B16R0.184 CCCCCCC(C)NCCOCC(=O)OC 34a_100000210919_100000090808 [1,1,0,0,0,0|2,0,0]=4 8834 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 34a_100000059025_100011215978 [1,1,0,0,0,0|1,0,0]=3 8835 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 34a_100000210265_100000204269 [1,1,0,0,0,0|1,0,0]=3 8836 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 7a_100000059025_100011215978 [1,1,0,0,0,0|1,0,0]=3 8837 B16R0.184 CCCCCCC(C)OCCCCC(=O)OC 7a_100000210265_100000204269 [1,1,0,0,0,0|1,0,0]=3 8838 B16R0.184 CCCCCCC(C)OCCOCC(=O)OC 34a_100000210265_100000090808 [1,1,0,0,0,0|2,0,0]=4 8839 B16R0.184 CCCCCCC(C)OCCOCC(=O)OC 7a_100000210265_100000090808 [1,1,0,0,0,0|2,0,0]=4 8840 B16R0.184 CCCCCCC(C)SCCCCC(=O)OC 62a_100000204269_100011215978 [1,1,0,0,0,0|1,0,0]=3 8841 B16R0.184 CCCCCCC(C)SCCCCC(=O)OC 62a_100011215978_100000204269 [1,1,0,0,0,0|1,0,0]=3 8842 B16R0.184 CCCCCCC(C)SCCOCC(=O)OC 62a_100000090808_100011215978 [1,1,0,0,0,0|2,0,0]=4 8843 B16R0.184 CCCCCCC(C)SCCOCC(=O)OC 62a_100011215978_100000090808 [1,1,0,0,0,0|2,0,0]=4 8844 B16R0.184 CCCCCCN(C)CCCCCC(=O)OC 2230a_106256046315_100009816466 [1,1,0,0,0,0|1,0,0]=3 8845 B16R0.184 CCCCCCN(C)CCCCCC(=O)OC 269982a_106256046315_100009816466 [1,1,0,0,0,0|1,0,0]=3 8846 B16R0.184 CCCCCNC(=O)CCCCCC(=O)OC 11a_100000209983_100009848860 [1,1,0,0,0,0|1,0,1]=4 8847 B16R0.184 CCCCCNC(=O)CCCCCC(=O)OC 1626a_100000209983_100009848860 [1,1,0,0,0,0|1,0,1]=4 8848 B16R0.184 CCCCCNC(=O)CCCCCC(=O)OC 240690a_100000209983_100009848860 [1,1,0,0,0,0|1,0,1]=4 8849 B16R0.184 CCCCOCC(=O)CCCCCC(=O)OC 1458a_100000757543_100009816466 [1,1,0,0,0,0|1,0,1]=4 8850 B16R0.184 CCCCOCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011995733 [1,1,0,0,0,0|1,0,1]=4 8851 B16R0.184 CCCCOCC(C)OCCCCC(=O)OC 34a_100011217071_100000204269 [1,1,0,0,0,0|2,0,0]=4 8852 B16R0.184 CCCCOCC(C)OCCCCC(=O)OC 7a_100011217071_100000204269 [1,1,0,0,0,0|2,0,0]=4 8853 B16R0.184 CCCCSCC(=O)CCCCCC(=O)OC 1458a_100000191162_100009816466 [1,1,0,0,0,0|1,0,1]=4 8854 B16R0.184 CCCOCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011215938 [1,1,0,0,0,0|1,0,1]=4 8855 B16R0.184 CCOCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100012232248 [1,1,0,0,0,0|1,0,1]=4 8856 B16R0.184 COC(=O)CCCCCC(=O)CCCCCF 1458a_100009848860_100000729378 [1,1,0,0,0,0|1,0,1]=4 8857 B16R0.184 COC(=O)CCCCCC(=O)CCCCCO 1458a_100009848860_100000746330 [1,1,0,0,0,0|1,0,1]=4 8858 B16R0.184 COC(=O)CCCCCC(=O)CCCCCO 1458a_100102619762_100009816466 [1,1,0,0,0,0|1,0,1]=4 8859 B16R0.184 COC(=O)CCCCCN(C)CCCCCO 2230a_100000722520_100009816466 [1,1,0,0,0,0|2,0,0]=4 8860 B16R0.184 COC(=O)CCCCCN(C)CCCCCO 269982a_100000722520_100009816466 [1,1,0,0,0,0|2,0,0]=4 8861 B16R0.184 COCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000755781 [1,1,0,0,0,0|1,0,1]=4 8862 B16R0.224 C=C(C)C(=O)CCCCCCCCCCCC 1458a_100000185857_100000759014 [1,1,0,0,0,0|1,0,0]=3 8863 B16R0.224 C=C(C)C(=O)CCCCCCCCCCCO 1458a_100000185857_100009812471 [1,1,0,0,0,0|2,0,0]=4 8864 B16R0.224 C=C(C)C(=O)NCCCCCCCCCCC 11a_200011215754_100000185857 [1,1,0,0,0,0|2,0,0]=4 8865 B16R0.224 C=C(C)C(=O)NCCCCCCCCCCC 1626a_200011215754_100000185857 [1,1,0,0,0,0|2,0,0]=4 8866 B16R0.224 CC(C)C(=O)CCCCCCCCCCCO 1458a_100000210198_100009812471 [1,1,0,0,0,0|2,0,0]=4 8867 B16R0.224 CC(F)C(=O)CCCCCCCCCCCO 1458a_100000062450_100009812471 [1,1,0,0,0,0|2,0,0]=4 8868 B16R0.224 CCCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100000759014 [1,1,0,0,0,0|1,0,0]=3 8869 B16R0.224 CCCCCCCCCCCCC(=O)C(C)C 1458a_100011215791_100000210206 [1,1,0,0,0,0|1,0,0]=3 8870 B16R0.224 CCCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100000759014 [1,1,0,0,0,0|1,0,0]=3 8871 B16R0.224 CCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000759014 [1,1,0,0,0,0|2,0,0]=4 8872 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100011215791 [1,1,0,0,0,0|1,0,0]=3 8873 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100011215791 [1,1,0,0,0,0|1,0,0]=3 8874 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100011215791 [1,1,0,0,0,0|1,0,0]=3 8875 B16R0.224 CCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000759014 [1,1,0,0,0,0|1,0,0]=3 8876 B16R0.224 CCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000759014 [1,1,0,0,0,0|1,0,0]=3 8877 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 11a_200011215754_100000210198 [1,1,0,0,0,0|2,0,0]=4 8878 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 1626a_200011215754_100000210198 [1,1,0,0,0,0|2,0,0]=4 8879 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 240690a_200011215754_100000210198 [1,1,0,0,0,0|2,0,0]=4 8880 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 527a_200011215754_100000210198 [1,1,0,0,0,0|2,0,0]=4 8881 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 11a_200011215754_100000062450 [1,1,0,0,0,0|2,0,0]=4 8882 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 1626a_200011215754_100000062450 [1,1,0,0,0,0|2,0,0]=4 8883 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 240690a_200011215754_100000062450 [1,1,0,0,0,0|2,0,0]=4 8884 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 527a_200011215754_100000062450 [1,1,0,0,0,0|2,0,0]=4 8885 B16R0.224 CCCCCCCCCCCNC(=O)N(C)C 2708a_200011215754_100102631434 [1,1,0,0,0,0|2,0,0]=4 8886 B16R0.224 CCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_200011215754_100000717761 [1,1,0,0,0,0|2,0,0]=4 8887 B16R0.224 CCCCCCCCCCCNC(=O)[C@H](C)O 1626a_200011215754_217856618621 [1,1,0,0,0,0|2,0,0]=4 8888 B16R0.224 CCCCCCCCCCCNC(=O)[C@H](C)O 240690a_200011215754_217856618621 [1,1,0,0,0,0|2,0,0]=4 8889 B16R0.224 CCCCCCCCCCNCC(=O)C(=O)C 34a_100000684558_100011261029 [1,1,0,0,0,0|2,0,0]=4 8890 B16R0.224 CCCCCCCCCCNCC(=O)C(C)C 2230a_100000684558_100000753385 [1,1,0,0,0,0|2,0,0]=4 8891 B16R0.224 CCCCCCCCCCNCC(=O)C(C)C 34a_100000684558_100000753385 [1,1,0,0,0,0|2,0,0]=4 8892 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 2230a_100000684558_100000185267 [1,1,0,0,0,0|2,0,0]=4 8893 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100000210320 [1,1,0,0,0,0|2,0,0]=4 8894 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 34a_100000684558_100000692301 [1,1,0,0,0,0|2,0,0]=4 8895 B16R0.224 CCCCCCCCCCOCC(=O)C(=O)C 34a_100000210711_100011261029 [1,1,0,0,0,0|2,0,0]=4 8896 B16R0.224 CCCCCCCCCCOCC(=O)C(C)C 34a_100000210711_100000753385 [1,1,0,0,0,0|2,0,0]=4 8897 B16R0.224 CCCCCCCCCCOCC(=O)C(C)C 7a_100000210711_100000753385 [1,1,0,0,0,0|2,0,0]=4 8898 B16R0.224 CCCCCCCCCCOCC(=O)N(C)C 34a_100000210711_100000692301 [1,1,0,0,0,0|2,0,0]=4 8899 B16R0.224 CCCCCCCCCCOCC(=O)N(C)C 7a_100000210711_100000692301 [1,1,0,0,0,0|2,0,0]=4 8900 B16R0.224 CCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210320 [1,1,0,0,0,0|2,0,0]=4 8901 B16R0.224 CCCCCCCCCCSCC(=O)C(C)C 62a_100000753385_100000210320 [1,1,0,0,0,0|2,0,0]=4 8902 B16R0.224 CCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100000210320 [1,1,0,0,0,0|2,0,0]=4 8903 B16R0.224 CCCCCCCCCNCCC(=O)N(C)C 2230a_100000212291_100000737620 [1,1,0,0,0,0|2,0,0]=4 8904 B16R0.224 CCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100011214924 [1,1,0,0,0,0|2,0,0]=4 8905 B16R0.224 CCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100011214924 [1,1,0,0,0,0|2,0,0]=4 8906 B16R0.224 CCCCCCCCCOCCC(=O)N(C)C 7a_100000210712_100000737620 [1,1,0,0,0,0|2,0,0]=4 8907 B16R0.224 CCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210670 [1,1,0,0,0,0|2,0,0]=4 8908 B16R0.224 CCCCCCCCNCCCC(=O)N(C)C 2230a_100000229939_100000737642 [1,1,0,0,0,0|2,0,0]=4 8909 B16R0.224 CCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210759 [1,1,0,0,0,0|2,0,0]=4 8910 B16R0.224 CCCCCCCCOCCCC(=O)N(C)C 7a_100000210232_100000737642 [1,1,0,0,0,0|2,0,0]=4 8911 B16R0.224 CCCCCCCCSCCCC(=O)N(C)C 62a_100000210759_100000737642 [1,1,0,0,0,0|2,0,0]=4 8912 B16R0.224 CCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210317 [1,1,0,0,0,0|2,0,0]=4 8913 B16R0.224 CCCCCCCOCCCCC(=O)N(C)C 34a_100000210272_100000752486 [1,1,0,0,0,0|2,0,0]=4 8914 B16R0.224 CCCCCCCOCCCCC(=O)N(C)C 7a_100000210272_100000752486 [1,1,0,0,0,0|2,0,0]=4 8915 B16R0.224 CCCCCCCSCCCCC(=O)N(C)C 62a_100000210614_100000752486 [1,1,0,0,0,0|2,0,0]=4 8916 B16R0.224 CCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210316 [1,1,0,0,0,0|2,0,0]=4 8917 B16R0.224 CN(C)C(=O)CCCCCCCCCCCO 240690a_100102631434_100000037981 [1,1,0,0,0,0|2,0,0]=4 8918 B16R0.224 C[C@@H](O)C(=O)CCCCCCCCCCCO 1458a_100000717761_100009812471 [1,1,0,0,0,0|2,0,0]=4 8919 B16R0.224 C[C@H](O)C(=O)CCCCCCCCCCCO 1458a_217856618621_100009812471 [1,1,0,0,0,0|2,0,0]=4 8920 B16R0.806 CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210303 [1,1,0,0,0,0|0,0,1]=3 8921 B16R0.806 CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000211992_100010282707 [1,1,0,0,0,0|0,0,1]=3 8922 B16R0.806 CCCC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000747444 [1,1,0,0,0,0|1,0,1]=4 8923 B16R0.806 CCCC(=O)CSCCCCCCC(=O)OC 62a_100000747444_100009815986 [1,1,0,0,0,0|1,0,1]=4 8924 B16R0.806 CCCC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000747444 [1,1,0,0,0,0|1,0,1]=4 8925 B16R0.806 CCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000211992 [1,1,0,0,0,0|1,0,1]=4 8926 B16R0.806 CCCC(C)CCCOCCCCC(=O)OC 34a_100011713154_100000204269 [1,1,0,0,0,0|1,0,0]=3 8927 B16R0.806 CCCC(C)CCCOCCCCC(=O)OC 7a_100011713154_100000204269 [1,1,0,0,0,0|1,0,0]=3 8928 B16R0.806 CCCC(C)CCCOCCOCC(=O)OC 34a_100011713154_100000090808 [1,1,0,0,0,0|2,0,0]=4 8929 B16R0.806 CCCC(C)CCCOCCOCC(=O)OC 7a_100011713154_100000090808 [1,1,0,0,0,0|2,0,0]=4 8930 B16R0.806 CCCC(C)CCOCCCCCC(=O)OC 34a_100011217855_100009816466 [1,1,0,0,0,0|1,0,0]=3 8931 B16R0.806 CCCC(C)CCOCCCCCC(=O)OC 7a_100011217855_100009816466 [1,1,0,0,0,0|1,0,0]=3 8932 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 34a_100000688023_100009815986 [1,1,0,0,0,0|1,0,0]=3 8933 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 34a_100009863599_100011216630 [1,1,0,0,0,0|1,0,0]=3 8934 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 7a_100000688023_100009815986 [1,1,0,0,0,0|1,0,0]=3 8935 B16R0.806 CCCC(C)COCCCCCCC(=O)OC 7a_100009863599_100011216630 [1,1,0,0,0,0|1,0,0]=3 8936 B16R0.806 CCCC(C)CSCCCCCCC(=O)OC 62a_100009815986_100011216630 [1,1,0,0,0,0|1,0,0]=3 8937 B16R0.806 CCCC(C)CSCCCCCCC(=O)OC 62a_100011216630_100009815986 [1,1,0,0,0,0|1,0,0]=3 8938 B16R0.806 CCCC(C)NCCCCCCCC(=O)OC 2230a_100000741246_100010004213 [1,1,0,0,0,0|1,0,0]=3 8939 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 34a_100000764384_100010004213 [1,1,0,0,0,0|1,0,0]=3 8940 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 34a_100011022521_100000766640 [1,1,0,0,0,0|1,0,0]=3 8941 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 7a_100000764384_100010004213 [1,1,0,0,0,0|1,0,0]=3 8942 B16R0.806 CCCC(C)OCCCCCCCC(=O)OC 7a_100011022521_100000766640 [1,1,0,0,0,0|1,0,0]=3 8943 B16R0.806 CCCC(C)SCCCCCCCC(=O)OC 62a_100000766640_100010004213 [1,1,0,0,0,0|1,0,0]=3 8944 B16R0.806 CCCC(C)SCCCCCCCC(=O)OC 62a_100010004213_100000766640 [1,1,0,0,0,0|1,0,0]=3 8945 B16R0.806 CCCN(C)CCCCCCCCC(=O)OC 2230a_100000747261_100010282707 [1,1,0,0,0,0|1,0,0]=3 8946 B16R0.806 CCCN(C)CCCCCCCCC(=O)OC 269982a_100000747261_100010282707 [1,1,0,0,0,0|1,0,0]=3 8947 B16R0.806 CCC[C@H](N)CCOCCCCCC(=O)OC 34a_100015193777_100009816466 [1,1,0,0,0,0|1,0,0]=3 8948 B16R0.806 CCC[C@H](N)COCCCCCCC(=O)OC 34a_100000732646_100009815986 [1,1,0,0,0,0|1,0,0]=3 8949 B16R0.806 CCNC(=O)CCCCCCCCC(=O)OC 11a_100015525214_100000036616 [1,1,0,0,0,0|1,0,1]=4 8950 B16R0.806 CCNC(=O)CCCCCCCCC(=O)OC 240690a_100015525214_100000036616 [1,1,0,0,0,0|1,0,1]=4 8951 B16R0.806 COC(=O)CCCCCCCCC(=O)CCF 1458a_100000036616_100011217306 [1,1,0,0,0,0|1,0,1]=4 8952 B16R0.806 COC(=O)CCCCCCCCC(=O)CCO 1458a_100000036616_100000211926 [1,1,0,0,0,0|1,0,1]=4 8953 B16R0.806 COC(=O)CCCCCCCCC(=O)CCO 1458a_100011216618_100010282707 [1,1,0,0,0,0|1,0,1]=4 8954 B16R0.806 COC(=O)CCCCCCCCC(=O)CSC 1458a_100000184570_100010282707 [1,1,0,0,0,0|1,0,1]=4 8955 B16R0.806 COC(=O)CCCCCCCCN(C)CCO 2230a_100000210263_100010282707 [1,1,0,0,0,0|2,0,0]=4 8956 B16R0.806 COC(=O)CCCCCCCCN(C)CCO 269982a_100000210263_100010282707 [1,1,0,0,0,0|2,0,0]=4 8957 B16R0.806 COC(=O)CCCCCCCN[C@H](C)CCO 2230a_100000706166_100010004213 [1,1,0,0,0,0|2,0,0]=4 8958 B16R0.806 COC(=O)CCCCCCCN[C@H](C)CCO 34a_100000706166_100010004213 [1,1,0,0,0,0|2,0,0]=4 8959 B16R0.806 COC(=O)CCCCCCCOC(C)CCBr 34a_100012276601_100010004213 [1,1,0,0,0,0|2,0,0]=4 8960 B16R0.806 COC(=O)CCCCCCCOC(C)CCO 34a_100011022521_100009893172 [1,1,0,0,0,0|2,0,0]=4 8961 B16R0.806 COC(=O)CCCCCCCOC(C)CCO 7a_100011022521_100009893172 [1,1,0,0,0,0|2,0,0]=4 8962 B16R0.806 COC(=O)CCCCCCCSC(C)CCO 62a_100009893172_100010004213 [1,1,0,0,0,0|2,0,0]=4 8963 B16R0.806 COC(=O)CCCCCCCSC(C)CCO 62a_100010004213_100009893172 [1,1,0,0,0,0|2,0,0]=4 8964 B16R0.806 COC(=O)CCCCCCOCC(C)CCN 34a_106354213184_100009815986 [1,1,0,0,0,0|2,0,0]=4 8965 B16R0.806 COCC(=O)CCCCCCCCC(=O)OC 1458a_100000210968_100010282707 [1,1,0,0,0,0|1,0,1]=4 8966 B16R0.806 COCC(C)OCCCCCCCC(=O)OC 34a_100011022521_100000765312 [1,1,0,0,0,0|2,0,0]=4 8967 B16R0.806 COCC(C)OCCCCCCCC(=O)OC 7a_100011022521_100000765312 [1,1,0,0,0,0|2,0,0]=4 8968 B16R0.806 COCC(C)SCCCCCCCC(=O)OC 62a_100000765312_100010004213 [1,1,0,0,0,0|2,0,0]=4 8969 B16R0.806 COCC(C)SCCCCCCCC(=O)OC 62a_100010004213_100000765312 [1,1,0,0,0,0|2,0,0]=4 8970 B16R0.806 COCC(N)COCCCCCCC(=O)OC 34a_100000724102_100009815986 [1,1,0,0,0,0|2,0,0]=4 8971 B16R0.806 COCC(O)CNCCCCCCC(=O)OC 2230a_100000756049_100009815986 [1,1,0,0,0,0|2,0,0]=4 8972 B16R0.806 COCC(O)CNCCCCCCC(=O)OC 34a_100000756049_100009815986 [1,1,0,0,0,0|2,0,0]=4 8973 B16R0.806 COCC(O)COCCCCCCC(=O)OC 34a_100009863599_100011215053 [1,1,0,0,0,0|2,0,0]=4 8974 B16R0.806 COCC(O)COCCCCCCC(=O)OC 7a_100009863599_100011215053 [1,1,0,0,0,0|2,0,0]=4 8975 B16R0.806 COCC(O)CSCCCCCCC(=O)OC 62a_100009815986_100011215053 [1,1,0,0,0,0|2,0,0]=4 8976 B16R0.806 COCC(O)CSCCCCCCC(=O)OC 62a_100011215053_100009815986 [1,1,0,0,0,0|2,0,0]=4 8977 B16R0.806 COC[C@@H](C)NCCCCCCCC(=O)OC 2230a_100000764878_100010004213 [1,1,0,0,0,0|2,0,0]=4 8978 B16R0.806 COC[C@@H](C)OCCCCCCCC(=O)OC 34a_100011934205_100010004213 [1,1,0,0,0,0|2,0,0]=4 8979 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)CC 1458a_100000210375_100000747405 [1,1,0,0,0,0|1,0,1]=4 8980 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)NC 1458a_100000210375_100000183359 [1,1,0,0,0,0|1,0,1]=4 8981 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000210375_100000747449 [1,1,0,0,0,0|0,0,1]=3 8982 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210319 [1,1,0,0,0,0|0,0,1]=3 8983 B16R0.1182 CCCCCCCCCCN(C)CC(=O)CC 269982a_100000207566_100000747405 [1,1,0,0,0,0|2,0,0]=4 8984 B16R0.1182 CCCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100000210320 [1,1,0,0,0,0|2,0,0]=4 8985 B16R0.1182 CCCCCCCCCCN(C)CC(=O)NC 2230a_100000207566_100000183359 [1,1,0,0,0,0|2,0,0]=4 8986 B16R0.1182 CCCCCCCCCCN(C)CC(=O)NC 269982a_100000207566_100000183359 [1,1,0,0,0,0|2,0,0]=4 8987 B16R0.1182 CCCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210320 [1,1,0,0,0,0|1,0,0]=3 8988 B16R0.1182 CCCCCCCCCCN(C)CC(=O)OC 2230a_100000207566_100000747449 [1,1,0,0,0,0|1,0,0]=3 8989 B16R0.1182 CCCCCCCCCCN(C)CC(=O)OC 269982a_100000207566_100000747449 [1,1,0,0,0,0|1,0,0]=3 8990 B16R0.1182 CCCCCCCCCNC(=O)CC(=O)OC 240690a_100000212291_100000211351 [1,1,0,0,0,0|1,0,1]=4 8991 B16R0.1182 CCCCCCCCCNC(C)CC(=O)OC 2230a_100000212291_100009817358 [1,1,0,0,0,0|1,0,0]=3 8992 B16R0.1182 CCCCCCCCCNC(C)CC(=O)OC 34a_100000212291_100009817358 [1,1,0,0,0,0|1,0,0]=3 8993 B16R0.1182 CCCCCCCCCOC(C)CC(=O)OC 34a_100000210712_100009817358 [1,1,0,0,0,0|1,0,0]=3 8994 B16R0.1182 CCCCCCCCCOC(C)CC(=O)OC 7a_100000210712_100009817358 [1,1,0,0,0,0|1,0,0]=3 8995 B16R0.1182 CCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210670 [1,1,0,0,0,0|1,0,0]=3 8996 B16R0.1182 CCCCCCCCNC[C@H](O)CC(=O)OC 34a_100000229939_100000754131 [1,1,0,0,0,0|1,0,0]=3 8997 B16R0.1182 CCCCCCCCOCC(=O)CC(=O)OC 1458a_100000759886_100000747449 [1,1,0,0,0,0|1,0,1]=4 8998 B16R0.1182 CCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000210232_100000754131 [1,1,0,0,0,0|1,0,0]=3 8999 B16R0.1182 CCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000210232_100000754131 [1,1,0,0,0,0|1,0,0]=3 9000 B16R0.1182 CCCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210317 [1,1,0,0,0,0|1,0,1]=4 9001 B16R0.1182 CCCCCCCCSCC(=O)CC(=O)OC 62a_100000210759_100000210525 [1,1,0,0,0,0|1,0,1]=4 9002 B16R0.1182 CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000210759_100000754131 [1,1,0,0,0,0|1,0,0]=3 9003 B16R0.1182 CCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210317 [1,1,0,0,0,0|1,0,0]=3 9004 B16R0.1182 CCCCCCOCCOC(C)CC(=O)OC 34a_100000691444_100009817358 [1,1,0,0,0,0|2,0,0]=4 9005 B16R0.1182 CCCCCCOCCOC(C)CC(=O)OC 7a_100000691444_100009817358 [1,1,0,0,0,0|2,0,0]=4 9006 B16R0.1182 CCCCCNCCOC[C@H](O)CC(=O)OC 34a_100000224656_100000754131 [1,1,0,0,0,0|2,0,0]=4 9007 B16R0.1182 CCCCCOCCOC[C@H](O)CC(=O)OC 34a_100011215259_100000754131 [1,1,0,0,0,0|2,0,0]=4 9008 B16R0.1182 CCCCCOCCOC[C@H](O)CC(=O)OC 7a_100011215259_100000754131 [1,1,0,0,0,0|2,0,0]=4 9009 B16R0.1182 CCCCNCCCCOC(C)CC(=O)OC 34a_200011216965_100009817358 [1,1,0,0,0,0|2,0,0]=4 9010 B16R0.1182 CCCCOCCCCOC(C)CC(=O)OC 34a_200000760531_100009817358 [1,1,0,0,0,0|2,0,0]=4 9011 B16R0.1182 CCCCOCCCCOC(C)CC(=O)OC 7a_200000760531_100009817358 [1,1,0,0,0,0|2,0,0]=4 9012 B16R0.1182 CCCCOCCCNC[C@H](O)CC(=O)OC 34a_200000211371_100000754131 [1,1,0,0,0,0|2,0,0]=4 9013 B16R0.1182 CCCCOCCCOC[C@H](O)CC(=O)OC 34a_200011215613_100000754131 [1,1,0,0,0,0|2,0,0]=4 9014 B16R0.1182 CCCCOCCCOC[C@H](O)CC(=O)OC 7a_200011215613_100000754131 [1,1,0,0,0,0|2,0,0]=4 9015 B16R0.1182 COC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100000747449 [1,1,0,0,0,0|1,0,1]=4 9016 B16R0.1182 COC(=O)CC(=O)CCCCCCCCCO 1458a_100000211351_100009813782 [1,1,0,0,0,0|1,0,1]=4 9017 B16R0.1182 COC(=O)CC(C)NCCCCCCCCO 2230a_102515433106_100009817358 [1,1,0,0,0,0|2,0,0]=4 9018 B16R0.1182 COC(=O)CC(C)NCCCCCCCCO 34a_102515433106_100009817358 [1,1,0,0,0,0|2,0,0]=4 9019 B16R0.1182 COC(=O)CC(C)OCCCCCCCCBr 34a_100009813846_100009817358 [1,1,0,0,0,0|2,0,0]=4 9020 B16R0.1182 COC(=O)CC(C)OCCCCCCCCBr 7a_100009813846_100009817358 [1,1,0,0,0,0|2,0,0]=4 9021 B16R0.1182 COC(=O)CC(C)OCCCCCCCCCl 34a_100000033203_100009817358 [1,1,0,0,0,0|2,0,0]=4 9022 B16R0.1182 COC(=O)CC(C)OCCCCCCCCCl 7a_100000033203_100009817358 [1,1,0,0,0,0|2,0,0]=4 9023 B16R0.1182 COC(=O)CC(C)OCCCCCCCCN 34a_102515433106_100009817358 [1,1,0,0,0,0|2,0,0]=4 9024 B16R0.1182 COC(=O)CC(C)SCCCCCCCCO 62a_100000033203_100009817358 [1,1,0,0,0,0|2,0,0]=4 9025 B16R0.1182 COC(=O)CC(C)SCCCCCCCCO 62a_100009817358_100000033203 [1,1,0,0,0,0|2,0,0]=4 9026 B16R0.1182 COC(=O)CN(C)CCCCCCCCCO 2230a_100000198492_100009813782 [1,1,0,0,0,0|2,0,0]=4 9027 B16R0.1182 COC(=O)C[C@@H](O)CNCCCCCCCO 34a_100011996573_100000754131 [1,1,0,0,0,0|2,0,0]=4 9028 B16R0.1182 COC(=O)C[C@@H](O)COCCCCCCCBr 34a_100000760002_100000754131 [1,1,0,0,0,0|2,0,0]=4 9029 B16R0.1182 COC(=O)C[C@@H](O)COCCCCCCCBr 7a_100000760002_100000754131 [1,1,0,0,0,0|2,0,0]=4 9030 B16R0.1182 COC(=O)C[C@@H](O)COCCCCCCCN 34a_100011996573_100000754131 [1,1,0,0,0,0|2,0,0]=4 9031 B16R0.1182 COC(=O)C[C@@H](O)CSCCCCCCCO 62a_100000754131_100000760002 [1,1,0,0,0,0|2,0,0]=4 9032 B16R0.1182 COC(=O)C[C@@H](O)CSCCCCCCCO 62a_100000760002_100000754131 [1,1,0,0,0,0|2,0,0]=4 9033 B16R0.1182 COCCCCCCOC[C@H](O)CC(=O)OC 34a_200012092642_100000754131 [1,1,0,0,0,0|2,0,0]=4 9034 B16R0.1182 COCCCCCCOC[C@H](O)CC(=O)OC 7a_200012092642_100000754131 [1,1,0,0,0,0|2,0,0]=4 9035 B16R0.1182 COCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011998445 [1,1,0,0,0,0|2,0,0]=4 9036 B16R0.1182 COCCCCCCSC[C@H](O)CC(=O)OC 62a_100011998445_100000754131 [1,1,0,0,0,0|2,0,0]=4 9037 B16R0.1817 CCCCCCCCC(=O)CCCC(=O)NC 1458a_100000210188_100000741757 [1,1,0,0,0,0|1,0,1]=4 9038 B16R0.1817 CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000210188_100011218270 [1,1,0,0,0,0|0,0,1]=3 9039 B16R0.1817 CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210759 [1,1,0,0,0,0|0,0,1]=3 9040 B16R0.1817 CCCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210759 [1,1,0,0,0,0|1,0,1]=4 9041 B16R0.1817 CCCCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000210188 [1,1,0,0,0,0|1,0,1]=4 9042 B16R0.1817 CCCCCCCCC(C)CNCC(=O)NC 270004a_100000693194_100011995885 [1,1,0,0,0,0|2,0,0]=4 9043 B16R0.1817 CCCCCCCCC(C)COCC(=O)CC 7a_200012125181_100000747405 [1,1,0,0,0,0|2,0,0]=4 9044 B16R0.1817 CCCCCCCCC(C)COCC(=O)NC 34a_200012125181_100000183359 [1,1,0,0,0,0|2,0,0]=4 9045 B16R0.1817 CCCCCCCCC(C)COCC(=O)NC 7a_200012125181_100000183359 [1,1,0,0,0,0|2,0,0]=4 9046 B16R0.1817 CCCCCCCCC(C)COCC(=O)OC 34a_200012125181_100000747449 [1,1,0,0,0,0|1,0,0]=3 9047 B16R0.1817 CCCCCCCCC(C)COCC(=O)OC 7a_200012125181_100000747449 [1,1,0,0,0,0|1,0,0]=3 9048 B16R0.1817 CCCCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100011216694 [1,1,0,0,0,0|2,0,0]=4 9049 B16R0.1817 CCCCCCCCC(C)OCCC(=O)NC 34a_100000210740_100012179268 [1,1,0,0,0,0|2,0,0]=4 9050 B16R0.1817 CCCCCCCCC(C)OCCC(=O)NC 7a_100000210740_100000737683 [1,1,0,0,0,0|2,0,0]=4 9051 B16R0.1817 CCCCCCCCC(C)OCCC(=O)OC 34a_100000210740_100000742370 [1,1,0,0,0,0|1,0,0]=3 9052 B16R0.1817 CCCCCCCCC(C)OCCC(=O)OC 7a_100000210740_100000204255 [1,1,0,0,0,0|1,0,0]=3 9053 B16R0.1817 CCCCCCCCN(C)CCCC(=O)NC 2230a_100000207567_100000741757 [1,1,0,0,0,0|2,0,0]=4 9054 B16R0.1817 CCCCCCCCN(C)CCCC(=O)NC 269982a_100000207567_100000741757 [1,1,0,0,0,0|2,0,0]=4 9055 B16R0.1817 CCCCCCCCN(C)CCCC(=O)OC 2230a_100000207567_100011218270 [1,1,0,0,0,0|1,0,0]=3 9056 B16R0.1817 CCCCCCCCN(C)CCCC(=O)OC 269982a_100000207567_100011218270 [1,1,0,0,0,0|1,0,0]=3 9057 B16R0.1817 CCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210759 [1,1,0,0,0,0|1,0,0]=3 9058 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 11a_100000229938_100000239890 [1,1,0,0,0,0|1,0,1]=4 9059 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 1626a_100000229938_100000239890 [1,1,0,0,0,0|1,0,1]=4 9060 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 240690a_100000229938_100000239890 [1,1,0,0,0,0|1,0,1]=4 9061 B16R0.1817 CCCCCCCNC(=O)CCCC(=O)OC 527a_100000229938_100000239890 [1,1,0,0,0,0|1,0,1]=4 9062 B16R0.1817 COC(=O)CCCC(=O)CCCCCCCO 1458a_100000239890_100000760002 [1,1,0,0,0,0|1,0,1]=4 9063 B16R0.1817 COC(=O)CCCC(=O)CCCCCCCO 1458a_100011219782_100011218270 [1,1,0,0,0,0|1,0,1]=4 9064 B16R0.1817 COC(=O)CCCN(C)CCCCCCCO 269982a_100000739225_100000760002 [1,1,0,0,0,0|2,0,0]=4 9065 B16R0.1817 COCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100011998445 [1,1,0,0,0,0|1,0,1]=4 9066 B16R0.1817 COCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100011998445 [1,1,0,0,0,0|2,0,0]=4 9067 B16R0.3257 CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210326 [1,1,0,0,0,0|0,0,1]=3 9068 B16R0.3257 CCCCCC(=O)CCCCCCC(=O)OC 1458a_100000212188_100009815986 [1,1,0,0,0,0|0,0,1]=3 9069 B16R0.3257 CCCCCC(=O)COCCCCC(=O)OC 34a_100000059025_200012276598 [1,1,0,0,0,0|1,0,1]=4 9070 B16R0.3257 CCCCCC(=O)COCCCCC(=O)OC 7a_100000059025_200012276598 [1,1,0,0,0,0|1,0,1]=4 9071 B16R0.3257 CCCCCC(=O)CSCCCCC(=O)OC 62a_100000204269_200012276598 [1,1,0,0,0,0|1,0,1]=4 9072 B16R0.3257 CCCCCC(=O)CSCCCCC(=O)OC 62a_200012276598_100000204269 [1,1,0,0,0,0|1,0,1]=4 9073 B16R0.3257 CCCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000212188 [1,1,0,0,0,0|1,0,1]=4 9074 B16R0.3257 CCCCCC(C)NCCCCCC(=O)OC 2230a_100000211957_100009816466 [1,1,0,0,0,0|1,0,0]=3 9075 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 34a_100000074720_200011218191 [1,1,0,0,0,0|1,0,0]=3 9076 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 34a_100011215632_100009816466 [1,1,0,0,0,0|1,0,0]=3 9077 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 7a_100000074720_200011218191 [1,1,0,0,0,0|1,0,0]=3 9078 B16R0.3257 CCCCCC(C)OCCCCCC(=O)OC 7a_100011215632_100009816466 [1,1,0,0,0,0|1,0,0]=3 9079 B16R0.3257 CCCCCC(C)SCCCCCC(=O)OC 62a_100009816466_200011218191 [1,1,0,0,0,0|1,0,0]=3 9080 B16R0.3257 CCCCCC(C)SCCCCCC(=O)OC 62a_200011218191_100009816466 [1,1,0,0,0,0|1,0,0]=3 9081 B16R0.3257 CCCCCN(C)CCCCCCC(=O)OC 2230a_100000223495_100009815986 [1,1,0,0,0,0|1,0,0]=3 9082 B16R0.3257 CCCCCN(C)CCCCCCC(=O)OC 269982a_100000223495_100009815986 [1,1,0,0,0,0|1,0,0]=3 9083 B16R0.3257 CCCCNC(=O)CCCCCCC(=O)OC 11a_100000102301_100000036694 [1,1,0,0,0,0|1,0,1]=4 9084 B16R0.3257 CCCCNC(=O)CCCCCCC(=O)OC 1626a_100000102301_100000036694 [1,1,0,0,0,0|1,0,1]=4 9085 B16R0.3257 CCCCNC(=O)CCCCCCC(=O)OC 240690a_100000102301_100000036694 [1,1,0,0,0,0|1,0,1]=4 9086 B16R0.3257 CCCOCC(=O)CCCCCCC(=O)OC 1458a_100000745993_100009815986 [1,1,0,0,0,0|1,0,1]=4 9087 B16R0.3257 CCCSCC(=O)CCCCCCC(=O)OC 1458a_100000217233_100009815986 [1,1,0,0,0,0|1,0,1]=4 9088 B16R0.3257 CCOCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011215890 [1,1,0,0,0,0|1,0,1]=4 9089 B16R0.3257 CCOCCC(=O)CCCCCCC(=O)OC 1458a_100000749530_100009815986 [1,1,0,0,0,0|1,0,1]=4 9090 B16R0.3257 CCSCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000757381 [1,1,0,0,0,0|1,0,1]=4 9091 B16R0.3257 CCSCCC(=O)CCCCCCC(=O)OC 1458a_100000230768_100009815986 [1,1,0,0,0,0|1,0,1]=4 9092 B16R0.3257 COC(=O)CCCCCCC(=O)CCCCF 1458a_100000036694_100000729493 [1,1,0,0,0,0|1,0,1]=4 9093 B16R0.3257 COC(=O)CCCCCCC(=O)CCCCO 1458a_100000036694_100000210776 [1,1,0,0,0,0|1,0,1]=4 9094 B16R0.3257 COC(=O)CCCCCCC(=O)CCCCO 1458a_100000695505_100009815986 [1,1,0,0,0,0|1,0,1]=4 9095 B16R0.3257 COC(=O)CCCCCCC(=O)CCCSC 1458a_100000173376_100009815986 [1,1,0,0,0,0|1,0,1]=4 9096 B16R0.3257 COC(=O)CCCCCCN(C)CCCCO 2230a_100000717598_100009815986 [1,1,0,0,0,0|2,0,0]=4 9097 B16R0.3257 COC(=O)CCCCCCN(C)CCCCO 269982a_100000717598_100009815986 [1,1,0,0,0,0|2,0,0]=4 9098 B16R0.3257 COC(=O)CCCCOC[C@@H](N)CCCCN 34a_100016993712_100000204269 [1,1,0,0,0,0|2,0,0]=4 9099 B16R0.3257 COCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000740836 [1,1,0,0,0,0|1,0,1]=4 9100 B16R0.3257 COCCCC(=O)CCCCCCC(=O)OC 1458a_100000741012_100009815986 [1,1,0,0,0,0|1,0,1]=4 9101 B16R0.3257 COCCCC(C)OCCCCCC(=O)OC 34a_200011539412_100009816466 [1,1,0,0,0,0|2,0,0]=4 9102 B16R0.3257 COCCCC(C)OCCCCCC(=O)OC 7a_200011539412_100009816466 [1,1,0,0,0,0|2,0,0]=4 9103 B16R0.3257 COCCCN(C)CCCCCCC(=O)OC 2230a_100000224831_100009815986 [1,1,0,0,0,0|2,0,0]=4 9104 B16R0.3257 COCCCN(C)CCCCCCC(=O)OC 269982a_100000224831_100009815986 [1,1,0,0,0,0|2,0,0]=4 9105 B16R0.3292 CCCCCCCCCCCCS(=O)(=O)NC 270084a_100102657272_100011216125 [1,1,0,0,0,0|2,0,0]=4 9106 B16R0.3292 CCCCCCCCCCCCS(=O)(=O)NC 274078a_100102657272_100011216125 [1,1,0,0,0,0|2,0,0]=4 9107 B16R0.6606 CCCCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210670 [1,1,0,0,0,0|1,0,1]=4 9108 B16R0.6606 CCCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210670 [1,1,0,0,0,0|0,0,1]=3 9109 B16R0.6606 CCCCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210670 [1,1,0,0,0,0|1,0,1]=4 9110 B16R0.6606 CCCCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000210558 [1,1,0,0,0,0|1,0,1]=4 9111 B16R0.6606 CCCCCCCCCC(C)NCC(=O)NC 270004a_100000693194_100011215753 [1,1,0,0,0,0|2,0,0]=4 9112 B16R0.6606 CCCCCCCCCC(C)OCC(=O)CC 7a_100011218016_100000747405 [1,1,0,0,0,0|2,0,0]=4 9113 B16R0.6606 CCCCCCCCCC(C)OCC(=O)NC 34a_100011218016_100000183359 [1,1,0,0,0,0|2,0,0]=4 9114 B16R0.6606 CCCCCCCCCC(C)OCC(=O)NC 7a_100011218016_100000183359 [1,1,0,0,0,0|2,0,0]=4 9115 B16R0.6606 CCCCCCCCCC(C)OCC(=O)OC 34a_100011218016_100000747449 [1,1,0,0,0,0|1,0,0]=3 9116 B16R0.6606 CCCCCCCCCC(C)OCC(=O)OC 7a_100011218016_100000747449 [1,1,0,0,0,0|1,0,0]=3 9117 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 2230a_100000232482_100000737683 [1,1,0,0,0,0|2,0,0]=4 9118 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100011214924 [1,1,0,0,0,0|2,0,0]=4 9119 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 269982a_100000232482_100000737683 [1,1,0,0,0,0|2,0,0]=4 9120 B16R0.6606 CCCCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100000210670 [1,1,0,0,0,0|2,0,0]=4 9121 B16R0.6606 CCCCCCCCCN(C)CCC(=O)OC 2230a_100000232482_100000204255 [1,1,0,0,0,0|1,0,0]=3 9122 B16R0.6606 CCCCCCCCCN(C)CCC(=O)OC 269982a_100000232482_100000204255 [1,1,0,0,0,0|1,0,0]=3 9123 B16R0.6606 CCCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210670 [1,1,0,0,0,0|1,0,0]=3 9124 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 11a_100000229939_100000187943 [1,1,0,0,0,0|1,0,1]=4 9125 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 1626a_100000229939_100000187943 [1,1,0,0,0,0|1,0,1]=4 9126 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 240690a_100000229939_100000187943 [1,1,0,0,0,0|1,0,1]=4 9127 B16R0.6606 CCCCCCCCNC(=O)CCC(=O)OC 527a_100000229939_100000187943 [1,1,0,0,0,0|1,0,1]=4 9128 B16R0.6606 CCCCCCCNCC(=O)CCC(=O)OC 2230a_100000229938_100000691467 [1,1,0,0,0,0|1,0,1]=4 9129 B16R0.6606 CCCCCCCOCC(=O)CCC(=O)OC 34a_100000210272_100000691467 [1,1,0,0,0,0|1,0,1]=4 9130 B16R0.6606 CCCCCCCOCC(=O)CCC(=O)OC 7a_100000210272_100000691467 [1,1,0,0,0,0|1,0,1]=4 9131 B16R0.6606 CCCCCCCSCC(=O)CCC(=O)OC 62a_100000210614_100000691467 [1,1,0,0,0,0|1,0,1]=4 9132 B16R0.6606 CCCCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210316 [1,1,0,0,0,0|1,0,1]=4 9133 B16R0.6606 COC(=O)CCC(=O)CCCCCCCCO 1458a_100000187943_100000033203 [1,1,0,0,0,0|1,0,1]=4 9134 B16R0.6606 COC(=O)CCN(C)CCCCCCCCO 269982a_100025711912_100000033203 [1,1,0,0,0,0|2,0,0]=4 9135 B16R0.41 CCCC(C)CCCOCCCCCC(=O)N 34a_100011713154_100009817443 [1,1,0,0,0,0|2,0,0]=4 9136 B16R0.41 CCCC(C)CCCOCCCCCC(=O)N 7a_100011713154_100009817443 [1,1,0,0,0,0|2,0,0]=4 9137 B16R0.41 CCCC(C)CCCOCCCCOC(=O)C 34a_100011713154_100000033659 [1,1,0,0,0,0|2,0,0]=4 9138 B16R0.41 CCCC(C)CCCOCCCCOC(=O)C 7a_100011713154_100000033659 [1,1,0,0,0,0|2,0,0]=4 9139 B16R0.41 CCCC(C)CCCOCCCCSC(=O)C 34a_100011713154_200010402107 [1,1,0,0,0,0|2,0,0]=4 9140 B16R0.41 CCCC(C)CCCOCCCCSC(=O)C 7a_100011713154_200010402107 [1,1,0,0,0,0|2,0,0]=4 9141 B16R0.41 CCCC(C)CCOCCCCCOC(=O)C 34a_100011217855_100000033007 [1,1,0,0,0,0|2,0,0]=4 9142 B16R0.41 CCCC(C)CCOCCCCCOC(=O)C 7a_100011217855_100000033007 [1,1,0,0,0,0|2,0,0]=4 9143 B16R0.41 CCCC(C)CNCCCCCCNC(=O)C 2230a_200011996284_100011216630 [1,1,0,0,0,0|2,0,0]=4 9144 B16R0.41 CCCC(C)CNCCCCCCNC(=O)C 270004a_200011996284_100000243154 [1,1,0,0,0,0|2,0,0]=4 9145 B16R0.41 CCCC(C)CNCCCCCCNC(=O)C 34a_200011996284_100011216630 [1,1,0,0,0,0|2,0,0]=4 9146 B16R0.41 CCCC(C)CNCCCCCCSC(=O)C 270004a_100000704104_100000243154 [1,1,0,0,0,0|2,0,0]=4 9147 B16R0.41 CCC[C@H](N)CCOCCCCCOC(=O)C 34a_100015193777_100000033007 [1,1,0,0,0,0|2,0,0]=4 9148 B16R0.41 CCOC(=O)CCCCCCCCCC(=O)C 1458a_100000070787_100009828014 [1,1,0,0,0,0|1,0,1]=4 9149 B16R0.114 CCCCCCCC(=O)CCCCCC(=O)N 1458a_100000211969_100009817443 [1,1,0,0,0,0|1,0,1]=4 9150 B16R0.114 CCCCCCCC(=O)CCCCOC(=O)C 1458a_100000211969_100000033659 [1,1,0,0,0,0|1,0,1]=4 9151 B16R0.114 CCCCCCCC(=O)CCCCSC(=O)C 1458a_100000211969_200010402107 [1,1,0,0,0,0|1,0,1]=4 9152 B16R0.114 CCCCCCCC(C)NCCCCC(=O)N 270004a_100000696515_100000210596 [1,1,0,0,0,0|2,0,0]=4 9153 B16R0.114 CCCCCCCC(C)NCCCCC(=O)N 34a_100000696515_200011218727 [1,1,0,0,0,0|2,0,0]=4 9154 B16R0.114 CCCCCCCC(C)NCCCNC(=O)C 270004a_100000736810_100000210596 [1,1,0,0,0,0|2,0,0]=4 9155 B16R0.114 CCCCCCCC(C)NCCCNC(=O)C 34a_100000736810_200011218727 [1,1,0,0,0,0|2,0,0]=4 9156 B16R0.114 CCCCCCCC(C)NCCOCC(=O)O 269956a_100000700818_200011218727 [1,1,0,0,0,0|2,0,0]=4 9157 B16R0.114 CCCCCCCC(C)OCCCCC(=O)C 34a_200011215852_100009817362 [1,1,0,0,0,0|1,0,0]=3 9158 B16R0.114 CCCCCCCC(C)OCCCCC(=O)C 7a_200011215852_100000735457 [1,1,0,0,0,0|1,0,0]=3 9159 B16R0.114 CCCCCCCC(C)OCCCCC(=O)N 34a_100012022536_200011218727 [1,1,0,0,0,0|2,0,0]=4 9160 B16R0.114 CCCCCCCC(C)OCCCCC(=O)N 7a_100012022536_200011218727 [1,1,0,0,0,0|2,0,0]=4 9161 B16R0.114 CCCCCCCC(C)OCCCNC(=O)C 34a_100000752032_200011218727 [1,1,0,0,0,0|2,0,0]=4 9162 B16R0.114 CCCCCCCC(C)OCCCOC(=O)C 34a_200011215852_100000042594 [1,1,0,0,0,0|2,0,0]=4 9163 B16R0.114 CCCCCCCC(C)OCCCOC(=O)C 7a_200011215852_100000042594 [1,1,0,0,0,0|2,0,0]=4 9164 B16R0.114 CCCCCCCC(C)OCCCSC(=O)C 34a_200011215852_100000038929 [1,1,0,0,0,0|2,0,0]=4 9165 B16R0.114 CCCCCCCC(C)OCCCSC(=O)C 7a_200011215852_100000038929 [1,1,0,0,0,0|2,0,0]=4 9166 B16R0.114 CCCCCCCC(C)SCCCCC(=O)C 62a_100000735457_200011218727 [1,1,0,0,0,0|1,0,0]=3 9167 B16R0.114 CCCCCCCC(C)SCCCCC(=O)C 62a_200011218727_100000735457 [1,1,0,0,0,0|1,0,0]=3 9168 B16R0.114 CCCCCCCC(C)SCCCOC(=O)C 62a_100000042594_200011218727 [1,1,0,0,0,0|2,0,0]=4 9169 B16R0.114 CCCCCCCC(C)SCCCOC(=O)C 62a_200011218727_100000042594 [1,1,0,0,0,0|2,0,0]=4 9170 B16R0.114 CCCCCCCC(C)SCCCSC(=O)C 62a_100000038929_200011218727 [1,1,0,0,0,0|2,0,0]=4 9171 B16R0.114 CCCCCCCC(C)SCCCSC(=O)C 62a_200011218727_100000038929 [1,1,0,0,0,0|2,0,0]=4 9172 B16R0.114 CCCCCCCN(C)CCCCCC(=O)N 2230a_100000228206_100009817443 [1,1,0,0,0,0|2,0,0]=4 9173 B16R0.114 CCCCCCCN(C)CCCCCC(=O)N 269982a_100000228206_100009817443 [1,1,0,0,0,0|2,0,0]=4 9174 B16R0.114 CCCCCCCN(C)CCCCOC(=O)C 269982a_100000228206_100000033659 [1,1,0,0,0,0|2,0,0]=4 9175 B16R0.114 CCCCCCCN(C)CCCCSC(=O)C 2230a_100000228206_200010402107 [1,1,0,0,0,0|2,0,0]=4 9176 B16R0.114 CCCCCCCN(C)CCCCSC(=O)C 269982a_100000228206_200010402107 [1,1,0,0,0,0|2,0,0]=4 9177 B16R0.131 CCCCC(C)CCCCOCCCC(=O)C 34a_200011021034_100000685027 [1,1,0,0,0,0|1,0,0]=3 9178 B16R0.131 CCCCC(C)CCCCOCCCC(=O)C 7a_200011021034_100011215641 [1,1,0,0,0,0|1,0,0]=3 9179 B16R0.131 CCCCC(C)CCCCOCCCC(=O)N 34a_200011021034_100102525003 [1,1,0,0,0,0|2,0,0]=4 9180 B16R0.131 CCCCC(C)CCCCOCCCC(=O)N 7a_200011021034_100102525003 [1,1,0,0,0,0|2,0,0]=4 9181 B16R0.131 CCCCC(C)CCCCOCCNC(=O)C 7a_200011021034_100000189650 [1,1,0,0,0,0|2,0,0]=4 9182 B16R0.131 CCCCC(C)CCCCOCCOC(=O)C 34a_200011021034_100009814007 [1,1,0,0,0,0|2,0,0]=4 9183 B16R0.131 CCCCC(C)CCCCOCCOC(=O)C 7a_200011021034_100009814007 [1,1,0,0,0,0|2,0,0]=4 9184 B16R0.131 CCCCC(C)COCCCCCOC(=O)C 34a_100011995851_100000033007 [1,1,0,0,0,0|2,0,0]=4 9185 B16R0.131 CCCCC(C)COCCCCCOC(=O)C 7a_100011995851_100000033007 [1,1,0,0,0,0|2,0,0]=4 9186 B16R0.131 CCCCC(C)NCCCCCCNC(=O)C 2230a_200011996284_200011215066 [1,1,0,0,0,0|2,0,0]=4 9187 B16R0.131 CCCCC(C)NCCCCCCNC(=O)C 270004a_200011996284_100000210087 [1,1,0,0,0,0|2,0,0]=4 9188 B16R0.131 CCCCC(C)NCCCCCCNC(=O)C 34a_200011996284_200011215066 [1,1,0,0,0,0|2,0,0]=4 9189 B16R0.131 CCCCC(C)NCCCCCCSC(=O)C 270004a_100000704104_100000210087 [1,1,0,0,0,0|2,0,0]=4 9190 B16R0.131 CCCC[C@H](N)COCCCCCOC(=O)C 34a_100011934283_100000033007 [1,1,0,0,0,0|2,0,0]=4 9191 B16R0.177 CCCCCCC(=O)CCCCCNC(=O)C 1458a_100000183861_100000210757 [1,1,0,0,0,0|1,0,1]=4 9192 B16R0.177 CCCCCCC(=O)CCCCCOC(=O)C 1458a_100102632555_100000033007 [1,1,0,0,0,0|1,0,1]=4 9193 B16R0.177 CCCCCCC(C)CCOCCCC(=O)C 34a_200011024964_100000685027 [1,1,0,0,0,0|1,0,0]=3 9194 B16R0.177 CCCCCCC(C)CCOCCCC(=O)C 7a_200011024964_100011215641 [1,1,0,0,0,0|1,0,0]=3 9195 B16R0.177 CCCCCCC(C)CCOCCCC(=O)N 34a_200011024964_100102525003 [1,1,0,0,0,0|2,0,0]=4 9196 B16R0.177 CCCCCCC(C)CCOCCCC(=O)N 7a_200011024964_100102525003 [1,1,0,0,0,0|2,0,0]=4 9197 B16R0.177 CCCCCCC(C)CCOCCNC(=O)C 7a_200011024964_100000189650 [1,1,0,0,0,0|2,0,0]=4 9198 B16R0.177 CCCCCCC(C)CCOCCOC(=O)C 34a_200011024964_100009814007 [1,1,0,0,0,0|2,0,0]=4 9199 B16R0.177 CCCCCCC(C)CCOCCOC(=O)C 7a_200011024964_100009814007 [1,1,0,0,0,0|2,0,0]=4 9200 B16R0.177 CCCCCCC(C)NCCCCCC(=O)N 2230a_100000210919_100009817443 [1,1,0,0,0,0|2,0,0]=4 9201 B16R0.177 CCCCCCC(C)NCCCCCC(=O)N 34a_100000210919_100009817443 [1,1,0,0,0,0|2,0,0]=4 9202 B16R0.177 CCCCCCC(C)NCCCCNC(=O)C 2230a_200011368371_100011215978 [1,1,0,0,0,0|2,0,0]=4 9203 B16R0.177 CCCCCCC(C)NCCCCNC(=O)C 270004a_200011368371_100000210826 [1,1,0,0,0,0|2,0,0]=4 9204 B16R0.177 CCCCCCC(C)NCCCCNC(=O)C 34a_200011368371_100011215978 [1,1,0,0,0,0|2,0,0]=4 9205 B16R0.177 CCCCCCC(C)NCCCCOC(=O)C 34a_100000210919_100000033659 [1,1,0,0,0,0|2,0,0]=4 9206 B16R0.177 CCCCCCC(C)NCCCCSC(=O)C 2230a_100000210919_200010402107 [1,1,0,0,0,0|2,0,0]=4 9207 B16R0.177 CCCCCCC(C)NCCCCSC(=O)C 34a_100000210919_200010402107 [1,1,0,0,0,0|2,0,0]=4 9208 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 34a_100000123541_100011215978 [1,1,0,0,0,0|2,0,0]=4 9209 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 34a_100000210265_100009817443 [1,1,0,0,0,0|2,0,0]=4 9210 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 7a_100000123541_100011215978 [1,1,0,0,0,0|2,0,0]=4 9211 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 7a_100000210265_100009817443 [1,1,0,0,0,0|2,0,0]=4 9212 B16R0.177 CCCCCCC(C)OCCCCCC(=O)[O-] 7a_100102619762_100011215978 [1,1,0,0,0,0|1,0,1]=4 9213 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 34a_100000073216_100011215978 [1,1,0,0,0,0|2,0,0]=4 9214 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 34a_100000210265_100000033659 [1,1,0,0,0,0|2,0,0]=4 9215 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 7a_100000073216_100011215978 [1,1,0,0,0,0|2,0,0]=4 9216 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 7a_100000210265_100000033659 [1,1,0,0,0,0|2,0,0]=4 9217 B16R0.177 CCCCCCC(C)OCCCCSC(=O)C 34a_100000210265_200010402107 [1,1,0,0,0,0|2,0,0]=4 9218 B16R0.177 CCCCCCC(C)OCCCCSC(=O)C 7a_100000210265_200010402107 [1,1,0,0,0,0|2,0,0]=4 9219 B16R0.177 CCCCCCC(C)SCCCCCC(=O)N 62a_100009817443_100011215978 [1,1,0,0,0,0|2,0,0]=4 9220 B16R0.177 CCCCCCC(C)SCCCCCC(=O)N 62a_100011215978_100009817443 [1,1,0,0,0,0|2,0,0]=4 9221 B16R0.177 CCCCCCC(C)SCCCCOC(=O)C 62a_100000033659_100011215978 [1,1,0,0,0,0|2,0,0]=4 9222 B16R0.177 CCCCCCC(C)SCCCCOC(=O)C 62a_100011215978_100000033659 [1,1,0,0,0,0|2,0,0]=4 9223 B16R0.177 CCCCCCC(C)SCCCCSC(=O)C 62a_100011215978_200010402107 [1,1,0,0,0,0|2,0,0]=4 9224 B16R0.177 CCCCCCC(C)SCCCCSC(=O)C 62a_200010402107_100011215978 [1,1,0,0,0,0|2,0,0]=4 9225 B16R0.177 CCCCCCN(C)CCCCCOC(=O)C 2230a_106256046315_100009813381 [1,1,0,0,0,0|2,0,0]=4 9226 B16R0.177 CCCCCCN(C)CCCCCOC(=O)C 269982a_106256046315_100000033007 [1,1,0,0,0,0|2,0,0]=4 9227 B16R0.297 C=C(C)CCOC(C)CCCCCCCCC 34a_100011218016_100000730704 [1,1,0,0,0,0|2,0,0]=4 9228 B16R0.297 C=C(C)CCOC(C)CCCCCCCCC 7a_100011218016_100000730704 [1,1,0,0,0,0|2,0,0]=4 9229 B16R0.297 CCCCCCCCCC(=O)CCCC(=O)C 1458a_100000210558_100011215641 [1,1,0,0,0,0|0,0,1]=3 9230 B16R0.297 CCCCCCCCCC(=O)CCCC(=O)N 1458a_100000210558_100102525003 [1,1,0,0,0,0|1,0,1]=4 9231 B16R0.297 CCCCCCCCCC(=O)CCNC(=O)C 1458a_100000183196_100000210670 [1,1,0,0,0,0|1,0,1]=4 9232 B16R0.297 CCCCCCCCCC(=O)CCNC(=O)C 1458a_100000210558_100000189650 [1,1,0,0,0,0|1,0,1]=4 9233 B16R0.297 CCCCCCCCCC(=O)CCOC(=O)C 1458a_100000210558_100009814007 [1,1,0,0,0,0|1,0,1]=4 9234 B16R0.297 CCCCCCCCCC(=O)CCSC(=O)C 1458a_100000048949_100000210670 [1,1,0,0,0,0|1,0,1]=4 9235 B16R0.297 CCCCCCCCCC(C)OCCC(=O)C 7a_100011218016_100000053229 [1,1,0,0,0,0|1,0,0]=3 9236 B16R0.297 CCCCCCCCCC(C)OCCC(=O)N 34a_100011218016_100000731001 [1,1,0,0,0,0|2,0,0]=4 9237 B16R0.297 CCCCCCCCCC(C)OCCC(=O)N 7a_100011218016_100000744528 [1,1,0,0,0,0|2,0,0]=4 9238 B16R0.297 CCCCCCCCCC(C)OCOC(=O)C 34a_100011218016_100009813279 [1,1,0,0,0,0|2,0,0]=4 9239 B16R0.297 CCCCCCCCCN(C)CCCC(=O)C 269982a_100000232482_100011215641 [1,1,0,0,0,0|1,0,0]=3 9240 B16R0.297 CCCCCCCCCN(C)CCCC(=O)N 269982a_100000232482_100102525003 [1,1,0,0,0,0|2,0,0]=4 9241 B16R0.297 CCCCCCCCCN(C)CCCC(=O)O 269956a_100000719178_100000210670 [1,1,0,0,0,0|1,0,0]=3 9242 B16R0.297 CCCCCCCCCN(C)CCNC(=O)C 2230a_100000232482_100000189650 [1,1,0,0,0,0|2,0,0]=4 9243 B16R0.297 CCCCCCCCCN(C)CCNC(=O)C 269982a_100000232482_100000189650 [1,1,0,0,0,0|2,0,0]=4 9244 B16R0.297 CCCCCCCCCN(C)CCOC(=O)C 269982a_100000232482_100009814007 [1,1,0,0,0,0|2,0,0]=4 9245 B16R0.297 CCCCCCCCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210759 [1,1,0,0,0,0|1,0,1]=4 9246 B16R0.297 CN(CCCCCCCCO)CCCC(=O)O 269956a_100000719178_100000033203 [1,1,0,0,0,0|2,0,0]=4 9247 B16R0.302 C=C(C)CC(=O)CCCCCCCCCCC 1458a_100000210736_100000748629 [1,1,0,0,0,0|1,0,1]=4 9248 B16R0.302 C=C(C)CN(C)CCCCCCCCCCC 2230a_100000225649_100011215454 [1,1,0,0,0,0|2,0,0]=4 9249 B16R0.302 C=C(C)CN(C)CCCCCCCCCCC 269982a_100000225649_100011215454 [1,1,0,0,0,0|2,0,0]=4 9250 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100000210736_100000187820 [1,1,0,0,0,0|1,0,1]=4 9251 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100011215454 [1,1,0,0,0,0|1,0,1]=4 9252 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000210736_100020667443 [1,1,0,0,0,0|0,0,2]=4 9253 B16R0.302 CCCCCCCCCCCN(C)CC(=O)N 2230a_100000739694_100011215454 [1,1,0,0,0,0|2,0,0]=4 9254 B16R0.302 CCCCCCCCCCCN(C)CC(=O)O 269956a_100000746989_100011215454 [1,1,0,0,0,0|1,0,0]=3 9255 B16R0.302 CCCCCCCCCCOC(=O)CC(=O)C 1458a_100000070787_100000210668 [1,1,0,0,0,0|1,0,1]=4 9256 B16R0.302 CCCCCCCCCCSC(C)OC(=O)C 62a_100009818208_100000210320 [1,1,0,0,0,0|2,0,0]=4 9257 B16R0.302 CCCCCCCCCNCC(O)CC(=O)O 269956a_100011218706_100000210670 [1,1,0,0,0,0|1,0,0]=3 9258 B16R0.302 CN(CCCCCCCCCCO)CC(=O)O 269956a_100000746989_100009813290 [1,1,0,0,0,0|2,0,0]=4 9259 B16R0.302 O=C(O)CC(O)CNCCCCCCCCO 269956a_100011218706_100000033203 [1,1,0,0,0,0|2,0,0]=4 9260 B16R0.1188 CCCCCCCCCCCCNS(=O)(=O)C 40a_100000210451_100000738038 [1,1,0,0,0,0|2,0,0]=4 9261 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 2230a_100000684558_100000731031 [1,1,0,0,0,0|2,0,0]=4 9262 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 2230a_100000740961_100000210320 [1,1,0,0,0,0|2,0,0]=4 9263 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 34a_100000684558_100000731031 [1,1,0,0,0,0|2,0,0]=4 9264 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 34a_100000740961_100000210320 [1,1,0,0,0,0|2,0,0]=4 9265 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 34a_100000210711_100000731031 [1,1,0,0,0,0|2,0,0]=4 9266 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 34a_100000211924_100000210320 [1,1,0,0,0,0|2,0,0]=4 9267 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 7a_100000210711_100000230027 [1,1,0,0,0,0|2,0,0]=4 9268 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 7a_100000211924_100000210320 [1,1,0,0,0,0|2,0,0]=4 9269 B16R0.1188 CCCCCCCCCCSCCS(=O)(=O)C 62a_100000731031_100000210320 [1,1,0,0,0,0|2,0,0]=4 9270 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 2230a_100000212291_100000754308 [1,1,0,0,0,0|2,0,0]=4 9271 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 2230a_100000742409_100011214924 [1,1,0,0,0,0|2,0,0]=4 9272 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 34a_100000212291_100000754308 [1,1,0,0,0,0|2,0,0]=4 9273 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 34a_100000742409_100011214924 [1,1,0,0,0,0|2,0,0]=4 9274 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 34a_100000210712_100000754308 [1,1,0,0,0,0|2,0,0]=4 9275 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 34a_100000689940_100011214924 [1,1,0,0,0,0|2,0,0]=4 9276 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 7a_100000210712_100000754308 [1,1,0,0,0,0|2,0,0]=4 9277 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 7a_100000689940_100000210328 [1,1,0,0,0,0|2,0,0]=4 9278 B16R0.1188 CCCCCCCCCSCCCS(=O)(=O)C 62a_100000754308_100000210670 [1,1,0,0,0,0|2,0,0]=4 9279 B16R0.1469 CCCCCC(C)NCCCCCNC(=O)C 2230a_200012022750_200011218191 [1,1,0,0,0,0|2,0,0]=4 9280 B16R0.1469 CCCCCC(C)NCCCCCNC(=O)C 270004a_200012022750_100000211708 [1,1,0,0,0,0|2,0,0]=4 9281 B16R0.1469 CCCCCC(C)NCCCCCNC(=O)C 34a_200012022750_200011218191 [1,1,0,0,0,0|2,0,0]=4 9282 B16R0.1469 CCCCCC(C)NCCCCCOC(=O)C 2230a_100000211957_100009813381 [1,1,0,0,0,0|2,0,0]=4 9283 B16R0.1469 CCCCCC(C)OCCCCCOC(=O)C 34a_100011215632_100000033007 [1,1,0,0,0,0|2,0,0]=4 9284 B16R0.1469 CCCCCC(C)OCCCCCOC(=O)C 7a_100011215632_100000033007 [1,1,0,0,0,0|2,0,0]=4 9285 B16R0.1469 CCCCCC(C)SCCCCCOC(=O)C 62a_100000033007_200011218191 [1,1,0,0,0,0|2,0,0]=4 9286 B16R0.1469 CCCCCC(C)SCCCCCOC(=O)C 62a_200011218191_100000033007 [1,1,0,0,0,0|2,0,0]=4 9287 B16R0.1820 C=C(C)CCOCC(C)CCCCCCCC 34a_200012125181_100000730704 [1,1,0,0,0,0|2,0,0]=4 9288 B16R0.1820 C=C(C)CCOCC(C)CCCCCCCC 7a_200012125181_100000730704 [1,1,0,0,0,0|2,0,0]=4 9289 B16R0.1820 CC(=O)CCCCC(=O)CCCCCCCO 1458a_100011219782_100000735457 [1,1,0,0,0,0|1,0,1]=4 9290 B16R0.1820 CCCCCCCCC(=O)CCCCC(=O)C 1458a_100000210188_100000735457 [1,1,0,0,0,0|0,0,1]=3 9291 B16R0.1820 CCCCCCCCC(=O)CCCNC(=O)C 1458a_100000194741_100000210759 [1,1,0,0,0,0|1,0,1]=4 9292 B16R0.1820 CCCCCCCCC(=O)CCCOC(=O)C 1458a_100000210188_100000042594 [1,1,0,0,0,0|1,0,1]=4 9293 B16R0.1820 CCCCCCCCC(=O)CCCSC(=O)C 1458a_100000210188_100000038929 [1,1,0,0,0,0|1,0,1]=4 9294 B16R0.1820 CCCCCCCCC(C)COCCC(=O)C 7a_200012125181_100000053229 [1,1,0,0,0,0|1,0,0]=3 9295 B16R0.1820 CCCCCCCCC(C)COCCC(=O)N 34a_200012125181_100000731001 [1,1,0,0,0,0|2,0,0]=4 9296 B16R0.1820 CCCCCCCCC(C)COCCC(=O)N 7a_200012125181_100000744528 [1,1,0,0,0,0|2,0,0]=4 9297 B16R0.1820 CCCCCCCCC(C)COCOC(=O)C 34a_200012125181_100009813279 [1,1,0,0,0,0|2,0,0]=4 9298 B16R0.1820 CCCCCCCCC(C)NCCCS(=O)C 270004a_200000753449_100011216694 [1,1,0,0,0,0|2,0,0]=4 9299 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)C 34a_100000210740_100000685027 [1,1,0,0,0,0|1,0,0]=3 9300 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)C 7a_100000210740_100011215641 [1,1,0,0,0,0|1,0,0]=3 9301 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)N 34a_100000210740_100102525003 [1,1,0,0,0,0|2,0,0]=4 9302 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)N 7a_100000210740_100102525003 [1,1,0,0,0,0|2,0,0]=4 9303 B16R0.1820 CCCCCCCCC(C)OCCNC(=O)C 7a_100000210740_100000189650 [1,1,0,0,0,0|2,0,0]=4 9304 B16R0.1820 CCCCCCCCC(C)OCCOC(=O)C 34a_100000210740_100009814007 [1,1,0,0,0,0|2,0,0]=4 9305 B16R0.1820 CCCCCCCCC(C)OCCOC(=O)C 7a_100000210740_100009814007 [1,1,0,0,0,0|2,0,0]=4 9306 B16R0.1820 CCCCCCCCN(C)CCCCC(=O)C 269982a_100000207567_100000735457 [1,1,0,0,0,0|1,0,0]=3 9307 B16R0.1820 CCCCCCCCN(C)CCCOC(=O)C 269982a_100000207567_100000042594 [1,1,0,0,0,0|2,0,0]=4 9308 B16R0.1820 CCCCCCCCN(C)CCCSC(=O)C 2230a_100000207567_100000038929 [1,1,0,0,0,0|2,0,0]=4 9309 B16R0.1820 CCCCCCCCN(C)CCCSC(=O)C 269982a_100000207567_100000038929 [1,1,0,0,0,0|2,0,0]=4 9310 B16R0.3183 C=C(C)CCC(=O)CCCCCCCCCC 1458a_100000210375_100000730704 [1,1,0,0,0,0|1,0,1]=4 9311 B16R0.3183 C=C(C)CCC(=O)CCCCCCCCCC 1458a_200000688413_100000210319 [1,1,0,0,0,0|1,0,1]=4 9312 B16R0.3183 C=C(C)CCC(C)NCCCCCCCCC 270004a_100000212291_100011215600 [1,1,0,0,0,0|2,0,0]=4 9313 B16R0.3183 C=C(C)CCN(C)CCCCCCCCCC 2230a_100000207566_100000730704 [1,1,0,0,0,0|2,0,0]=4 9314 B16R0.3183 C=C(C)CCN(C)CCCCCCCCCC 269982a_100000207566_100000730704 [1,1,0,0,0,0|2,0,0]=4 9315 B16R0.3183 C=C(C)COC(C)CCCCCCCCCC 34a_100011215000_100000748629 [1,1,0,0,0,0|2,0,0]=4 9316 B16R0.3183 C=C(C)COC(C)CCCCCCCCCC 7a_100011215000_100000748629 [1,1,0,0,0,0|2,0,0]=4 9317 B16R0.3183 CCCCCCCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210319 [1,1,0,0,0,0|1,0,1]=4 9318 B16R0.3183 CCCCCCCCCCC(=O)CNC(=O)C 1458a_100000194580_100000210319 [1,1,0,0,0,0|1,0,1]=4 9319 B16R0.3183 CCCCCCCCCCC(=O)COC(=O)C 1458a_100000183556_100000210319 [1,1,0,0,0,0|1,0,1]=4 9320 B16R0.3183 CCCCCCCCCCC(=O)CSC(=O)C 1458a_100000049016_100000210319 [1,1,0,0,0,0|1,0,1]=4 9321 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)N 34a_100011215000_100000187820 [1,1,0,0,0,0|2,0,0]=4 9322 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)N 7a_100011215000_100000187820 [1,1,0,0,0,0|2,0,0]=4 9323 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)[O-] 34a_100011215000_100020667443 [1,1,0,0,0,0|1,0,1]=4 9324 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)C 269982a_100000207566_100000053229 [1,1,0,0,0,0|1,0,0]=3 9325 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 2230a_100000207566_100000744528 [1,1,0,0,0,0|2,0,0]=4 9326 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 2230a_100000730477_100000210320 [1,1,0,0,0,0|2,0,0]=4 9327 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 269982a_100000207566_100000744528 [1,1,0,0,0,0|2,0,0]=4 9328 B16R0.3183 CCCCCCCCCCN(C)COC(=O)C 269982a_100000207566_100000076356 [1,1,0,0,0,0|2,0,0]=4 9329 B16R0.3183 CCCCCCCCCNC(C)COC(=O)C 270004a_100000212291_100000000629 [1,1,0,0,0,0|2,0,0]=4 9330 B16R0.3183 CCCCCCCCNCC(C)CSC(=O)C 2230a_100000229939_200000116872 [1,1,0,0,0,0|2,0,0]=4 9331 B16R0.3183 CCCCCCCCNCC(C)CSC(=O)C 34a_100000229939_200000116872 [1,1,0,0,0,0|2,0,0]=4 9332 B16R0.3183 CCCCCCCCNCC(O)COC(=O)C 34a_100000229939_200000139349 [1,1,0,0,0,0|2,0,0]=4 9333 B16R0.3183 CCCCCCCCOCC(C)CSC(=O)C 34a_100000210232_200000116872 [1,1,0,0,0,0|2,0,0]=4 9334 B16R0.3183 CCCCCCCCOCC(C)CSC(=O)C 7a_100000210232_200000116872 [1,1,0,0,0,0|2,0,0]=4 9335 B16R0.3183 CCCCCCCCOCC(O)COC(=O)C 34a_100000210232_200000139349 [1,1,0,0,0,0|2,0,0]=4 9336 B16R0.3183 CCCCCCCCOCC(O)COC(=O)C 7a_100000210232_200000139349 [1,1,0,0,0,0|2,0,0]=4 9337 B16R0.3183 CCCCCCCCSCC(C)CSC(=O)C 62a_100000210759_200000116872 [1,1,0,0,0,0|2,0,0]=4 9338 B16R0.3183 CCCCCCCCSCC(C)CSC(=O)C 62a_200000116872_100000210317 [1,1,0,0,0,0|2,0,0]=4 9339 B16R0.3183 CCCCCCCCSCC(O)COC(=O)C 62a_100000210759_200000139349 [1,1,0,0,0,0|2,0,0]=4 9340 B16R0.3183 CCCCCCCCSCC(O)COC(=O)C 62a_200000139349_100000210317 [1,1,0,0,0,0|2,0,0]=4 9341 B16R0.3288 CC(=O)CCCCNCCCCCCC(C)C 34a_100000211014_100009817362 [1,1,0,0,0,0|1,0,0]=3 9342 B16R0.3288 CC(=O)CCCCOCCCCCNC(C)C 34a_100011629493_100009817362 [1,1,0,0,0,0|2,0,0]=4 9343 B16R0.3288 CC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000685027 [1,1,0,0,0,0|1,0,0]=3 9344 B16R0.3288 CC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100011215641 [1,1,0,0,0,0|1,0,0]=3 9345 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)C 2230a_200011996284_100011214892 [1,1,0,0,0,0|2,0,0]=4 9346 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)C 34a_200011996284_100011214892 [1,1,0,0,0,0|2,0,0]=4 9347 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)O 2230a_200011996284_200000718107 [1,1,0,0,0,0|2,0,0]=4 9348 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)O 34a_200011996284_200000718107 [1,1,0,0,0,0|2,0,0]=4 9349 B16R0.3288 CC(=O)NCCCCCNCCCCC(C)C 2230a_200012022750_100011216152 [1,1,0,0,0,0|2,0,0]=4 9350 B16R0.3288 CC(=O)NCCCCCNCCCCC(C)C 34a_200012022750_100011216152 [1,1,0,0,0,0|2,0,0]=4 9351 B16R0.3288 CC(=O)NCCCCNCCCCCC(C)C 2230a_200011368371_100000210682 [1,1,0,0,0,0|2,0,0]=4 9352 B16R0.3288 CC(=O)NCCCCNCCCCCC(C)C 34a_200011368371_100000210682 [1,1,0,0,0,0|2,0,0]=4 9353 B16R0.3288 CC(=O)NCCOCCCCCCCC(C)C 7a_200000210741_100000189650 [1,1,0,0,0,0|2,0,0]=4 9354 B16R0.3288 CC(=O)OCCCCCOCCCCC(C)C 34a_100011214890_100000033007 [1,1,0,0,0,0|2,0,0]=4 9355 B16R0.3288 CC(=O)OCCCCCOCCCCC(C)C 7a_100011214890_100000033007 [1,1,0,0,0,0|2,0,0]=4 9356 B16R0.3288 CC(=O)OCCCCCSCCCCC(C)C 62a_100000033007_100011216152 [1,1,0,0,0,0|2,0,0]=4 9357 B16R0.3288 CC(=O)OCCCCCSCCCCC(C)C 62a_100011216152_100000033007 [1,1,0,0,0,0|2,0,0]=4 9358 B16R0.3288 CC(=O)OCCCCNCCCCCC(C)C 34a_100011290863_100000033659 [1,1,0,0,0,0|2,0,0]=4 9359 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 34a_100000073216_100000210682 [1,1,0,0,0,0|2,0,0]=4 9360 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 34a_100011995859_100000033659 [1,1,0,0,0,0|2,0,0]=4 9361 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 7a_100000073216_100000210682 [1,1,0,0,0,0|2,0,0]=4 9362 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 7a_100011995859_100000033659 [1,1,0,0,0,0|2,0,0]=4 9363 B16R0.3288 CC(=O)OCCCCSCCCCCC(C)C 62a_100000033659_100000210682 [1,1,0,0,0,0|2,0,0]=4 9364 B16R0.3288 CC(=O)OCCCCSCCCCCC(C)C 62a_100000210682_100000033659 [1,1,0,0,0,0|2,0,0]=4 9365 B16R0.3288 CC(=O)OCCCNCCCCCCC(C)C 34a_100000211014_100000042594 [1,1,0,0,0,0|2,0,0]=4 9366 B16R0.3288 CC(=O)OCCOCCCCCCCC(C)C 34a_200000210741_100009814007 [1,1,0,0,0,0|2,0,0]=4 9367 B16R0.3288 CC(=O)OCCOCCCCCCCC(C)C 7a_200000210741_100009814007 [1,1,0,0,0,0|2,0,0]=4 9368 B16R0.3288 CC(=O)SCCCCNCCCCCC(C)C 2230a_100011290863_200010402107 [1,1,0,0,0,0|2,0,0]=4 9369 B16R0.3288 CC(=O)SCCCCNCCCCCC(C)C 34a_100011290863_200010402107 [1,1,0,0,0,0|2,0,0]=4 9370 B16R0.3288 CC(=O)SCCCCOCCCCCC(C)C 34a_100011995859_200010402107 [1,1,0,0,0,0|2,0,0]=4 9371 B16R0.3288 CC(=O)SCCCCOCCCCCC(C)C 7a_100011995859_200010402107 [1,1,0,0,0,0|2,0,0]=4 9372 B16R0.3288 CC(=O)SCCCCSCCCCCC(C)C 62a_100000210682_200010402107 [1,1,0,0,0,0|2,0,0]=4 9373 B16R0.3288 CC(=O)SCCCCSCCCCCC(C)C 62a_200010402107_100000210682 [1,1,0,0,0,0|2,0,0]=4 9374 B16R0.3288 CC(=O)SCCCNCCCCCCC(C)C 2230a_100000211014_100000038929 [1,1,0,0,0,0|2,0,0]=4 9375 B16R0.3288 CC(=O)SCCCNCCCCCCC(C)C 34a_100000211014_100000038929 [1,1,0,0,0,0|2,0,0]=4 9376 B16R0.3288 CC(C)CCCCCCCOCCCC(=O)N 34a_200000210741_100102525003 [1,1,0,0,0,0|2,0,0]=4 9377 B16R0.3288 CC(C)CCCCCCCOCCCC(=O)N 7a_200000210741_100102525003 [1,1,0,0,0,0|2,0,0]=4 9378 B16R0.3288 CC(C)CCCCCNCCCCCC(=O)N 2230a_100011290863_100009817443 [1,1,0,0,0,0|2,0,0]=4 9379 B16R0.3288 CC(C)CCCCCNCCCCCC(=O)N 34a_100011290863_100009817443 [1,1,0,0,0,0|2,0,0]=4 9380 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 34a_100000123541_100000210682 [1,1,0,0,0,0|2,0,0]=4 9381 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 34a_100011995859_100009817443 [1,1,0,0,0,0|2,0,0]=4 9382 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 7a_100000123541_100000210682 [1,1,0,0,0,0|2,0,0]=4 9383 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 7a_100011995859_100009817443 [1,1,0,0,0,0|2,0,0]=4 9384 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210682 [1,1,0,0,0,0|1,0,1]=4 9385 B16R0.3288 CC(C)CCCCCSCCCCCC(=O)N 62a_100000210682_100009817443 [1,1,0,0,0,0|2,0,0]=4 9386 B16R0.3288 CC(C)CCCCCSCCCCCC(=O)N 62a_100009817443_100000210682 [1,1,0,0,0,0|2,0,0]=4 9387 B16R0.3288 CC(C)NCCCCCCCCCCC(=O)N 2230a_100138425928_200010167045 [1,1,0,0,0,0|2,0,0]=4 9388 B16R0.3288 CC(C)NCCCCCCCCCCC(=O)N 34a_100138425928_200010167045 [1,1,0,0,0,0|2,0,0]=4 9389 B16R0.3288 CC(C)OCCCCCCCCCCC(=O)N 34a_100000212225_200010167045 [1,1,0,0,0,0|2,0,0]=4 9390 B16R0.3288 CC(C)SCCCCCCCCCCC(=O)N 62a_100000210206_200010167045 [1,1,0,0,0,0|2,0,0]=4 9391 B16R0.3288 CC(C)SCCCCCCCCCCC(=O)N 62a_200010167045_100000210206 [1,1,0,0,0,0|2,0,0]=4 9392 B18R0.41 CCCCCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210614 [0,2,0,0,0,0|0,0,1]=3 9393 B18R0.41 CCCCCCCC(=O)CCCCCC(=O)OCC 1458a_100000211969_100000755133 [0,2,0,0,0,0|0,0,1]=3 9394 B18R0.41 CCCCCCCC(=O)CCCOCC(=O)OCC 1458a_100000211969_100009893628 [0,2,0,0,0,0|1,0,1]=4 9395 B18R0.41 CCCCCCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000211969 [0,2,0,0,0,0|1,0,1]=4 9396 B18R0.41 CCCCCCCC(C)OCCCCC(=O)OCC 34a_200011215852_100000750268 [0,2,0,0,0,0|1,0,0]=3 9397 B18R0.41 CCCCCCCC(C)OCCCCC(=O)OCC 7a_200011215852_100000750268 [0,2,0,0,0,0|1,0,0]=3 9398 B18R0.41 CCCCCCCC(C)OCCOCC(=O)OCC 34a_200011215852_100000088970 [0,2,0,0,0,0|2,0,0]=4 9399 B18R0.41 CCCCCCCC(C)OCCOCC(=O)OCC 7a_200011215852_100000088970 [0,2,0,0,0,0|2,0,0]=4 9400 B18R0.41 CCCCCCCC(C)OCCSCC(=O)OCC 7a_200000230590_200011218727 [0,2,0,0,0,0|2,0,0]=4 9401 B18R0.41 CCCCCCCC(C)SCCCCC(=O)OCC 62a_100000750268_200011218727 [0,2,0,0,0,0|1,0,0]=3 9402 B18R0.41 CCCCCCCC(C)SCCCCC(=O)OCC 62a_200011218727_100000750268 [0,2,0,0,0,0|1,0,0]=3 9403 B18R0.41 CCCCCCCC(C)SCCOCC(=O)OCC 62a_100000088970_200011218727 [0,2,0,0,0,0|2,0,0]=4 9404 B18R0.41 CCCCCCCC(C)SCCOCC(=O)OCC 62a_200011218727_100000088970 [0,2,0,0,0,0|2,0,0]=4 9405 B18R0.41 CCCCCCCN(C)CCCCCC(=O)OCC 2230a_100000228206_100000755133 [0,2,0,0,0,0|1,0,0]=3 9406 B18R0.41 CCCCCCCN(C)CCCCCC(=O)OCC 269982a_100000228206_100000755133 [0,2,0,0,0,0|1,0,0]=3 9407 B18R0.41 CCCCCCCN(C)CCCOCC(=O)OCC 2230a_100000228206_100009893628 [0,2,0,0,0,0|2,0,0]=4 9408 B18R0.41 CCCCCCCN(C)CCCOCC(=O)OCC 269982a_100000228206_100009893628 [0,2,0,0,0,0|2,0,0]=4 9409 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 11a_100000210581_100000037472 [0,2,0,0,0,0|1,0,1]=4 9410 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 1626a_100000210581_100000037472 [0,2,0,0,0,0|1,0,1]=4 9411 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 240690a_100000210581_100000037472 [0,2,0,0,0,0|1,0,1]=4 9412 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 527a_100000210581_100000037472 [0,2,0,0,0,0|1,0,1]=4 9413 B18R0.41 CCCCOCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000743108 [0,2,0,0,0,0|1,0,1]=4 9414 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCCF 1458a_100000037472_100015922095 [0,2,0,0,0,0|1,0,1]=4 9415 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCCO 1458a_100000037472_100000766143 [0,2,0,0,0,0|1,0,1]=4 9416 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCCO 1458a_100011996774_100000755133 [0,2,0,0,0,0|1,0,1]=4 9417 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCOC 1458a_100011935119_100000755133 [0,2,0,0,0,0|1,0,1]=4 9418 B18R0.101 C#CCCCCCCC(=O)CCCCCC(=O)OC 1458a_100000034748_100009816466 [0,2,0,0,0,0|0,0,2]=4 9419 B18R0.101 C#CCCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100012276617 [0,2,0,0,0,0|0,0,2]=4 9420 B18R0.101 C=CCCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011215473 [0,2,0,0,0,0|0,0,2]=4 9421 B18R0.101 C=CCCCCCCC(=O)CCCCCC(=O)OC 1458a_100011809334_100009816466 [0,2,0,0,0,0|0,0,2]=4 9422 B18R0.101 CCCCC/C=C/CC(=O)CCCCCC(=O)OC 1458a_100020675968_100009816466 [0,2,0,0,0,0|0,0,2]=4 9423 B18R0.101 CCCCCC#CCC(=O)CCCCCC(=O)OC 1458a_100009848860_100009816472 [0,2,0,0,0,0|0,0,2]=4 9424 B18R0.101 CCCCCCC=CC(=O)CCCCCC(=O)OC 1458a_200015324643_100009816466 [0,2,0,0,0,0|0,0,2]=4 9425 B18R0.101 CCCCCCCCC(=O)CCCCCC(=O)OC 1458a_100000210188_100009816466 [0,2,0,0,0,0|0,0,0]=2 9426 B18R0.101 CCCCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210759 [0,2,0,0,0,0|0,0,0]=2 9427 B18R0.101 CCCCCCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000210188 [0,2,0,0,0,0|0,0,1]=3 9428 B18R0.101 CCCCCCCCC(C)CNCCCC(=O)NC 270004a_100000740002_100011995885 [0,2,0,0,0,0|1,0,0]=3 9429 B18R0.101 CCCCCCCCC(C)CNCCNC(=O)CC 270004a_100132302217_100011995885 [0,2,0,0,0,0|2,0,0]=4 9430 B18R0.101 CCCCCCCCC(C)COC/C=C/C(=O)OC 34a_200012125181_100000742655 [0,2,0,0,0,0|0,0,2]=4 9431 B18R0.101 CCCCCCCCC(C)COC/C=C/C(=O)OC 7a_200012125181_100000742655 [0,2,0,0,0,0|0,0,2]=4 9432 B18R0.101 CCCCCCCCC(C)COCCCC(=O)NC 34a_200012125181_100000741757 [0,2,0,0,0,0|1,0,0]=3 9433 B18R0.101 CCCCCCCCC(C)COCCCC(=O)NC 7a_200012125181_100000741757 [0,2,0,0,0,0|1,0,0]=3 9434 B18R0.101 CCCCCCCCC(C)COCCCC(=O)OC 34a_200012125181_100000742333 [0,2,0,0,0,0|0,0,0]=2 9435 B18R0.101 CCCCCCCCC(C)COCCCC(=O)OC 7a_200012125181_100011218270 [0,2,0,0,0,0|0,0,0]=2 9436 B18R0.101 CCCCCCCCC(C)COCCOC(=O)NC 34a_200012125181_200011997002 [0,2,0,0,0,0|2,0,0]=4 9437 B18R0.101 CCCCCCCCC(C)COCCOC(=O)NC 7a_200012125181_200011997002 [0,2,0,0,0,0|2,0,0]=4 9438 B18R0.101 CCCCCCCCC(C)OCCCCC(=O)OC 34a_100000210740_100000204269 [0,2,0,0,0,0|0,0,0]=2 9439 B18R0.101 CCCCCCCCC(C)OCCCCC(=O)OC 7a_100000210740_100000204269 [0,2,0,0,0,0|0,0,0]=2 9440 B18R0.101 CCCCCCCCC(C)OCCOCC(=O)OC 34a_100000210740_100000090808 [0,2,0,0,0,0|1,0,0]=3 9441 B18R0.101 CCCCCCCCC(C)OCCOCC(=O)OC 7a_100000210740_100000090808 [0,2,0,0,0,0|1,0,0]=3 9442 B18R0.101 CCCCCCCCN(C)CCCCCC(=O)OC 2230a_100000207567_100009816466 [0,2,0,0,0,0|0,0,0]=2 9443 B18R0.101 CCCCCCCCN(C)CCCCCC(=O)OC 269982a_100000207567_100009816466 [0,2,0,0,0,0|0,0,0]=2 9444 B18R0.101 CCCCCCCNC(=O)CCCCCC(=O)OC 11a_100000229938_100009848860 [0,2,0,0,0,0|0,0,1]=3 9445 B18R0.101 CCCCCCCNC(=O)CCCCCC(=O)OC 1626a_100000229938_100009848860 [0,2,0,0,0,0|0,0,1]=3 9446 B18R0.101 CCCCCCCNC(=O)CCCCCC(=O)OC 240690a_100000229938_100009848860 [0,2,0,0,0,0|0,0,1]=3 9447 B18R0.101 CCCCSCCNC(=O)CCCCCC(=O)OC 11a_100025743550_100009848860 [0,2,0,0,0,0|1,0,1]=4 9448 B18R0.101 CCCCSCCNC(=O)CCCCCC(=O)OC 1626a_100025743550_100009848860 [0,2,0,0,0,0|1,0,1]=4 9449 B18R0.101 CCCCSCCNC(=O)CCCCCC(=O)OC 240690a_100025743550_100009848860 [0,2,0,0,0,0|1,0,1]=4 9450 B18R0.101 CCCOCCCNC(=O)CCCCCC(=O)OC 1626a_100011217757_100009848860 [0,2,0,0,0,0|1,0,1]=4 9451 B18R0.101 CCCOCCCNC(=O)CCCCCC(=O)OC 240690a_100011217757_100009848860 [0,2,0,0,0,0|1,0,1]=4 9452 B18R0.101 CCOCCOCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011211534 [0,2,0,0,0,0|1,0,1]=4 9453 B18R0.101 COC(=O)CCCCCC(=O)CCCCCCC#N 1458a_100009848860_100009813337 [0,2,0,0,0,0|0,0,2]=4 9454 B18R0.101 COC(=O)CCCCCC(=O)CCCCCCCO 1458a_100009848860_100000760002 [0,2,0,0,0,0|0,0,1]=3 9455 B18R0.101 COC(=O)CCCCCC(=O)CCCCCCCO 1458a_100011219782_100009816466 [0,2,0,0,0,0|0,0,1]=3 9456 B18R0.101 COC(=O)CCCCCC(=O)NCCCCCCO 240690a_100000686447_100009848860 [0,2,0,0,0,0|1,0,1]=4 9457 B18R0.101 COC(=O)CCCCNC(=O)CCCCCCCO 188690a_100000746077_100011219782 [0,2,0,0,0,0|1,0,1]=4 9458 B18R0.101 COCCCCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011998445 [0,2,0,0,0,0|0,0,1]=3 9459 B18R0.101 COCCCCCNC(=O)CCCCCC(=O)OC 11a_100000747528_100009848860 [0,2,0,0,0,0|1,0,1]=4 9460 B18R0.101 COCCCCCNC(=O)CCCCCC(=O)OC 1626a_100000747528_100009848860 [0,2,0,0,0,0|1,0,1]=4 9461 B18R0.101 COCCCCCNC(=O)CCCCCC(=O)OC 240690a_100000747528_100009848860 [0,2,0,0,0,0|1,0,1]=4 9462 B18R0.101 COCCOCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100011216529 [0,2,0,0,0,0|1,0,1]=4 9463 B18R0.3274 CCCCCC(=O)CC(=O)CCCCCC(=O)OC 1458a_100009848860_200012276598 [0,2,0,0,0,0|0,0,2]=4 9464 B18R0.3274 CCCCCC(C)NC(=O)CCCCCC(=O)OC 11a_100000211957_100009848860 [0,2,0,0,0,0|1,0,1]=4 9465 B18R0.3274 CCCCCC(C)NC(=O)CCCCCC(=O)OC 1626a_100000211957_100009848860 [0,2,0,0,0,0|1,0,1]=4 9466 B18R0.3274 CCCCCC(C)NC(=O)CCCCCC(=O)OC 240690a_100000211957_100009848860 [0,2,0,0,0,0|1,0,1]=4 9467 B18R0.6866 CCCCCCCC(C)(C)OCCCCC(=O)OC 34a_100000059025_200000046972 [0,2,0,0,0,0|1,0,0]=3 9468 B18R0.6866 CCCCCCCC(C)(C)OCCCCC(=O)OC 7a_100000059025_200000046972 [0,2,0,0,0,0|1,0,0]=3 9469 B18R0.6866 CCCCCCCC(C)(C)SCCCCC(=O)OC 62a_100000204269_200000046972 [0,2,0,0,0,0|1,0,0]=3 9470 B18R0.6866 CCCCCCCC(C)(C)SCCCCC(=O)OC 62a_200000046972_100000204269 [0,2,0,0,0,0|1,0,0]=3 9471 B18R0.6866 CCCCCCCC(C)(C)SCCOCC(=O)OC 62a_100000090808_200000046972 [0,2,0,0,0,0|2,0,0]=4 9472 B18R0.6866 CCCCCCCC(C)(C)SCCOCC(=O)OC 62a_200000046972_100000090808 [0,2,0,0,0,0|2,0,0]=4 9473 B18R0.9618 CCCCCCCC(O)CC(=O)CCCC(=O)NC 1458a_200011667753_100000741757 [0,2,0,0,0,0|1,0,1]=4 9474 B18R0.9618 CCCCCCCC(O)CC(=O)CCCC(=O)OC 1458a_200011667753_100011218270 [0,2,0,0,0,0|0,0,1]=3 9475 B18R0.9618 CCCCCCCC(O)CC(=O)NCCC(=O)OC 188690a_100000683876_200011667753 [0,2,0,0,0,0|1,0,1]=4 9476 B18R0.9731 CCCCCCCC(C)OCC(=O)CCC(=O)OC 34a_200011215852_100000691467 [0,2,0,0,0,0|1,0,1]=4 9477 B18R0.9731 CCCCCCCC(C)OCC(=O)CCC(=O)OC 7a_200011215852_100000691467 [0,2,0,0,0,0|1,0,1]=4 9478 B18R0.9731 CCCCCCCC(C)SCC(=O)CCC(=O)OC 62a_100000691467_200011218727 [0,2,0,0,0,0|1,0,1]=4 9479 B18R0.9731 CCCCCCCC(C)SCC(=O)CCC(=O)OC 62a_200011218727_100000691467 [0,2,0,0,0,0|1,0,1]=4 9480 B18R0.13742 COC(=O)CCCCCC(=O)CCCCCC(C)C 1458a_100000766313_100009816466 [0,2,0,0,0,0|0,0,1]=3 9481 B18R0.13742 COC(=O)CCCCCC(=O)CCCCCC(C)C 1458a_100009848860_100000210682 [0,2,0,0,0,0|0,0,1]=3 9482 B18R0.13742 COC(=O)CCCCNC(=O)CCCCCC(C)C 188690a_100000746077_100000766313 [0,2,0,0,0,0|1,0,1]=4 9483 B18R0.19121 CCCCCCCC(C)C(=O)CCCCC(=O)OC 1458a_100000695723_200011218727 [0,2,0,0,0,0|0,0,1]=3 9484 B18R0.19121 CCCCCCCC(C)C(=O)CCCNC(=O)OC 1458a_100000753017_200011218727 [0,2,0,0,0,0|1,0,1]=4 9485 B18R0.19121 CCCCCCCN(C)C(=O)CCCCC(=O)OC 11a_100000228206_100000695723 [0,2,0,0,0,0|1,0,1]=4 9486 B18R0.19121 CCCCCCCN(C)C(=O)CCCCC(=O)OC 1626a_100000228206_100000695723 [0,2,0,0,0,0|1,0,1]=4 9487 B18R0.19121 CCCCCCCN(C)C(=O)CCCCC(=O)OC 240690a_100000228206_100000695723 [0,2,0,0,0,0|1,0,1]=4 9488 B18R0.19121 CCCCCCCN(C)C(=O)CCCCC(=O)OC 527a_100000228206_100000695723 [0,2,0,0,0,0|1,0,1]=4 9489 B18R0.19339 CCCCCCCC(C)OCCCCC(=O)N(C)C 34a_200011215852_100000752486 [0,2,0,0,0,0|2,0,0]=4 9490 B18R0.19339 CCCCCCCC(C)OCCCCC(=O)N(C)C 7a_200011215852_100000752486 [0,2,0,0,0,0|2,0,0]=4 9491 B18R0.19339 CCCCCCCC(C)SCCCCC(=O)N(C)C 62a_100000752486_200011218727 [0,2,0,0,0,0|2,0,0]=4 9492 B18R0.19339 CCCCCCCC(C)SCCCCC(=O)N(C)C 62a_200011218727_100000752486 [0,2,0,0,0,0|2,0,0]=4 9493 B18R0.19451 CCCCCCC(C)C(=O)CCCCCC(=O)OC 1458a_100009848860_100011215978 [0,2,0,0,0,0|0,0,1]=3 9494 B18R0.19451 CCCCCCC(O)C(=O)CCCCCC(=O)OC 1458a_100011215828_100009816466 [0,2,0,0,0,0|0,0,1]=3 9495 B18R0.19451 CCCCCCC(O)C(=O)NCCCCC(=O)OC 188690a_100000746077_100011215828 [0,2,0,0,0,0|1,0,1]=4 9496 B18R0.19451 CCCCCCN(C)C(=O)CCCCCC(=O)OC 11a_106256046315_100009848860 [0,2,0,0,0,0|1,0,1]=4 9497 B18R0.19451 CCCCCCN(C)C(=O)CCCCCC(=O)OC 1626a_106256046315_100009848860 [0,2,0,0,0,0|1,0,1]=4 9498 B18R0.19451 CCCCCCN(C)C(=O)CCCCCC(=O)OC 240690a_106256046315_100009848860 [0,2,0,0,0,0|1,0,1]=4 9499 B18R0.19488 C=CC(CCCCCCC)OCCCCC(=O)OC 34a_200011934235_100000204269 [0,2,0,0,0,0|1,0,0]=3 9500 B18R0.19488 C=CC(CCCCCCC)OCCCCC(=O)OC 7a_200011934235_100000204269 [0,2,0,0,0,0|1,0,0]=3 9501 B18R0.19488 C=CC(CCCCCCC)OCCOCC(=O)OC 34a_200011934235_100000090808 [0,2,0,0,0,0|2,0,0]=4 9502 B18R0.19488 C=CC(CCCCCCC)OCCOCC(=O)OC 7a_200011934235_100000090808 [0,2,0,0,0,0|2,0,0]=4 9503 B18R0.19488 CCCCCCCC(CC)OCCCCC(=O)OC 34a_200011217053_100000204269 [0,2,0,0,0,0|1,0,0]=3 9504 B18R0.19488 CCCCCCCC(CC)OCCCCC(=O)OC 7a_200011217053_100000204269 [0,2,0,0,0,0|1,0,0]=3 9505 B18R0.19488 CCCCCCCC(CC)OCCOCC(=O)OC 34a_200011217053_100000090808 [0,2,0,0,0,0|2,0,0]=4 9506 B18R0.19488 CCCCCCCC(CC)OCCOCC(=O)OC 7a_200011217053_100000090808 [0,2,0,0,0,0|2,0,0]=4 9507 B18R0.19488 CCCCCCCN(CC)CCCCCC(=O)OC 2230a_100000228213_100009816466 [0,2,0,0,0,0|1,0,0]=3 9508 B18R0.19488 CCCCCCCN(CC)CCCCCC(=O)OC 269982a_100000228213_100009816466 [0,2,0,0,0,0|1,0,0]=3 9509 B18R0.19586 CCCCC(C)CCC(=O)CCCCCC(=O)OC 1458a_100000033779_100009816466 [0,2,0,0,0,0|0,0,1]=3 9510 B18R0.19586 CCCCC(C)CCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000033779 [0,2,0,0,0,0|1,0,1]=4 9511 B18R0.100 CCCCCCCCC(=O)CCCCC(=O)OCC 1458a_100000210188_100000750268 [0,2,0,0,0,0|0,0,1]=3 9512 B18R0.100 CCCCCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210759 [0,2,0,0,0,0|0,0,1]=3 9513 B18R0.100 CCCCCCCCC(=O)CCOCC(=O)OCC 1458a_100000210188_100000088970 [0,2,0,0,0,0|1,0,1]=4 9514 B18R0.100 CCCCCCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000210188 [0,2,0,0,0,0|1,0,1]=4 9515 B18R0.100 CCCCCCCCC(C)CNCCC(=O)NCC 270004a_100025743525_100011995885 [0,2,0,0,0,0|2,0,0]=4 9516 B18R0.100 CCCCCCCCC(C)COCCC(=O)NCC 7a_200012125181_100000737597 [0,2,0,0,0,0|2,0,0]=4 9517 B18R0.100 CCCCCCCCC(C)COCCC(=O)OCC 34a_200012125181_100000765890 [0,2,0,0,0,0|1,0,0]=3 9518 B18R0.100 CCCCCCCCC(C)COCCC(=O)OCC 7a_200012125181_100011206558 [0,2,0,0,0,0|1,0,0]=3 9519 B18R0.100 CCCCCCCCC(C)OCCCC(=O)OCC 34a_100000210740_100009991533 [0,2,0,0,0,0|1,0,0]=3 9520 B18R0.100 CCCCCCCCC(C)OCCCC(=O)OCC 7a_100000210740_100011215271 [0,2,0,0,0,0|1,0,0]=3 9521 B18R0.100 CCCCCCCCC(C)OCCNC(=O)OCC 7a_100000210740_200011445536 [0,2,0,0,0,0|2,0,0]=4 9522 B18R0.100 CCCCCCCCN(C)CCCCC(=O)OCC 2230a_100000207567_100000750268 [0,2,0,0,0,0|1,0,0]=3 9523 B18R0.100 CCCCCCCCN(C)CCCCC(=O)OCC 269982a_100000207567_100000750268 [0,2,0,0,0,0|1,0,0]=3 9524 B18R0.100 CCCCCCCCN(C)CCOCC(=O)OCC 2230a_100000207567_100000088970 [0,2,0,0,0,0|2,0,0]=4 9525 B18R0.100 CCCCCCCCN(C)CCOCC(=O)OCC 269982a_100000207567_100000088970 [0,2,0,0,0,0|2,0,0]=4 9526 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 11a_100000229938_100011217402 [0,2,0,0,0,0|1,0,1]=4 9527 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 1626a_100000229938_100011217402 [0,2,0,0,0,0|1,0,1]=4 9528 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 240690a_100000229938_100011217402 [0,2,0,0,0,0|1,0,1]=4 9529 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 527a_100000229938_100011217402 [0,2,0,0,0,0|1,0,1]=4 9530 B18R0.100 CCOC(=O)CCCCC(=O)CCCCCCCO 1458a_100011217402_100000760002 [0,2,0,0,0,0|1,0,1]=4 9531 B18R0.100 CCOC(=O)CCCCC(=O)CCCCCCCO 1458a_100011219782_100000750268 [0,2,0,0,0,0|1,0,1]=4 9532 B18R0.100 CCOC(=O)CCCCC(=O)CCCCCCOC 1458a_100011217402_100011998445 [0,2,0,0,0,0|1,0,1]=4 9533 B18R0.139 CCCCCCC(C)NC(=O)CCCCC(=O)OC 11a_100000210919_100000695723 [0,2,0,0,0,0|1,0,1]=4 9534 B18R0.139 CCCCCCC(C)NC(=O)CCCCC(=O)OC 1626a_100000210919_100000695723 [0,2,0,0,0,0|1,0,1]=4 9535 B18R0.139 CCCCCCC(C)NC(=O)CCCCC(=O)OC 240690a_100000210919_100000695723 [0,2,0,0,0,0|1,0,1]=4 9536 B18R0.139 CCCCCCC(C)NC(=O)CCCCC(=O)OC 527a_100000210919_100000695723 [0,2,0,0,0,0|1,0,1]=4 9537 B18R0.3072 CCCCCCCCC(=O)CCCCC(=O)N(C)C 1458a_100000210188_100000752486 [0,2,0,0,0,0|1,0,1]=4 9538 B18R0.3072 CCCCCCCCC(C)CNCCC(=O)N(C)C 270004a_100000738053_100011995885 [0,2,0,0,0,0|2,0,0]=4 9539 B18R0.3072 CCCCCCCCC(C)COCCC(=O)N(C)C 7a_200012125181_100000737620 [0,2,0,0,0,0|2,0,0]=4 9540 B18R0.3072 CCCCCCCCC(C)NCCCC(=O)N(C)C 270004a_200000744827_100011216694 [0,2,0,0,0,0|2,0,0]=4 9541 B18R0.3072 CCCCCCCCC(C)OCCCC(=O)N(C)C 7a_100000210740_100000737642 [0,2,0,0,0,0|2,0,0]=4 9542 B18R0.3072 CCCCCCCCN(C)CCCCC(=O)N(C)C 269982a_100000207567_100000752486 [0,2,0,0,0,0|2,0,0]=4 9543 B18R0.6441 CCCCCCCCC(=O)N(C)CCCC(=O)OC 240690a_100000739225_100000210188 [0,2,0,0,0,0|1,0,1]=4 9544 B18R0.6441 CCCCCCCCC(=O)N(C)CCCC(=O)OC 527a_100000739225_100000210188 [0,2,0,0,0,0|1,0,1]=4 9545 B18R0.6441 CCCCCCCCC(O)C(=O)CCCC(=O)NC 1458a_200011995895_100000741757 [0,2,0,0,0,0|1,0,1]=4 9546 B18R0.6441 CCCCCCCCC(O)C(=O)CCCC(=O)OC 1458a_200011995895_100011218270 [0,2,0,0,0,0|0,0,1]=3 9547 B18R0.6441 CCCCCCCCC(O)C(=O)NCCC(=O)OC 188690a_100000683876_200011995895 [0,2,0,0,0,0|1,0,1]=4 9548 B18R0.6441 CCCCCCCCN(C)C(=O)CCCC(=O)OC 11a_100000207567_100000239890 [0,2,0,0,0,0|1,0,1]=4 9549 B18R0.6441 CCCCCCCCN(C)C(=O)CCCC(=O)OC 1626a_100000207567_100000239890 [0,2,0,0,0,0|1,0,1]=4 9550 B18R0.6441 CCCCCCCCN(C)C(=O)CCCC(=O)OC 240690a_100000207567_100000239890 [0,2,0,0,0,0|1,0,1]=4 9551 B18R0.6441 CCCCCCCCN(C)C(=O)CCCC(=O)OC 527a_100000207567_100000239890 [0,2,0,0,0,0|1,0,1]=4 9552 B18R0.6725 CCCCCCCCC(=O)NCC(O)CC(=O)OC 188690a_100025770978_100000210188 [0,2,0,0,0,0|1,0,1]=4 9553 B18R0.6725 CCCCCCCCC(C)COC(C)CC(=O)OC 34a_200012125181_100009817358 [0,2,0,0,0,0|1,0,0]=3 9554 B18R0.6725 CCCCCCCCC(C)COC(C)CC(=O)OC 7a_200012125181_100009817358 [0,2,0,0,0,0|1,0,0]=3 9555 B18R0.6725 CCCCCCCCC(C)OC[C@H](O)CC(=O)OC 34a_100000210740_100000754131 [0,2,0,0,0,0|1,0,0]=3 9556 B18R0.6725 CCCCCCCCC(C)OC[C@H](O)CC(=O)OC 7a_100000210740_100000754131 [0,2,0,0,0,0|1,0,0]=3 9557 B18R0.11019 CCCCCCCCC(CC)NCCCC(=O)NC 270004a_100000740002_200011217995 [0,2,0,0,0,0|2,0,0]=4 9558 B18R0.11019 CCCCCCCCC(CC)OCCCC(=O)NC 34a_200011216270_100000741757 [0,2,0,0,0,0|2,0,0]=4 9559 B18R0.11019 CCCCCCCCC(CC)OCCCC(=O)NC 7a_200011216270_100000741757 [0,2,0,0,0,0|2,0,0]=4 9560 B18R0.11019 CCCCCCCCC(CC)OCCCC(=O)OC 34a_200011216270_100000742333 [0,2,0,0,0,0|1,0,0]=3 9561 B18R0.11019 CCCCCCCCC(CC)OCCCC(=O)OC 7a_200011216270_100011218270 [0,2,0,0,0,0|1,0,0]=3 9562 B18R0.11627 C#CCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000087357_100000204269 [0,2,0,0,0,0|0,0,2]=4 9563 B18R0.11627 C#CCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100153394163 [0,2,0,0,0,0|0,0,2]=4 9564 B18R0.11627 C=CCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100012355270 [0,2,0,0,0,0|0,0,2]=4 9565 B18R0.11627 C=CCCCCCCCC(=O)CCCCC(=O)OC 1458a_100011216160_100000204269 [0,2,0,0,0,0|0,0,2]=4 9566 B18R0.11627 CCCCC#CCCCC(=O)CCCCC(=O)OC 1458a_100000695723_200000047210 [0,2,0,0,0,0|0,0,2]=4 9567 B18R0.11627 CCCCC/C=C/CCC(=O)CCCCC(=O)OC 1458a_200015255902_100000204269 [0,2,0,0,0,0|0,0,2]=4 9568 B18R0.11627 CCCCCC/C=C/CC(=O)CCCCC(=O)OC 1458a_100020681715_100000204269 [0,2,0,0,0,0|0,0,2]=4 9569 B18R0.11627 CCCCCCCC=CC(=O)CCCCC(=O)OC 1458a_200015332781_100000204269 [0,2,0,0,0,0|0,0,2]=4 9570 B18R0.11627 CCCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000210558_100000204269 [0,2,0,0,0,0|0,0,0]=2 9571 B18R0.11627 CCCCCCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210670 [0,2,0,0,0,0|0,0,0]=2 9572 B18R0.11627 CCCCCCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210670 [0,2,0,0,0,0|0,0,1]=3 9573 B18R0.11627 CCCCCCCCCC(=O)CCOCC(=O)OC 1458a_100000210558_100000090808 [0,2,0,0,0,0|0,0,1]=3 9574 B18R0.11627 CCCCCCCCCC(=O)NCCCC(=O)NC 11a_100000740002_100000210558 [0,2,0,0,0,0|1,0,1]=4 9575 B18R0.11627 CCCCCCCCCC(=O)NCCCC(=O)NC 240690a_100000740002_100000210558 [0,2,0,0,0,0|1,0,1]=4 9576 B18R0.11627 CCCCCCCCCC(=O)NCCCC(=O)NC 527a_100000740002_100000210558 [0,2,0,0,0,0|1,0,1]=4 9577 B18R0.11627 CCCCCCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100000210558 [0,2,0,0,0,0|0,0,1]=3 9578 B18R0.11627 CCCCCCCCCC(=O)OCSCC(=O)OC 62a_100000747449_200010990708 [0,2,0,0,0,0|1,0,1]=4 9579 B18R0.11627 CCCCCCCCCC(C)CNCCC(=O)NC 270004a_100000738227_200011218516 [0,2,0,0,0,0|1,0,0]=3 9580 B18R0.11627 CCCCCCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100011215753 [0,2,0,0,0,0|1,0,0]=3 9581 B18R0.11627 CCCCCCCCCC(C)NCCNC(=O)CC 270004a_100132302217_100011215753 [0,2,0,0,0,0|2,0,0]=4 9582 B18R0.11627 CCCCCCCCCC(C)OC/C=C/C(=O)OC 34a_100011218016_100000742655 [0,2,0,0,0,0|0,0,2]=4 9583 B18R0.11627 CCCCCCCCCC(C)OC/C=C/C(=O)OC 7a_100011218016_100000742655 [0,2,0,0,0,0|0,0,2]=4 9584 B18R0.11627 CCCCCCCCCC(C)OCCCC(=O)NC 34a_100011218016_100000741757 [0,2,0,0,0,0|1,0,0]=3 9585 B18R0.11627 CCCCCCCCCC(C)OCCCC(=O)NC 7a_100011218016_100000741757 [0,2,0,0,0,0|1,0,0]=3 9586 B18R0.11627 CCCCCCCCCC(C)OCCCC(=O)OC 34a_100011218016_100000742333 [0,2,0,0,0,0|0,0,0]=2 9587 B18R0.11627 CCCCCCCCCC(C)OCCCC(=O)OC 7a_100011218016_100011218270 [0,2,0,0,0,0|0,0,0]=2 9588 B18R0.11627 CCCCCCCCCC(C)OCCOC(=O)NC 34a_100011218016_200011997002 [0,2,0,0,0,0|2,0,0]=4 9589 B18R0.11627 CCCCCCCCCC(C)OCCOC(=O)NC 7a_100011218016_200011997002 [0,2,0,0,0,0|2,0,0]=4 9590 B18R0.11627 CCCCCCCCCN(C)CCCCC(=O)OC 2230a_100000232482_100000204269 [0,2,0,0,0,0|0,0,0]=2 9591 B18R0.11627 CCCCCCCCCN(C)CCCCC(=O)OC 269982a_100000232482_100000204269 [0,2,0,0,0,0|0,0,0]=2 9592 B18R0.11627 CCCCCCCCCN(C)CCOCC(=O)OC 2230a_100000232482_100000090808 [0,2,0,0,0,0|1,0,0]=3 9593 B18R0.11627 CCCCCCCCNC(=O)CCCCC(=O)OC 11a_100000229939_100000695723 [0,2,0,0,0,0|0,0,1]=3 9594 B18R0.11627 CCCCCCCCNC(=O)CCCCC(=O)OC 1626a_100000229939_100000695723 [0,2,0,0,0,0|0,0,1]=3 9595 B18R0.11627 CCCCCCCCNC(=O)CCCCC(=O)OC 240690a_100000229939_100000695723 [0,2,0,0,0,0|0,0,1]=3 9596 B18R0.11627 CCCCCCCCNC(=O)CCCCC(=O)OC 527a_100000229939_100000695723 [0,2,0,0,0,0|0,0,1]=3 9597 B18R0.11627 CCCCCCCCNC(=O)CCCNC(=O)OC 11a_100000229939_100000753017 [0,2,0,0,0,0|1,0,1]=4 9598 B18R0.11627 CCCCCCCCNC(=O)CCCNC(=O)OC 1626a_100000229939_100000753017 [0,2,0,0,0,0|1,0,1]=4 9599 B18R0.11627 CCCCCCCCNC(=O)CCCNC(=O)OC 240690a_100000229939_100000753017 [0,2,0,0,0,0|1,0,1]=4 9600 B18R0.11627 CCCCCCCCNC(=O)CCCNC(=O)OC 527a_100000229939_100000753017 [0,2,0,0,0,0|1,0,1]=4 9601 B18R0.11627 CCCCCCCNCC(=O)NCCCC(=O)OC 2230a_100000229938_100000230218 [0,2,0,0,0,0|1,0,1]=4 9602 B18R0.11627 CCCCCCCOCC(=O)NCCCC(=O)OC 34a_100000210272_100000230218 [0,2,0,0,0,0|1,0,1]=4 9603 B18R0.11627 CCCCCCCOCC(=O)NCCCC(=O)OC 7a_100000210272_100000230218 [0,2,0,0,0,0|1,0,1]=4 9604 B18R0.11627 CCCCCCCSCC(=O)NCCCC(=O)OC 62a_100000210614_100000230218 [0,2,0,0,0,0|1,0,1]=4 9605 B18R0.11627 CCCCCCCSCC(=O)NCCCC(=O)OC 62a_100000230218_100000210316 [0,2,0,0,0,0|1,0,1]=4 9606 B18R0.11627 CCCCOCCCNC(=O)CCCCC(=O)OC 1626a_200000211371_100000695723 [0,2,0,0,0,0|1,0,1]=4 9607 B18R0.11627 CCCCOCCCNC(=O)CCCCC(=O)OC 240690a_200000211371_100000695723 [0,2,0,0,0,0|1,0,1]=4 9608 B18R0.11627 CCCCOCCCNC(=O)CCCCC(=O)OC 527a_200000211371_100000695723 [0,2,0,0,0,0|1,0,1]=4 9609 B18R0.11627 CCCCOCCOCC(=O)CCCCC(=O)OC 1458a_100011216887_100000204269 [0,2,0,0,0,0|1,0,1]=4 9610 B18R0.11627 COC(=O)CCCCC(=O)CCCCCCCCO 1458a_100000695723_100000033203 [0,2,0,0,0,0|0,0,1]=3 9611 B18R0.11627 COC(=O)CCCCC(=O)NCCCCCCCO 240690a_100011996573_100000695723 [0,2,0,0,0,0|1,0,1]=4 9612 B18R0.11627 COC(=O)CCCNC(=O)CCCCCCCCO 188690a_100000184769_100000015970 [0,2,0,0,0,0|1,0,1]=4 9613 B18R0.11627 COC(=O)NCCCC(=O)CCCCCCCCO 1458a_100000753017_100000033203 [0,2,0,0,0,0|1,0,1]=4 9614 B18R0.13156 CCCCCC(C)CCC(=O)CCCCC(=O)OC 1458a_100000034243_100000204269 [0,2,0,0,0,0|0,0,1]=3 9615 B18R0.13156 CCCCCC(C)CCC(=O)CCOCC(=O)OC 1458a_100000034243_100000090808 [0,2,0,0,0,0|1,0,1]=4 9616 B18R0.13156 CCCCCC(C)CCC(=O)NCCCC(=O)OC 188690a_100000184769_100000034243 [0,2,0,0,0,0|1,0,1]=4 9617 B18R0.13156 CCCCCN(C)CCC(=O)CCCCC(=O)OC 1458a_100016987678_100000204269 [0,2,0,0,0,0|1,0,1]=4 9618 B18R0.15644 COC(=O)CCCCC(=O)CCCCCCC(C)C 1458a_100000040743_100000204269 [0,2,0,0,0,0|0,0,1]=3 9619 B18R0.15644 COC(=O)CCCCC(=O)NCCCCCC(C)C 1626a_100011290863_100000695723 [0,2,0,0,0,0|1,0,1]=4 9620 B18R0.15644 COC(=O)CCCCC(=O)NCCCCCC(C)C 240690a_100011290863_100000695723 [0,2,0,0,0,0|1,0,1]=4 9621 B18R0.15644 COC(=O)CCCCC(=O)NCCCCCC(C)C 527a_100011290863_100000695723 [0,2,0,0,0,0|1,0,1]=4 9622 B18R0.15644 COC(=O)CCCNC(=O)CCCCCCC(C)C 188690a_100000184769_100000040743 [0,2,0,0,0,0|1,0,1]=4 9623 B18R0.15644 COC(=O)COCCC(=O)CCCCCCC(C)C 1458a_100000040743_100000090808 [0,2,0,0,0,0|1,0,1]=4 9624 B18R0.19890 CCCCCCCCC(=O)CC(=O)CCC(=O)OC 1458a_100000210188_100000691467 [0,2,0,0,0,0|0,0,2]=4 9625 B18R0.19890 CCCCCCCCC(C)CN(C)CCC(=O)NC 270004a_100000750875_100011995885 [0,2,0,0,0,0|2,0,0]=4 9626 B18R0.19890 CCCCCCCCN(C)CC(=O)CCC(=O)OC 2230a_100000207567_100000691467 [0,2,0,0,0,0|1,0,1]=4 9627 B18R0.19890 CCCCCCCCN(C)CC(=O)CCC(=O)OC 269982a_100000207567_100000691467 [0,2,0,0,0,0|1,0,1]=4 9628 B18R0.20595 CCCCCCCNS(=O)(=O)CCCCC(=O)OC 270084a_100000229938_100000055593 [0,2,0,0,0,0|2,0,0]=4 9629 B18R0.20595 CCCCCCCNS(=O)(=O)CCCCC(=O)OC 274078a_100000229938_100000055593 [0,2,0,0,0,0|2,0,0]=4 9630 B18R0.20937 C=C(COCC(C)CCCCCCCC)C(=O)OC 34a_200012125181_100009813391 [0,2,0,0,0,0|1,0,1]=4 9631 B18R0.20937 CCCCCCCCC(=O)CCCN(C)C(=O)OC 1458a_100000752137_100000210759 [0,2,0,0,0,0|1,0,1]=4 9632 B18R0.20937 CCCCCCCCC(C)CNCC(C)C(=O)NC 270004a_100015187722_100011995885 [0,2,0,0,0,0|2,0,0]=4 9633 B18R0.20937 CCCCCCCCC(C)COCC(=O)C(=O)OC 34a_200012125181_100011610305 [0,2,0,0,0,0|1,0,1]=4 9634 B18R0.20937 CCCCCCCCC(C)COCC(C)C(=O)OC 34a_200012125181_100000698445 [0,2,0,0,0,0|1,0,0]=3 9635 B18R0.20937 CCCCCCCCC(C)OCCC(C)C(=O)OC 34a_100000210740_100000034942 [0,2,0,0,0,0|1,0,0]=3 9636 B18R0.20937 CCCCCCCCC(C)OCCC(C)C(=O)OC 7a_100000210740_100000034942 [0,2,0,0,0,0|1,0,0]=3 9637 B18R0.131 CCCCCCC(C)CCOCCCC(=O)N(C)C 7a_200011024964_100000737642 [0,2,0,0,0,0|2,0,0]=4 9638 B18R0.137 CCCCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210757 [0,2,0,0,0,0|0,0,1]=3 9639 B18R0.137 CCCCCCC(=O)CCCCCCC(=O)OCC 1458a_100102632555_100009814379 [0,2,0,0,0,0|0,0,1]=3 9640 B18R0.137 CCCCCCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100102632555 [0,2,0,0,0,0|1,0,1]=4 9641 B18R0.137 CCCCCCC(C)CCOCCCC(=O)OCC 34a_200011024964_100009991533 [0,2,0,0,0,0|1,0,0]=3 9642 B18R0.137 CCCCCCC(C)CCOCCCC(=O)OCC 7a_200011024964_100011215271 [0,2,0,0,0,0|1,0,0]=3 9643 B18R0.137 CCCCCCC(C)CCOCCNC(=O)OCC 7a_200011024964_200011445536 [0,2,0,0,0,0|2,0,0]=4 9644 B18R0.137 CCCCCCC(C)NCCCCCC(=O)OCC 2230a_100000210919_100000755133 [0,2,0,0,0,0|1,0,0]=3 9645 B18R0.137 CCCCCCC(C)NCCCCCC(=O)OCC 34a_100000210919_100000755133 [0,2,0,0,0,0|1,0,0]=3 9646 B18R0.137 CCCCCCC(C)NCCCOCC(=O)OCC 2230a_100000210919_100009893628 [0,2,0,0,0,0|2,0,0]=4 9647 B18R0.137 CCCCCCC(C)NCCCOCC(=O)OCC 34a_100000210919_100009893628 [0,2,0,0,0,0|2,0,0]=4 9648 B18R0.137 CCCCCCC(C)OCCCCCC(=O)OCC 34a_100000210265_100000755133 [0,2,0,0,0,0|1,0,0]=3 9649 B18R0.137 CCCCCCC(C)OCCCCCC(=O)OCC 7a_100000210265_100000755133 [0,2,0,0,0,0|1,0,0]=3 9650 B18R0.137 CCCCCCC(C)OCCCCCC(=O)OCC 7a_100011214988_100011215978 [0,2,0,0,0,0|1,0,0]=3 9651 B18R0.137 CCCCCCC(C)OCCCOCC(=O)OCC 34a_100000210265_100009893628 [0,2,0,0,0,0|2,0,0]=4 9652 B18R0.137 CCCCCCC(C)OCCCOCC(=O)OCC 7a_100000210265_100009893628 [0,2,0,0,0,0|2,0,0]=4 9653 B18R0.137 CCCCCCC(C)SCCCCCC(=O)OCC 62a_100000755133_100011215978 [0,2,0,0,0,0|1,0,0]=3 9654 B18R0.137 CCCCCCC(C)SCCCCCC(=O)OCC 62a_100011215978_100000755133 [0,2,0,0,0,0|1,0,0]=3 9655 B18R0.137 CCCCCCC(C)SCCCOCC(=O)OCC 62a_100009893628_100011215978 [0,2,0,0,0,0|2,0,0]=4 9656 B18R0.137 CCCCCCC(C)SCCCOCC(=O)OCC 62a_100011215978_100009893628 [0,2,0,0,0,0|2,0,0]=4 9657 B18R0.137 CCCCCCN(C)CCCCCCC(=O)OCC 2230a_106256046315_100009814379 [0,2,0,0,0,0|1,0,0]=3 9658 B18R0.137 CCCCCCN(C)CCCCCCC(=O)OCC 269982a_106256046315_100009814379 [0,2,0,0,0,0|1,0,0]=3 9659 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 11a_100000209983_100000031895 [0,2,0,0,0,0|1,0,1]=4 9660 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 1626a_100000209983_100000031895 [0,2,0,0,0,0|1,0,1]=4 9661 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 240690a_100000209983_100000031895 [0,2,0,0,0,0|1,0,1]=4 9662 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 527a_100000209983_100000031895 [0,2,0,0,0,0|1,0,1]=4 9663 B18R0.137 CCCCOCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100011995733 [0,2,0,0,0,0|1,0,1]=4 9664 B18R0.137 CCCCOCC(=O)CCCCCCC(=O)OCC 1458a_100000757543_100009814379 [0,2,0,0,0,0|1,0,1]=4 9665 B18R0.137 CCCCOCC(C)OCCCCCC(=O)OCC 34a_100011217071_100000755133 [0,2,0,0,0,0|2,0,0]=4 9666 B18R0.137 CCCCOCC(C)OCCCCCC(=O)OCC 7a_100011217071_100000755133 [0,2,0,0,0,0|2,0,0]=4 9667 B18R0.137 CCCCSCC(=O)CCCCCCC(=O)OCC 1458a_100000191162_100009814379 [0,2,0,0,0,0|1,0,1]=4 9668 B18R0.137 CCCOCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100011215938 [0,2,0,0,0,0|1,0,1]=4 9669 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCCF 1458a_100000031895_100000729378 [0,2,0,0,0,0|1,0,1]=4 9670 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCCO 1458a_100000031895_100000746330 [0,2,0,0,0,0|1,0,1]=4 9671 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCCO 1458a_100102619762_100009814379 [0,2,0,0,0,0|1,0,1]=4 9672 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCOC 1458a_100000031895_100000755781 [0,2,0,0,0,0|1,0,1]=4 9673 B18R0.137 CCOC(=O)CCCCCCN(C)CCCCCO 2230a_100000722520_100009814379 [0,2,0,0,0,0|2,0,0]=4 9674 B18R0.137 CCOC(=O)CCCCCCN(C)CCCCCO 269982a_100000722520_100009814379 [0,2,0,0,0,0|2,0,0]=4 9675 B18R0.137 CCOCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100012232248 [0,2,0,0,0,0|1,0,1]=4 9676 B18R0.6552 CCCCC(C)NC(=O)CCCCCCC(=O)OC 11a_100000126638_100000036694 [0,2,0,0,0,0|1,0,1]=4 9677 B18R0.6552 CCCCC(C)NC(=O)CCCCCCC(=O)OC 1626a_100000126638_100000036694 [0,2,0,0,0,0|1,0,1]=4 9678 B18R0.6552 CCCCC(C)NC(=O)CCCCCCC(=O)OC 240690a_100000126638_100000036694 [0,2,0,0,0,0|1,0,1]=4 9679 B18R0.11174 C#CC(CCCCCBr)OCCCCCC(=O)OC 34a_200010408556_100009816466 [0,2,0,0,0,0|2,0,0]=4 9680 B18R0.11174 C#CC(CCCCCBr)OCCCCCC(=O)OC 7a_200010408556_100009816466 [0,2,0,0,0,0|2,0,0]=4 9681 B18R0.11174 C=CC(CCCCCC)OCCCCCC(=O)OC 34a_200011215977_100009816466 [0,2,0,0,0,0|1,0,0]=3 9682 B18R0.11174 C=CC(CCCCCC)OCCCCCC(=O)OC 7a_200011215977_100009816466 [0,2,0,0,0,0|1,0,0]=3 9683 B18R0.11174 CCCCCCC(CC)OCCCCCC(=O)OC 34a_100011215785_100009816466 [0,2,0,0,0,0|1,0,0]=3 9684 B18R0.11174 CCCCCCC(CC)OCCCCCC(=O)OC 7a_100011215785_100009816466 [0,2,0,0,0,0|1,0,0]=3 9685 B18R0.11295 CCCCCCC(C)CCOC[C@H](O)CC(=O)OC 34a_200011024964_100000754131 [0,2,0,0,0,0|1,0,0]=3 9686 B18R0.11295 CCCCCCC(C)CCOC[C@H](O)CC(=O)OC 7a_200011024964_100000754131 [0,2,0,0,0,0|1,0,0]=3 9687 B18R0.12069 CCC(C)CCNC(=O)CCCCCCC(=O)OC 11a_100020591266_100000036694 [0,2,0,0,0,0|1,0,1]=4 9688 B18R0.12069 CCC(C)CCNC(=O)CCCCCCC(=O)OC 1626a_100020591266_100000036694 [0,2,0,0,0,0|1,0,1]=4 9689 B18R0.12069 CCC(C)CCNC(=O)CCCCCCC(=O)OC 240690a_100020591266_100000036694 [0,2,0,0,0,0|1,0,1]=4 9690 B18R0.12069 CCN(C)CCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100015186262 [0,2,0,0,0,0|1,0,1]=4 9691 B18R0.12071 COC(=O)CCCCCCC(=O)CCCCC(=O)C 1458a_100000036694_100000735457 [0,2,0,0,0,0|0,0,2]=4 9692 B18R0.12071 COC(=O)CCCCCCC(=O)CCCCC(C)C 1458a_100000036694_100011216152 [0,2,0,0,0,0|0,0,1]=3 9693 B18R0.12071 COC(=O)CCCCCCC(=O)CCCCC(C)C 1458a_100011933920_100009815986 [0,2,0,0,0,0|0,0,1]=3 9694 B18R0.12071 COC(=O)CCCCCCC(=O)NCCCC(C)C 11a_200000737386_100000036694 [0,2,0,0,0,0|1,0,1]=4 9695 B18R0.12071 COC(=O)CCCCCCC(=O)NCCCC(C)C 1626a_200000737386_100000036694 [0,2,0,0,0,0|1,0,1]=4 9696 B18R0.12071 COC(=O)CCCCCCC(=O)NCCCC(C)C 240690a_200000737386_100000036694 [0,2,0,0,0,0|1,0,1]=4 9697 B18R0.12071 COC(=O)CCCCCNC(=O)CCCCC(C)C 188690a_100000184999_100011933920 [0,2,0,0,0,0|1,0,1]=4 9698 B18R0.17368 CCCCCCC(C)(C)OCCCCCC(=O)OC 7a_200011995690_100009816466 [0,2,0,0,0,0|1,0,0]=3 9699 B18R0.17368 COC(=O)CCCCCOC(C)(C)CCCCCBr 7a_100010402123_100009816466 [0,2,0,0,0,0|2,0,0]=4 9700 B18R0.19335 C#CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100012094781 [0,2,0,0,0,0|0,0,2]=4 9701 B18R0.19335 C#CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000694772_100009815986 [0,2,0,0,0,0|0,0,2]=4 9702 B18R0.19335 C=CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000700193 [0,2,0,0,0,0|0,0,2]=4 9703 B18R0.19335 C=CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100011934241_100009815986 [0,2,0,0,0,0|0,0,2]=4 9704 B18R0.19335 CCCC/C=C/CC(=O)CCCCCCC(=O)OC 1458a_200016282684_100009815986 [0,2,0,0,0,0|0,0,2]=4 9705 B18R0.19335 CCCCCC#CC(=O)CCCCCCC(=O)OC 1458a_100011215388_100009815986 [0,2,0,0,0,0|0,0,2]=4 9706 B18R0.19335 CCCCCC=CC(=O)CCCCCCC(=O)OC 1458a_100016263427_100009815986 [0,2,0,0,0,0|0,0,2]=4 9707 B18R0.19335 CCCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210614 [0,2,0,0,0,0|0,0,0]=2 9708 B18R0.19335 CCCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000211969_100009815986 [0,2,0,0,0,0|0,0,0]=2 9709 B18R0.19335 CCCCCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100000211969 [0,2,0,0,0,0|0,0,1]=3 9710 B18R0.19335 CCCCCCCC(=O)NCCOCCC(=O)OC 188690a_100102954618_100000211969 [0,2,0,0,0,0|1,0,1]=4 9711 B18R0.19335 CCCCCCCC(=O)OCSCCCC(=O)OC 62a_100011218270_100009852258 [0,2,0,0,0,0|1,0,1]=4 9712 B18R0.19335 CCCCCCCC(C)OCCCCCC(=O)OC 34a_100000074720_200011218727 [0,2,0,0,0,0|0,0,0]=2 9713 B18R0.19335 CCCCCCCC(C)OCCCCCC(=O)OC 34a_200011215852_100009816466 [0,2,0,0,0,0|0,0,0]=2 9714 B18R0.19335 CCCCCCCC(C)OCCCCCC(=O)OC 7a_100000074720_200011218727 [0,2,0,0,0,0|0,0,0]=2 9715 B18R0.19335 CCCCCCCC(C)OCCCCCC(=O)OC 7a_200011215852_100009816466 [0,2,0,0,0,0|0,0,0]=2 9716 B18R0.19335 CCCCCCCC(C)SCCCCCC(=O)OC 62a_100009816466_200011218727 [0,2,0,0,0,0|0,0,0]=2 9717 B18R0.19335 CCCCCCCC(C)SCCCCCC(=O)OC 62a_200011218727_100009816466 [0,2,0,0,0,0|0,0,0]=2 9718 B18R0.19335 CCCCCCCN(C)CCCCCCC(=O)OC 2230a_100000228206_100009815986 [0,2,0,0,0,0|0,0,0]=2 9719 B18R0.19335 CCCCCCCN(C)CCCCCCC(=O)OC 269982a_100000228206_100009815986 [0,2,0,0,0,0|0,0,0]=2 9720 B18R0.19335 CCCCCCNC(=O)CCCCCCC(=O)OC 11a_100000210581_100000036694 [0,2,0,0,0,0|0,0,1]=3 9721 B18R0.19335 CCCCCCNC(=O)CCCCCCC(=O)OC 1626a_100000210581_100000036694 [0,2,0,0,0,0|0,0,1]=3 9722 B18R0.19335 CCCCCCNC(=O)CCCCCCC(=O)OC 240690a_100000210581_100000036694 [0,2,0,0,0,0|0,0,1]=3 9723 B18R0.19335 CCCCCCNC(=O)COCCCCC(=O)OC 34a_100000059025_100000230325 [0,2,0,0,0,0|1,0,1]=4 9724 B18R0.19335 CCCCCCNC(=O)COCCCCC(=O)OC 7a_100000059025_100000230325 [0,2,0,0,0,0|1,0,1]=4 9725 B18R0.19335 CCCCCCNC(=O)CSCCCCC(=O)OC 62a_100000230325_100000204269 [0,2,0,0,0,0|1,0,1]=4 9726 B18R0.19335 CCCCCNNC(=O)CCCCCCC(=O)OC 22a_100000694160_100000036694 [0,2,0,0,0,0|1,0,1]=4 9727 B18R0.19335 CCCCOCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000743108 [0,2,0,0,0,0|0,0,1]=3 9728 B18R0.19335 CCCOCCNC(=O)CCCCCCC(=O)OC 1626a_100161115042_100000036694 [0,2,0,0,0,0|1,0,1]=4 9729 B18R0.19335 CCCOCCNC(=O)CCCCCCC(=O)OC 240690a_100161115042_100000036694 [0,2,0,0,0,0|1,0,1]=4 9730 B18R0.19335 CCCSCCNC(=O)CCCCCCC(=O)OC 11a_100020603323_100000036694 [0,2,0,0,0,0|1,0,1]=4 9731 B18R0.19335 CCCSCCNC(=O)CCCCCCC(=O)OC 240690a_100020603323_100000036694 [0,2,0,0,0,0|1,0,1]=4 9732 B18R0.19335 CCOCCCNC(=O)CCCCCCC(=O)OC 11a_100000210961_100000036694 [0,2,0,0,0,0|1,0,1]=4 9733 B18R0.19335 CCOCCCNC(=O)CCCCCCC(=O)OC 1626a_100000210961_100000036694 [0,2,0,0,0,0|1,0,1]=4 9734 B18R0.19335 CCOCCCNC(=O)CCCCCCC(=O)OC 240690a_100000210961_100000036694 [0,2,0,0,0,0|1,0,1]=4 9735 B18R0.19335 COC(=O)CCCCCCC(=O)CCCCCC#N 1458a_100000036694_100009813376 [0,2,0,0,0,0|0,0,2]=4 9736 B18R0.19335 COC(=O)CCCCCCC(=O)CCCCCCF 1458a_100000036694_100015922095 [0,2,0,0,0,0|0,0,1]=3 9737 B18R0.19335 COC(=O)CCCCCCC(=O)CCCCCCO 1458a_100000036694_100000766143 [0,2,0,0,0,0|0,0,1]=3 9738 B18R0.19335 COC(=O)CCCCCCC(=O)CCCCCCO 1458a_100011996774_100009815986 [0,2,0,0,0,0|0,0,1]=3 9739 B18R0.19335 COC(=O)CCCCCCC(=O)NCCCCCO 240690a_100000762737_100000036694 [0,2,0,0,0,0|1,0,1]=4 9740 B18R0.19335 COC(=O)CCCCCNC(=O)CCCCCCO 188690a_100000184999_100011996774 [0,2,0,0,0,0|1,0,1]=4 9741 B18R0.19335 COCCCCCC(=O)CCCCCCC(=O)OC 1458a_100011935119_100009815986 [0,2,0,0,0,0|0,0,1]=3 9742 B18R0.19335 COCCCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100011935119 [0,2,0,0,0,0|1,0,1]=4 9743 B18R0.19335 COCCOCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000695917 [0,2,0,0,0,0|1,0,1]=4 9744 B18R0.19335 COCCOCCC(=O)CCCCCCC(=O)OC 1458a_100000745395_100009815986 [0,2,0,0,0,0|1,0,1]=4 9745 B18R0.19899 CCCCCCC(C)CCOCCC(C)C(=O)OC 34a_200011024964_100000034942 [0,2,0,0,0,0|1,0,0]=3 9746 B18R0.19899 CCCCCCC(C)CCOCCC(C)C(=O)OC 7a_200011024964_100000034942 [0,2,0,0,0,0|1,0,0]=3 9747 B18R0.19959 CCCCCC(C)C(=O)CCCCCCC(=O)OC 1458a_100000036694_200011218191 [0,2,0,0,0,0|0,0,1]=3 9748 B18R0.19959 CCCCCC(C)C(=O)CCCCCCC(=O)OC 1458a_100011215998_100009815986 [0,2,0,0,0,0|0,0,1]=3 9749 B18R0.19959 CCCCCC(C)C(=O)NCCCCCC(=O)OC 188690a_100000184999_100011215998 [0,2,0,0,0,0|1,0,1]=4 9750 B18R0.19959 CCCCCN(C)C(=O)CCCCCCC(=O)OC 11a_100000223495_100000036694 [0,2,0,0,0,0|1,0,1]=4 9751 B18R0.19959 CCCCCN(C)C(=O)CCCCCCC(=O)OC 1626a_100000223495_100000036694 [0,2,0,0,0,0|1,0,1]=4 9752 B18R0.19959 CCCCCN(C)C(=O)CCCCCCC(=O)OC 240690a_100000223495_100000036694 [0,2,0,0,0,0|1,0,1]=4 9753 B18R0.19959 CCCCSC(C)C(=O)CCCCCCC(=O)OC 1458a_100000191163_100009815986 [0,2,0,0,0,0|1,0,1]=4 9754 B18R0.110 C#CCC(=O)CCCCCCCCCCCCCC 1458a_100000297455_100000184674 [0,2,0,0,0,0|1,0,1]=4 9755 B18R0.110 C#CCC(=O)CCCCCCCCCCCCCC 1458a_100011220946_100011215471 [0,2,0,0,0,0|1,0,1]=4 9756 B18R0.110 C#CCC(=O)CCCCCCCCCCCCCO 1458a_100011220946_100009812470 [0,2,0,0,0,0|1,0,1]=4 9757 B18R0.110 C#CCC(=O)NCCCCCCCCCCCCC 1626a_100011215765_100011220946 [0,2,0,0,0,0|1,0,1]=4 9758 B18R0.110 C#CCC(=O)NCCCCCCCCCCCCC 527a_100011215765_100011220946 [0,2,0,0,0,0|1,0,1]=4 9759 B18R0.110 C#CCCCCCCCCCCOCC(=O)OCC 34a_100000054667_100000188475 [0,2,0,0,0,0|0,0,2]=4 9760 B18R0.110 C#CCCCCCCCCCCOCC(=O)OCC 7a_100000054667_100000188475 [0,2,0,0,0,0|0,0,2]=4 9761 B18R0.110 C#CCCCCCCCCCOCCC(=O)OCC 34a_100000034437_100000765890 [0,2,0,0,0,0|0,0,2]=4 9762 B18R0.110 C#CCCCCCCCCCOCCC(=O)OCC 7a_100000034437_100011206558 [0,2,0,0,0,0|0,0,2]=4 9763 B18R0.110 C#CCCCCCCCCOCCCC(=O)OCC 34a_100000065265_100009991533 [0,2,0,0,0,0|0,0,2]=4 9764 B18R0.110 C#CCCCCCCCCOCCCC(=O)OCC 7a_100000065265_100011215271 [0,2,0,0,0,0|0,0,2]=4 9765 B18R0.110 C#CCCCCCCCOCCCCC(=O)OCC 34a_100000054614_100000750268 [0,2,0,0,0,0|0,0,2]=4 9766 B18R0.110 C#CCCCCCCCOCCCCC(=O)OCC 7a_100000054614_100000750268 [0,2,0,0,0,0|0,0,2]=4 9767 B18R0.110 C#CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100153394163 [0,2,0,0,0,0|0,0,2]=4 9768 B18R0.110 C#CCCCCCCCSCCCCC(=O)OCC 62a_100153394163_100000750268 [0,2,0,0,0,0|0,0,2]=4 9769 B18R0.110 C#CCCCCCCOCCCCCC(=O)OCC 34a_100011217361_100000755133 [0,2,0,0,0,0|0,0,2]=4 9770 B18R0.110 C#CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100012276617 [0,2,0,0,0,0|0,0,2]=4 9771 B18R0.110 C#CCCCCCCOCCCCCC(=O)OCC 7a_100011217361_100000755133 [0,2,0,0,0,0|0,0,2]=4 9772 B18R0.110 C#CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100012276617 [0,2,0,0,0,0|0,0,2]=4 9773 B18R0.110 C#CCCCCCCSCCCCCC(=O)OCC 62a_100012276617_100000755133 [0,2,0,0,0,0|0,0,2]=4 9774 B18R0.110 C#CCCCCCOCCCCCCC(=O)OCC 34a_100000766912_100009814379 [0,2,0,0,0,0|0,0,2]=4 9775 B18R0.110 C#CCCCCCOCCCCCCC(=O)OCC 7a_100000766912_100009814379 [0,2,0,0,0,0|0,0,2]=4 9776 B18R0.110 C#CCCCCCSCCCCCCC(=O)OCC 62a_100012094781_100009814379 [0,2,0,0,0,0|0,0,2]=4 9777 B18R0.110 C#CCCCCNCCCCCCCC(=O)OCC 2230a_100000706060_100009991516 [0,2,0,0,0,0|0,0,2]=4 9778 B18R0.110 C#CCCCCNCCCCCCCC(=O)OCC 34a_100000706060_100009991516 [0,2,0,0,0,0|0,0,2]=4 9779 B18R0.110 C#CCCCCOCCCCCCCC(=O)OCC 34a_100000766709_100009991516 [0,2,0,0,0,0|0,0,2]=4 9780 B18R0.110 C#CCCCCOCCCCCCCC(=O)OCC 7a_100000766709_100009991516 [0,2,0,0,0,0|0,0,2]=4 9781 B18R0.110 C#CCCCCSCCCCCCCC(=O)OCC 62a_100010269958_100009991516 [0,2,0,0,0,0|0,0,2]=4 9782 B18R0.110 C#CCCCNCCCCCCCCC(=O)OCC 34a_100000718082_100010175975 [0,2,0,0,0,0|0,0,2]=4 9783 B18R0.110 C#CCCCOCCCCCCCCC(=O)OCC 34a_100000215630_100010175975 [0,2,0,0,0,0|0,0,2]=4 9784 B18R0.110 C#CCCCOCCCCCCCCC(=O)OCC 7a_100000215630_100010175975 [0,2,0,0,0,0|0,0,2]=4 9785 B18R0.110 C#CCCCSCCCCCCCCC(=O)OCC 62a_100011215417_100010175975 [0,2,0,0,0,0|0,0,2]=4 9786 B18R0.110 C#CCCNCCCCCCCCCC(=O)OCC 34a_100000755551_100009828014 [0,2,0,0,0,0|0,0,2]=4 9787 B18R0.110 C#CCCOCCCCCCCCCC(=O)OCC 34a_100011215631_100009828014 [0,2,0,0,0,0|0,0,2]=4 9788 B18R0.110 C#CCCSCCCCCCCCCC(=O)OCC 62a_100000688953_100009828014 [0,2,0,0,0,0|0,0,2]=4 9789 B18R0.110 C#CCNCCCCCCCCCCC(=O)OCC 34a_100000212058_100009827693 [0,2,0,0,0,0|0,0,2]=4 9790 B18R0.110 C#CCOCCCCCCCCCCC(=O)OCC 34a_100000210247_100009827693 [0,2,0,0,0,0|0,0,2]=4 9791 B18R0.110 C#CCSCCCCCCCCCCC(=O)OCC 62a_100000038162_100009827693 [0,2,0,0,0,0|0,0,2]=4 9792 B18R0.110 C/C=C/CCOCCCCCCCCC(=O)OCC 34a_100016278192_100010175975 [0,2,0,0,0,0|0,0,2]=4 9793 B18R0.110 C/C=C/COCCCCCCCCCC(=O)OCC 34a_100016270725_100009828014 [0,2,0,0,0,0|0,0,2]=4 9794 B18R0.110 C/C=C/CSCCCCCCCCCC(=O)OCC 62a_100102629194_100009828014 [0,2,0,0,0,0|0,0,2]=4 9795 B18R0.110 C=CCC(=O)NCCCCCCCCCCCCC 11a_100011215765_100000210193 [0,2,0,0,0,0|1,0,1]=4 9796 B18R0.110 C=CCC(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000210193 [0,2,0,0,0,0|1,0,1]=4 9797 B18R0.110 C=CCC(=O)NCCCCCCCCCCCCC 240690a_100011215765_100000210193 [0,2,0,0,0,0|1,0,1]=4 9798 B18R0.110 C=CCC(=O)NCCCCCCCCCCCCC 527a_100011215765_100000210193 [0,2,0,0,0,0|1,0,1]=4 9799 B18R0.110 C=CCCCCCCCCCCSCC(=O)OCC 62a_100000188475_100011093070 [0,2,0,0,0,0|0,0,2]=4 9800 B18R0.110 C=CCCCCCCCCCCSCC(=O)OCC 62a_100011093070_100000188475 [0,2,0,0,0,0|0,0,2]=4 9801 B18R0.110 C=CCCCCCCCCCNCCC(=O)OCC 2230a_100000081888_100011206558 [0,2,0,0,0,0|0,0,2]=4 9802 B18R0.110 C=CCCCCCCCCCNCCC(=O)OCC 34a_100000081888_100000765890 [0,2,0,0,0,0|0,0,2]=4 9803 B18R0.110 C=CCCCCCCCCCOCCC(=O)OCC 34a_100000038209_100000765890 [0,2,0,0,0,0|0,0,2]=4 9804 B18R0.110 C=CCCCCCCCCCOCCC(=O)OCC 7a_100000038209_100011206558 [0,2,0,0,0,0|0,0,2]=4 9805 B18R0.110 C=CCCCCCCCCCSCCC(=O)OCC 62a_100000765890_100009814027 [0,2,0,0,0,0|0,0,2]=4 9806 B18R0.110 C=CCCCCCCCCCSCCC(=O)OCC 62a_100009814027_100000765890 [0,2,0,0,0,0|0,0,2]=4 9807 B18R0.110 C=CCCCCCCCCOCCCC(=O)OCC 34a_100011215194_100009991533 [0,2,0,0,0,0|0,0,2]=4 9808 B18R0.110 C=CCCCCCCCCOCCCC(=O)OCC 7a_100011215194_100011215271 [0,2,0,0,0,0|0,0,2]=4 9809 B18R0.110 C=CCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100011933949 [0,2,0,0,0,0|0,0,2]=4 9810 B18R0.110 C=CCCCCCCCCSCCCC(=O)OCC 62a_100009991533_100011933949 [0,2,0,0,0,0|0,0,2]=4 9811 B18R0.110 C=CCCCCCCCCSCCCC(=O)OCC 62a_100011933949_100009991533 [0,2,0,0,0,0|0,0,2]=4 9812 B18R0.110 C=CCCCCCCCOCCCCC(=O)OCC 34a_100000730831_100000750268 [0,2,0,0,0,0|0,0,2]=4 9813 B18R0.110 C=CCCCCCCCOCCCCC(=O)OCC 7a_100000730831_100000750268 [0,2,0,0,0,0|0,0,2]=4 9814 B18R0.110 C=CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100012355270 [0,2,0,0,0,0|0,0,2]=4 9815 B18R0.110 C=CCCCCCCCSCCCCC(=O)OCC 62a_100012355270_100000750268 [0,2,0,0,0,0|0,0,2]=4 9816 B18R0.110 C=CCCCCCCOCCCCCC(=O)OCC 34a_200011216477_100000755133 [0,2,0,0,0,0|0,0,2]=4 9817 B18R0.110 C=CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100011215473 [0,2,0,0,0,0|0,0,2]=4 9818 B18R0.110 C=CCCCCCCOCCCCCC(=O)OCC 7a_200011216477_100000755133 [0,2,0,0,0,0|0,0,2]=4 9819 B18R0.110 C=CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100011215473 [0,2,0,0,0,0|0,0,2]=4 9820 B18R0.110 C=CCCCCCCSCCCCCC(=O)OCC 62a_100011215473_100000755133 [0,2,0,0,0,0|0,0,2]=4 9821 B18R0.110 C=CCCCCCOCCCCCCC(=O)OCC 34a_100011216702_100009814379 [0,2,0,0,0,0|0,0,2]=4 9822 B18R0.110 C=CCCCCCOCCCCCCC(=O)OCC 7a_100011216702_100009814379 [0,2,0,0,0,0|0,0,2]=4 9823 B18R0.110 C=CCCCCCSCCCCCCC(=O)OCC 62a_100000700193_100009814379 [0,2,0,0,0,0|0,0,2]=4 9824 B18R0.110 C=CCCCCNCCCCCCCC(=O)OCC 2230a_100000703577_100009991516 [0,2,0,0,0,0|0,0,2]=4 9825 B18R0.110 C=CCCCCNCCCCCCCC(=O)OCC 34a_100000703577_100009991516 [0,2,0,0,0,0|0,0,2]=4 9826 B18R0.110 C=CCCCCOCCCCCCCC(=O)OCC 34a_100000766645_100009991516 [0,2,0,0,0,0|0,0,2]=4 9827 B18R0.110 C=CCCCCOCCCCCCCC(=O)OCC 7a_100000766645_100009991516 [0,2,0,0,0,0|0,0,2]=4 9828 B18R0.110 C=CCCCCSCCCCCCCC(=O)OCC 62a_100011215482_100009991516 [0,2,0,0,0,0|0,0,2]=4 9829 B18R0.110 C=CCCCNCCCCCCCCC(=O)OCC 2230a_100000700776_100010175975 [0,2,0,0,0,0|0,0,2]=4 9830 B18R0.110 C=CCCCNCCCCCCCCC(=O)OCC 34a_100000700776_100010175975 [0,2,0,0,0,0|0,0,2]=4 9831 B18R0.110 C=CCCCOCCCCCCCCC(=O)OCC 34a_100000758997_100010175975 [0,2,0,0,0,0|0,0,2]=4 9832 B18R0.110 C=CCCCOCCCCCCCCC(=O)OCC 7a_100000758997_100010175975 [0,2,0,0,0,0|0,0,2]=4 9833 B18R0.110 C=CCCCSCCCCCCCCC(=O)OCC 62a_100011713584_100010175975 [0,2,0,0,0,0|0,0,2]=4 9834 B18R0.110 C=CCCNCCCCCCCCCC(=O)OCC 2230a_100015191253_100009828014 [0,2,0,0,0,0|0,0,2]=4 9835 B18R0.110 C=CCCOCCCCCCCCCC(=O)OCC 34a_100011205117_100009828014 [0,2,0,0,0,0|0,0,2]=4 9836 B18R0.110 C=CCCSCCCCCCCCCC(=O)OCC 62a_100000754431_100009828014 [0,2,0,0,0,0|0,0,2]=4 9837 B18R0.110 C=CCNCCCCCCCCCCC(=O)OCC 2230a_100020586998_100009827693 [0,2,0,0,0,0|0,0,2]=4 9838 B18R0.110 C=CCOCCCCCCCCCCC(=O)OCC 34a_200000210373_100009827693 [0,2,0,0,0,0|0,0,2]=4 9839 B18R0.110 C=CCSCCCCCCCCCCC(=O)OCC 62a_100000210623_100009827693 [0,2,0,0,0,0|0,0,2]=4 9840 B18R0.110 C=COC(=O)CNCCCCCCCCCCCC 2230a_100000210451_100000036128 [0,2,0,0,0,0|0,0,1]=3 9841 B18R0.110 C=COC(=O)CNCCCCCCCCCCCC 34a_100000210451_100000036128 [0,2,0,0,0,0|0,0,1]=3 9842 B18R0.110 C=COC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000036128 [0,2,0,0,0,0|1,0,1]=4 9843 B18R0.110 C=COC(=O)COCCCCCCCCCCCC 34a_100000210810_100000036128 [0,2,0,0,0,0|0,0,1]=3 9844 B18R0.110 C=COC(=O)COCCCCCCCCCOCC 34a_100009875440_100000036128 [0,2,0,0,0,0|1,0,1]=4 9845 B18R0.110 C=COC(=O)CSCCCCCCCCCCCC 62a_100000036128_100000759014 [0,2,0,0,0,0|0,0,1]=3 9846 B18R0.110 C=COC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000036128 [0,2,0,0,0,0|1,0,1]=4 9847 B18R0.110 CC#CC(=O)CCCCCCCCCCCCCC 1458a_100000763181_100011215471 [0,2,0,0,0,0|1,0,0]=3 9848 B18R0.110 CC#CC(=O)CCCCCCCCCCCCCO 1458a_100000763181_100009812470 [0,2,0,0,0,0|1,0,0]=3 9849 B18R0.110 CC#CCCOCCCCCCCCC(=O)OCC 34a_100000750427_100010175975 [0,2,0,0,0,0|0,0,2]=4 9850 B18R0.110 CC#CCNCCCCCCCCCC(=O)OCC 2230a_100000685387_100009828014 [0,2,0,0,0,0|0,0,2]=4 9851 B18R0.110 CC#CCNCCCCCCCCCC(=O)OCC 34a_100000685387_100009828014 [0,2,0,0,0,0|0,0,2]=4 9852 B18R0.110 CC#CCOCCCCCCCCCC(=O)OCC 34a_100000761923_100009828014 [0,2,0,0,0,0|0,0,2]=4 9853 B18R0.110 CC#CCSCCCCCCCCCC(=O)OCC 62a_100000748600_100009828014 [0,2,0,0,0,0|0,0,2]=4 9854 B18R0.110 CC/C=C/CCCOCCCCCCC(=O)OCC 34a_100016287902_100009814379 [0,2,0,0,0,0|0,0,2]=4 9855 B18R0.110 CC/C=C/CCCOCCCCCCC(=O)OCC 7a_100016287902_100009814379 [0,2,0,0,0,0|0,0,2]=4 9856 B18R0.110 CC/C=C\CCCCCOCCCCC(=O)OCC 34a_100016268722_100000750268 [0,2,0,0,0,0|0,0,2]=4 9857 B18R0.110 CC/C=C\CCCCCOCCCCC(=O)OCC 7a_100016268722_100000750268 [0,2,0,0,0,0|0,0,2]=4 9858 B18R0.110 CC/C=C\CCCCOCCCCCC(=O)OCC 34a_100016287862_100000755133 [0,2,0,0,0,0|0,0,2]=4 9859 B18R0.110 CC/C=C\CCCCOCCCCCC(=O)OCC 7a_100016287862_100000755133 [0,2,0,0,0,0|0,0,2]=4 9860 B18R0.110 CC/C=C\CCOCCCCCCCC(=O)OCC 34a_100016288707_100009991516 [0,2,0,0,0,0|0,0,2]=4 9861 B18R0.110 CC/C=C\CCOCCCCCCCC(=O)OCC 7a_100016288707_100009991516 [0,2,0,0,0,0|0,0,2]=4 9862 B18R0.110 CC/C=C\CCSCCCCCCCC(=O)OCC 62a_100015370543_100009991516 [0,2,0,0,0,0|0,0,2]=4 9863 B18R0.110 CC/C=C\COCCCCCCCCC(=O)OCC 34a_100016268518_100010175975 [0,2,0,0,0,0|0,0,2]=4 9864 B18R0.110 CC/C=C\CSCCCCCCCCC(=O)OCC 62a_100103147603_100010175975 [0,2,0,0,0,0|0,0,2]=4 9865 B18R0.110 CC=CC(=O)CCCCCCCCCCCCCO 1458a_100000210699_100009812470 [0,2,0,0,0,0|1,0,0]=3 9866 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCC 11a_100011215765_100000210699 [0,2,0,0,0,0|1,0,0]=3 9867 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000210699 [0,2,0,0,0,0|1,0,0]=3 9868 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCC 240690a_100011215765_100000210699 [0,2,0,0,0,0|1,0,0]=3 9869 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000210699 [0,2,0,0,0,0|2,0,0]=4 9870 B18R0.110 CC=CCCCOCCCCCCCC(=O)OCC 34a_100020645299_100009991516 [0,2,0,0,0,0|0,0,2]=4 9871 B18R0.110 CC=CCSCCCCCCCCCC(=O)OCC 62a_100000070051_100009828014 [0,2,0,0,0,0|0,0,2]=4 9872 B18R0.110 CCC#CCCCCCCCCOCC(=O)OCC 34a_200000031908_100000188475 [0,2,0,0,0,0|0,0,2]=4 9873 B18R0.110 CCC#CCCCCCCCCOCC(=O)OCC 7a_200000031908_100000188475 [0,2,0,0,0,0|0,0,2]=4 9874 B18R0.110 CCC#CCCCCCCOCCCC(=O)OCC 7a_100012001163_200000036426 [0,2,0,0,0,0|0,0,2]=4 9875 B18R0.110 CCC#CCCCCCCSCCCC(=O)OCC 62a_100009991533_200000036426 [0,2,0,0,0,0|0,0,2]=4 9876 B18R0.110 CCC#CCCCCCCSCCCC(=O)OCC 62a_200000036426_100009991533 [0,2,0,0,0,0|0,0,2]=4 9877 B18R0.110 CCC#CCCOCCCCCCCC(=O)OCC 34a_100000036655_100009991516 [0,2,0,0,0,0|0,0,2]=4 9878 B18R0.110 CCC#CCCOCCCCCCCC(=O)OCC 7a_100000036655_100009991516 [0,2,0,0,0,0|0,0,2]=4 9879 B18R0.110 CCC#CCOCCCCCCCCC(=O)OCC 34a_100000032950_100010175975 [0,2,0,0,0,0|0,0,2]=4 9880 B18R0.110 CCC#CCSCCCCCCCCC(=O)OCC 62a_100009813939_100010175975 [0,2,0,0,0,0|0,0,2]=4 9881 B18R0.110 CCC/C=C/COCCCCCCCC(=O)OCC 34a_100016278788_100009991516 [0,2,0,0,0,0|0,0,2]=4 9882 B18R0.110 CCC/C=C/COCCCCCCCC(=O)OCC 7a_100016278788_100009991516 [0,2,0,0,0,0|0,0,2]=4 9883 B18R0.110 CCCC#CCCOCCCCCCC(=O)OCC 34a_100000042726_100009814379 [0,2,0,0,0,0|0,0,2]=4 9884 B18R0.110 CCCC#CCCOCCCCCCC(=O)OCC 7a_100000042726_100009814379 [0,2,0,0,0,0|0,0,2]=4 9885 B18R0.110 CCCC#CCOCCCCCCCC(=O)OCC 34a_100000034806_100009991516 [0,2,0,0,0,0|0,0,2]=4 9886 B18R0.110 CCCC#CCOCCCCCCCC(=O)OCC 7a_100000034806_100009991516 [0,2,0,0,0,0|0,0,2]=4 9887 B18R0.110 CCCC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000211992 [0,2,0,0,0,0|2,0,0]=4 9888 B18R0.110 CCCC/C=C/CCCCOCCCC(=O)OCC 34a_200020645093_100009991533 [0,2,0,0,0,0|0,0,2]=4 9889 B18R0.110 CCCC/C=C/CCCCOCCCC(=O)OCC 7a_200020645093_100011215271 [0,2,0,0,0,0|0,0,2]=4 9890 B18R0.110 CCCC/C=C/COCCCCCCC(=O)OCC 34a_200016272032_100009814379 [0,2,0,0,0,0|0,0,2]=4 9891 B18R0.110 CCCC/C=C/COCCCCCCC(=O)OCC 7a_200016272032_100009814379 [0,2,0,0,0,0|0,0,2]=4 9892 B18R0.110 CCCC/C=C\CCOCCCCCC(=O)OCC 34a_200016286491_100000755133 [0,2,0,0,0,0|0,0,2]=4 9893 B18R0.110 CCCC/C=C\CCOCCCCCC(=O)OCC 7a_200016286491_100000755133 [0,2,0,0,0,0|0,0,2]=4 9894 B18R0.110 CCCCC#CCCCCCCSCC(=O)OCC 62a_100000188475_200000043322 [0,2,0,0,0,0|0,0,2]=4 9895 B18R0.110 CCCCC#CCCCCCCSCC(=O)OCC 62a_200000043322_100000188475 [0,2,0,0,0,0|0,0,2]=4 9896 B18R0.110 CCCCC#CCCCCOCCCC(=O)OCC 34a_200000066234_100009991533 [0,2,0,0,0,0|0,0,2]=4 9897 B18R0.110 CCCCC#CCCCCOCCCC(=O)OCC 7a_200000066234_100011215271 [0,2,0,0,0,0|0,0,2]=4 9898 B18R0.110 CCCCC#CCCCSCCCCC(=O)OCC 62a_100000750268_200000047210 [0,2,0,0,0,0|0,0,2]=4 9899 B18R0.110 CCCCC#CCCCSCCCCC(=O)OCC 62a_200000047210_100000750268 [0,2,0,0,0,0|0,0,2]=4 9900 B18R0.110 CCCCC#CCCOCCCCCC(=O)OCC 34a_100000037610_100000755133 [0,2,0,0,0,0|0,0,2]=4 9901 B18R0.110 CCCCC#CCCOCCCCCC(=O)OCC 7a_100000037610_100000755133 [0,2,0,0,0,0|0,0,2]=4 9902 B18R0.110 CCCCC#CCOCCCCCCC(=O)OCC 34a_200000034558_100009814379 [0,2,0,0,0,0|0,0,2]=4 9903 B18R0.110 CCCCC#CCOCCCCCCC(=O)OCC 7a_200000034558_100009814379 [0,2,0,0,0,0|0,0,2]=4 9904 B18R0.110 CCCCC/C=C/COCCCCCC(=O)OCC 34a_100016258190_100000755133 [0,2,0,0,0,0|0,0,2]=4 9905 B18R0.110 CCCCC/C=C/COCCCCCC(=O)OCC 7a_100016258190_100000755133 [0,2,0,0,0,0|0,0,2]=4 9906 B18R0.110 CCCCC/C=C\CCCOCCCC(=O)OCC 34a_100020655193_100009991533 [0,2,0,0,0,0|0,0,2]=4 9907 B18R0.110 CCCCC/C=C\CCCOCCCC(=O)OCC 7a_100020655193_100011215271 [0,2,0,0,0,0|0,0,2]=4 9908 B18R0.110 CCCCC/C=C\CCOCCCCC(=O)OCC 34a_100016277358_100000750268 [0,2,0,0,0,0|0,0,2]=4 9909 B18R0.110 CCCCC/C=C\CCOCCCCC(=O)OCC 7a_100016277358_100000750268 [0,2,0,0,0,0|0,0,2]=4 9910 B18R0.110 CCCCCC#CCCOCCCCC(=O)OCC 34a_200000042877_100000750268 [0,2,0,0,0,0|0,0,2]=4 9911 B18R0.110 CCCCCC#CCCOCCCCC(=O)OCC 7a_200000042877_100000750268 [0,2,0,0,0,0|0,0,2]=4 9912 B18R0.110 CCCCCC#CCOCCCCCC(=O)OCC 34a_200000033628_100000755133 [0,2,0,0,0,0|0,0,2]=4 9913 B18R0.110 CCCCCC#CCOCCCCCC(=O)OCC 7a_100011214988_100009816472 [0,2,0,0,0,0|0,0,2]=4 9914 B18R0.110 CCCCCC#CCOCCCCCC(=O)OCC 7a_200000033628_100000755133 [0,2,0,0,0,0|0,0,2]=4 9915 B18R0.110 CCCCCC#CCSCCCCCC(=O)OCC 62a_100000755133_100009816472 [0,2,0,0,0,0|0,0,2]=4 9916 B18R0.110 CCCCCC#CCSCCCCCC(=O)OCC 62a_100009816472_100000755133 [0,2,0,0,0,0|0,0,2]=4 9917 B18R0.110 CCCCCC/C=C/COCCCCC(=O)OCC 34a_200016276170_100000750268 [0,2,0,0,0,0|0,0,2]=4 9918 B18R0.110 CCCCCC/C=C/COCCCCC(=O)OCC 7a_200016276170_100000750268 [0,2,0,0,0,0|0,0,2]=4 9919 B18R0.110 CCCCCCC#CCCOCCCC(=O)OCC 34a_200000033163_100009991533 [0,2,0,0,0,0|0,0,2]=4 9920 B18R0.110 CCCCCCC#CCCOCCCC(=O)OCC 7a_200000033163_100011215271 [0,2,0,0,0,0|0,0,2]=4 9921 B18R0.110 CCCCCCC#CCOCCCCC(=O)OCC 34a_200000037284_100000750268 [0,2,0,0,0,0|0,0,2]=4 9922 B18R0.110 CCCCCCC#CCOCCCCC(=O)OCC 7a_200000037284_100000750268 [0,2,0,0,0,0|0,0,2]=4 9923 B18R0.110 CCCCCCCC#CCOCCCC(=O)OCC 34a_200000061759_100009991533 [0,2,0,0,0,0|0,0,2]=4 9924 B18R0.110 CCCCCCCC#CCOCCCC(=O)OCC 7a_200000061759_100011215271 [0,2,0,0,0,0|0,0,2]=4 9925 B18R0.110 CCCCCCCC/C=C/COCCC(=O)OCC 34a_200020667288_100000765890 [0,2,0,0,0,0|0,0,2]=4 9926 B18R0.110 CCCCCCCC/C=C/COCCC(=O)OCC 7a_200020667288_100011206558 [0,2,0,0,0,0|0,0,2]=4 9927 B18R0.110 CCCCCCCCC/C=C/COCC(=O)OCC 34a_100015232335_100000188475 [0,2,0,0,0,0|0,0,2]=4 9928 B18R0.110 CCCCCCCCC/C=C/COCC(=O)OCC 7a_100015232335_100000188475 [0,2,0,0,0,0|0,0,2]=4 9929 B18R0.110 CCCCCCCCCCCC=NNC(=O)COC 4a_100000216845_100011218549 [0,2,0,0,0,0|1,0,1]=4 9930 B18R0.110 CCCCCCCCCCCCCCC(=O)CC#N 1458a_100000297455_100011214920 [0,2,0,0,0,0|1,0,1]=4 9931 B18R0.110 CCCCCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100011215471 [0,2,0,0,0,0|1,0,1]=4 9932 B18R0.110 CCCCCCCCCCCCCCC(=O)NCC 11a_100015525214_100000297455 [0,2,0,0,0,0|1,0,0]=3 9933 B18R0.110 CCCCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000297455 [0,2,0,0,0,0|1,0,0]=3 9934 B18R0.110 CCCCCCCCCCCCCCC(=O)NNC 22a_100016993582_100000297455 [0,2,0,0,0,0|1,0,0]=3 9935 B18R0.110 CCCCCCCCCCCCCNC(=O)C=CBr 1626a_100011215765_100016273825 [0,2,0,0,0,0|1,0,1]=4 9936 B18R0.110 CCCCCCCCCCCCCNC(=O)C=CBr 240690a_100011215765_100016273825 [0,2,0,0,0,0|1,0,1]=4 9937 B18R0.110 CCCCCCCCCCCCCNC(=O)C=CCl 11a_100011215765_200016279998 [0,2,0,0,0,0|1,0,1]=4 9938 B18R0.110 CCCCCCCCCCCCCNC(=O)C=CCl 1626a_100011215765_200016279998 [0,2,0,0,0,0|1,0,1]=4 9939 B18R0.110 CCCCCCCCCCCCCNC(=O)C=CCl 240690a_100011215765_200016279998 [0,2,0,0,0,0|1,0,1]=4 9940 B18R0.110 CCCCCCCCCCCCCNC(=O)C=CI 1626a_100011215765_100016256311 [0,2,0,0,0,0|1,0,1]=4 9941 B18R0.110 CCCCCCCCCCCCCNC(=O)CC#N 1626a_100011215765_100051588842 [0,2,0,0,0,0|1,0,1]=4 9942 B18R0.110 CCCCCCCCCCCCCNC(=O)CC#N 240690a_100011215765_100051588842 [0,2,0,0,0,0|1,0,1]=4 9943 B18R0.110 CCCCCCCCCCCCCNC(=O)CCC 11a_100011215765_100000211992 [0,2,0,0,0,0|1,0,0]=3 9944 B18R0.110 CCCCCCCCCCCCCNC(=O)CCC 1626a_100011215765_100000211992 [0,2,0,0,0,0|1,0,0]=3 9945 B18R0.110 CCCCCCCCCCCCCNC(=O)CCC 240690a_100011215765_100000211992 [0,2,0,0,0,0|1,0,0]=3 9946 B18R0.110 CCCCCCCCCCCCCNC(=O)CCC 527a_100011215765_100000211992 [0,2,0,0,0,0|1,0,0]=3 9947 B18R0.110 CCCCCCCCCCCCCNC(=O)CCO 240690a_100011215765_100011216618 [0,2,0,0,0,0|1,0,0]=3 9948 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 11a_100011215765_100000210968 [0,2,0,0,0,0|0,0,0]=2 9949 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 1626a_100011215765_100000210968 [0,2,0,0,0,0|0,0,0]=2 9950 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 240690a_100011215765_100000210968 [0,2,0,0,0,0|0,0,0]=2 9951 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 527a_100011215765_100000210968 [0,2,0,0,0,0|0,0,0]=2 9952 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 11a_100011215765_100000184570 [0,2,0,0,0,0|0,1,0]=3 9953 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 1626a_100011215765_100000184570 [0,2,0,0,0,0|0,1,0]=3 9954 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 240690a_100011215765_100000184570 [0,2,0,0,0,0|0,1,0]=3 9955 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 527a_100011215765_100000184570 [0,2,0,0,0,0|0,1,0]=3 9956 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 2708a_100011215765_100015525214 [0,2,0,0,0,0|1,0,0]=3 9957 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 2708a_100015525214_100011215765 [0,2,0,0,0,0|1,0,0]=3 9958 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 273464a_100011215765_100015525214 [0,2,0,0,0,0|1,0,0]=3 9959 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 273464a_100015525214_100011215765 [0,2,0,0,0,0|1,0,0]=3 9960 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 512a_100011215765_100015525214 [0,2,0,0,0,0|1,0,0]=3 9961 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 512a_100015525214_100011215765 [0,2,0,0,0,0|1,0,0]=3 9962 B18R0.110 CCCCCCCCCCCCCNC(=O)NNC 273464a_100011215765_100016993582 [0,2,0,0,0,0|1,0,0]=3 9963 B18R0.110 CCCCCCCCCCCCCNC(=O)NNC 512a_100011215765_100016993582 [0,2,0,0,0,0|1,0,0]=3 9964 B18R0.110 CCCCCCCCCCCCCNC(=O)NNC 512a_100016993582_100011215765 [0,2,0,0,0,0|1,0,0]=3 9965 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 2230a_100000210451_100000183381 [0,2,0,0,0,0|1,0,0]=3 9966 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011215052 [0,2,0,0,0,0|1,0,0]=3 9967 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 270004a_100016988866_100011218549 [0,2,0,0,0,0|1,0,0]=3 9968 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 34a_100000210451_100000183381 [0,2,0,0,0,0|1,0,0]=3 9969 B18R0.110 CCCCCCCCCCCCNCC(=O)NCO 2230a_100000210451_100000185155 [0,2,0,0,0,0|1,0,0]=3 9970 B18R0.110 CCCCCCCCCCCCNCC(=O)NCO 34a_100000210451_100000185155 [0,2,0,0,0,0|1,0,0]=3 9971 B18R0.110 CCCCCCCCCCCCNCC(=O)OCC 2230a_100000210451_100000188475 [0,2,0,0,0,0|0,0,0]=2 9972 B18R0.110 CCCCCCCCCCCCNCC(=O)OCC 34a_100000210451_100000188475 [0,2,0,0,0,0|0,0,0]=2 9973 B18R0.110 CCCCCCCCCCCCOCC(=O)NCC 34a_100000210810_100000183381 [0,2,0,0,0,0|1,0,0]=3 9974 B18R0.110 CCCCCCCCCCCCOCC(=O)NCC 7a_100000210810_100000183381 [0,2,0,0,0,0|1,0,0]=3 9975 B18R0.110 CCCCCCCCCCCCOCC(=O)NCO 34a_100000210810_100000185155 [0,2,0,0,0,0|1,0,0]=3 9976 B18R0.110 CCCCCCCCCCCCOCC(=O)NCO 7a_100000210810_100000185155 [0,2,0,0,0,0|1,0,0]=3 9977 B18R0.110 CCCCCCCCCCCCOCC(=O)OCC 34a_100000210810_100000188475 [0,2,0,0,0,0|0,0,0]=2 9978 B18R0.110 CCCCCCCCCCCCOCC(=O)OCC 7a_100000210810_100000188475 [0,2,0,0,0,0|0,0,0]=2 9979 B18R0.110 CCCCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000759014 [0,2,0,0,0,0|1,0,0]=3 9980 B18R0.110 CCCCCCCCCCCCSCC(=O)NCO 62a_100000185155_100000759014 [0,2,0,0,0,0|1,0,0]=3 9981 B18R0.110 CCCCCCCCCCCCSCC(=O)OCC 62a_100000188475_100000759014 [0,2,0,0,0,0|0,0,0]=2 9982 B18R0.110 CCCCCCCCCCCNCCC(=O)NCC 2230a_200011215754_100000737597 [0,2,0,0,0,0|1,0,0]=3 9983 B18R0.110 CCCCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011215454 [0,2,0,0,0,0|1,0,0]=3 9984 B18R0.110 CCCCCCCCCCCNCCC(=O)OCC 2230a_200011215754_100011206558 [0,2,0,0,0,0|0,0,0]=2 9985 B18R0.110 CCCCCCCCCCCNCCC(=O)OCC 34a_200011215754_100000765890 [0,2,0,0,0,0|0,0,0]=2 9986 B18R0.110 CCCCCCCCCCCNCOC(=O)CCC 2230a_200011215754_100000034017 [0,2,0,0,0,0|2,0,0]=4 9987 B18R0.110 CCCCCCCCCCCNCOC(=O)CCC 34a_200011215754_100000034017 [0,2,0,0,0,0|2,0,0]=4 9988 B18R0.110 CCCCCCCCCCCOCCC(=O)NCC 7a_100000210809_100000737597 [0,2,0,0,0,0|1,0,0]=3 9989 B18R0.110 CCCCCCCCCCCOCCC(=O)OCC 34a_100000210809_100000765890 [0,2,0,0,0,0|0,0,0]=2 9990 B18R0.110 CCCCCCCCCCCOCCC(=O)OCC 7a_100000210809_100011206558 [0,2,0,0,0,0|0,0,0]=2 9991 B18R0.110 CCCCCCCCCCCOCOC(=O)CCC 34a_100000210809_100000034017 [0,2,0,0,0,0|2,0,0]=4 9992 B18R0.110 CCCCCCCCCCCSCCC(=O)NCC 62a_100000737597_100011215454 [0,2,0,0,0,0|1,0,0]=3 9993 B18R0.110 CCCCCCCCCCCSCCC(=O)OCC 62a_100000765890_100011215454 [0,2,0,0,0,0|0,0,0]=2 9994 B18R0.110 CCCCCCCCCCNC/C=C/C(=O)OCC 2230a_100000684558_100016267167 [0,2,0,0,0,0|0,0,2]=4 9995 B18R0.110 CCCCCCCCCCNC/C=C/C(=O)OCC 34a_100000684558_100016267167 [0,2,0,0,0,0|0,0,2]=4 9996 B18R0.110 CCCCCCCCCCNCCCC(=O)OCC 2230a_100000684558_100009991533 [0,2,0,0,0,0|0,0,0]=2 9997 B18R0.110 CCCCCCCCCCNCCCC(=O)OCC 34a_100000684558_100009991533 [0,2,0,0,0,0|0,0,0]=2 9998 B18R0.110 CCCCCCCCCCOC/C=C/C(=O)OCC 34a_100000210711_100016267167 [0,2,0,0,0,0|0,0,2]=4 9999 B18R0.110 CCCCCCCCCCOC/C=C/C(=O)OCC 7a_100000210711_100016267167 [0,2,0,0,0,0|0,0,2]=4 10000 B18R0.110 CCCCCCCCCCOCCCC(=O)OCC 34a_100000210711_100009991533 [0,2,0,0,0,0|0,0,0]=2 10001 B18R0.110 CCCCCCCCCCOCCCC(=O)OCC 7a_100000210711_100011215271 [0,2,0,0,0,0|0,0,0]=2 10002 B18R0.110 CCCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210320 [0,2,0,0,0,0|0,0,0]=2 10003 B18R0.110 CCCCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210320 [0,2,0,0,0,0|1,0,0]=3 10004 B18R0.110 CCCCCCCCCCOCCNC(=O)OCC 7a_100000210711_200011445536 [0,2,0,0,0,0|1,0,0]=3 10005 B18R0.110 CCCCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210320 [0,2,0,0,0,0|0,0,2]=4 10006 B18R0.110 CCCCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210320 [0,2,0,0,0,0|0,0,0]=2 10007 B18R0.110 CCCCCCCCCNCCCCC(=O)OCC 2230a_100000212291_100000750268 [0,2,0,0,0,0|0,0,0]=2 10008 B18R0.110 CCCCCCCCCNCCCCC(=O)OCC 34a_100000212291_100000750268 [0,2,0,0,0,0|0,0,0]=2 10009 B18R0.110 CCCCCCCCCNCCOCC(=O)OCC 2230a_100000212291_100000088970 [0,2,0,0,0,0|1,0,0]=3 10010 B18R0.110 CCCCCCCCCNCCOCC(=O)OCC 34a_100000212291_100000088970 [0,2,0,0,0,0|1,0,0]=3 10011 B18R0.110 CCCCCCCCCOCCCCC(=O)OCC 34a_100000210712_100000750268 [0,2,0,0,0,0|0,0,0]=2 10012 B18R0.110 CCCCCCCCCOCCCCC(=O)OCC 7a_100000210712_100000750268 [0,2,0,0,0,0|0,0,0]=2 10013 B18R0.110 CCCCCCCCCOCCOCC(=O)OCC 34a_100000210712_100000088970 [0,2,0,0,0,0|1,0,0]=3 10014 B18R0.110 CCCCCCCCCOCCOCC(=O)OCC 7a_100000210712_100000088970 [0,2,0,0,0,0|1,0,0]=3 10015 B18R0.110 CCCCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210328 [0,2,0,0,0,0|1,0,0]=3 10016 B18R0.110 CCCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210670 [0,2,0,0,0,0|0,0,0]=2 10017 B18R0.110 CCCCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210670 [0,2,0,0,0,0|1,0,0]=3 10018 B18R0.110 CCCCCCCCNCCCCCC(=O)OCC 2230a_100000229939_100000755133 [0,2,0,0,0,0|0,0,0]=2 10019 B18R0.110 CCCCCCCCNCCCCCC(=O)OCC 34a_100000229939_100000755133 [0,2,0,0,0,0|0,0,0]=2 10020 B18R0.110 CCCCCCCCNCCCOCC(=O)OCC 2230a_100000229939_100009893628 [0,2,0,0,0,0|1,0,0]=3 10021 B18R0.110 CCCCCCCCNCCCOCC(=O)OCC 34a_100000229939_100009893628 [0,2,0,0,0,0|1,0,0]=3 10022 B18R0.110 CCCCCCCCOCCCCCC(=O)OCC 34a_100000210232_100000755133 [0,2,0,0,0,0|0,0,0]=2 10023 B18R0.110 CCCCCCCCOCCCCCC(=O)OCC 7a_100000210232_100000755133 [0,2,0,0,0,0|0,0,0]=2 10024 B18R0.110 CCCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210759 [0,2,0,0,0,0|0,0,0]=2 10025 B18R0.110 CCCCCCCCOCCCOCC(=O)OCC 34a_100000210232_100009893628 [0,2,0,0,0,0|1,0,0]=3 10026 B18R0.110 CCCCCCCCOCCCOCC(=O)OCC 7a_100000210232_100009893628 [0,2,0,0,0,0|1,0,0]=3 10027 B18R0.110 CCCCCCCCSCCCCCC(=O)OCC 62a_100000210759_100000755133 [0,2,0,0,0,0|0,0,0]=2 10028 B18R0.110 CCCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210317 [0,2,0,0,0,0|0,0,0]=2 10029 B18R0.110 CCCCCCCCSCCCOCC(=O)OCC 62a_100000210759_100009893628 [0,2,0,0,0,0|1,0,0]=3 10030 B18R0.110 CCCCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210317 [0,2,0,0,0,0|1,0,0]=3 10031 B18R0.110 CCCCCCCNCCCCCCC(=O)OCC 2230a_100000229938_100009814379 [0,2,0,0,0,0|0,0,0]=2 10032 B18R0.110 CCCCCCCOCCCCCCC(=O)OCC 34a_100000210272_100009814379 [0,2,0,0,0,0|0,0,0]=2 10033 B18R0.110 CCCCCCCOCCCCCCC(=O)OCC 7a_100000210272_100009814379 [0,2,0,0,0,0|0,0,0]=2 10034 B18R0.110 CCCCCCCSCCCCCCC(=O)OCC 62a_100000210614_100009814379 [0,2,0,0,0,0|0,0,0]=2 10035 B18R0.110 CCCCCCNCCCCCCCC(=O)OCC 2230a_100000210581_100009991516 [0,2,0,0,0,0|0,0,0]=2 10036 B18R0.110 CCCCCCOCCCCCCCC(=O)OCC 34a_100000210259_100009991516 [0,2,0,0,0,0|0,0,0]=2 10037 B18R0.110 CCCCCCOCCCCCCCC(=O)OCC 7a_100000210259_100009991516 [0,2,0,0,0,0|0,0,0]=2 10038 B18R0.110 CCCCCCOCCOCCCCC(=O)OCC 34a_100000691444_100000750268 [0,2,0,0,0,0|1,0,0]=3 10039 B18R0.110 CCCCCCOCCOCCCCC(=O)OCC 7a_100000691444_100000750268 [0,2,0,0,0,0|1,0,0]=3 10040 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 34a_100000032842_100000188475 [0,2,0,0,0,0|2,0,0]=4 10041 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 34a_100000691444_100000088970 [0,2,0,0,0,0|2,0,0]=4 10042 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 7a_100000032842_100000188475 [0,2,0,0,0,0|2,0,0]=4 10043 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 7a_100000691444_100000088970 [0,2,0,0,0,0|2,0,0]=4 10044 B18R0.110 CCCCCCSCCCCCCCC(=O)OCC 62a_100000210314_100009991516 [0,2,0,0,0,0|0,0,0]=2 10045 B18R0.110 CCCCCNCCCCCCCCC(=O)OCC 2230a_100000209983_100010175975 [0,2,0,0,0,0|0,0,0]=2 10046 B18R0.110 CCCCCNCCOCCCCCC(=O)OCC 34a_100000224656_100000755133 [0,2,0,0,0,0|1,0,0]=3 10047 B18R0.110 CCCCCNCCOCCCOCC(=O)OCC 34a_100000224656_100009893628 [0,2,0,0,0,0|2,0,0]=4 10048 B18R0.110 CCCCCOCCCCCCCCC(=O)OCC 34a_100000210253_100010175975 [0,2,0,0,0,0|0,0,0]=2 10049 B18R0.110 CCCCCOCCCCCCCCC(=O)OCC 7a_100000210253_100010175975 [0,2,0,0,0,0|0,0,0]=2 10050 B18R0.110 CCCCCOCCOCCCCCC(=O)OCC 34a_100011215259_100000755133 [0,2,0,0,0,0|1,0,0]=3 10051 B18R0.110 CCCCCOCCOCCCCCC(=O)OCC 7a_100011215259_100000755133 [0,2,0,0,0,0|1,0,0]=3 10052 B18R0.110 CCCCCOCCOCCCOCC(=O)OCC 34a_100011215259_100009893628 [0,2,0,0,0,0|2,0,0]=4 10053 B18R0.110 CCCCCOCCOCCCOCC(=O)OCC 7a_100011215259_100009893628 [0,2,0,0,0,0|2,0,0]=4 10054 B18R0.110 CCCCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000718602 [0,2,0,0,0,0|2,0,0]=4 10055 B18R0.110 CCCCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210326 [0,2,0,0,0,0|2,0,0]=4 10056 B18R0.110 CCCCCSCCCCCCCCC(=O)OCC 62a_100000210326_100010175975 [0,2,0,0,0,0|0,0,0]=2 10057 B18R0.110 CCCCNCCCCCCCCCC(=O)OCC 2230a_100000102301_100009828014 [0,2,0,0,0,0|0,0,0]=2 10058 B18R0.110 CCCCNCCCCCCCCCC(=O)OCC 7a_106832991798_100009828014 [0,2,0,0,0,0|0,0,0]=2 10059 B18R0.110 CCCCNCCCCOCCCCC(=O)OCC 34a_200011216965_100000750268 [0,2,0,0,0,0|1,0,0]=3 10060 B18R0.110 CCCCNCCCCOCCOCC(=O)OCC 34a_200011216965_100000088970 [0,2,0,0,0,0|2,0,0]=4 10061 B18R0.110 CCCCNN=CCCCCCCCC(=O)OCC 4a_100025702795_100102623289 [0,2,0,0,0,0|1,0,1]=4 10062 B18R0.110 CCCCOCCCCCCCCCC(=O)OCC 34a_100000210227_100009828014 [0,2,0,0,0,0|0,0,0]=2 10063 B18R0.110 CCCCOCCCCCCCCCC(=O)OCC 7a_100000210227_100009828014 [0,2,0,0,0,0|0,0,0]=2 10064 B18R0.110 CCCCOCCCCOCCCCC(=O)OCC 34a_200000760531_100000750268 [0,2,0,0,0,0|1,0,0]=3 10065 B18R0.110 CCCCOCCCCOCCCCC(=O)OCC 7a_200000760531_100000750268 [0,2,0,0,0,0|1,0,0]=3 10066 B18R0.110 CCCCOCCCCOCCOCC(=O)OCC 34a_200000760531_100000088970 [0,2,0,0,0,0|2,0,0]=4 10067 B18R0.110 CCCCOCCCCOCCOCC(=O)OCC 7a_200000760531_100000088970 [0,2,0,0,0,0|2,0,0]=4 10068 B18R0.110 CCCCOCCCNCCCCCC(=O)OCC 2230a_200000211371_100000755133 [0,2,0,0,0,0|1,0,0]=3 10069 B18R0.110 CCCCOCCCNCCCCCC(=O)OCC 34a_200000211371_100000755133 [0,2,0,0,0,0|1,0,0]=3 10070 B18R0.110 CCCCOCCCNCCCOCC(=O)OCC 2230a_200000211371_100009893628 [0,2,0,0,0,0|2,0,0]=4 10071 B18R0.110 CCCCOCCCNCCCOCC(=O)OCC 34a_200000211371_100009893628 [0,2,0,0,0,0|2,0,0]=4 10072 B18R0.110 CCCCOCCCOCCCCCC(=O)OCC 34a_200011215613_100000755133 [0,2,0,0,0,0|1,0,0]=3 10073 B18R0.110 CCCCOCCCOCCCCCC(=O)OCC 7a_200011215613_100000755133 [0,2,0,0,0,0|1,0,0]=3 10074 B18R0.110 CCCCOCCCOCCCOCC(=O)OCC 34a_200011215613_100009893628 [0,2,0,0,0,0|2,0,0]=4 10075 B18R0.110 CCCCOCCCOCCCOCC(=O)OCC 7a_200011215613_100009893628 [0,2,0,0,0,0|2,0,0]=4 10076 B18R0.110 CCCCOCCOCCCCCCC(=O)OCC 34a_100000210238_100009814379 [0,2,0,0,0,0|1,0,0]=3 10077 B18R0.110 CCCCOCCOCCCCCCC(=O)OCC 7a_100000210238_100009814379 [0,2,0,0,0,0|1,0,0]=3 10078 B18R0.110 CCCCOCCOCCOCCCC(=O)OCC 34a_100011215186_100009991533 [0,2,0,0,0,0|2,0,0]=4 10079 B18R0.110 CCCCOCCOCCOCCCC(=O)OCC 7a_100011215186_100011215271 [0,2,0,0,0,0|2,0,0]=4 10080 B18R0.110 CCCCOCCSCCCCCCC(=O)OCC 62a_100000743108_100009814379 [0,2,0,0,0,0|1,0,0]=3 10081 B18R0.110 CCCCOCSCCCCCCCC(=O)OCC 62a_100011995733_100009991516 [0,2,0,0,0,0|1,0,0]=3 10082 B18R0.110 CCCCSCCCCCCCCCC(=O)OCC 62a_100000210211_100009828014 [0,2,0,0,0,0|0,0,0]=2 10083 B18R0.110 CCCCSCCNCCCCCCC(=O)OCC 2230a_100025743550_100009814379 [0,2,0,0,0,0|1,0,0]=3 10084 B18R0.110 CCCCSCCOCCCCCCC(=O)OCC 34a_200000230436_100009814379 [0,2,0,0,0,0|1,0,0]=3 10085 B18R0.110 CCCCSCCOCCCCCCC(=O)OCC 7a_200000230436_100009814379 [0,2,0,0,0,0|1,0,0]=3 10086 B18R0.110 CCCOCCCCCCCCCCC(=O)OCC 34a_100000210258_100009827693 [0,2,0,0,0,0|0,0,0]=2 10087 B18R0.110 CCCOCCCNCCCCCCC(=O)OCC 2230a_100011217757_100009814379 [0,2,0,0,0,0|1,0,0]=3 10088 B18R0.110 CCCOCCCNCCCCCCC(=O)OCC 34a_100011217757_100009814379 [0,2,0,0,0,0|1,0,0]=3 10089 B18R0.110 CCCOCCNCCCCCCCC(=O)OCC 2230a_100161115042_100009991516 [0,2,0,0,0,0|1,0,0]=3 10090 B18R0.110 CCCOCCNCCCCCCCC(=O)OCC 34a_100161115042_100009991516 [0,2,0,0,0,0|1,0,0]=3 10091 B18R0.110 CCCOCCOCCCCCCCC(=O)OCC 34a_100000752267_100009991516 [0,2,0,0,0,0|1,0,0]=3 10092 B18R0.110 CCCOCCOCCCCCCCC(=O)OCC 7a_100000752267_100009991516 [0,2,0,0,0,0|1,0,0]=3 10093 B18R0.110 CCCOCCOCCNCCCCC(=O)OCC 2230a_200011904461_100000750268 [0,2,0,0,0,0|2,0,0]=4 10094 B18R0.110 CCCOCCOCCNCCCCC(=O)OCC 34a_200011904461_100000750268 [0,2,0,0,0,0|2,0,0]=4 10095 B18R0.110 CCCOCCSCCCCCCCC(=O)OCC 62a_100011215938_100009991516 [0,2,0,0,0,0|1,0,0]=3 10096 B18R0.110 CCCSCCCCCCCCCCC(=O)OCC 62a_100000210303_100009827693 [0,2,0,0,0,0|0,0,0]=2 10097 B18R0.110 CCCSCCNCCCCCCCC(=O)OCC 2230a_100020603323_100009991516 [0,2,0,0,0,0|1,0,0]=3 10098 B18R0.110 CCCSCCOCCCCCCCC(=O)OCC 34a_200000230433_100009991516 [0,2,0,0,0,0|1,0,0]=3 10099 B18R0.110 CCCSCCOCCCCCCCC(=O)OCC 7a_200000230433_100009991516 [0,2,0,0,0,0|1,0,0]=3 10100 B18R0.110 CCNC(=O)CCCCCCCCCCCCCO 240690a_100015525214_100020644313 [0,2,0,0,0,0|1,0,0]=3 10101 B18R0.110 CCNC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000737597 [0,2,0,0,0,0|2,0,0]=4 10102 B18R0.110 CCNC(=O)CCNCCCCCCCCCCO 34a_100025743525_100009813290 [0,2,0,0,0,0|2,0,0]=4 10103 B18R0.110 CCNC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000737597 [0,2,0,0,0,0|2,0,0]=4 10104 B18R0.110 CCNC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000737597 [0,2,0,0,0,0|2,0,0]=4 10105 B18R0.110 CCNC(=O)CCSCCCCCCCCCCO 62a_100000737597_200000033068 [0,2,0,0,0,0|2,0,0]=4 10106 B18R0.110 CCNC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000737597 [0,2,0,0,0,0|2,0,0]=4 10107 B18R0.110 CCNC(=O)CNCCCCCCCCCCCO 2230a_100016988866_100009812471 [0,2,0,0,0,0|2,0,0]=4 10108 B18R0.110 CCNC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000183381 [0,2,0,0,0,0|2,0,0]=4 10109 B18R0.110 CCNC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000183381 [0,2,0,0,0,0|2,0,0]=4 10110 B18R0.110 CCNC(=O)COCCCCCCCCCOCC 34a_100009875440_100000183381 [0,2,0,0,0,0|2,0,0]=4 10111 B18R0.110 CCNC(=O)COCCCCCCCCCOCC 7a_100009875440_100000183381 [0,2,0,0,0,0|2,0,0]=4 10112 B18R0.110 CCNC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000183381 [0,2,0,0,0,0|2,0,0]=4 10113 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 2708a_100000066677_100015525214 [0,2,0,0,0,0|2,0,0]=4 10114 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 2708a_100015525214_100000066677 [0,2,0,0,0,0|2,0,0]=4 10115 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 273464a_100000066677_100015525214 [0,2,0,0,0,0|2,0,0]=4 10116 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 273464a_100015525214_100000066677 [0,2,0,0,0,0|2,0,0]=4 10117 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 512a_100000066677_100015525214 [0,2,0,0,0,0|2,0,0]=4 10118 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 512a_100015525214_100000066677 [0,2,0,0,0,0|2,0,0]=4 10119 B18R0.110 CCNCCCCCCCCCCCC(=O)OCC 2230a_100015525214_100103168309 [0,2,0,0,0,0|0,0,0]=2 10120 B18R0.110 CCOC(=O)CCCCCCCCCCCSCC 62a_100000210202_100103168309 [0,2,0,0,0,0|0,0,0]=2 10121 B18R0.110 CCOC(=O)CCCCCCCCCCCSCF 62a_100015361967_100103168309 [0,2,0,0,0,0|1,0,0]=3 10122 B18R0.110 CCOC(=O)CCCCCCCCCCNCCF 34a_100000724931_100009827693 [0,2,0,0,0,0|1,0,0]=3 10123 B18R0.110 CCOC(=O)CCCCCCCCCCNCCO 2230a_100016997473_100009827693 [0,2,0,0,0,0|1,0,0]=3 10124 B18R0.110 CCOC(=O)CCCCCCCCCCNCCO 34a_100016990907_100009827693 [0,2,0,0,0,0|1,0,0]=3 10125 B18R0.110 CCOC(=O)CCCCCCCCCCOCCBr 34a_100000211926_100009827693 [0,2,0,0,0,0|1,0,0]=3 10126 B18R0.110 CCOC(=O)CCCCCCCCCCOCCN 34a_100000210304_100009827693 [0,2,0,0,0,0|1,0,0]=3 10127 B18R0.110 CCOC(=O)CCCCCCCCCCSCC#N 62a_100011215382_100009827693 [0,2,0,0,0,0|1,0,1]=4 10128 B18R0.110 CCOC(=O)CCCCCCCCCCSCC=O 62a_200015260668_100009827693 [0,2,0,0,0,0|1,0,1]=4 10129 B18R0.110 CCOC(=O)CCCCCCCCCCSCCF 62a_100011217306_100009827693 [0,2,0,0,0,0|1,0,0]=3 10130 B18R0.110 CCOC(=O)CCCCCCCCCCSCCO 62a_100000211926_100009827693 [0,2,0,0,0,0|1,0,0]=3 10131 B18R0.110 CCOC(=O)CCCCCCCCCCSCOC 62a_100000766300_100009827693 [0,2,0,0,0,0|1,0,0]=3 10132 B18R0.110 CCOC(=O)CCCCCCCCCCSCSC 62a_100011218213_100009827693 [0,2,0,0,0,0|1,0,0]=3 10133 B18R0.110 CCOC(=O)CCCCCCCCCNCCCF 2230a_100015189416_100009828014 [0,2,0,0,0,0|1,0,0]=3 10134 B18R0.110 CCOC(=O)CCCCCCCCCNCCCF 34a_100015189416_100009828014 [0,2,0,0,0,0|1,0,0]=3 10135 B18R0.110 CCOC(=O)CCCCCCCCCNCCOC 2230a_100000209980_100009828014 [0,2,0,0,0,0|1,0,0]=3 10136 B18R0.110 CCOC(=O)CCCCCCCCCNCCSC 2230a_100020590264_100009828014 [0,2,0,0,0,0|1,0,0]=3 10137 B18R0.110 CCOC(=O)CCCCCCCCCOCCCBr 34a_100011217188_100009828014 [0,2,0,0,0,0|1,0,0]=3 10138 B18R0.110 CCOC(=O)CCCCCCCCCOCCCCl 34a_100000230001_100009828014 [0,2,0,0,0,0|1,0,0]=3 10139 B18R0.110 CCOC(=O)CCCCCCCCCOCCCF 34a_100000759539_100009828014 [0,2,0,0,0,0|1,0,0]=3 10140 B18R0.110 CCOC(=O)CCCCCCCCCOCCCN 34a_100000182051_100009828014 [0,2,0,0,0,0|1,0,0]=3 10141 B18R0.110 CCOC(=O)CCCCCCCCCOCCOC 34a_100000210237_100009828014 [0,2,0,0,0,0|1,0,0]=3 10142 B18R0.110 CCOC(=O)CCCCCCCCCOCCON 34a_100000700252_100009828014 [0,2,0,0,0,0|2,0,0]=4 10143 B18R0.110 CCOC(=O)CCCCCCCCCOCCSC 34a_100000230434_100009828014 [0,2,0,0,0,0|1,0,0]=3 10144 B18R0.110 CCOC(=O)CCCCCCCCCOCCSC 7a_100000230434_100009828014 [0,2,0,0,0,0|1,0,0]=3 10145 B18R0.110 CCOC(=O)CCCCCCCCCSCCC#N 62a_100011215226_100009828014 [0,2,0,0,0,0|1,0,1]=4 10146 B18R0.110 CCOC(=O)CCCCCCCCCSCCCF 62a_100011934791_100009828014 [0,2,0,0,0,0|1,0,0]=3 10147 B18R0.110 CCOC(=O)CCCCCCCCCSCCCO 62a_100011215043_100009828014 [0,2,0,0,0,0|1,0,0]=3 10148 B18R0.110 CCOC(=O)CCCCCCCCCSCCOC 62a_100000233755_100009828014 [0,2,0,0,0,0|1,0,0]=3 10149 B18R0.110 CCOC(=O)CCCCCCCCCSCCSC 62a_100000212216_100009828014 [0,2,0,0,0,0|1,0,0]=3 10150 B18R0.110 CCOC(=O)CCCCCCCCNCCCCO 2230a_100000750430_100010175975 [0,2,0,0,0,0|1,0,0]=3 10151 B18R0.110 CCOC(=O)CCCCCCCCNCCCCO 34a_100000750430_100010175975 [0,2,0,0,0,0|1,0,0]=3 10152 B18R0.110 CCOC(=O)CCCCCCCCNCCCOC 34a_100150723488_100010175975 [0,2,0,0,0,0|1,0,0]=3 10153 B18R0.110 CCOC(=O)CCCCCCCCNCCCSC 2230a_100000749238_100010175975 [0,2,0,0,0,0|1,0,0]=3 10154 B18R0.110 CCOC(=O)CCCCCCCCNCCSCC 2230a_100000106463_100010175975 [0,2,0,0,0,0|1,0,0]=3 10155 B18R0.110 CCOC(=O)CCCCCCCCOCCCCBr 34a_100011216708_100010175975 [0,2,0,0,0,0|1,0,0]=3 10156 B18R0.110 CCOC(=O)CCCCCCCCOCCCCCl 34a_100000210776_100010175975 [0,2,0,0,0,0|1,0,0]=3 10157 B18R0.110 CCOC(=O)CCCCCCCCOCCCCCl 7a_100000210776_100010175975 [0,2,0,0,0,0|1,0,0]=3 10158 B18R0.110 CCOC(=O)CCCCCCCCOCCCCF 34a_100011995726_100010175975 [0,2,0,0,0,0|1,0,0]=3 10159 B18R0.110 CCOC(=O)CCCCCCCCOCCCCF 7a_100011995726_100010175975 [0,2,0,0,0,0|1,0,0]=3 10160 B18R0.110 CCOC(=O)CCCCCCCCOCCCCI 34a_200012148704_100010175975 [0,2,0,0,0,0|1,0,0]=3 10161 B18R0.110 CCOC(=O)CCCCCCCCOCCCCN 34a_100000750430_100010175975 [0,2,0,0,0,0|1,0,0]=3 10162 B18R0.110 CCOC(=O)CCCCCCCCOCCCNC 34a_100000213112_100010175975 [0,2,0,0,0,0|1,0,0]=3 10163 B18R0.110 CCOC(=O)CCCCCCCCOCCCOC 34a_100000740835_100010175975 [0,2,0,0,0,0|1,0,0]=3 10164 B18R0.110 CCOC(=O)CCCCCCCCOCCCSC 34a_100000690336_100010175975 [0,2,0,0,0,0|1,0,0]=3 10165 B18R0.110 CCOC(=O)CCCCCCCCOCCCSC 7a_100000690336_100010175975 [0,2,0,0,0,0|1,0,0]=3 10166 B18R0.110 CCOC(=O)CCCCCCCCOCCSCC 34a_100000212035_100010175975 [0,2,0,0,0,0|1,0,0]=3 10167 B18R0.110 CCOC(=O)CCCCCCCCOCCSCC 7a_100000212035_100010175975 [0,2,0,0,0,0|1,0,0]=3 10168 B18R0.110 CCOC(=O)CCCCCCCCSCCCC#N 62a_100000687738_100010175975 [0,2,0,0,0,0|1,0,1]=4 10169 B18R0.110 CCOC(=O)CCCCCCCCSCCCC=O 62a_200011292268_100010175975 [0,2,0,0,0,0|1,0,1]=4 10170 B18R0.110 CCOC(=O)CCCCCCCCSCCCCF 62a_100000729493_100010175975 [0,2,0,0,0,0|1,0,0]=3 10171 B18R0.110 CCOC(=O)CCCCCCCCSCCCCO 62a_100000210776_100010175975 [0,2,0,0,0,0|1,0,0]=3 10172 B18R0.110 CCOC(=O)CCCCCCCCSCCCOC 62a_100000709357_100010175975 [0,2,0,0,0,0|1,0,0]=3 10173 B18R0.110 CCOC(=O)CCCCCCCCSCCSCC 62a_100000757381_100010175975 [0,2,0,0,0,0|1,0,0]=3 10174 B18R0.110 CCOC(=O)CCCCCCCNCCCCCO 2230a_100000762737_100009991516 [0,2,0,0,0,0|1,0,0]=3 10175 B18R0.110 CCOC(=O)CCCCCCCNCCCCCO 34a_100000762737_100009991516 [0,2,0,0,0,0|1,0,0]=3 10176 B18R0.110 CCOC(=O)CCCCCCCNCCOCCO 2230a_100000211614_100009991516 [0,2,0,0,0,0|2,0,0]=4 10177 B18R0.110 CCOC(=O)CCCCCCCNCCOCCO 34a_100000211614_100009991516 [0,2,0,0,0,0|2,0,0]=4 10178 B18R0.110 CCOC(=O)CCCCCCCNCCSCCO 2230a_100011219999_100009991516 [0,2,0,0,0,0|2,0,0]=4 10179 B18R0.110 CCOC(=O)CCCCCCCOCCCCCBr 34a_100000746331_100009991516 [0,2,0,0,0,0|1,0,0]=3 10180 B18R0.110 CCOC(=O)CCCCCCCOCCCCCBr 7a_100000746331_100009991516 [0,2,0,0,0,0|1,0,0]=3 10181 B18R0.110 CCOC(=O)CCCCCCCOCCCCCCl 34a_100000746330_100009991516 [0,2,0,0,0,0|1,0,0]=3 10182 B18R0.110 CCOC(=O)CCCCCCCOCCCCCCl 7a_100000746330_100009991516 [0,2,0,0,0,0|1,0,0]=3 10183 B18R0.110 CCOC(=O)CCCCCCCOCCCCCI 34a_200012148887_100009991516 [0,2,0,0,0,0|1,0,0]=3 10184 B18R0.110 CCOC(=O)CCCCCCCOCCCCCI 7a_200012148887_100009991516 [0,2,0,0,0,0|1,0,0]=3 10185 B18R0.110 CCOC(=O)CCCCCCCOCCCCCN 34a_100000762737_100009991516 [0,2,0,0,0,0|1,0,0]=3 10186 B18R0.110 CCOC(=O)CCCCCCCOCCCCOC 34a_100000740925_100009991516 [0,2,0,0,0,0|1,0,0]=3 10187 B18R0.110 CCOC(=O)CCCCCCCOCCCCSC 34a_100011217163_100009991516 [0,2,0,0,0,0|1,0,0]=3 10188 B18R0.110 CCOC(=O)CCCCCCCOCCCCSC 7a_100011217163_100009991516 [0,2,0,0,0,0|1,0,0]=3 10189 B18R0.110 CCOC(=O)CCCCCCCOCCCSCC 34a_100011216438_100009991516 [0,2,0,0,0,0|1,0,0]=3 10190 B18R0.110 CCOC(=O)CCCCCCCOCCCSCC 7a_100011216438_100009991516 [0,2,0,0,0,0|1,0,0]=3 10191 B18R0.110 CCOC(=O)CCCCCCCOCCOCCBr 34a_100000692535_100009991516 [0,2,0,0,0,0|2,0,0]=4 10192 B18R0.110 CCOC(=O)CCCCCCCOCCOCCBr 7a_100000692535_100009991516 [0,2,0,0,0,0|2,0,0]=4 10193 B18R0.110 CCOC(=O)CCCCCCCOCCOCCCl 34a_100011215305_100009991516 [0,2,0,0,0,0|2,0,0]=4 10194 B18R0.110 CCOC(=O)CCCCCCCOCCOCCCl 7a_100011215305_100009991516 [0,2,0,0,0,0|2,0,0]=4 10195 B18R0.110 CCOC(=O)CCCCCCCOCCOCCF 34a_200015357709_100009991516 [0,2,0,0,0,0|2,0,0]=4 10196 B18R0.110 CCOC(=O)CCCCCCCOCCOCCF 7a_200015357709_100009991516 [0,2,0,0,0,0|2,0,0]=4 10197 B18R0.110 CCOC(=O)CCCCCCCOCCOCCI 34a_100012149058_100009991516 [0,2,0,0,0,0|2,0,0]=4 10198 B18R0.110 CCOC(=O)CCCCCCCOCCOCCI 7a_100012149058_100009991516 [0,2,0,0,0,0|2,0,0]=4 10199 B18R0.110 CCOC(=O)CCCCCCCOCCOCCN 34a_100000211614_100009991516 [0,2,0,0,0,0|2,0,0]=4 10200 B18R0.110 CCOC(=O)CCCCCCCSCCCCC#N 62a_100011219923_100009991516 [0,2,0,0,0,0|1,0,1]=4 10201 B18R0.110 CCOC(=O)CCCCCCCSCCCCC=O 62a_100000139335_100009991516 [0,2,0,0,0,0|1,0,1]=4 10202 B18R0.110 CCOC(=O)CCCCCCCSCCCCCF 62a_100000729378_100009991516 [0,2,0,0,0,0|1,0,0]=3 10203 B18R0.110 CCOC(=O)CCCCCCCSCCCCCO 62a_100000746330_100009991516 [0,2,0,0,0,0|1,0,0]=3 10204 B18R0.110 CCOC(=O)CCCCCCCSCCCCOC 62a_100000730899_100009991516 [0,2,0,0,0,0|1,0,0]=3 10205 B18R0.110 CCOC(=O)CCCCCCCSCCOCCO 62a_100011215305_100009991516 [0,2,0,0,0,0|2,0,0]=4 10206 B18R0.110 CCOC(=O)CCCCCCCSCOCCOC 62a_100000231047_100009991516 [0,2,0,0,0,0|2,0,0]=4 10207 B18R0.110 CCOC(=O)CCCCCCNCCCCCCO 2230a_100000686447_100009814379 [0,2,0,0,0,0|1,0,0]=3 10208 B18R0.110 CCOC(=O)CCCCCCNCCCCCCO 34a_100000686447_100009814379 [0,2,0,0,0,0|1,0,0]=3 10209 B18R0.110 CCOC(=O)CCCCCCNCCCCCOC 2230a_100000747528_100009814379 [0,2,0,0,0,0|1,0,0]=3 10210 B18R0.110 CCOC(=O)CCCCCCNCCCCCOC 34a_100000747528_100009814379 [0,2,0,0,0,0|1,0,0]=3 10211 B18R0.110 CCOC(=O)CCCCCCNCCOCCOC 2230a_100000745349_100009814379 [0,2,0,0,0,0|2,0,0]=4 10212 B18R0.110 CCOC(=O)CCCCCCNCCOCCOC 34a_100000745349_100009814379 [0,2,0,0,0,0|2,0,0]=4 10213 B18R0.110 CCOC(=O)CCCCCCOCCCCCCBr 34a_100011215345_100009814379 [0,2,0,0,0,0|1,0,0]=3 10214 B18R0.110 CCOC(=O)CCCCCCOCCCCCCBr 7a_100011215345_100009814379 [0,2,0,0,0,0|1,0,0]=3 10215 B18R0.110 CCOC(=O)CCCCCCOCCCCCCCl 34a_100000766143_100009814379 [0,2,0,0,0,0|1,0,0]=3 10216 B18R0.110 CCOC(=O)CCCCCCOCCCCCCCl 7a_100000766143_100009814379 [0,2,0,0,0,0|1,0,0]=3 10217 B18R0.110 CCOC(=O)CCCCCCOCCCCCCF 34a_100000732779_100009814379 [0,2,0,0,0,0|1,0,0]=3 10218 B18R0.110 CCOC(=O)CCCCCCOCCCCCCF 7a_100000732779_100009814379 [0,2,0,0,0,0|1,0,0]=3 10219 B18R0.110 CCOC(=O)CCCCCCOCCCCCCN 34a_100000686447_100009814379 [0,2,0,0,0,0|1,0,0]=3 10220 B18R0.110 CCOC(=O)CCCCCCOCCCCCNC 34a_100000722520_100009814379 [0,2,0,0,0,0|1,0,0]=3 10221 B18R0.110 CCOC(=O)CCCCCCOCCOCCNC 34a_100000228057_100009814379 [0,2,0,0,0,0|2,0,0]=4 10222 B18R0.110 CCOC(=O)CCCCCCOCCOCCOC 34a_100011215163_100009814379 [0,2,0,0,0,0|2,0,0]=4 10223 B18R0.110 CCOC(=O)CCCCCCOCCOCCOC 7a_100011215163_100009814379 [0,2,0,0,0,0|2,0,0]=4 10224 B18R0.110 CCOC(=O)CCCCCCSCCCCCC#N 62a_100009813376_100009814379 [0,2,0,0,0,0|1,0,1]=4 10225 B18R0.110 CCOC(=O)CCCCCCSCCCCCC=O 62a_100000139337_100009814379 [0,2,0,0,0,0|1,0,1]=4 10226 B18R0.110 CCOC(=O)CCCCCCSCCCCCCF 62a_100015922095_100009814379 [0,2,0,0,0,0|1,0,0]=3 10227 B18R0.110 CCOC(=O)CCCCCCSCCCCCCO 62a_100000766143_100009814379 [0,2,0,0,0,0|1,0,0]=3 10228 B18R0.110 CCOC(=O)CCCCCCSCCOCCOC 62a_100000695917_100009814379 [0,2,0,0,0,0|2,0,0]=4 10229 B18R0.110 CCOC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100000755133 [0,2,0,0,0,0|1,0,0]=3 10230 B18R0.110 CCOC(=O)CCCCCNCCCCCCCO 34a_100011996573_100000755133 [0,2,0,0,0,0|1,0,0]=3 10231 B18R0.110 CCOC(=O)CCCCCNCCCOCCCO 2230a_100011310245_100000755133 [0,2,0,0,0,0|2,0,0]=4 10232 B18R0.110 CCOC(=O)CCCCCNCCCOCCCO 34a_100011310245_100000755133 [0,2,0,0,0,0|2,0,0]=4 10233 B18R0.110 CCOC(=O)CCCCCNCCCOCCOC 2230a_100000206027_100000755133 [0,2,0,0,0,0|2,0,0]=4 10234 B18R0.110 CCOC(=O)CCCCCNCCCOCCOC 34a_100000206027_100000755133 [0,2,0,0,0,0|2,0,0]=4 10235 B18R0.110 CCOC(=O)CCCCCOCCCCCCC#N 7a_100011214988_100009813337 [0,2,0,0,0,0|1,0,1]=4 10236 B18R0.110 CCOC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100000755133 [0,2,0,0,0,0|1,0,0]=3 10237 B18R0.110 CCOC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100000755133 [0,2,0,0,0,0|1,0,0]=3 10238 B18R0.110 CCOC(=O)CCCCCOCCCCCCCN 34a_100011996573_100000755133 [0,2,0,0,0,0|1,0,0]=3 10239 B18R0.110 CCOC(=O)CCCCCOCCCCCCCO 7a_100011214988_100000760002 [0,2,0,0,0,0|1,0,0]=3 10240 B18R0.110 CCOC(=O)CCCCCOCCCCCCOC 34a_200012092642_100000755133 [0,2,0,0,0,0|1,0,0]=3 10241 B18R0.110 CCOC(=O)CCCCCOCCCCCCOC 7a_100011214988_100011998445 [0,2,0,0,0,0|1,0,0]=3 10242 B18R0.110 CCOC(=O)CCCCCOCCCCCCOC 7a_200012092642_100000755133 [0,2,0,0,0,0|1,0,0]=3 10243 B18R0.110 CCOC(=O)CCCCCOCCCOCCCN 34a_100011310245_100000755133 [0,2,0,0,0,0|2,0,0]=4 10244 B18R0.110 CCOC(=O)CCCCCOCCCOCCOC 7a_100011214988_100011216529 [0,2,0,0,0,0|2,0,0]=4 10245 B18R0.110 CCOC(=O)CCCCCSCCCCCCC#N 62a_100000755133_100009813337 [0,2,0,0,0,0|1,0,1]=4 10246 B18R0.110 CCOC(=O)CCCCCSCCCCCCC#N 62a_100009813337_100000755133 [0,2,0,0,0,0|1,0,1]=4 10247 B18R0.110 CCOC(=O)CCCCCSCCCCCCCO 62a_100000755133_100000760002 [0,2,0,0,0,0|1,0,0]=3 10248 B18R0.110 CCOC(=O)CCCCCSCCCCCCCO 62a_100000760002_100000755133 [0,2,0,0,0,0|1,0,0]=3 10249 B18R0.110 CCOC(=O)CCCCCSCCCCCCOC 62a_100000755133_100011998445 [0,2,0,0,0,0|1,0,0]=3 10250 B18R0.110 CCOC(=O)CCCCCSCCCCCCOC 62a_100011998445_100000755133 [0,2,0,0,0,0|1,0,0]=3 10251 B18R0.110 CCOC(=O)CCCCCSCCCOCCOC 62a_100000755133_100011216529 [0,2,0,0,0,0|2,0,0]=4 10252 B18R0.110 CCOC(=O)CCCCCSCCCOCCOC 62a_100011216529_100000755133 [0,2,0,0,0,0|2,0,0]=4 10253 B18R0.110 CCOC(=O)CCCCNCCCCCCCCO 2230a_102515433106_100000750268 [0,2,0,0,0,0|1,0,0]=3 10254 B18R0.110 CCOC(=O)CCCCNCCCCCCCCO 34a_102515433106_100000750268 [0,2,0,0,0,0|1,0,0]=3 10255 B18R0.110 CCOC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100000750268 [0,2,0,0,0,0|1,0,0]=3 10256 B18R0.110 CCOC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000750268 [0,2,0,0,0,0|1,0,0]=3 10257 B18R0.110 CCOC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100000750268 [0,2,0,0,0,0|1,0,0]=3 10258 B18R0.110 CCOC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000750268 [0,2,0,0,0,0|1,0,0]=3 10259 B18R0.110 CCOC(=O)CCCCOCCCCCCCCN 34a_102515433106_100000750268 [0,2,0,0,0,0|1,0,0]=3 10260 B18R0.110 CCOC(=O)CCCCOCCCCCNCCN 34a_103619048469_100000750268 [0,2,0,0,0,0|2,0,0]=4 10261 B18R0.110 CCOC(=O)CCCCOCCCOCCCOC 34a_200011215475_100000750268 [0,2,0,0,0,0|2,0,0]=4 10262 B18R0.110 CCOC(=O)CCCCOCCCOCCCOC 7a_200011215475_100000750268 [0,2,0,0,0,0|2,0,0]=4 10263 B18R0.110 CCOC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000750268 [0,2,0,0,0,0|1,0,0]=3 10264 B18R0.110 CCOC(=O)CCCCSCCCCCCCCO 62a_100000750268_100000033203 [0,2,0,0,0,0|1,0,0]=3 10265 B18R0.110 CCOC(=O)CCCNCCCCCCCCCO 2230a_100000078944_100009991533 [0,2,0,0,0,0|1,0,0]=3 10266 B18R0.110 CCOC(=O)CCCNCCCCCCCCCO 34a_100000078944_100009991533 [0,2,0,0,0,0|1,0,0]=3 10267 B18R0.110 CCOC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100009991533 [0,2,0,0,0,0|1,0,0]=3 10268 B18R0.110 CCOC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011215271 [0,2,0,0,0,0|1,0,0]=3 10269 B18R0.110 CCOC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100009991533 [0,2,0,0,0,0|1,0,0]=3 10270 B18R0.110 CCOC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011215271 [0,2,0,0,0,0|1,0,0]=3 10271 B18R0.110 CCOC(=O)CCCOCCCCCCCCCN 34a_100000078944_100009991533 [0,2,0,0,0,0|1,0,0]=3 10272 B18R0.110 CCOC(=O)CCCOCCCCCCCCCO 7a_100012001163_100009813782 [0,2,0,0,0,0|1,0,0]=3 10273 B18R0.110 CCOC(=O)CCCSCCCCCCCCCO 62a_100009813782_100009991533 [0,2,0,0,0,0|1,0,0]=3 10274 B18R0.110 CCOC(=O)CCCSCCCCCCCCCO 62a_100009991533_100009813782 [0,2,0,0,0,0|1,0,0]=3 10275 B18R0.110 CCOC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100011206558 [0,2,0,0,0,0|1,0,0]=3 10276 B18R0.110 CCOC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000765890 [0,2,0,0,0,0|1,0,0]=3 10277 B18R0.110 CCOC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000765890 [0,2,0,0,0,0|1,0,0]=3 10278 B18R0.110 CCOC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100011206558 [0,2,0,0,0,0|1,0,0]=3 10279 B18R0.110 CCOC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000765890 [0,2,0,0,0,0|1,0,0]=3 10280 B18R0.110 CCOC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100011206558 [0,2,0,0,0,0|1,0,0]=3 10281 B18R0.110 CCOC(=O)CCOCCCCCCCCCCN 34a_100000066964_100000765890 [0,2,0,0,0,0|1,0,0]=3 10282 B18R0.110 CCOC(=O)CCSCCCCCCCCCCO 62a_100000765890_200000033068 [0,2,0,0,0,0|1,0,0]=3 10283 B18R0.110 CCOC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000765890 [0,2,0,0,0,0|1,0,0]=3 10284 B18R0.110 CCOC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000188475 [0,2,0,0,0,0|1,0,0]=3 10285 B18R0.110 CCOC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000188475 [0,2,0,0,0,0|1,0,0]=3 10286 B18R0.110 CCOC(=O)COCCCNCCCCCCCO 2230a_100011996573_100009893628 [0,2,0,0,0,0|2,0,0]=4 10287 B18R0.110 CCOC(=O)COCCCNCCCCCCCO 34a_100011996573_100009893628 [0,2,0,0,0,0|2,0,0]=4 10288 B18R0.110 CCOC(=O)COCCCOCCCCCCCBr 34a_100000760002_100009893628 [0,2,0,0,0,0|2,0,0]=4 10289 B18R0.110 CCOC(=O)COCCCOCCCCCCCBr 7a_100000760002_100009893628 [0,2,0,0,0,0|2,0,0]=4 10290 B18R0.110 CCOC(=O)COCCCOCCCCCCCN 34a_100011996573_100009893628 [0,2,0,0,0,0|2,0,0]=4 10291 B18R0.110 CCOC(=O)COCCCOCCCCCCOC 34a_200012092642_100009893628 [0,2,0,0,0,0|2,0,0]=4 10292 B18R0.110 CCOC(=O)COCCCOCCCCCCOC 7a_200012092642_100009893628 [0,2,0,0,0,0|2,0,0]=4 10293 B18R0.110 CCOC(=O)COCCCSCCCCCCCO 62a_100000760002_100009893628 [0,2,0,0,0,0|2,0,0]=4 10294 B18R0.110 CCOC(=O)COCCCSCCCCCCCO 62a_100009893628_100000760002 [0,2,0,0,0,0|2,0,0]=4 10295 B18R0.110 CCOC(=O)COCCCSCCCCCCOC 62a_100009893628_100011998445 [0,2,0,0,0,0|2,0,0]=4 10296 B18R0.110 CCOC(=O)COCCCSCCCCCCOC 62a_100011998445_100009893628 [0,2,0,0,0,0|2,0,0]=4 10297 B18R0.110 CCOC(=O)COCCNCCCCCCCCO 2230a_102515433106_100000088970 [0,2,0,0,0,0|2,0,0]=4 10298 B18R0.110 CCOC(=O)COCCNCCCCCCCCO 34a_102515433106_100000088970 [0,2,0,0,0,0|2,0,0]=4 10299 B18R0.110 CCOC(=O)COCCOCCCCCCCCBr 34a_100009813846_100000088970 [0,2,0,0,0,0|2,0,0]=4 10300 B18R0.110 CCOC(=O)COCCOCCCCCCCCBr 7a_100009813846_100000088970 [0,2,0,0,0,0|2,0,0]=4 10301 B18R0.110 CCOC(=O)COCCOCCCCCCCCCl 34a_100000033203_100000088970 [0,2,0,0,0,0|2,0,0]=4 10302 B18R0.110 CCOC(=O)COCCOCCCCCCCCCl 7a_100000033203_100000088970 [0,2,0,0,0,0|2,0,0]=4 10303 B18R0.110 CCOC(=O)COCCOCCCCCCCCN 34a_102515433106_100000088970 [0,2,0,0,0,0|2,0,0]=4 10304 B18R0.110 CCOC(=O)COCCSCCCCCCCCO 62a_100000033203_100000088970 [0,2,0,0,0,0|2,0,0]=4 10305 B18R0.110 CCOC(=O)COCCSCCCCCCCCO 62a_100000088970_100000033203 [0,2,0,0,0,0|2,0,0]=4 10306 B18R0.110 CCOC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000188475 [0,2,0,0,0,0|1,0,0]=3 10307 B18R0.110 CCOC(=O)CSCCOCCCCCCCCO 7a_200000230590_100000033203 [0,2,0,0,0,0|2,0,0]=4 10308 B18R0.110 CCOC(=O)NCCOCCCCCCCCCBr 7a_100009813782_200011445536 [0,2,0,0,0,0|2,0,0]=4 10309 B18R0.110 CCOC(=O)NCCOCCCCCCCCCCl 7a_100009868337_200011445536 [0,2,0,0,0,0|2,0,0]=4 10310 B18R0.110 CCOC(=O)NCCOCCCCCCCCCO 34a_100000158857_100009813782 [0,2,0,0,0,0|2,0,0]=4 10311 B18R0.110 CCOC(=O)NCCSCCCCCCCCCO 62a_100009813782_200011445536 [0,2,0,0,0,0|2,0,0]=4 10312 B18R0.110 CCOC(=O)OCSCCCCCCCCCCO 62a_100009813290_100000075025 [0,2,0,0,0,0|2,0,0]=4 10313 B18R0.110 CCOCCCCCCCCCCCC(=O)OCC 34a_100121572206_100103168309 [0,2,0,0,0,0|0,0,0]=2 10314 B18R0.110 CCOCCCCCCCCCOCC(=O)NCO 34a_100009875440_100000185155 [0,2,0,0,0,0|2,0,0]=4 10315 B18R0.110 CCOCCCCCCCCCOCC(=O)NCO 7a_100009875440_100000185155 [0,2,0,0,0,0|2,0,0]=4 10316 B18R0.110 CCOCCCCCCCCCOCC(=O)OCC 34a_100009875440_100000188475 [0,2,0,0,0,0|1,0,0]=3 10317 B18R0.110 CCOCCCCCCCCCOCC(=O)OCC 7a_100009875440_100000188475 [0,2,0,0,0,0|1,0,0]=3 10318 B18R0.110 CCOCCCNCCCCCCCC(=O)OCC 2230a_100000210961_100009991516 [0,2,0,0,0,0|1,0,0]=3 10319 B18R0.110 CCOCCCNCCCCCCCC(=O)OCC 34a_100000210961_100009991516 [0,2,0,0,0,0|1,0,0]=3 10320 B18R0.110 CCOCCCOCCCCCCCC(=O)OCC 34a_100000757476_100009991516 [0,2,0,0,0,0|1,0,0]=3 10321 B18R0.110 CCOCCCOCCCCCCCC(=O)OCC 7a_100000757476_100009991516 [0,2,0,0,0,0|1,0,0]=3 10322 B18R0.110 CCOCCCSCCCCCCCC(=O)OCC 62a_100012232248_100009991516 [0,2,0,0,0,0|1,0,0]=3 10323 B18R0.110 CCOCCNCCCCCCCCC(=O)OCC 2230a_102516460346_100010175975 [0,2,0,0,0,0|1,0,0]=3 10324 B18R0.110 CCOCCNCCCCCCCCC(=O)OCC 34a_102516460346_100010175975 [0,2,0,0,0,0|1,0,0]=3 10325 B18R0.110 CCOCCOCCCCCCCCC(=O)OCC 34a_100000210136_100010175975 [0,2,0,0,0,0|1,0,0]=3 10326 B18R0.110 CCOCCOCCCCCCCCC(=O)OCC 7a_100000210136_100010175975 [0,2,0,0,0,0|1,0,0]=3 10327 B18R0.110 CCOCCOCCNCCCCCC(=O)OCC 2230a_100102712874_100000755133 [0,2,0,0,0,0|2,0,0]=4 10328 B18R0.110 CCOCCOCCNCCCCCC(=O)OCC 34a_100102712874_100000755133 [0,2,0,0,0,0|2,0,0]=4 10329 B18R0.110 CCOCCOCCOCCCCCC(=O)OCC 34a_100000210240_100000755133 [0,2,0,0,0,0|2,0,0]=4 10330 B18R0.110 CCOCCOCCOCCCCCC(=O)OCC 7a_100000210240_100000755133 [0,2,0,0,0,0|2,0,0]=4 10331 B18R0.110 CCOCCOCCOCCCCCC(=O)OCC 7a_100011214988_100011211534 [0,2,0,0,0,0|2,0,0]=4 10332 B18R0.110 CCOCCOCCSCCCCCC(=O)OCC 62a_100000755133_100011211534 [0,2,0,0,0,0|2,0,0]=4 10333 B18R0.110 CCOCCOCCSCCCCCC(=O)OCC 62a_100011211534_100000755133 [0,2,0,0,0,0|2,0,0]=4 10334 B18R0.110 CCOCCSCCCCCCCCC(=O)OCC 62a_100000210147_100010175975 [0,2,0,0,0,0|1,0,0]=3 10335 B18R0.110 CCOCSCCCCCCCCCC(=O)OCC 62a_100000739092_100009828014 [0,2,0,0,0,0|1,0,0]=3 10336 B18R0.110 CNNC(=O)CCCCCCCCCCCCCO 22a_100016993582_100020644313 [0,2,0,0,0,0|1,0,0]=3 10337 B18R0.110 CNNC(=O)NCCCCCCCCCCCCO 273464a_100000066677_100016993582 [0,2,0,0,0,0|2,0,0]=4 10338 B18R0.110 CNNC(=O)NCCCCCCCCCCCCO 512a_100000066677_100016993582 [0,2,0,0,0,0|2,0,0]=4 10339 B18R0.110 CNNC(=O)NCCCCCCCCCCCCO 512a_100016993582_100000066677 [0,2,0,0,0,0|2,0,0]=4 10340 B18R0.110 COCC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000210968 [0,2,0,0,0,0|1,0,0]=3 10341 B18R0.110 CSCC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000184570 [0,2,0,0,0,0|1,1,0]=4 10342 B18R0.110 N#CCC(=O)CCCCCCCCCCCCCO 1458a_100051588842_100009812470 [0,2,0,0,0,0|1,0,1]=4 10343 B18R0.110 O=C(C=CBr)CCCCCCCCCCCCCO 1458a_100016273825_100009812470 [0,2,0,0,0,0|1,0,1]=4 10344 B18R0.110 O=C(C=CCl)CCCCCCCCCCCCCO 1458a_200016279998_100009812470 [0,2,0,0,0,0|1,0,1]=4 10345 B18R0.110 O=C(C=CI)CCCCCCCCCCCCCO 1458a_100016256311_100009812470 [0,2,0,0,0,0|1,0,1]=4 10346 B18R0.110 O=C(CCO)NCCCCCCCCCCCCO 240690a_100000066677_100011216618 [0,2,0,0,0,0|2,0,0]=4 10347 B18R0.110 O=C(COCCCCCCCCCCCBr)NCO 34a_100009812471_100000185155 [0,2,0,0,0,0|2,0,0]=4 10348 B18R0.110 O=C(COCCCCCCCCCCCBr)NCO 7a_100009812471_100000185155 [0,2,0,0,0,0|2,0,0]=4 10349 B18R0.110 O=C(CSCCCCCCCCCCCO)NCO 62a_100009812471_100000185155 [0,2,0,0,0,0|2,0,0]=4 10350 B18R0.114 C=C(Br)CCOCCCCCCCCCC(=O)OC 34a_100009813270_100009813843 [0,2,0,0,0,0|0,0,2]=4 10351 B18R0.114 C=C(C)CCOCCCCCCCCCC(=O)OC 34a_100000764851_100009813843 [0,2,0,0,0,0|0,0,1]=3 10352 B18R0.114 C=C(C)CCSCCCCCCCCCC(=O)OC 62a_100000730704_100009813843 [0,2,0,0,0,0|0,0,1]=3 10353 B18R0.114 C=C(C)COCCCCCCCCCCC(=O)OC 34a_100000210245_100009812566 [0,2,0,0,0,0|0,0,1]=3 10354 B18R0.114 C=C(C)COCCCCCCCCCCC(=O)OC 34a_100011003013_100000748629 [0,2,0,0,0,0|0,0,1]=3 10355 B18R0.114 C=C(C)COCCCCCCCCCCC(=O)OC 7a_100011003013_100000748629 [0,2,0,0,0,0|0,0,1]=3 10356 B18R0.114 C=C(C)CSCCCCCCCCCCC(=O)OC 62a_100000748629_100009812566 [0,2,0,0,0,0|0,0,1]=3 10357 B18R0.114 C=C(F)COCCCCCCCCCCC(=O)OC 34a_100011003013_100009893438 [0,2,0,0,0,0|0,0,2]=4 10358 B18R0.114 C=C(F)COCCCCCCCCCCC(=O)OC 34a_200010262243_100009812566 [0,2,0,0,0,0|0,0,2]=4 10359 B18R0.114 C=C(F)COCCCCCCCCCCC(=O)OC 7a_100011003013_100000042424 [0,2,0,0,0,0|0,0,2]=4 10360 B18R0.114 C=C(F)CSCCCCCCCCCCC(=O)OC 62a_100000042424_100009812566 [0,2,0,0,0,0|0,0,2]=4 10361 B18R0.114 CCC(=O)CCCCCCCCCCCSC(=O)C 1458a_100000210414_100010140907 [0,2,0,0,0,0|1,0,1]=4 10362 B18R0.114 COC(=O)CCCCCCCCC=NNCC(C)O 4a_200000730056_200010166605 [0,2,0,0,0,0|1,0,1]=4 10363 B18R0.114 COC(=O)CCCCCCCCCCCCC(=O)C 1458a_100000070787_209314222159 [0,2,0,0,0,0|0,0,0]=2 10364 B18R0.114 COC(=O)CCCCCCCCCCCCN(C)C 2230a_100102631434_209314222159 [0,2,0,0,0,0|0,0,0]=2 10365 B18R0.114 COC(=O)CCCCCCCCCCCCN(C)C 269982a_100102631434_209314222159 [0,2,0,0,0,0|0,0,0]=2 10366 B18R0.114 COC(=O)CCCCCCCCCCCNC(=O)C 188690a_200020660844_100015343762 [0,2,0,0,0,0|0,0,1]=3 10367 B18R0.114 COC(=O)CCCCCCCCCCCNC(C)C 2230a_100138425928_100010983606 [0,2,0,0,0,0|0,0,0]=2 10368 B18R0.114 COC(=O)CCCCCCCCCCCNC(C)C 34a_100138425928_100010983606 [0,2,0,0,0,0|0,0,0]=2 10369 B18R0.114 COC(=O)CCCCCCCCCCCOC(C)C 34a_100000212225_100010983606 [0,2,0,0,0,0|0,0,0]=2 10370 B18R0.114 COC(=O)CCCCCCCCCCCSC(C)C 62a_100000210206_100010983606 [0,2,0,0,0,0|0,0,0]=2 10371 B18R0.114 COC(=O)CCCCCCCCCCNCC(=O)N 2230a_100000711301_100009812566 [0,2,0,0,0,0|1,0,1]=4 10372 B18R0.114 COC(=O)CCCCCCCCCCNCC(=O)O 269956a_100016091260_100009812566 [0,2,0,0,0,0|1,0,1]=4 10373 B18R0.114 COC(=O)CCCCCCCCCCNCC(C)C 2230a_100000210953_100009812566 [0,2,0,0,0,0|0,0,0]=2 10374 B18R0.114 COC(=O)CCCCCCCCCCNCC(C)C 34a_100000210953_100009812566 [0,2,0,0,0,0|0,0,0]=2 10375 B18R0.114 COC(=O)CCCCCCCCCCNCC(C)O 2230a_100000210904_100009812566 [0,2,0,0,0,0|0,0,0]=2 10376 B18R0.114 COC(=O)CCCCCCCCCCNCC(C)O 34a_100000210904_100009812566 [0,2,0,0,0,0|0,0,0]=2 10377 B18R0.114 COC(=O)CCCCCCCCCCNCC(F)F 34a_100000765723_100009812566 [0,2,0,0,0,0|1,0,0]=3 10378 B18R0.114 COC(=O)CCCCCCCCCCOCC(=O)C 34a_100000211253_100009812566 [0,2,0,0,0,0|0,0,1]=3 10379 B18R0.114 COC(=O)CCCCCCCCCCOCC(=O)N 34a_100011003013_100000187820 [0,2,0,0,0,0|1,0,1]=4 10380 B18R0.114 COC(=O)CCCCCCCCCCOCC(=O)N 7a_100011003013_100000187820 [0,2,0,0,0,0|1,0,1]=4 10381 B18R0.114 COC(=O)CCCCCCCCCCOCC(=O)[O-] 34a_100011003013_100020667443 [0,2,0,0,0,0|1,0,1]=4 10382 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)Br 34a_100012180447_100009812566 [0,2,0,0,0,0|0,0,0]=2 10383 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)C 34a_100000210257_100009812566 [0,2,0,0,0,0|0,0,0]=2 10384 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)C 34a_100011003013_100000210624 [0,2,0,0,0,0|0,0,0]=2 10385 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)C 7a_100011003013_100000210760 [0,2,0,0,0,0|0,0,0]=2 10386 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)F 34a_100015925927_100009812566 [0,2,0,0,0,0|0,0,0]=2 10387 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)O 34a_100011003013_100011218427 [0,2,0,0,0,0|0,0,0]=2 10388 B18R0.114 COC(=O)CCCCCCCCCCOCC(C)O 7a_100011003013_100011218427 [0,2,0,0,0,0|0,0,0]=2 10389 B18R0.114 COC(=O)CCCCCCCCCCOCC(F)F 34a_100000743014_100009812566 [0,2,0,0,0,0|1,0,0]=3 10390 B18R0.114 COC(=O)CCCCCCCCCCOCC(F)F 34a_100011003013_100011934356 [0,2,0,0,0,0|1,0,0]=3 10391 B18R0.114 COC(=O)CCCCCCCCCCOCC(F)F 7a_100011003013_100011934356 [0,2,0,0,0,0|1,0,0]=3 10392 B18R0.114 COC(=O)CCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009812566 [0,2,0,0,0,0|0,0,0]=2 10393 B18R0.114 COC(=O)CCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100009812566 [0,2,0,0,0,0|0,0,0]=2 10394 B18R0.114 COC(=O)CCCCCCCCCCOC[C@@H](C)O 34a_100011003013_100009817552 [0,2,0,0,0,0|0,0,0]=2 10395 B18R0.114 COC(=O)CCCCCCCCCCOC[C@@H](C)O 7a_100011003013_100009817552 [0,2,0,0,0,0|0,0,0]=2 10396 B18R0.114 COC(=O)CCCCCCCCCCOC[N+](=O)[O-] 34a_100011003013_100000761209 [0,2,0,0,0,0|2,0,0]=4 10397 B18R0.114 COC(=O)CCCCCCCCCCSCC(=O)N 62a_100000747473_100009812566 [0,2,0,0,0,0|1,0,1]=4 10398 B18R0.114 COC(=O)CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100009812566 [0,2,0,0,0,0|1,0,1]=4 10399 B18R0.114 COC(=O)CCCCCCCCCCSCC(C)C 62a_100000210624_100009812566 [0,2,0,0,0,0|0,0,0]=2 10400 B18R0.114 COC(=O)CCCCCCCCCCSCC(C)O 62a_100011218427_100009812566 [0,2,0,0,0,0|0,0,0]=2 10401 B18R0.114 COC(=O)CCCCCCCCCCSCC(F)F 62a_100011934356_100009812566 [0,2,0,0,0,0|1,0,0]=3 10402 B18R0.114 COC(=O)CCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100009812566 [0,2,0,0,0,0|0,0,0]=2 10403 B18R0.114 COC(=O)CCCCCCCCCNCC=C(C)C 34a_100000718196_100009813843 [0,2,0,0,0,0|0,0,2]=4 10404 B18R0.114 COC(=O)CCCCCCCCCNCCC(C)O 2230a_200000755665_100009813843 [0,2,0,0,0,0|0,0,0]=2 10405 B18R0.114 COC(=O)CCCCCCCCCOCC=C(C)C 34a_100000753907_100009813843 [0,2,0,0,0,0|0,0,2]=4 10406 B18R0.114 COC(=O)CCCCCCCCCOCCC(=O)C 34a_100000759926_100009813843 [0,2,0,0,0,0|0,0,1]=3 10407 B18R0.114 COC(=O)CCCCCCCCCOCCC(=O)C 7a_100000759926_100009813843 [0,2,0,0,0,0|0,0,1]=3 10408 B18R0.114 COC(=O)CCCCCCCCCOCCC(=O)N 34a_100000757172_100009813843 [0,2,0,0,0,0|1,0,1]=4 10409 B18R0.114 COC(=O)CCCCCCCCCOCCC(=O)N 7a_100000757172_100009813843 [0,2,0,0,0,0|1,0,1]=4 10410 B18R0.114 COC(=O)CCCCCCCCCOCCC(C)Br 34a_100009893172_100009813843 [0,2,0,0,0,0|0,0,0]=2 10411 B18R0.114 COC(=O)CCCCCCCCCOCCC(C)C 34a_100000210254_100009813843 [0,2,0,0,0,0|0,0,0]=2 10412 B18R0.114 COC(=O)CCCCCCCCCOCCC(C)C 7a_100000210254_100009813843 [0,2,0,0,0,0|0,0,0]=2 10413 B18R0.114 COC(=O)CCCCCCCCCOCCC(F)F 34a_100103093639_100009813843 [0,2,0,0,0,0|1,0,0]=3 10414 B18R0.114 COC(=O)CCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100009813843 [0,2,0,0,0,0|0,0,0]=2 10415 B18R0.114 COC(=O)CCCCCCCCCSCC=C(C)C 62a_100000761012_100009813843 [0,2,0,0,0,0|0,0,2]=4 10416 B18R0.114 COC(=O)CCCCCCCCCSCCC(=O)C 62a_100000053229_100009813843 [0,2,0,0,0,0|0,0,1]=3 10417 B18R0.114 COC(=O)CCCCCCCCCSCCC(=O)N 62a_100000744528_100009813843 [0,2,0,0,0,0|1,0,1]=4 10418 B18R0.114 COC(=O)CCCCCCCCCSCCC(C)C 62a_100000210312_100009813843 [0,2,0,0,0,0|0,0,0]=2 10419 B18R0.114 COC(=O)CCCCCCCCCSCCC(C)O 62a_100012276601_100009813843 [0,2,0,0,0,0|0,0,0]=2 10420 B18R0.114 COC(=O)CCCCCCCCCSCOC(=O)C 62a_100000076356_100009813843 [0,2,0,0,0,0|1,0,1]=4 10421 B18R0.114 COC(=O)CCCCCCCCCSCOC(C)C 62a_100000709892_100009813843 [0,2,0,0,0,0|1,0,0]=3 10422 B18R0.114 COC(=O)CCCCCCCCNCCCC(=O)N 34a_100000739312_100010282707 [0,2,0,0,0,0|1,0,1]=4 10423 B18R0.114 COC(=O)CCCCCCCCNCCCC(C)C 2230a_200000737386_100010282707 [0,2,0,0,0,0|0,0,0]=2 10424 B18R0.114 COC(=O)CCCCCCCCNCCCC(C)C 34a_200000737386_100010282707 [0,2,0,0,0,0|0,0,0]=2 10425 B18R0.114 COC(=O)CCCCCCCCNCCCS(=O)C 2230a_200000753449_100010282707 [0,2,0,0,0,0|1,0,0]=3 10426 B18R0.114 COC(=O)CCCCCCCCNCCNC(=O)C 2230a_100000209853_100010282707 [0,2,0,0,0,0|1,0,1]=4 10427 B18R0.114 COC(=O)CCCCCCCCNCCOC(C)C 2230a_100000701111_100010282707 [0,2,0,0,0,0|1,0,0]=3 10428 B18R0.114 COC(=O)CCCCCCCCNCCOC(C)C 34a_100000701111_100010282707 [0,2,0,0,0,0|1,0,0]=3 10429 B18R0.114 COC(=O)CCCCCCCCNCCSC(C)C 2230a_100000731138_100010282707 [0,2,0,0,0,0|1,0,0]=3 10430 B18R0.114 COC(=O)CCCCCCCCNCCSC(C)C 34a_100000731138_100010282707 [0,2,0,0,0,0|1,0,0]=3 10431 B18R0.114 COC(=O)CCCCCCCCOCCC=C(C)C 34a_100000035544_100011217483 [0,2,0,0,0,0|0,0,2]=4 10432 B18R0.114 COC(=O)CCCCCCCCOCCC=C(C)C 7a_100000035544_100011217483 [0,2,0,0,0,0|0,0,2]=4 10433 B18R0.114 COC(=O)CCCCCCCCOCCCC(=O)C 34a_100000035544_100000685027 [0,2,0,0,0,0|0,0,1]=3 10434 B18R0.114 COC(=O)CCCCCCCCOCCCC(=O)C 34a_100000759063_100010282707 [0,2,0,0,0,0|0,0,1]=3 10435 B18R0.114 COC(=O)CCCCCCCCOCCCC(=O)C 7a_100000035544_100011215641 [0,2,0,0,0,0|0,0,1]=3 10436 B18R0.114 COC(=O)CCCCCCCCOCCCC(=O)C 7a_100000759063_100010282707 [0,2,0,0,0,0|0,0,1]=3 10437 B18R0.114 COC(=O)CCCCCCCCOCCCC(=O)N 34a_100000035544_100102525003 [0,2,0,0,0,0|1,0,1]=4 10438 B18R0.114 COC(=O)CCCCCCCCOCCCC(=O)N 7a_100000035544_100102525003 [0,2,0,0,0,0|1,0,1]=4 10439 B18R0.114 COC(=O)CCCCCCCCOCCCC(C)C 34a_100000035544_100011214892 [0,2,0,0,0,0|0,0,0]=2 10440 B18R0.114 COC(=O)CCCCCCCCOCCCC(C)C 34a_100000210774_100010282707 [0,2,0,0,0,0|0,0,0]=2 10441 B18R0.114 COC(=O)CCCCCCCCOCCCC(C)C 7a_100000035544_100011214892 [0,2,0,0,0,0|0,0,0]=2 10442 B18R0.114 COC(=O)CCCCCCCCOCCCC(C)C 7a_100000210774_100010282707 [0,2,0,0,0,0|0,0,0]=2 10443 B18R0.114 COC(=O)CCCCCCCCOCCCC(C)O 34a_100000035544_200000718107 [0,2,0,0,0,0|0,0,0]=2 10444 B18R0.114 COC(=O)CCCCCCCCOCCCC(C)O 7a_100000035544_200000718107 [0,2,0,0,0,0|0,0,0]=2 10445 B18R0.114 COC(=O)CCCCCCCCOCCCN(C)C 7a_100000035544_100000757444 [0,2,0,0,0,0|1,0,0]=3 10446 B18R0.114 COC(=O)CCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100010282707 [0,2,0,0,0,0|2,0,0]=4 10447 B18R0.114 COC(=O)CCCCCCCCOCCNC(=O)C 34a_100000158858_100010282707 [0,2,0,0,0,0|1,0,1]=4 10448 B18R0.114 COC(=O)CCCCCCCCOCCNC(=O)C 7a_100000035544_100000189650 [0,2,0,0,0,0|1,0,1]=4 10449 B18R0.114 COC(=O)CCCCCCCCOCCNC(C)C 34a_100000224655_100010282707 [0,2,0,0,0,0|1,0,0]=3 10450 B18R0.114 COC(=O)CCCCCCCCOCCOC(=O)C 34a_100000035544_100009814007 [0,2,0,0,0,0|1,0,1]=4 10451 B18R0.114 COC(=O)CCCCCCCCOCCOC(=O)C 7a_100000035544_100009814007 [0,2,0,0,0,0|1,0,1]=4 10452 B18R0.114 COC(=O)CCCCCCCCOCCOC(C)C 34a_100000035544_100000211751 [0,2,0,0,0,0|1,0,0]=3 10453 B18R0.114 COC(=O)CCCCCCCCOCCOC(C)C 34a_100000211219_100010282707 [0,2,0,0,0,0|1,0,0]=3 10454 B18R0.114 COC(=O)CCCCCCCCOCCOC(C)C 7a_100000035544_100000211751 [0,2,0,0,0,0|1,0,0]=3 10455 B18R0.114 COC(=O)CCCCCCCCOCCOC(C)C 7a_100000211219_100010282707 [0,2,0,0,0,0|1,0,0]=3 10456 B18R0.114 COC(=O)CCCCCCCCOCCSC(C)C 34a_100000035544_100000730970 [0,2,0,0,0,0|1,0,0]=3 10457 B18R0.114 COC(=O)CCCCCCCCOCCSC(C)C 34a_200011212901_100010282707 [0,2,0,0,0,0|1,0,0]=3 10458 B18R0.114 COC(=O)CCCCCCCCOCCSC(C)C 7a_100000035544_100000730970 [0,2,0,0,0,0|1,0,0]=3 10459 B18R0.114 COC(=O)CCCCCCCCOCCSC(C)C 7a_200011212901_100010282707 [0,2,0,0,0,0|1,0,0]=3 10460 B18R0.114 COC(=O)CCCCCCCCSCCC=C(C)C 62a_100010282707_100011217483 [0,2,0,0,0,0|0,0,2]=4 10461 B18R0.114 COC(=O)CCCCCCCCSCCC=C(C)C 62a_100011217483_100010282707 [0,2,0,0,0,0|0,0,2]=4 10462 B18R0.114 COC(=O)CCCCCCCCSCCCC(=O)C 62a_100010282707_100011215641 [0,2,0,0,0,0|0,0,1]=3 10463 B18R0.114 COC(=O)CCCCCCCCSCCCC(=O)C 62a_100011215641_100010282707 [0,2,0,0,0,0|0,0,1]=3 10464 B18R0.114 COC(=O)CCCCCCCCSCCCC(=O)N 62a_100010282707_100102525003 [0,2,0,0,0,0|1,0,1]=4 10465 B18R0.114 COC(=O)CCCCCCCCSCCCC(=O)N 62a_100102525003_100010282707 [0,2,0,0,0,0|1,0,1]=4 10466 B18R0.114 COC(=O)CCCCCCCCSCCCC(C)C 62a_100010282707_100011214892 [0,2,0,0,0,0|0,0,0]=2 10467 B18R0.114 COC(=O)CCCCCCCCSCCCC(C)C 62a_100011214892_100010282707 [0,2,0,0,0,0|0,0,0]=2 10468 B18R0.114 COC(=O)CCCCCCCCSCCCC(C)O 62a_100010282707_200000718107 [0,2,0,0,0,0|0,0,0]=2 10469 B18R0.114 COC(=O)CCCCCCCCSCCCC(C)O 62a_200000718107_100010282707 [0,2,0,0,0,0|0,0,0]=2 10470 B18R0.114 COC(=O)CCCCCCCCSCCCN(C)C 62a_100010282707_100000757444 [0,2,0,0,0,0|1,0,0]=3 10471 B18R0.114 COC(=O)CCCCCCCCSCCNC(=O)C 62a_100000189650_100010282707 [0,2,0,0,0,0|1,0,1]=4 10472 B18R0.114 COC(=O)CCCCCCCCSCCNC(=O)C 62a_100010282707_100000189650 [0,2,0,0,0,0|1,0,1]=4 10473 B18R0.114 COC(=O)CCCCCCCCSCCOC(=O)C 62a_100009814007_100010282707 [0,2,0,0,0,0|1,0,1]=4 10474 B18R0.114 COC(=O)CCCCCCCCSCCOC(=O)C 62a_100010282707_100009814007 [0,2,0,0,0,0|1,0,1]=4 10475 B18R0.114 COC(=O)CCCCCCCCSCCOC(C)C 62a_100000211751_100010282707 [0,2,0,0,0,0|1,0,0]=3 10476 B18R0.114 COC(=O)CCCCCCCCSCCOC(C)C 62a_100010282707_100000211751 [0,2,0,0,0,0|1,0,0]=3 10477 B18R0.114 COC(=O)CCCCCCCCSCCSC(C)C 62a_100000730970_100010282707 [0,2,0,0,0,0|1,0,0]=3 10478 B18R0.114 COC(=O)CCCCCCCCSCCSC(C)C 62a_100010282707_100000730970 [0,2,0,0,0,0|1,0,0]=3 10479 B18R0.114 COC(=O)CCCCCCCNCCCCC(=O)N 34a_100000696515_100010004213 [0,2,0,0,0,0|1,0,1]=4 10480 B18R0.114 COC(=O)CCCCCCCNCCCNC(=O)C 34a_100000736810_100010004213 [0,2,0,0,0,0|1,0,1]=4 10481 B18R0.114 COC(=O)CCCCCCCNCCCOC(C)C 2230a_100000737246_100010004213 [0,2,0,0,0,0|1,0,0]=3 10482 B18R0.114 COC(=O)CCCCCCCNCCCOC(C)C 34a_100000737246_100010004213 [0,2,0,0,0,0|1,0,0]=3 10483 B18R0.114 COC(=O)CCCCCCCOCCCCB(O)O 34a_100011022521_200009817182 [0,2,0,0,0,0|2,0,0]=4 10484 B18R0.114 COC(=O)CCCCCCCOCCCCB(O)O 7a_100011022521_200009817182 [0,2,0,0,0,0|2,0,0]=4 10485 B18R0.114 COC(=O)CCCCCCCOCCCCC(=O)C 34a_100011022521_100009817362 [0,2,0,0,0,0|0,0,1]=3 10486 B18R0.114 COC(=O)CCCCCCCOCCCCC(=O)C 7a_100011022521_100000735457 [0,2,0,0,0,0|0,0,1]=3 10487 B18R0.114 COC(=O)CCCCCCCOCCCCC(=O)N 34a_100012022536_100010004213 [0,2,0,0,0,0|1,0,1]=4 10488 B18R0.114 COC(=O)CCCCCCCOCCCCC(=O)N 7a_100012022536_100010004213 [0,2,0,0,0,0|1,0,1]=4 10489 B18R0.114 COC(=O)CCCCCCCOCCCCC(C)C 34a_100011022521_100011216152 [0,2,0,0,0,0|0,0,0]=2 10490 B18R0.114 COC(=O)CCCCCCCOCCCCC(C)C 34a_100011214890_100010004213 [0,2,0,0,0,0|0,0,0]=2 10491 B18R0.114 COC(=O)CCCCCCCOCCCCC(C)C 7a_100011022521_100011216152 [0,2,0,0,0,0|0,0,0]=2 10492 B18R0.114 COC(=O)CCCCCCCOCCCCC(C)C 7a_100011214890_100010004213 [0,2,0,0,0,0|0,0,0]=2 10493 B18R0.114 COC(=O)CCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100010004213 [0,2,0,0,0,0|2,0,0]=4 10494 B18R0.114 COC(=O)CCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100010004213 [0,2,0,0,0,0|2,0,0]=4 10495 B18R0.114 COC(=O)CCCCCCCOCCCNC(=O)C 34a_100000752032_100010004213 [0,2,0,0,0,0|1,0,1]=4 10496 B18R0.114 COC(=O)CCCCCCCOCCCNC(C)C 34a_100000182298_100010004213 [0,2,0,0,0,0|1,0,0]=3 10497 B18R0.114 COC(=O)CCCCCCCOCCCOC(=O)C 34a_100011022521_100000042594 [0,2,0,0,0,0|1,0,1]=4 10498 B18R0.114 COC(=O)CCCCCCCOCCCOC(=O)C 7a_100011022521_100000042594 [0,2,0,0,0,0|1,0,1]=4 10499 B18R0.114 COC(=O)CCCCCCCOCCCOC(=S)C 34a_100011022521_200135323944 [0,2,0,0,0,0|1,0,1]=4 10500 B18R0.114 COC(=O)CCCCCCCOCCCOC(=S)C 7a_100011022521_200135323944 [0,2,0,0,0,0|1,0,1]=4 10501 B18R0.114 COC(=O)CCCCCCCOCCCSC(=O)C 34a_100011022521_100000038929 [0,2,0,0,0,0|1,0,1]=4 10502 B18R0.114 COC(=O)CCCCCCCOCCCSC(=O)C 7a_100011022521_100000038929 [0,2,0,0,0,0|1,0,1]=4 10503 B18R0.114 COC(=O)CCCCCCCOCCNCC(C)C 34a_100015185251_100010004213 [0,2,0,0,0,0|1,0,0]=3 10504 B18R0.114 COC(=O)CCCCCCCOCCOCC(C)C 34a_100000703358_100010004213 [0,2,0,0,0,0|1,0,0]=3 10505 B18R0.114 COC(=O)CCCCCCCOCCOCC(C)C 7a_100000703358_100010004213 [0,2,0,0,0,0|1,0,0]=3 10506 B18R0.114 COC(=O)CCCCCCCOCCOCC(F)F 34a_100000704375_100010004213 [0,2,0,0,0,0|2,0,0]=4 10507 B18R0.114 COC(=O)CCCCCCCOCCOCC(F)F 34a_100011022521_200012177212 [0,2,0,0,0,0|2,0,0]=4 10508 B18R0.114 COC(=O)CCCCCCCOCCOCC(F)F 7a_100000704375_100010004213 [0,2,0,0,0,0|2,0,0]=4 10509 B18R0.114 COC(=O)CCCCCCCOCCOCC(F)F 7a_100011022521_200012177212 [0,2,0,0,0,0|2,0,0]=4 10510 B18R0.114 COC(=O)CCCCCCCOCCSCC(C)C 34a_200000230437_100010004213 [0,2,0,0,0,0|1,0,0]=3 10511 B18R0.114 COC(=O)CCCCCCCOCCSCC(C)C 7a_200000230437_100010004213 [0,2,0,0,0,0|1,0,0]=3 10512 B18R0.114 COC(=O)CCCCCCCSCCCCB(O)O 62a_100010004213_200009817182 [0,2,0,0,0,0|2,0,0]=4 10513 B18R0.114 COC(=O)CCCCCCCSCCCCB(O)O 62a_200009817182_100010004213 [0,2,0,0,0,0|2,0,0]=4 10514 B18R0.114 COC(=O)CCCCCCCSCCCCC(=O)C 62a_100000735457_100010004213 [0,2,0,0,0,0|0,0,1]=3 10515 B18R0.114 COC(=O)CCCCCCCSCCCCC(=O)C 62a_100010004213_100000735457 [0,2,0,0,0,0|0,0,1]=3 10516 B18R0.114 COC(=O)CCCCCCCSCCCCC(C)C 62a_100010004213_100011216152 [0,2,0,0,0,0|0,0,0]=2 10517 B18R0.114 COC(=O)CCCCCCCSCCCCC(C)C 62a_100011216152_100010004213 [0,2,0,0,0,0|0,0,0]=2 10518 B18R0.114 COC(=O)CCCCCCCSCCCCN(C)C 62a_100010004213_100000690147 [0,2,0,0,0,0|1,0,0]=3 10519 B18R0.114 COC(=O)CCCCCCCSCCCOC(=O)C 62a_100000042594_100010004213 [0,2,0,0,0,0|1,0,1]=4 10520 B18R0.114 COC(=O)CCCCCCCSCCCOC(=O)C 62a_100010004213_100000042594 [0,2,0,0,0,0|1,0,1]=4 10521 B18R0.114 COC(=O)CCCCCCCSCCCOC(=S)C 62a_100010004213_200135323944 [0,2,0,0,0,0|1,0,1]=4 10522 B18R0.114 COC(=O)CCCCCCCSCCCOC(=S)C 62a_200135323944_100010004213 [0,2,0,0,0,0|1,0,1]=4 10523 B18R0.114 COC(=O)CCCCCCCSCCCSC(=O)C 62a_100000038929_100010004213 [0,2,0,0,0,0|1,0,1]=4 10524 B18R0.114 COC(=O)CCCCCCCSCCCSC(=O)C 62a_100010004213_100000038929 [0,2,0,0,0,0|1,0,1]=4 10525 B18R0.114 COC(=O)CCCCCCCSCCOCC(F)F 62a_100010004213_200012177212 [0,2,0,0,0,0|2,0,0]=4 10526 B18R0.114 COC(=O)CCCCCCCSCCOCC(F)F 62a_200012177212_100010004213 [0,2,0,0,0,0|2,0,0]=4 10527 B18R0.114 COC(=O)CCCCCCNCCCCCC(C)C 2230a_100011290863_100009815986 [0,2,0,0,0,0|0,0,0]=2 10528 B18R0.114 COC(=O)CCCCCCNCCCCCC(C)C 34a_100011290863_100009815986 [0,2,0,0,0,0|0,0,0]=2 10529 B18R0.114 COC(=O)CCCCCCNCCCCNC(=O)C 2230a_200011368371_100009815986 [0,2,0,0,0,0|1,0,1]=4 10530 B18R0.114 COC(=O)CCCCCCNCCCCNC(=O)C 34a_200011368371_100009815986 [0,2,0,0,0,0|1,0,1]=4 10531 B18R0.114 COC(=O)CCCCCCNCCCOCC(C)C 2230a_100000205972_100009815986 [0,2,0,0,0,0|1,0,0]=3 10532 B18R0.114 COC(=O)CCCCCCNCCCOCC(C)C 34a_100000205972_100009815986 [0,2,0,0,0,0|1,0,0]=3 10533 B18R0.114 COC(=O)CCCCCCOCCCCCB(O)O 34a_100009863599_200009817188 [0,2,0,0,0,0|2,0,0]=4 10534 B18R0.114 COC(=O)CCCCCCOCCCCCB(O)O 7a_100009863599_200009817188 [0,2,0,0,0,0|2,0,0]=4 10535 B18R0.114 COC(=O)CCCCCCOCCCCCC(=O)N 34a_100000123541_100009815986 [0,2,0,0,0,0|1,0,1]=4 10536 B18R0.114 COC(=O)CCCCCCOCCCCCC(=O)N 34a_100009863599_100009817443 [0,2,0,0,0,0|1,0,1]=4 10537 B18R0.114 COC(=O)CCCCCCOCCCCCC(=O)N 7a_100000123541_100009815986 [0,2,0,0,0,0|1,0,1]=4 10538 B18R0.114 COC(=O)CCCCCCOCCCCCC(=O)N 7a_100009863599_100009817443 [0,2,0,0,0,0|1,0,1]=4 10539 B18R0.114 COC(=O)CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100009815986 [0,2,0,0,0,0|1,0,1]=4 10540 B18R0.114 COC(=O)CCCCCCOCCCCCC(C)C 34a_100009863599_100000210682 [0,2,0,0,0,0|0,0,0]=2 10541 B18R0.114 COC(=O)CCCCCCOCCCCCC(C)C 34a_100011995859_100009815986 [0,2,0,0,0,0|0,0,0]=2 10542 B18R0.114 COC(=O)CCCCCCOCCCCCC(C)C 7a_100009863599_100000210682 [0,2,0,0,0,0|0,0,0]=2 10543 B18R0.114 COC(=O)CCCCCCOCCCCCC(C)C 7a_100011995859_100009815986 [0,2,0,0,0,0|0,0,0]=2 10544 B18R0.114 COC(=O)CCCCCCOCCCCNC(C)C 34a_100011521146_100009815986 [0,2,0,0,0,0|1,0,0]=3 10545 B18R0.114 COC(=O)CCCCCCOCCCCOC(=O)C 34a_100000073216_100009815986 [0,2,0,0,0,0|1,0,1]=4 10546 B18R0.114 COC(=O)CCCCCCOCCCCOC(=O)C 34a_100009863599_100000033659 [0,2,0,0,0,0|1,0,1]=4 10547 B18R0.114 COC(=O)CCCCCCOCCCCOC(=O)C 7a_100000073216_100009815986 [0,2,0,0,0,0|1,0,1]=4 10548 B18R0.114 COC(=O)CCCCCCOCCCCOC(=O)C 7a_100009863599_100000033659 [0,2,0,0,0,0|1,0,1]=4 10549 B18R0.114 COC(=O)CCCCCCOCCCCSC(=O)C 34a_100009863599_200010402107 [0,2,0,0,0,0|1,0,1]=4 10550 B18R0.114 COC(=O)CCCCCCOCCCCSC(=O)C 7a_100009863599_200010402107 [0,2,0,0,0,0|1,0,1]=4 10551 B18R0.114 COC(=O)CCCCCCSCCCCCB(O)O 62a_100009815986_200009817188 [0,2,0,0,0,0|2,0,0]=4 10552 B18R0.114 COC(=O)CCCCCCSCCCCCB(O)O 62a_200009817188_100009815986 [0,2,0,0,0,0|2,0,0]=4 10553 B18R0.114 COC(=O)CCCCCCSCCCCCC(=O)N 62a_100009815986_100009817443 [0,2,0,0,0,0|1,0,1]=4 10554 B18R0.114 COC(=O)CCCCCCSCCCCCC(=O)N 62a_100009817443_100009815986 [0,2,0,0,0,0|1,0,1]=4 10555 B18R0.114 COC(=O)CCCCCCSCCCCCC(C)C 62a_100000210682_100009815986 [0,2,0,0,0,0|0,0,0]=2 10556 B18R0.114 COC(=O)CCCCCCSCCCCCC(C)C 62a_100009815986_100000210682 [0,2,0,0,0,0|0,0,0]=2 10557 B18R0.114 COC(=O)CCCCCCSCCCCOC(=O)C 62a_100000033659_100009815986 [0,2,0,0,0,0|1,0,1]=4 10558 B18R0.114 COC(=O)CCCCCCSCCCCOC(=O)C 62a_100009815986_100000033659 [0,2,0,0,0,0|1,0,1]=4 10559 B18R0.114 COC(=O)CCCCCCSCCCCSC(=O)C 62a_100009815986_200010402107 [0,2,0,0,0,0|1,0,1]=4 10560 B18R0.114 COC(=O)CCCCCCSCCCCSC(=O)C 62a_200010402107_100009815986 [0,2,0,0,0,0|1,0,1]=4 10561 B18R0.114 COC(=O)CCCCCNCCCCCCC(C)C 2230a_100000211014_100009816466 [0,2,0,0,0,0|0,0,0]=2 10562 B18R0.114 COC(=O)CCCCCNCCCCCCC(C)C 34a_100000211014_100009816466 [0,2,0,0,0,0|0,0,0]=2 10563 B18R0.114 COC(=O)CCCCCNCCCCCNC(=O)C 2230a_200012022750_100009816466 [0,2,0,0,0,0|1,0,1]=4 10564 B18R0.114 COC(=O)CCCCCNCCCCCNC(=O)C 34a_200012022750_100009816466 [0,2,0,0,0,0|1,0,1]=4 10565 B18R0.114 COC(=O)CCCCCOCCCCCCB(O)O 34a_100000074720_100009817187 [0,2,0,0,0,0|2,0,0]=4 10566 B18R0.114 COC(=O)CCCCCOCCCCCCB(O)O 7a_100000074720_100009817187 [0,2,0,0,0,0|2,0,0]=4 10567 B18R0.114 COC(=O)CCCCCOCCCCCNC(C)C 34a_100011629493_100009816466 [0,2,0,0,0,0|1,0,0]=3 10568 B18R0.114 COC(=O)CCCCCOCCCCCOC(=O)C 34a_100000074720_100000033007 [0,2,0,0,0,0|1,0,1]=4 10569 B18R0.114 COC(=O)CCCCCOCCCCCOC(=O)C 7a_100000074720_100000033007 [0,2,0,0,0,0|1,0,1]=4 10570 B18R0.114 COC(=O)CCCCCSCCCCCCB(O)O 62a_100009816466_100009817187 [0,2,0,0,0,0|2,0,0]=4 10571 B18R0.114 COC(=O)CCCCCSCCCCCCB(O)O 62a_100009817187_100009816466 [0,2,0,0,0,0|2,0,0]=4 10572 B18R0.114 COC(=O)CCCCCSCCCCCOC(=O)C 62a_100000033007_100009816466 [0,2,0,0,0,0|1,0,1]=4 10573 B18R0.114 COC(=O)CCCCCSCCCCCOC(=O)C 62a_100009816466_100000033007 [0,2,0,0,0,0|1,0,1]=4 10574 B18R0.114 COC(=O)CCCCNCCCCCCNC(=O)C 2230a_200011996284_100000204269 [0,2,0,0,0,0|1,0,1]=4 10575 B18R0.114 COC(=O)CCCCNCCCCCCNC(=O)C 34a_200011996284_100000204269 [0,2,0,0,0,0|1,0,1]=4 10576 B18R0.114 COC(=O)CCCCOCCCCCCCC(C)C 34a_200000210741_100000204269 [0,2,0,0,0,0|0,0,0]=2 10577 B18R0.114 COC(=O)CCCCOCCCCCCCC(C)C 7a_200000210741_100000204269 [0,2,0,0,0,0|0,0,0]=2 10578 B18R0.114 COC(=O)CCOCCOCCOCCCC(C)C 34a_100010982084_100011214892 [0,2,0,0,0,0|2,0,0]=4 10579 B18R0.114 COC(=O)CCOCCOCCOCCCC(C)C 7a_100010982084_100011214892 [0,2,0,0,0,0|2,0,0]=4 10580 B18R0.114 COC(=O)CCOCCOCCOCCCC(C)O 34a_100010982084_200000718107 [0,2,0,0,0,0|2,0,0]=4 10581 B18R0.114 COC(=O)CCOCCOCCOCCCC(C)O 7a_100010982084_200000718107 [0,2,0,0,0,0|2,0,0]=4 10582 B18R0.114 COC(=O)COCCOCCCCCCCC(C)C 34a_200000210741_100000090808 [0,2,0,0,0,0|1,0,0]=3 10583 B18R0.114 COC(=O)COCCOCCCCCCCC(C)C 7a_200000210741_100000090808 [0,2,0,0,0,0|1,0,0]=3 10584 B18R0.114 COC(=O)COCCOCCOCCCCC(C)C 34a_100011023656_100011216152 [0,2,0,0,0,0|2,0,0]=4 10585 B18R0.114 COC(=O)COCCOCCOCCCCC(C)C 7a_100011023656_100011216152 [0,2,0,0,0,0|2,0,0]=4 10586 B18R0.114 COC(=O)CSCCCCCCCCCCC(=O)N 62a_100000747449_200010167045 [0,2,0,0,0,0|1,0,1]=4 10587 B18R0.114 COC(=O)CSCCCCCCCCCCC(=O)N 62a_200010167045_100000747449 [0,2,0,0,0,0|1,0,1]=4 10588 B18R0.126 C#CCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100010269958 [0,2,0,0,0,0|0,0,2]=4 10589 B18R0.126 C#CCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000696528_100010004213 [0,2,0,0,0,0|0,0,2]=4 10590 B18R0.126 C=CCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100011215482 [0,2,0,0,0,0|0,0,2]=4 10591 B18R0.126 C=CCCCCC(=O)CCCCCCCC(=O)OC 1458a_100011215552_100010004213 [0,2,0,0,0,0|0,0,2]=4 10592 B18R0.126 C=CCCCCN(C)CCCCCCCC(=O)OC 2230a_100012000471_100010004213 [0,2,0,0,0,0|0,0,2]=4 10593 B18R0.126 C=CCCCCN(C)CCCCCCCC(=O)OC 269982a_100012000471_100010004213 [0,2,0,0,0,0|0,0,2]=4 10594 B18R0.126 CC/C=C\CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100015370543 [0,2,0,0,0,0|0,0,2]=4 10595 B18R0.126 CCC/C=C/CC(=O)CCCCCCCC(=O)OC 1458a_200016266809_100010004213 [0,2,0,0,0,0|0,0,2]=4 10596 B18R0.126 CCCCC=CC(=O)CCCCCCCC(=O)OC 1458a_100016266645_100010004213 [0,2,0,0,0,0|0,0,2]=4 10597 B18R0.126 CCCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210757 [0,2,0,0,0,0|0,0,0]=2 10598 B18R0.126 CCCCCCC(=O)CCCCCCCC(=O)OC 1458a_100102632555_100010004213 [0,2,0,0,0,0|0,0,0]=2 10599 B18R0.126 CCCCCCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100102632555 [0,2,0,0,0,0|0,0,1]=3 10600 B18R0.126 CCCCCCC(C)CCOCCCCC(=O)OC 34a_200011024964_100000204269 [0,2,0,0,0,0|0,0,0]=2 10601 B18R0.126 CCCCCCC(C)CCOCCCCC(=O)OC 7a_200011024964_100000204269 [0,2,0,0,0,0|0,0,0]=2 10602 B18R0.126 CCCCCCC(C)CCOCCOCC(=O)OC 34a_200011024964_100000090808 [0,2,0,0,0,0|1,0,0]=3 10603 B18R0.126 CCCCCCC(C)CCOCCOCC(=O)OC 7a_200011024964_100000090808 [0,2,0,0,0,0|1,0,0]=3 10604 B18R0.126 CCCCCCC(C)NCCCCCCC(=O)OC 2230a_100000210919_100009815986 [0,2,0,0,0,0|0,0,0]=2 10605 B18R0.126 CCCCCCC(C)NCCCCCCC(=O)OC 34a_100000210919_100009815986 [0,2,0,0,0,0|0,0,0]=2 10606 B18R0.126 CCCCCCC(C)OCCCCCCC(=O)OC 34a_100000210265_100009815986 [0,2,0,0,0,0|0,0,0]=2 10607 B18R0.126 CCCCCCC(C)OCCCCCCC(=O)OC 34a_100009863599_100011215978 [0,2,0,0,0,0|0,0,0]=2 10608 B18R0.126 CCCCCCC(C)OCCCCCCC(=O)OC 7a_100000210265_100009815986 [0,2,0,0,0,0|0,0,0]=2 10609 B18R0.126 CCCCCCC(C)OCCCCCCC(=O)OC 7a_100009863599_100011215978 [0,2,0,0,0,0|0,0,0]=2 10610 B18R0.126 CCCCCCC(C)SCCCCCCC(=O)OC 62a_100009815986_100011215978 [0,2,0,0,0,0|0,0,0]=2 10611 B18R0.126 CCCCCCC(C)SCCCCCCC(=O)OC 62a_100011215978_100009815986 [0,2,0,0,0,0|0,0,0]=2 10612 B18R0.126 CCCCCCN(C)CCCCCCCC(=O)OC 2230a_106256046315_100010004213 [0,2,0,0,0,0|0,0,0]=2 10613 B18R0.126 CCCCCCN(C)CCCCCCCC(=O)OC 269982a_106256046315_100010004213 [0,2,0,0,0,0|0,0,0]=2 10614 B18R0.126 CCCCCNC(=O)CCCCCCCC(=O)OC 11a_100000209983_100000033222 [0,2,0,0,0,0|0,0,1]=3 10615 B18R0.126 CCCCCNC(=O)CCCCCCCC(=O)OC 1626a_100000209983_100000033222 [0,2,0,0,0,0|0,0,1]=3 10616 B18R0.126 CCCCCNC(=O)CCCCCCCC(=O)OC 240690a_100000209983_100000033222 [0,2,0,0,0,0|0,0,1]=3 10617 B18R0.126 CCCCCNC(=O)COCCCCCC(=O)OC 34a_100000074720_100000230301 [0,2,0,0,0,0|1,0,1]=4 10618 B18R0.126 CCCCCNC(=O)COCCCCCC(=O)OC 7a_100000074720_100000230301 [0,2,0,0,0,0|1,0,1]=4 10619 B18R0.126 CCCCCNC(=O)CSCCCCCC(=O)OC 62a_100000230301_100009816466 [0,2,0,0,0,0|1,0,1]=4 10620 B18R0.126 CCCCCNC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000230301 [0,2,0,0,0,0|1,0,1]=4 10621 B18R0.126 CCCCOCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100011995733 [0,2,0,0,0,0|0,0,1]=3 10622 B18R0.126 CCCCOCC(=O)CCCCCCCC(=O)OC 1458a_100000757543_100010004213 [0,2,0,0,0,0|0,0,1]=3 10623 B18R0.126 CCCCOCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000757543 [0,2,0,0,0,0|1,0,1]=4 10624 B18R0.126 CCCCOCC(C)OCCCCCCC(=O)OC 34a_100011217071_100009815986 [0,2,0,0,0,0|1,0,0]=3 10625 B18R0.126 CCCCOCC(C)OCCCCCCC(=O)OC 7a_100011217071_100009815986 [0,2,0,0,0,0|1,0,0]=3 10626 B18R0.126 CCCCSCC(=O)CCCCCCCC(=O)OC 1458a_100000191162_100010004213 [0,2,0,0,0,0|0,0,1]=3 10627 B18R0.126 CCCCSCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000191162 [0,2,0,0,0,0|1,0,1]=4 10628 B18R0.126 CCCOCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100011215938 [0,2,0,0,0,0|0,0,1]=3 10629 B18R0.126 CCOCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100012232248 [0,2,0,0,0,0|0,0,1]=3 10630 B18R0.126 CCOCCNC(=O)CCCCCCCC(=O)OC 11a_100011200944_100000033222 [0,2,0,0,0,0|1,0,1]=4 10631 B18R0.126 CCOCCNC(=O)CCCCCCCC(=O)OC 1626a_102516460346_100000033222 [0,2,0,0,0,0|1,0,1]=4 10632 B18R0.126 CCOCCNC(=O)CCCCCCCC(=O)OC 240690a_100011200944_100000033222 [0,2,0,0,0,0|1,0,1]=4 10633 B18R0.126 CCSCCNC(=O)CCCCCCCC(=O)OC 11a_100000106463_100000033222 [0,2,0,0,0,0|1,0,1]=4 10634 B18R0.126 CCSCCNC(=O)CCCCCCCC(=O)OC 1626a_100000106463_100000033222 [0,2,0,0,0,0|1,0,1]=4 10635 B18R0.126 CCSCCNC(=O)CCCCCCCC(=O)OC 240690a_100000106463_100000033222 [0,2,0,0,0,0|1,0,1]=4 10636 B18R0.126 COC(=O)CCCCCCCC(=O)CCCCC#N 1458a_100000033222_100000211819 [0,2,0,0,0,0|0,0,2]=4 10637 B18R0.126 COC(=O)CCCCCCCC(=O)CCCCCF 1458a_100000033222_100000729378 [0,2,0,0,0,0|0,0,1]=3 10638 B18R0.126 COC(=O)CCCCCCCC(=O)CCCCCO 1458a_100000033222_100000746330 [0,2,0,0,0,0|0,0,1]=3 10639 B18R0.126 COC(=O)CCCCCCCC(=O)CCCCCO 1458a_100102619762_100010004213 [0,2,0,0,0,0|0,0,1]=3 10640 B18R0.126 COC(=O)CCCCCCCC(=O)CCOCCO 1458a_100000033222_100011215305 [0,2,0,0,0,0|1,0,1]=4 10641 B18R0.126 COC(=O)CCCCCCCC(=O)CCOCCO 1458a_100011229844_100010004213 [0,2,0,0,0,0|1,0,1]=4 10642 B18R0.126 COC(=O)CCCCCCCC(=O)NCCCCO 240690a_100000750430_100000033222 [0,2,0,0,0,0|1,0,1]=4 10643 B18R0.126 COC(=O)CCCCCCCC(=O)NCCCSC 11a_100000749238_100000033222 [0,2,0,0,0,0|1,0,1]=4 10644 B18R0.126 COC(=O)CCCCCCCC(=O)NCCCSC 1626a_100000749238_100000033222 [0,2,0,0,0,0|1,0,1]=4 10645 B18R0.126 COC(=O)CCCCCCCC(=O)NCCCSC 240690a_100000749238_100000033222 [0,2,0,0,0,0|1,0,1]=4 10646 B18R0.126 COC(=O)CCCCCCCN(C)CCCCCO 2230a_100000722520_100010004213 [0,2,0,0,0,0|1,0,0]=3 10647 B18R0.126 COC(=O)CCCCCCCN(C)CCCCCO 269982a_100000722520_100010004213 [0,2,0,0,0,0|1,0,0]=3 10648 B18R0.126 COC(=O)CCCCCCCN(C)CCOCCO 2230a_100000228057_100010004213 [0,2,0,0,0,0|2,0,0]=4 10649 B18R0.126 COC(=O)CCCCCCCN(C)CCOCCO 269982a_100000228057_100010004213 [0,2,0,0,0,0|2,0,0]=4 10650 B18R0.126 COC(=O)CCCCCCNC(=O)CCCCCO 188690a_100000739044_100102619762 [0,2,0,0,0,0|1,0,1]=4 10651 B18R0.126 COCCCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000755781 [0,2,0,0,0,0|0,0,1]=3 10652 B18R0.126 COCCCNC(=O)CCCCCCCC(=O)OC 1626a_100150723488_100000033222 [0,2,0,0,0,0|1,0,1]=4 10653 B18R0.126 COCCCNC(=O)CCCCCCCC(=O)OC 240690a_100150723488_100000033222 [0,2,0,0,0,0|1,0,1]=4 10654 B18R0.126 COCCOCC(=O)CCCCCCCC(=O)OC 1458a_100000211095_100010004213 [0,2,0,0,0,0|1,0,1]=4 10655 B18R0.171 C#CC(=O)CCCCCCCCCCCCCC=C 1458a_100000211873_102495333938 [0,2,0,0,0,0|1,0,1]=4 10656 B18R0.171 C#CC(=O)CCCCCCCCCCCCCCC 1458a_100000211873_100000210322 [0,2,0,0,0,0|1,0,1]=4 10657 B18R0.171 C#CC(=O)CCCCCCCCCCCCCCO 1458a_100000211873_100009828009 [0,2,0,0,0,0|1,0,1]=4 10658 B18R0.171 C#CCCCCCCCCCCOCCC(=O)NC 34a_100000054667_100012179268 [0,2,0,0,0,0|1,0,1]=4 10659 B18R0.171 C#CCCCCCCCCCCOCCC(=O)NC 7a_100000054667_100000737683 [0,2,0,0,0,0|1,0,1]=4 10660 B18R0.171 C#CCCCCCCCCCCOCCC(=O)OC 34a_100000054667_100000742370 [0,2,0,0,0,0|0,0,1]=3 10661 B18R0.171 C#CCCCCCCCCCCOCCC(=O)OC 7a_100000054667_100000204255 [0,2,0,0,0,0|0,0,1]=3 10662 B18R0.171 C#CCCCCCCCCCOCCCC(=O)NC 34a_100000034437_100000741757 [0,2,0,0,0,0|1,0,1]=4 10663 B18R0.171 C#CCCCCCCCCCOCCCC(=O)NC 7a_100000034437_100000741757 [0,2,0,0,0,0|1,0,1]=4 10664 B18R0.171 C#CCCCCCCCCCOCCCC(=O)OC 34a_100000034437_100000742333 [0,2,0,0,0,0|0,0,1]=3 10665 B18R0.171 C#CCCCCCCCCCOCCCC(=O)OC 7a_100000034437_100011218270 [0,2,0,0,0,0|0,0,1]=3 10666 B18R0.171 C#CCCCCCCCCOCCCCC(=O)OC 34a_100000065265_100000204269 [0,2,0,0,0,0|0,0,1]=3 10667 B18R0.171 C#CCCCCCCCCOCCCCC(=O)OC 7a_100000065265_100000204269 [0,2,0,0,0,0|0,0,1]=3 10668 B18R0.171 C#CCCCCCCCCOCCOCC(=O)OC 34a_100000065265_100000090808 [0,2,0,0,0,0|0,0,2]=4 10669 B18R0.171 C#CCCCCCCCCOCCOCC(=O)OC 7a_100000065265_100000090808 [0,2,0,0,0,0|0,0,2]=4 10670 B18R0.171 C#CCCCCCCCOCCCCCC(=O)OC 34a_100000054614_100009816466 [0,2,0,0,0,0|0,0,1]=3 10671 B18R0.171 C#CCCCCCCCOCCCCCC(=O)OC 34a_100000074720_100153394163 [0,2,0,0,0,0|0,0,1]=3 10672 B18R0.171 C#CCCCCCCCOCCCCCC(=O)OC 7a_100000054614_100009816466 [0,2,0,0,0,0|0,0,1]=3 10673 B18R0.171 C#CCCCCCCCOCCCCCC(=O)OC 7a_100000074720_100153394163 [0,2,0,0,0,0|0,0,1]=3 10674 B18R0.171 C#CCCCCCCCSCCCCCC(=O)OC 62a_100009816466_100153394163 [0,2,0,0,0,0|0,0,1]=3 10675 B18R0.171 C#CCCCCCCCSCCCCCC(=O)OC 62a_100153394163_100009816466 [0,2,0,0,0,0|0,0,1]=3 10676 B18R0.171 C#CCCCCCCOCCCCCCC(=O)OC 34a_100009863599_100012276617 [0,2,0,0,0,0|0,0,1]=3 10677 B18R0.171 C#CCCCCCCOCCCCCCC(=O)OC 34a_100011217361_100009815986 [0,2,0,0,0,0|0,0,1]=3 10678 B18R0.171 C#CCCCCCCOCCCCCCC(=O)OC 7a_100009863599_100012276617 [0,2,0,0,0,0|0,0,1]=3 10679 B18R0.171 C#CCCCCCCOCCCCCCC(=O)OC 7a_100011217361_100009815986 [0,2,0,0,0,0|0,0,1]=3 10680 B18R0.171 C#CCCCCCCSCCCCCCC(=O)OC 62a_100009815986_100012276617 [0,2,0,0,0,0|0,0,1]=3 10681 B18R0.171 C#CCCCCCCSCCCCCCC(=O)OC 62a_100012276617_100009815986 [0,2,0,0,0,0|0,0,1]=3 10682 B18R0.171 C#CCCCCCOCCCCCCCC(=O)OC 34a_100000766912_100010004213 [0,2,0,0,0,0|0,0,1]=3 10683 B18R0.171 C#CCCCCCOCCCCCCCC(=O)OC 34a_100011022521_100012094781 [0,2,0,0,0,0|0,0,1]=3 10684 B18R0.171 C#CCCCCCOCCCCCCCC(=O)OC 7a_100000766912_100010004213 [0,2,0,0,0,0|0,0,1]=3 10685 B18R0.171 C#CCCCCCOCCCCCCCC(=O)OC 7a_100011022521_100012094781 [0,2,0,0,0,0|0,0,1]=3 10686 B18R0.171 C#CCCCCCSCCCCCCCC(=O)OC 62a_100010004213_100012094781 [0,2,0,0,0,0|0,0,1]=3 10687 B18R0.171 C#CCCCCCSCCCCCCCC(=O)OC 62a_100012094781_100010004213 [0,2,0,0,0,0|0,0,1]=3 10688 B18R0.171 C#CCCCCNCCCCCCCCC(=O)OC 2230a_100000706060_100010282707 [0,2,0,0,0,0|0,0,1]=3 10689 B18R0.171 C#CCCCCNCCCCCCCCC(=O)OC 34a_100000706060_100010282707 [0,2,0,0,0,0|0,0,1]=3 10690 B18R0.171 C#CCCCCOCCCCCCCCC(=O)OC 34a_100000035544_100010269958 [0,2,0,0,0,0|0,0,1]=3 10691 B18R0.171 C#CCCCCOCCCCCCCCC(=O)OC 34a_100000766709_100010282707 [0,2,0,0,0,0|0,0,1]=3 10692 B18R0.171 C#CCCCCOCCCCCCCCC(=O)OC 7a_100000035544_100010269958 [0,2,0,0,0,0|0,0,1]=3 10693 B18R0.171 C#CCCCCOCCCCCCCCC(=O)OC 7a_100000766709_100010282707 [0,2,0,0,0,0|0,0,1]=3 10694 B18R0.171 C#CCCCCSCCCCCCCCC(=O)OC 62a_100010269958_100010282707 [0,2,0,0,0,0|0,0,1]=3 10695 B18R0.171 C#CCCCCSCCCCCCCCC(=O)OC 62a_100010282707_100010269958 [0,2,0,0,0,0|0,0,1]=3 10696 B18R0.171 C#CCCCNCCCCCCCCCC(=O)OC 34a_100000718082_100009813843 [0,2,0,0,0,0|0,0,1]=3 10697 B18R0.171 C#CCCCOCCCCCCCCCC(=O)OC 34a_100000215630_100009813843 [0,2,0,0,0,0|0,0,1]=3 10698 B18R0.171 C#CCCCOCCCCCCCCCC(=O)OC 7a_100000215630_100009813843 [0,2,0,0,0,0|0,0,1]=3 10699 B18R0.171 C#CCCCSCCCCCCCCCC(=O)OC 62a_100011215417_100009813843 [0,2,0,0,0,0|0,0,1]=3 10700 B18R0.171 C#CCCNCCCCCCCCCCC(=O)OC 34a_100000755551_100009812566 [0,2,0,0,0,0|0,0,1]=3 10701 B18R0.171 C#CCCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000688953 [0,2,0,0,0,0|0,0,1]=3 10702 B18R0.171 C#CCCOCCCCCCCCCCC(=O)OC 34a_100011215631_100009812566 [0,2,0,0,0,0|0,0,1]=3 10703 B18R0.171 C#CCCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000688953 [0,2,0,0,0,0|0,0,1]=3 10704 B18R0.171 C#CCCSCCCCCCCCCCC(=O)OC 62a_100000688953_100009812566 [0,2,0,0,0,0|0,0,1]=3 10705 B18R0.171 C#CCNCCCCCCCCCCCC(=O)OC 34a_100000212058_100010983606 [0,2,0,0,0,0|0,0,1]=3 10706 B18R0.171 C#CCOCCCCCCCCCCCC(=O)OC 34a_100000210247_100010983606 [0,2,0,0,0,0|0,0,1]=3 10707 B18R0.171 C#CCOCCCCCCOCCCCC(=O)OC 34a_200011021349_100000204269 [0,2,0,0,0,0|0,0,2]=4 10708 B18R0.171 C#CCOCCCCCCOCCCCC(=O)OC 7a_200011021349_100000204269 [0,2,0,0,0,0|0,0,2]=4 10709 B18R0.171 C#CCOCCNCCCCCCCCC(=O)OC 2230a_100000700922_100010282707 [0,2,0,0,0,0|0,0,2]=4 10710 B18R0.171 C#CCOCCNCCCCCCCCC(=O)OC 34a_100000700922_100010282707 [0,2,0,0,0,0|0,0,2]=4 10711 B18R0.171 C#CCOCCOCCCCCCCCC(=O)OC 34a_100000035544_100010402529 [0,2,0,0,0,0|0,0,2]=4 10712 B18R0.171 C#CCOCCOCCCCCCCCC(=O)OC 34a_100000054580_100010282707 [0,2,0,0,0,0|0,0,2]=4 10713 B18R0.171 C#CCOCCOCCCCCCCCC(=O)OC 7a_100000035544_100010402529 [0,2,0,0,0,0|0,0,2]=4 10714 B18R0.171 C#CCOCCOCCCCCCCCC(=O)OC 7a_100000054580_100010282707 [0,2,0,0,0,0|0,0,2]=4 10715 B18R0.171 C#CCOCCSCCCCCCCCC(=O)OC 62a_100010282707_100010402529 [0,2,0,0,0,0|0,0,2]=4 10716 B18R0.171 C#CCOCCSCCCCCCCCC(=O)OC 62a_100010402529_100010282707 [0,2,0,0,0,0|0,0,2]=4 10717 B18R0.171 C#CCSCCCCCCCCCCCC(=O)OC 62a_100000038162_100010983606 [0,2,0,0,0,0|0,0,1]=3 10718 B18R0.171 C/C=C/CCOCCCCCCCCCC(=O)OC 34a_100016278192_100009813843 [0,2,0,0,0,0|0,0,1]=3 10719 B18R0.171 C/C=C/COCCCCCCCCCCC(=O)OC 34a_100011003013_100102629194 [0,2,0,0,0,0|0,0,1]=3 10720 B18R0.171 C/C=C/COCCCCCCCCCCC(=O)OC 34a_100016270725_100009812566 [0,2,0,0,0,0|0,0,1]=3 10721 B18R0.171 C/C=C/COCCCCCCCCCCC(=O)OC 7a_100011003013_100102629194 [0,2,0,0,0,0|0,0,1]=3 10722 B18R0.171 C/C=C/CSCCCCCCCCCCC(=O)OC 62a_100102629194_100009812566 [0,2,0,0,0,0|0,0,1]=3 10723 B18R0.171 C=CC(=O)NCCCCCCCCCCCCCC 1626a_100011217771_100000185746 [0,2,0,0,0,0|1,0,1]=4 10724 B18R0.171 C=CC(=O)NCCCCCCCCCCCCCC 240690a_100011217771_200121576911 [0,2,0,0,0,0|1,0,1]=4 10725 B18R0.171 C=CC(=O)NCCCCOCCCCCCCCC 34a_100014118770_100011214924 [0,2,0,0,0,0|1,0,1]=4 10726 B18R0.171 C=CC(=O)NCCNCCCCCCCCCCC 2230a_114873766552_100011215454 [0,2,0,0,0,0|1,0,1]=4 10727 B18R0.171 C=CC(=O)NCCOCCCCCCCCCCC 34a_100011304386_100011215454 [0,2,0,0,0,0|1,0,1]=4 10728 B18R0.171 C=CC(=O)OCCCCCCNCCCCCCC 2230a_100000229938_100009894100 [0,2,0,0,0,0|1,0,1]=4 10729 B18R0.171 C=CC(=O)OCCCCCCOCCCCCCC 34a_100000210272_100009894100 [0,2,0,0,0,0|1,0,1]=4 10730 B18R0.171 C=CC(=O)OCCCCCCOCCCCCCC 7a_100000210272_100009894100 [0,2,0,0,0,0|1,0,1]=4 10731 B18R0.171 C=CC(=O)OCCCCCCSCCCCCCC 62a_100000210614_100009894100 [0,2,0,0,0,0|1,0,1]=4 10732 B18R0.171 C=CC(=O)OCCCCCCSCCCCCCC 62a_100009894100_100000210316 [0,2,0,0,0,0|1,0,1]=4 10733 B18R0.171 C=CC(=O)OCCCCCOCCCCCCCC 7a_200011023508_100000210759 [0,2,0,0,0,0|1,0,1]=4 10734 B18R0.171 C=CC(=O)OCCNCCCCCCCCCCC 2230a_200011215754_100009813456 [0,2,0,0,0,0|1,0,1]=4 10735 B18R0.171 C=CC(=O)OCCNCCCCCCCCCCC 34a_200011215754_100009813456 [0,2,0,0,0,0|1,0,1]=4 10736 B18R0.171 C=CC(=O)OCCOCCCCCCCCCCC 34a_100000210809_100009813456 [0,2,0,0,0,0|1,0,1]=4 10737 B18R0.171 C=CC(=O)OCCOCCCCCCCCCCC 7a_100000210809_100009813456 [0,2,0,0,0,0|1,0,1]=4 10738 B18R0.171 C=CC(=O)OCCSCCCCCCCCCCC 62a_100009813456_100011215454 [0,2,0,0,0,0|1,0,1]=4 10739 B18R0.171 C=CCCCCCCCCCCCNCC(=O)NC 2230a_100000693194_102130925996 [0,2,0,0,0,0|1,0,1]=4 10740 B18R0.171 C=CCCCCCCCCCCCOCC(=O)NC 34a_100000750040_102130925996 [0,2,0,0,0,0|1,0,1]=4 10741 B18R0.171 C=CCCCCCCCCCCCSCC(=O)NC 62a_100000183359_102130925996 [0,2,0,0,0,0|1,0,1]=4 10742 B18R0.171 C=CCCCCCCCCCCCSCC(=O)NC 62a_102130925996_100000183359 [0,2,0,0,0,0|1,0,1]=4 10743 B18R0.171 C=CCCCCCCCCCCCSCC(=O)OC 62a_100000747449_102130925996 [0,2,0,0,0,0|0,0,1]=3 10744 B18R0.171 C=CCCCCCCCCCCCSCC(=O)OC 62a_102130925996_100000747449 [0,2,0,0,0,0|0,0,1]=3 10745 B18R0.171 C=CCCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011093070 [0,2,0,0,0,0|1,0,1]=4 10746 B18R0.171 C=CCCCCCCCCCCNCCC(=O)NC 34a_100000738227_100011093070 [0,2,0,0,0,0|1,0,1]=4 10747 B18R0.171 C=CCCCCCCCCCCOCCC(=O)NC 34a_100000754576_100011093070 [0,2,0,0,0,0|1,0,1]=4 10748 B18R0.171 C=CCCCCCCCCCCSCCC(=O)NC 62a_100000737683_100011093070 [0,2,0,0,0,0|1,0,1]=4 10749 B18R0.171 C=CCCCCCCCCCCSCCC(=O)NC 62a_100011093070_100000737683 [0,2,0,0,0,0|1,0,1]=4 10750 B18R0.171 C=CCCCCCCCCCCSCCC(=O)OC 62a_100000204255_100011093070 [0,2,0,0,0,0|0,0,1]=3 10751 B18R0.171 C=CCCCCCCCCCCSCCC(=O)OC 62a_100011093070_100000204255 [0,2,0,0,0,0|0,0,1]=3 10752 B18R0.171 C=CCCCCCCCCCCSCOC(=O)OC 62a_100011093070_100000139417 [0,2,0,0,0,0|0,0,2]=4 10753 B18R0.171 C=CCCCCCCCCCNCCCC(=O)NC 2230a_100000081888_100000741757 [0,2,0,0,0,0|1,0,1]=4 10754 B18R0.171 C=CCCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100009814027 [0,2,0,0,0,0|1,0,1]=4 10755 B18R0.171 C=CCCCCCCCCCNCCCC(=O)NC 34a_100000081888_100000741757 [0,2,0,0,0,0|1,0,1]=4 10756 B18R0.171 C=CCCCCCCCCCNCCCC(=O)NC 34a_100000740002_100009814027 [0,2,0,0,0,0|1,0,1]=4 10757 B18R0.171 C=CCCCCCCCCCNCCCC(=O)OC 2230a_100000081888_100011218270 [0,2,0,0,0,0|0,0,1]=3 10758 B18R0.171 C=CCCCCCCCCCNCCCC(=O)OC 34a_100000081888_100000742333 [0,2,0,0,0,0|0,0,1]=3 10759 B18R0.171 C=CCCCCCCCCCOCCCC(=O)NC 34a_100000038209_100000741757 [0,2,0,0,0,0|1,0,1]=4 10760 B18R0.171 C=CCCCCCCCCCOCCCC(=O)NC 7a_100000038209_100000741757 [0,2,0,0,0,0|1,0,1]=4 10761 B18R0.171 C=CCCCCCCCCCOCCCC(=O)OC 34a_100000038209_100000742333 [0,2,0,0,0,0|0,0,1]=3 10762 B18R0.171 C=CCCCCCCCCCOCCCC(=O)OC 7a_100000038209_100011218270 [0,2,0,0,0,0|0,0,1]=3 10763 B18R0.171 C=CCCCCCCCCCOCCNC(=O)OC 34a_100000757965_100009814027 [0,2,0,0,0,0|0,0,2]=4 10764 B18R0.171 C=CCCCCCCCCCOCCOC(=O)OC 34a_100010262106_100009814027 [0,2,0,0,0,0|0,0,2]=4 10765 B18R0.171 C=CCCCCCCCCCSCCCC(=O)NC 62a_100000741757_100009814027 [0,2,0,0,0,0|1,0,1]=4 10766 B18R0.171 C=CCCCCCCCCCSCCCC(=O)NC 62a_100009814027_100000741757 [0,2,0,0,0,0|1,0,1]=4 10767 B18R0.171 C=CCCCCCCCCCSCCCC(=O)OC 62a_100009814027_100011218270 [0,2,0,0,0,0|0,0,1]=3 10768 B18R0.171 C=CCCCCCCCCCSCCCC(=O)OC 62a_100011218270_100009814027 [0,2,0,0,0,0|0,0,1]=3 10769 B18R0.171 C=CCCCCCCCCOCCCCC(=O)OC 34a_100000059025_100011933949 [0,2,0,0,0,0|0,0,1]=3 10770 B18R0.171 C=CCCCCCCCCOCCCCC(=O)OC 34a_100011215194_100000204269 [0,2,0,0,0,0|0,0,1]=3 10771 B18R0.171 C=CCCCCCCCCOCCCCC(=O)OC 7a_100000059025_100011933949 [0,2,0,0,0,0|0,0,1]=3 10772 B18R0.171 C=CCCCCCCCCOCCCCC(=O)OC 7a_100011215194_100000204269 [0,2,0,0,0,0|0,0,1]=3 10773 B18R0.171 C=CCCCCCCCCOCCOCC(=O)OC 34a_100011215194_100000090808 [0,2,0,0,0,0|0,0,2]=4 10774 B18R0.171 C=CCCCCCCCCOCCOCC(=O)OC 7a_100011215194_100000090808 [0,2,0,0,0,0|0,0,2]=4 10775 B18R0.171 C=CCCCCCCCCSCCCCC(=O)OC 62a_100000204269_100011933949 [0,2,0,0,0,0|0,0,1]=3 10776 B18R0.171 C=CCCCCCCCCSCCCCC(=O)OC 62a_100011933949_100000204269 [0,2,0,0,0,0|0,0,1]=3 10777 B18R0.171 C=CCCCCCCCCSCCOCC(=O)OC 62a_100000090808_100011933949 [0,2,0,0,0,0|0,0,2]=4 10778 B18R0.171 C=CCCCCCCCCSCCOCC(=O)OC 62a_100011933949_100000090808 [0,2,0,0,0,0|0,0,2]=4 10779 B18R0.171 C=CCCCCCCCOCCCCCC(=O)OC 34a_100000074720_100012355270 [0,2,0,0,0,0|0,0,1]=3 10780 B18R0.171 C=CCCCCCCCOCCCCCC(=O)OC 34a_100000730831_100009816466 [0,2,0,0,0,0|0,0,1]=3 10781 B18R0.171 C=CCCCCCCCOCCCCCC(=O)OC 7a_100000074720_100012355270 [0,2,0,0,0,0|0,0,1]=3 10782 B18R0.171 C=CCCCCCCCOCCCCCC(=O)OC 7a_100000730831_100009816466 [0,2,0,0,0,0|0,0,1]=3 10783 B18R0.171 C=CCCCCCCCSCCCCCC(=O)OC 62a_100009816466_100012355270 [0,2,0,0,0,0|0,0,1]=3 10784 B18R0.171 C=CCCCCCCCSCCCCCC(=O)OC 62a_100012355270_100009816466 [0,2,0,0,0,0|0,0,1]=3 10785 B18R0.171 C=CCCCCCCOCCCCCCC(=O)OC 34a_100009863599_100011215473 [0,2,0,0,0,0|0,0,1]=3 10786 B18R0.171 C=CCCCCCCOCCCCCCC(=O)OC 34a_200011216477_100009815986 [0,2,0,0,0,0|0,0,1]=3 10787 B18R0.171 C=CCCCCCCOCCCCCCC(=O)OC 7a_100009863599_100011215473 [0,2,0,0,0,0|0,0,1]=3 10788 B18R0.171 C=CCCCCCCOCCCCCCC(=O)OC 7a_200011216477_100009815986 [0,2,0,0,0,0|0,0,1]=3 10789 B18R0.171 C=CCCCCCCSCCCCCCC(=O)OC 62a_100009815986_100011215473 [0,2,0,0,0,0|0,0,1]=3 10790 B18R0.171 C=CCCCCCCSCCCCCCC(=O)OC 62a_100011215473_100009815986 [0,2,0,0,0,0|0,0,1]=3 10791 B18R0.171 C=CCCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000700193 [0,2,0,0,0,0|0,0,1]=3 10792 B18R0.171 C=CCCCCCOCCCCCCCC(=O)OC 34a_100011216702_100010004213 [0,2,0,0,0,0|0,0,1]=3 10793 B18R0.171 C=CCCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000700193 [0,2,0,0,0,0|0,0,1]=3 10794 B18R0.171 C=CCCCCCOCCCCCCCC(=O)OC 7a_100011216702_100010004213 [0,2,0,0,0,0|0,0,1]=3 10795 B18R0.171 C=CCCCCCSCCCCCCCC(=O)OC 62a_100000700193_100010004213 [0,2,0,0,0,0|0,0,1]=3 10796 B18R0.171 C=CCCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000700193 [0,2,0,0,0,0|0,0,1]=3 10797 B18R0.171 C=CCCCCNCCCCCCCCC(=O)OC 2230a_100000703577_100010282707 [0,2,0,0,0,0|0,0,1]=3 10798 B18R0.171 C=CCCCCNCCCCCCCCC(=O)OC 34a_100000703577_100010282707 [0,2,0,0,0,0|0,0,1]=3 10799 B18R0.171 C=CCCCCOCCCCCCCCC(=O)OC 34a_100000035544_100011215482 [0,2,0,0,0,0|0,0,1]=3 10800 B18R0.171 C=CCCCCOCCCCCCCCC(=O)OC 34a_100000766645_100010282707 [0,2,0,0,0,0|0,0,1]=3 10801 B18R0.171 C=CCCCCOCCCCCCCCC(=O)OC 7a_100000035544_100011215482 [0,2,0,0,0,0|0,0,1]=3 10802 B18R0.171 C=CCCCCOCCCCCCCCC(=O)OC 7a_100000766645_100010282707 [0,2,0,0,0,0|0,0,1]=3 10803 B18R0.171 C=CCCCCSCCCCCCCCC(=O)OC 62a_100010282707_100011215482 [0,2,0,0,0,0|0,0,1]=3 10804 B18R0.171 C=CCCCCSCCCCCCCCC(=O)OC 62a_100011215482_100010282707 [0,2,0,0,0,0|0,0,1]=3 10805 B18R0.171 C=CCCCNCCCCCCCCCC(=O)OC 2230a_100000700776_100009813843 [0,2,0,0,0,0|0,0,1]=3 10806 B18R0.171 C=CCCCNCCCCCCCCCC(=O)OC 34a_100000700776_100009813843 [0,2,0,0,0,0|0,0,1]=3 10807 B18R0.171 C=CCCCOCCCCCCCCCC(=O)OC 34a_100000758997_100009813843 [0,2,0,0,0,0|0,0,1]=3 10808 B18R0.171 C=CCCCOCCCCCCCCCC(=O)OC 7a_100000758997_100009813843 [0,2,0,0,0,0|0,0,1]=3 10809 B18R0.171 C=CCCCSCCCCCCCCCC(=O)OC 62a_100011713584_100009813843 [0,2,0,0,0,0|0,0,1]=3 10810 B18R0.171 C=CCCNCCCCCCCCCCC(=O)OC 2230a_100015191253_100009812566 [0,2,0,0,0,0|0,0,1]=3 10811 B18R0.171 C=CCCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000754431 [0,2,0,0,0,0|0,0,1]=3 10812 B18R0.171 C=CCCOCCCCCCCCCCC(=O)OC 34a_100011205117_100009812566 [0,2,0,0,0,0|0,0,1]=3 10813 B18R0.171 C=CCCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000754431 [0,2,0,0,0,0|0,0,1]=3 10814 B18R0.171 C=CCCSCCCCCCCCCCC(=O)OC 62a_100000754431_100009812566 [0,2,0,0,0,0|0,0,1]=3 10815 B18R0.171 C=CCNCCCCCCCCCCCC(=O)OC 2230a_100020586998_100010983606 [0,2,0,0,0,0|0,0,1]=3 10816 B18R0.171 C=CCOCCCCCCCCCCCC(=O)OC 34a_200000210373_100010983606 [0,2,0,0,0,0|0,0,1]=3 10817 B18R0.171 C=CCOCCOCCCCCCCCC(=O)OC 34a_100000037705_100010282707 [0,2,0,0,0,0|0,0,2]=4 10818 B18R0.171 C=CCOCCOCCCCCCCCC(=O)OC 7a_100000037705_100010282707 [0,2,0,0,0,0|0,0,2]=4 10819 B18R0.171 C=CCSCCCCCCCCCCCC(=O)OC 62a_100000210623_100010983606 [0,2,0,0,0,0|0,0,1]=3 10820 B18R0.171 C=COCCCCOCCCCCCCC(=O)OC 34a_100000031558_100010004213 [0,2,0,0,0,0|0,0,2]=4 10821 B18R0.171 C=COCCCCOCCCCCCCC(=O)OC 7a_100000031558_100010004213 [0,2,0,0,0,0|0,0,2]=4 10822 B18R0.171 C=COCCCNCCCCCCCCC(=O)OC 2230a_100000210767_100010282707 [0,2,0,0,0,0|0,0,2]=4 10823 B18R0.171 C=COCCCNCCCCCCCCC(=O)OC 34a_100000210767_100010282707 [0,2,0,0,0,0|0,0,2]=4 10824 B18R0.171 C=COCCOCCCCCCCCCC(=O)OC 34a_100000033082_100009813843 [0,2,0,0,0,0|0,0,2]=4 10825 B18R0.171 C=COCCSCCCCCCCCCC(=O)OC 62a_100000039644_100009813843 [0,2,0,0,0,0|0,0,2]=4 10826 B18R0.171 CC#CCCOCCCCCCCCCC(=O)OC 34a_100000750427_100009813843 [0,2,0,0,0,0|0,0,1]=3 10827 B18R0.171 CC#CCNCCCCCCCCCCC(=O)OC 2230a_100000685387_100009812566 [0,2,0,0,0,0|0,0,1]=3 10828 B18R0.171 CC#CCNCCCCCCCCCCC(=O)OC 34a_100000685387_100009812566 [0,2,0,0,0,0|0,0,1]=3 10829 B18R0.171 CC#CCOCCCCCCCCCCC(=O)OC 34a_100000761923_100009812566 [0,2,0,0,0,0|0,0,1]=3 10830 B18R0.171 CC#CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000748600 [0,2,0,0,0,0|0,0,1]=3 10831 B18R0.171 CC#CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000748600 [0,2,0,0,0,0|0,0,1]=3 10832 B18R0.171 CC#CCSCCCCCCCCCCC(=O)OC 62a_100000748600_100009812566 [0,2,0,0,0,0|0,0,1]=3 10833 B18R0.171 CC/C=C/CCCOCCCCCCCC(=O)OC 34a_100016287902_100010004213 [0,2,0,0,0,0|0,0,1]=3 10834 B18R0.171 CC/C=C/CCCOCCCCCCCC(=O)OC 7a_100016287902_100010004213 [0,2,0,0,0,0|0,0,1]=3 10835 B18R0.171 CC/C=C\CCCCCCCNCCCC(=O)NC 269862a_100000740002_200025770492 [0,2,0,0,0,0|1,0,1]=4 10836 B18R0.171 CC/C=C\CCCCCOCCCCCC(=O)OC 34a_100016268722_100009816466 [0,2,0,0,0,0|0,0,1]=3 10837 B18R0.171 CC/C=C\CCCCCOCCCCCC(=O)OC 7a_100016268722_100009816466 [0,2,0,0,0,0|0,0,1]=3 10838 B18R0.171 CC/C=C\CCCCOCCCCCCC(=O)OC 34a_100016287862_100009815986 [0,2,0,0,0,0|0,0,1]=3 10839 B18R0.171 CC/C=C\CCCCOCCCCCCC(=O)OC 7a_100016287862_100009815986 [0,2,0,0,0,0|0,0,1]=3 10840 B18R0.171 CC/C=C\CCOCCCCCCCCC(=O)OC 34a_100000035544_100015370543 [0,2,0,0,0,0|0,0,1]=3 10841 B18R0.171 CC/C=C\CCOCCCCCCCCC(=O)OC 34a_100016288707_100010282707 [0,2,0,0,0,0|0,0,1]=3 10842 B18R0.171 CC/C=C\CCOCCCCCCCCC(=O)OC 7a_100000035544_100015370543 [0,2,0,0,0,0|0,0,1]=3 10843 B18R0.171 CC/C=C\CCOCCCCCCCCC(=O)OC 7a_100016288707_100010282707 [0,2,0,0,0,0|0,0,1]=3 10844 B18R0.171 CC/C=C\CCSCCCCCCCCC(=O)OC 62a_100010282707_100015370543 [0,2,0,0,0,0|0,0,1]=3 10845 B18R0.171 CC/C=C\CCSCCCCCCCCC(=O)OC 62a_100015370543_100010282707 [0,2,0,0,0,0|0,0,1]=3 10846 B18R0.171 CC/C=C\COCCCCCCCCCC(=O)OC 34a_100016268518_100009813843 [0,2,0,0,0,0|0,0,1]=3 10847 B18R0.171 CC/C=C\CSCCCCCCCCCC(=O)OC 62a_100103147603_100009813843 [0,2,0,0,0,0|0,0,1]=3 10848 B18R0.171 CC=C=CCCOCCCCCCCCC(=O)OC 34a_100011020354_100010282707 [0,2,0,0,0,0|0,0,2]=4 10849 B18R0.171 CC=CCCCOCCCCCCCCC(=O)OC 34a_100020645299_100010282707 [0,2,0,0,0,0|0,0,1]=3 10850 B18R0.171 CC=CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000070051 [0,2,0,0,0,0|0,0,1]=3 10851 B18R0.171 CC=CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000070051 [0,2,0,0,0,0|0,0,1]=3 10852 B18R0.171 CC=CCSCCCCCCCCCCC(=O)OC 62a_100000070051_100009812566 [0,2,0,0,0,0|0,0,1]=3 10853 B18R0.171 CCC#CCCCCCCCCOCCC(=O)NC 34a_200000031908_100012179268 [0,2,0,0,0,0|1,0,1]=4 10854 B18R0.171 CCC#CCCCCCCCCOCCC(=O)NC 7a_200000031908_100000737683 [0,2,0,0,0,0|1,0,1]=4 10855 B18R0.171 CCC#CCCCCCCCCOCCC(=O)OC 34a_200000031908_100000742370 [0,2,0,0,0,0|0,0,1]=3 10856 B18R0.171 CCC#CCCCCCCCCOCCC(=O)OC 7a_200000031908_100000204255 [0,2,0,0,0,0|0,0,1]=3 10857 B18R0.171 CCC#CCCCCCCOCCCCC(=O)OC 34a_100000059025_200000036426 [0,2,0,0,0,0|0,0,1]=3 10858 B18R0.171 CCC#CCCCCCCOCCCCC(=O)OC 7a_100000059025_200000036426 [0,2,0,0,0,0|0,0,1]=3 10859 B18R0.171 CCC#CCCCCCCSCCCCC(=O)OC 62a_100000204269_200000036426 [0,2,0,0,0,0|0,0,1]=3 10860 B18R0.171 CCC#CCCCCCCSCCCCC(=O)OC 62a_200000036426_100000204269 [0,2,0,0,0,0|0,0,1]=3 10861 B18R0.171 CCC#CCCCCCCSCCOCC(=O)OC 62a_100000090808_200000036426 [0,2,0,0,0,0|0,0,2]=4 10862 B18R0.171 CCC#CCCCCCCSCCOCC(=O)OC 62a_200000036426_100000090808 [0,2,0,0,0,0|0,0,2]=4 10863 B18R0.171 CCC#CCCOCCCCCCCCC(=O)OC 34a_100000036655_100010282707 [0,2,0,0,0,0|0,0,1]=3 10864 B18R0.171 CCC#CCCOCCCCCCCCC(=O)OC 7a_100000036655_100010282707 [0,2,0,0,0,0|0,0,1]=3 10865 B18R0.171 CCC#CCOCCCCCCCCCC(=O)OC 34a_100000032950_100009813843 [0,2,0,0,0,0|0,0,1]=3 10866 B18R0.171 CCC#CCSCCCCCCCCCC(=O)OC 62a_100009813939_100009813843 [0,2,0,0,0,0|0,0,1]=3 10867 B18R0.171 CCC(=O)NCCNCCCCCCCCCCO 34a_100132302217_100009813290 [0,2,0,0,0,0|2,0,0]=4 10868 B18R0.171 CCC(=O)NCCOCCCCCCCCCCO 34a_200000158885_100009813290 [0,2,0,0,0,0|2,0,0]=4 10869 B18R0.171 CCC(=O)NCCOCCCCCCCCCCO 7a_200000158885_100009813290 [0,2,0,0,0,0|2,0,0]=4 10870 B18R0.171 CCC(=O)OCCOCCCCCCCCCCO 7a_200000031056_100009813290 [0,2,0,0,0,0|2,0,0]=4 10871 B18R0.171 CCC/C=C/COCCCCCCCCC(=O)OC 34a_100016278788_100010282707 [0,2,0,0,0,0|0,0,1]=3 10872 B18R0.171 CCC/C=C/COCCCCCCCCC(=O)OC 7a_100016278788_100010282707 [0,2,0,0,0,0|0,0,1]=3 10873 B18R0.171 CCCC#CCCOCCCCCCCC(=O)OC 34a_100000042726_100010004213 [0,2,0,0,0,0|0,0,1]=3 10874 B18R0.171 CCCC#CCCOCCCCCCCC(=O)OC 7a_100000042726_100010004213 [0,2,0,0,0,0|0,0,1]=3 10875 B18R0.171 CCCC#CCOCCCCCCCCC(=O)OC 34a_100000034806_100010282707 [0,2,0,0,0,0|0,0,1]=3 10876 B18R0.171 CCCC#CCOCCCCCCCCC(=O)OC 7a_100000034806_100010282707 [0,2,0,0,0,0|0,0,1]=3 10877 B18R0.171 CCCC/C=C/CCCCOCCCCC(=O)OC 34a_200020645093_100000204269 [0,2,0,0,0,0|0,0,1]=3 10878 B18R0.171 CCCC/C=C/CCCCOCCCCC(=O)OC 7a_200020645093_100000204269 [0,2,0,0,0,0|0,0,1]=3 10879 B18R0.171 CCCC/C=C/CCCCOCCOCC(=O)OC 34a_200020645093_100000090808 [0,2,0,0,0,0|0,0,2]=4 10880 B18R0.171 CCCC/C=C/CCCCOCCOCC(=O)OC 7a_200020645093_100000090808 [0,2,0,0,0,0|0,0,2]=4 10881 B18R0.171 CCCC/C=C/COCCCCCCCC(=O)OC 34a_200016272032_100010004213 [0,2,0,0,0,0|0,0,1]=3 10882 B18R0.171 CCCC/C=C/COCCCCCCCC(=O)OC 7a_200016272032_100010004213 [0,2,0,0,0,0|0,0,1]=3 10883 B18R0.171 CCCC/C=C\CCOCCCCCCC(=O)OC 34a_200016286491_100009815986 [0,2,0,0,0,0|0,0,1]=3 10884 B18R0.171 CCCC/C=C\CCOCCCCCCC(=O)OC 7a_200016286491_100009815986 [0,2,0,0,0,0|0,0,1]=3 10885 B18R0.171 CCCCC#CCCCCCCNCCC(=O)NC 2230a_100000738227_200000043322 [0,2,0,0,0,0|1,0,1]=4 10886 B18R0.171 CCCCC#CCCCCCCNCCC(=O)NC 34a_100000738227_200000043322 [0,2,0,0,0,0|1,0,1]=4 10887 B18R0.171 CCCCC#CCCCCCCOCCC(=O)NC 34a_100000754576_200000043322 [0,2,0,0,0,0|1,0,1]=4 10888 B18R0.171 CCCCC#CCCCCCCSCCC(=O)NC 62a_100000737683_200000043322 [0,2,0,0,0,0|1,0,1]=4 10889 B18R0.171 CCCCC#CCCCCCCSCCC(=O)NC 62a_200000043322_100000737683 [0,2,0,0,0,0|1,0,1]=4 10890 B18R0.171 CCCCC#CCCCCCCSCCC(=O)OC 62a_100000204255_200000043322 [0,2,0,0,0,0|0,0,1]=3 10891 B18R0.171 CCCCC#CCCCCCCSCCC(=O)OC 62a_200000043322_100000204255 [0,2,0,0,0,0|0,0,1]=3 10892 B18R0.171 CCCCC#CCCCCCCSCOC(=O)OC 62a_200000043322_100000139417 [0,2,0,0,0,0|0,0,2]=4 10893 B18R0.171 CCCCC#CCCCCOCCCCC(=O)OC 34a_200000066234_100000204269 [0,2,0,0,0,0|0,0,1]=3 10894 B18R0.171 CCCCC#CCCCCOCCCCC(=O)OC 7a_200000066234_100000204269 [0,2,0,0,0,0|0,0,1]=3 10895 B18R0.171 CCCCC#CCCCCOCCOCC(=O)OC 34a_200000066234_100000090808 [0,2,0,0,0,0|0,0,2]=4 10896 B18R0.171 CCCCC#CCCCCOCCOCC(=O)OC 7a_200000066234_100000090808 [0,2,0,0,0,0|0,0,2]=4 10897 B18R0.171 CCCCC#CCCCOCCCCCC(=O)OC 34a_100000074720_200000047210 [0,2,0,0,0,0|0,0,1]=3 10898 B18R0.171 CCCCC#CCCCOCCCCCC(=O)OC 7a_100000074720_200000047210 [0,2,0,0,0,0|0,0,1]=3 10899 B18R0.171 CCCCC#CCCCSCCCCCC(=O)OC 62a_100009816466_200000047210 [0,2,0,0,0,0|0,0,1]=3 10900 B18R0.171 CCCCC#CCCCSCCCCCC(=O)OC 62a_200000047210_100009816466 [0,2,0,0,0,0|0,0,1]=3 10901 B18R0.171 CCCCC#CCCOCCCCCCC(=O)OC 34a_100000037610_100009815986 [0,2,0,0,0,0|0,0,1]=3 10902 B18R0.171 CCCCC#CCCOCCCCCCC(=O)OC 7a_100000037610_100009815986 [0,2,0,0,0,0|0,0,1]=3 10903 B18R0.171 CCCCC#CCOCCCCCCCC(=O)OC 34a_200000034558_100010004213 [0,2,0,0,0,0|0,0,1]=3 10904 B18R0.171 CCCCC#CCOCCCCCCCC(=O)OC 7a_200000034558_100010004213 [0,2,0,0,0,0|0,0,1]=3 10905 B18R0.171 CCCCC/C=C/COCCCCCCC(=O)OC 34a_100016258190_100009815986 [0,2,0,0,0,0|0,0,1]=3 10906 B18R0.171 CCCCC/C=C/COCCCCCCC(=O)OC 7a_100016258190_100009815986 [0,2,0,0,0,0|0,0,1]=3 10907 B18R0.171 CCCCC/C=C\CCCOCCCCC(=O)OC 34a_100020655193_100000204269 [0,2,0,0,0,0|0,0,1]=3 10908 B18R0.171 CCCCC/C=C\CCCOCCCCC(=O)OC 7a_100020655193_100000204269 [0,2,0,0,0,0|0,0,1]=3 10909 B18R0.171 CCCCC/C=C\CCCOCCOCC(=O)OC 34a_100020655193_100000090808 [0,2,0,0,0,0|0,0,2]=4 10910 B18R0.171 CCCCC/C=C\CCCOCCOCC(=O)OC 7a_100020655193_100000090808 [0,2,0,0,0,0|0,0,2]=4 10911 B18R0.171 CCCCC/C=C\CCOCCCCCC(=O)OC 34a_100016277358_100009816466 [0,2,0,0,0,0|0,0,1]=3 10912 B18R0.171 CCCCC/C=C\CCOCCCCCC(=O)OC 7a_100016277358_100009816466 [0,2,0,0,0,0|0,0,1]=3 10913 B18R0.171 CCCCCC#CCCOCCCCCC(=O)OC 34a_200000042877_100009816466 [0,2,0,0,0,0|0,0,1]=3 10914 B18R0.171 CCCCCC#CCCOCCCCCC(=O)OC 7a_200000042877_100009816466 [0,2,0,0,0,0|0,0,1]=3 10915 B18R0.171 CCCCCC#CCOCCCCCCC(=O)OC 34a_100009863599_100009816472 [0,2,0,0,0,0|0,0,1]=3 10916 B18R0.171 CCCCCC#CCOCCCCCCC(=O)OC 34a_200000033628_100009815986 [0,2,0,0,0,0|0,0,1]=3 10917 B18R0.171 CCCCCC#CCOCCCCCCC(=O)OC 7a_100009863599_100009816472 [0,2,0,0,0,0|0,0,1]=3 10918 B18R0.171 CCCCCC#CCOCCCCCCC(=O)OC 7a_200000033628_100009815986 [0,2,0,0,0,0|0,0,1]=3 10919 B18R0.171 CCCCCC#CCSCCCCCCC(=O)OC 62a_100009815986_100009816472 [0,2,0,0,0,0|0,0,1]=3 10920 B18R0.171 CCCCCC#CCSCCCCCCC(=O)OC 62a_100009816472_100009815986 [0,2,0,0,0,0|0,0,1]=3 10921 B18R0.171 CCCCCC/C=C/COCCCCCC(=O)OC 34a_200016276170_100009816466 [0,2,0,0,0,0|0,0,1]=3 10922 B18R0.171 CCCCCC/C=C/COCCCCCC(=O)OC 7a_200016276170_100009816466 [0,2,0,0,0,0|0,0,1]=3 10923 B18R0.171 CCCCCC/C=C\CCCCCCCC(=O)CF 1458a_100020587579_100015361967 [0,2,0,0,0,0|2,0,0]=4 10924 B18R0.171 CCCCCC/C=C\CCCCCCCC(=O)NC 11a_106832991635_100020587579 [0,2,0,0,0,0|1,0,0]=3 10925 B18R0.171 CCCCCC/C=C\CCCCCCCC(=O)NC 1626a_100102657272_100020587579 [0,2,0,0,0,0|1,0,0]=3 10926 B18R0.171 CCCCCC/C=C\CCCCCCCC(=O)NC 240690a_100102657272_100020587579 [0,2,0,0,0,0|1,0,0]=3 10927 B18R0.171 CCCCCC/C=C\CCCCCCCC(=O)NC 527a_100102657272_100020587579 [0,2,0,0,0,0|1,0,0]=3 10928 B18R0.171 CCCCCCC#CCCOCCCCC(=O)OC 34a_200000033163_100000204269 [0,2,0,0,0,0|0,0,1]=3 10929 B18R0.171 CCCCCCC#CCCOCCCCC(=O)OC 7a_200000033163_100000204269 [0,2,0,0,0,0|0,0,1]=3 10930 B18R0.171 CCCCCCC#CCCOCCOCC(=O)OC 34a_200000033163_100000090808 [0,2,0,0,0,0|0,0,2]=4 10931 B18R0.171 CCCCCCC#CCCOCCOCC(=O)OC 7a_200000033163_100000090808 [0,2,0,0,0,0|0,0,2]=4 10932 B18R0.171 CCCCCCC#CCOCCCCCC(=O)OC 34a_200000037284_100009816466 [0,2,0,0,0,0|0,0,1]=3 10933 B18R0.171 CCCCCCC#CCOCCCCCC(=O)OC 7a_200000037284_100009816466 [0,2,0,0,0,0|0,0,1]=3 10934 B18R0.171 CCCCCCCC#CCOCCCCC(=O)OC 34a_200000061759_100000204269 [0,2,0,0,0,0|0,0,1]=3 10935 B18R0.171 CCCCCCCC#CCOCCCCC(=O)OC 7a_200000061759_100000204269 [0,2,0,0,0,0|0,0,1]=3 10936 B18R0.171 CCCCCCCC#CCOCCOCC(=O)OC 34a_200000061759_100000090808 [0,2,0,0,0,0|0,0,2]=4 10937 B18R0.171 CCCCCCCC#CCOCCOCC(=O)OC 7a_200000061759_100000090808 [0,2,0,0,0,0|0,0,2]=4 10938 B18R0.171 CCCCCCCC/C=C/COCCCC(=O)NC 34a_200020667288_100000741757 [0,2,0,0,0,0|1,0,1]=4 10939 B18R0.171 CCCCCCCC/C=C/COCCCC(=O)NC 7a_200020667288_100000741757 [0,2,0,0,0,0|1,0,1]=4 10940 B18R0.171 CCCCCCCC/C=C/COCCCC(=O)OC 34a_200020667288_100000742333 [0,2,0,0,0,0|0,0,1]=3 10941 B18R0.171 CCCCCCCC/C=C/COCCCC(=O)OC 7a_200020667288_100011218270 [0,2,0,0,0,0|0,0,1]=3 10942 B18R0.171 CCCCCCCCC/C=C/COCCC(=O)NC 34a_100015232335_100012179268 [0,2,0,0,0,0|1,0,1]=4 10943 B18R0.171 CCCCCCCCC/C=C/COCCC(=O)NC 7a_100015232335_100000737683 [0,2,0,0,0,0|1,0,1]=4 10944 B18R0.171 CCCCCCCCC/C=C/COCCC(=O)OC 34a_100015232335_100000742370 [0,2,0,0,0,0|0,0,1]=3 10945 B18R0.171 CCCCCCCCC/C=C/COCCC(=O)OC 7a_100015232335_100000204255 [0,2,0,0,0,0|0,0,1]=3 10946 B18R0.171 CCCCCCCCCC/C=C/COCC(=O)CC 7a_200025761149_100000747405 [0,2,0,0,0,0|1,0,1]=4 10947 B18R0.171 CCCCCCCCCC/C=C/COCC(=O)NC 34a_200025761149_100000183359 [0,2,0,0,0,0|1,0,1]=4 10948 B18R0.171 CCCCCCCCCC/C=C/COCC(=O)NC 7a_200025761149_100000183359 [0,2,0,0,0,0|1,0,1]=4 10949 B18R0.171 CCCCCCCCCC/C=C/COCC(=O)OC 34a_200025761149_100000747449 [0,2,0,0,0,0|0,0,1]=3 10950 B18R0.171 CCCCCCCCCC/C=C/COCC(=O)OC 7a_200025761149_100000747449 [0,2,0,0,0,0|0,0,1]=3 10951 B18R0.171 CCCCCCCCCCCCC=NNC(=O)CC 4a_100000183195_200011215488 [0,2,0,0,0,0|1,0,1]=4 10952 B18R0.171 CCCCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000610636 [0,2,0,0,0,0|1,0,0]=3 10953 B18R0.171 CCCCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000610636 [0,2,0,0,0,0|1,0,0]=3 10954 B18R0.171 CCCCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000610636 [0,2,0,0,0,0|1,0,0]=3 10955 B18R0.171 CCCCCCCCCCCCCCNC(=O)CC 11a_100011217771_100000210414 [0,2,0,0,0,0|1,0,0]=3 10956 B18R0.171 CCCCCCCCCCCCCCNC(=O)CC 1626a_100011217771_100000210414 [0,2,0,0,0,0|1,0,0]=3 10957 B18R0.171 CCCCCCCCCCCCCCNC(=O)CC 240690a_100011217771_100000210414 [0,2,0,0,0,0|1,0,0]=3 10958 B18R0.171 CCCCCCCCCCCCCCNC(=O)CC 527a_100011217771_100000210414 [0,2,0,0,0,0|1,0,0]=3 10959 B18R0.171 CCCCCCCCCCCCCCNC(=O)CO 240690a_100011217771_100000210174 [0,2,0,0,0,0|2,0,0]=4 10960 B18R0.171 CCCCCCCCCCCCCCNC(=O)CO 527a_100011217771_100000210174 [0,2,0,0,0,0|2,0,0]=4 10961 B18R0.171 CCCCCCCCCCCCCCNC(=O)NC 2708a_100011217771_106832991635 [0,2,0,0,0,0|1,0,0]=3 10962 B18R0.171 CCCCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100011217771 [0,2,0,0,0,0|1,0,0]=3 10963 B18R0.171 CCCCCCCCCCCCCCNC(=O)NC 273464a_100011217771_100102657272 [0,2,0,0,0,0|1,0,0]=3 10964 B18R0.171 CCCCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100011217771 [0,2,0,0,0,0|1,0,0]=3 10965 B18R0.171 CCCCCCCCCCCCCCNC(=O)NC 512a_100011217771_100102657272 [0,2,0,0,0,0|1,0,0]=3 10966 B18R0.171 CCCCCCCCCCCCCCNC(=O)NC 512a_106832991638_100011217771 [0,2,0,0,0,0|1,0,0]=3 10967 B18R0.171 CCCCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100000210684 [0,2,0,0,0,0|1,0,0]=3 10968 B18R0.171 CCCCCCCCCCCCCNCC(=O)NC 2230a_100011215765_100000183359 [0,2,0,0,0,0|1,0,0]=3 10969 B18R0.171 CCCCCCCCCCCCCNCC(=O)NC 270004a_100000693194_200011215488 [0,2,0,0,0,0|1,0,0]=3 10970 B18R0.171 CCCCCCCCCCCCCNCC(=O)NC 34a_100011215765_100000183359 [0,2,0,0,0,0|1,0,0]=3 10971 B18R0.171 CCCCCCCCCCCCCNCC(=O)OC 2230a_100011215765_100000747449 [0,2,0,0,0,0|0,0,0]=2 10972 B18R0.171 CCCCCCCCCCCCCNCC(=O)OC 34a_100011215765_100000747449 [0,2,0,0,0,0|0,0,0]=2 10973 B18R0.171 CCCCCCCCCCCCCOCC(=O)NC 34a_100000185773_100000183359 [0,2,0,0,0,0|1,0,0]=3 10974 B18R0.171 CCCCCCCCCCCCCOCC(=O)NC 34a_100000750040_100000210684 [0,2,0,0,0,0|1,0,0]=3 10975 B18R0.171 CCCCCCCCCCCCCOCC(=O)NC 7a_100000185773_100000183359 [0,2,0,0,0,0|1,0,0]=3 10976 B18R0.171 CCCCCCCCCCCCCOCC(=O)OC 34a_100000185773_100000747449 [0,2,0,0,0,0|0,0,0]=2 10977 B18R0.171 CCCCCCCCCCCCCOCC(=O)OC 7a_100000185773_100000747449 [0,2,0,0,0,0|0,0,0]=2 10978 B18R0.171 CCCCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011934334 [0,2,0,0,0,0|1,0,0]=3 10979 B18R0.171 CCCCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011934334 [0,2,0,0,0,0|0,0,0]=2 10980 B18R0.171 CCCCCCCCCCCCNCCC(=O)NC 2230a_100000210451_100000737683 [0,2,0,0,0,0|1,0,0]=3 10981 B18R0.171 CCCCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011215052 [0,2,0,0,0,0|1,0,0]=3 10982 B18R0.171 CCCCCCCCCCCCNCCC(=O)NC 270004a_100000738227_100011218549 [0,2,0,0,0,0|1,0,0]=3 10983 B18R0.171 CCCCCCCCCCCCNCCC(=O)NC 34a_100000210451_100012179268 [0,2,0,0,0,0|1,0,0]=3 10984 B18R0.171 CCCCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000759014 [0,2,0,0,0,0|1,0,0]=3 10985 B18R0.171 CCCCCCCCCCCCNCCC(=O)OC 2230a_100000210451_100000204255 [0,2,0,0,0,0|0,0,0]=2 10986 B18R0.171 CCCCCCCCCCCCNCCC(=O)OC 34a_100000210451_100000742370 [0,2,0,0,0,0|0,0,0]=2 10987 B18R0.171 CCCCCCCCCCCCOCCC(=O)NC 34a_100000210810_100012179268 [0,2,0,0,0,0|1,0,0]=3 10988 B18R0.171 CCCCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000759014 [0,2,0,0,0,0|1,0,0]=3 10989 B18R0.171 CCCCCCCCCCCCOCCC(=O)NC 7a_100000210810_100000737683 [0,2,0,0,0,0|1,0,0]=3 10990 B18R0.171 CCCCCCCCCCCCOCCC(=O)OC 34a_100000210810_100000742370 [0,2,0,0,0,0|0,0,0]=2 10991 B18R0.171 CCCCCCCCCCCCOCCC(=O)OC 7a_100000210810_100000204255 [0,2,0,0,0,0|0,0,0]=2 10992 B18R0.171 CCCCCCCCCCCCSCCC(=O)NC 11a_106832991635_100008107568 [0,2,0,0,0,0|1,0,0]=3 10993 B18R0.171 CCCCCCCCCCCCSCCC(=O)NC 1626a_100102657272_100008107568 [0,2,0,0,0,0|1,0,0]=3 10994 B18R0.171 CCCCCCCCCCCCSCCC(=O)NC 240690a_100102657272_100008107568 [0,2,0,0,0,0|1,0,0]=3 10995 B18R0.171 CCCCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000759014 [0,2,0,0,0,0|1,0,0]=3 10996 B18R0.171 CCCCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000759014 [0,2,0,0,0,0|0,0,0]=2 10997 B18R0.171 CCCCCCCCCCCNC/C=C/C(=O)OC 2230a_200011215754_100000742655 [0,2,0,0,0,0|0,0,1]=3 10998 B18R0.171 CCCCCCCCCCCNC/C=C/C(=O)OC 34a_200011215754_100000742655 [0,2,0,0,0,0|0,0,1]=3 10999 B18R0.171 CCCCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011215454 [0,2,0,0,0,0|1,0,0]=3 11000 B18R0.171 CCCCCCCCCCCNCCCC(=O)NC 2230a_200011215754_100000741757 [0,2,0,0,0,0|1,0,0]=3 11001 B18R0.171 CCCCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011215454 [0,2,0,0,0,0|1,0,0]=3 11002 B18R0.171 CCCCCCCCCCCNCCCC(=O)NC 34a_200011215754_100000741757 [0,2,0,0,0,0|1,0,0]=3 11003 B18R0.171 CCCCCCCCCCCNCCCC(=O)OC 2230a_200011215754_100011218270 [0,2,0,0,0,0|0,0,0]=2 11004 B18R0.171 CCCCCCCCCCCNCCCC(=O)OC 34a_200011215754_100000742333 [0,2,0,0,0,0|0,0,0]=2 11005 B18R0.171 CCCCCCCCCCCNCCNC(=O)CC 34a_100132302217_100011215454 [0,2,0,0,0,0|1,0,0]=3 11006 B18R0.171 CCCCCCCCCCCNCCNC(=O)NC 34a_100015205895_100011215454 [0,2,0,0,0,0|1,0,0]=3 11007 B18R0.171 CCCCCCCCCCCNCCOC(=O)NC 34a_200011215754_200011997002 [0,2,0,0,0,0|1,0,0]=3 11008 B18R0.171 CCCCCCCCCCCOC/C=C/C(=O)OC 34a_100000210809_100000742655 [0,2,0,0,0,0|0,0,1]=3 11009 B18R0.171 CCCCCCCCCCCOC/C=C/C(=O)OC 7a_100000210809_100000742655 [0,2,0,0,0,0|0,0,1]=3 11010 B18R0.171 CCCCCCCCCCCOCCCC(=O)NC 34a_100000210809_100000741757 [0,2,0,0,0,0|1,0,0]=3 11011 B18R0.171 CCCCCCCCCCCOCCCC(=O)NC 7a_100000210809_100000741757 [0,2,0,0,0,0|1,0,0]=3 11012 B18R0.171 CCCCCCCCCCCOCCCC(=O)NN 34a_100000211488_100011215454 [0,2,0,0,0,0|2,0,0]=4 11013 B18R0.171 CCCCCCCCCCCOCCCC(=O)OC 34a_100000210809_100000742333 [0,2,0,0,0,0|0,0,0]=2 11014 B18R0.171 CCCCCCCCCCCOCCCC(=O)OC 7a_100000210809_100011218270 [0,2,0,0,0,0|0,0,0]=2 11015 B18R0.171 CCCCCCCCCCCOCCNC(=O)CC 34a_200000158885_100011215454 [0,2,0,0,0,0|1,0,0]=3 11016 B18R0.171 CCCCCCCCCCCOCCNC(=O)CC 7a_200000158885_100011215454 [0,2,0,0,0,0|1,0,0]=3 11017 B18R0.171 CCCCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011215454 [0,2,0,0,0,0|0,0,0]=2 11018 B18R0.171 CCCCCCCCCCCOCCOC(=O)CC 7a_200000031056_100011215454 [0,2,0,0,0,0|1,0,0]=3 11019 B18R0.171 CCCCCCCCCCCOCCOC(=O)NC 34a_100000210809_200011997002 [0,2,0,0,0,0|1,0,0]=3 11020 B18R0.171 CCCCCCCCCCCOCCOC(=O)NC 7a_100000210809_200011997002 [0,2,0,0,0,0|1,0,0]=3 11021 B18R0.171 CCCCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011215454 [0,2,0,0,0,0|0,0,0]=2 11022 B18R0.171 CCCCCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100011215454 [0,2,0,0,0,0|0,0,1]=3 11023 B18R0.171 CCCCCCCCCCCSCCCC(=O)NC 62a_100000741757_100011215454 [0,2,0,0,0,0|1,0,0]=3 11024 B18R0.171 CCCCCCCCCCCSCCCC(=O)OC 62a_100011218270_100011215454 [0,2,0,0,0,0|0,0,0]=2 11025 B18R0.171 CCCCCCCCCCCSCCOC(=O)NC 62a_200011997002_100011215454 [0,2,0,0,0,0|1,0,0]=3 11026 B18R0.171 CCCCCCCCCCNCCCCC(=O)OC 2230a_100000684558_100000204269 [0,2,0,0,0,0|0,0,0]=2 11027 B18R0.171 CCCCCCCCCCNCCCCC(=O)OC 34a_100000684558_100000204269 [0,2,0,0,0,0|0,0,0]=2 11028 B18R0.171 CCCCCCCCCCNCCOCC(=O)OC 2230a_100000684558_100000090808 [0,2,0,0,0,0|0,0,0]=2 11029 B18R0.171 CCCCCCCCCCNCCOCC(=O)OC 34a_100000684558_100000090808 [0,2,0,0,0,0|0,0,0]=2 11030 B18R0.171 CCCCCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210320 [0,2,0,0,0,0|0,0,0]=2 11031 B18R0.171 CCCCCCCCCCOCCCCC(=O)OC 34a_100000210711_100000204269 [0,2,0,0,0,0|0,0,0]=2 11032 B18R0.171 CCCCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210320 [0,2,0,0,0,0|0,0,0]=2 11033 B18R0.171 CCCCCCCCCCOCCCCC(=O)OC 7a_100000210711_100000204269 [0,2,0,0,0,0|0,0,0]=2 11034 B18R0.171 CCCCCCCCCCOCCOCC(=O)OC 34a_100000210711_100000090808 [0,2,0,0,0,0|0,0,0]=2 11035 B18R0.171 CCCCCCCCCCOCCOCC(=O)OC 7a_100000210711_100000090808 [0,2,0,0,0,0|0,0,0]=2 11036 B18R0.171 CCCCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210320 [0,2,0,0,0,0|0,0,0]=2 11037 B18R0.171 CCCCCCCCCCSCCOCC(=O)NC 34a_100011628728_100000183359 [0,2,0,0,0,0|1,0,0]=3 11038 B18R0.171 CCCCCCCCCCSCCOCC(=O)NC 7a_100011628728_100000183359 [0,2,0,0,0,0|1,0,0]=3 11039 B18R0.171 CCCCCCCCCCSCCOCC(=O)OC 34a_100011628728_100000747449 [0,2,0,0,0,0|0,0,0]=2 11040 B18R0.171 CCCCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210320 [0,2,0,0,0,0|0,0,0]=2 11041 B18R0.171 CCCCCCCCCCSCCOCC(=O)OC 7a_100011628728_100000747449 [0,2,0,0,0,0|0,0,0]=2 11042 B18R0.171 CCCCCCCCCNCCCCCC(=O)OC 2230a_100000212291_100009816466 [0,2,0,0,0,0|0,0,0]=2 11043 B18R0.171 CCCCCCCCCNCCCCCC(=O)OC 34a_100000212291_100009816466 [0,2,0,0,0,0|0,0,0]=2 11044 B18R0.171 CCCCCCCCCOCCCCCC(=O)OC 34a_100000074720_100011214924 [0,2,0,0,0,0|0,0,0]=2 11045 B18R0.171 CCCCCCCCCOCCCCCC(=O)OC 34a_100000210712_100009816466 [0,2,0,0,0,0|0,0,0]=2 11046 B18R0.171 CCCCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210328 [0,2,0,0,0,0|0,0,0]=2 11047 B18R0.171 CCCCCCCCCOCCCCCC(=O)OC 7a_100000210712_100009816466 [0,2,0,0,0,0|0,0,0]=2 11048 B18R0.171 CCCCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210670 [0,2,0,0,0,0|0,0,0]=2 11049 B18R0.171 CCCCCCCCNCCCCCCC(=O)OC 2230a_100000229939_100009815986 [0,2,0,0,0,0|0,0,0]=2 11050 B18R0.171 CCCCCCCCNCCCCCCC(=O)OC 34a_100000229939_100009815986 [0,2,0,0,0,0|0,0,0]=2 11051 B18R0.171 CCCCCCCCOCCCCCCC(=O)OC 34a_100000210232_100009815986 [0,2,0,0,0,0|0,0,0]=2 11052 B18R0.171 CCCCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210759 [0,2,0,0,0,0|0,0,0]=2 11053 B18R0.171 CCCCCCCCOCCCCCCC(=O)OC 7a_100000210232_100009815986 [0,2,0,0,0,0|0,0,0]=2 11054 B18R0.171 CCCCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210759 [0,2,0,0,0,0|0,0,0]=2 11055 B18R0.171 CCCCCCCCSCCCCCCC(=O)OC 62a_100000210759_100009815986 [0,2,0,0,0,0|0,0,0]=2 11056 B18R0.171 CCCCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210317 [0,2,0,0,0,0|0,0,0]=2 11057 B18R0.171 CCCCCCCNCCCCCCCC(=O)OC 2230a_100000229938_100010004213 [0,2,0,0,0,0|0,0,0]=2 11058 B18R0.171 CCCCCCCOCCCCCCCC(=O)OC 34a_100000210272_100010004213 [0,2,0,0,0,0|0,0,0]=2 11059 B18R0.171 CCCCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000210614 [0,2,0,0,0,0|0,0,0]=2 11060 B18R0.171 CCCCCCCOCCCCCCCC(=O)OC 7a_100000210272_100010004213 [0,2,0,0,0,0|0,0,0]=2 11061 B18R0.171 CCCCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210614 [0,2,0,0,0,0|0,0,0]=2 11062 B18R0.171 CCCCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000210614 [0,2,0,0,0,0|1,0,0]=3 11063 B18R0.171 CCCCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210614 [0,2,0,0,0,0|1,0,0]=3 11064 B18R0.171 CCCCCCCSCCCCCCCC(=O)OC 62a_100000210614_100010004213 [0,2,0,0,0,0|0,0,0]=2 11065 B18R0.171 CCCCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210316 [0,2,0,0,0,0|0,0,0]=2 11066 B18R0.171 CCCCCCNCCCCCCCCC(=O)OC 2230a_100000210581_100010282707 [0,2,0,0,0,0|0,0,0]=2 11067 B18R0.171 CCCCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210314 [0,2,0,0,0,0|0,0,0]=2 11068 B18R0.171 CCCCCCOCCCCCCCCC(=O)OC 34a_100000210259_100010282707 [0,2,0,0,0,0|0,0,0]=2 11069 B18R0.171 CCCCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210314 [0,2,0,0,0,0|0,0,0]=2 11070 B18R0.171 CCCCCCOCCCCCCCCC(=O)OC 7a_100000210259_100010282707 [0,2,0,0,0,0|0,0,0]=2 11071 B18R0.171 CCCCCCOCCOCCCCCC(=O)OC 34a_100000691444_100009816466 [0,2,0,0,0,0|0,0,0]=2 11072 B18R0.171 CCCCCCOCCOCCCCCC(=O)OC 7a_100000691444_100009816466 [0,2,0,0,0,0|0,0,0]=2 11073 B18R0.171 CCCCCCOCCOCCOCCC(=O)NC 34a_100000032842_100012179268 [0,2,0,0,0,0|2,0,0]=4 11074 B18R0.171 CCCCCCOCCOCCOCCC(=O)NC 7a_100000032842_100000737683 [0,2,0,0,0,0|2,0,0]=4 11075 B18R0.171 CCCCCCOCCOCCOCCC(=O)OC 34a_100000032842_100000742370 [0,2,0,0,0,0|1,0,0]=3 11076 B18R0.171 CCCCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210314 [0,2,0,0,0,0|1,0,0]=3 11077 B18R0.171 CCCCCCOCCOCCOCCC(=O)OC 7a_100000032842_100000204255 [0,2,0,0,0,0|1,0,0]=3 11078 B18R0.171 CCCCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210314 [0,2,0,0,0,0|1,0,0]=3 11079 B18R0.171 CCCCCCSCCCCCCCCC(=O)OC 62a_100000210314_100010282707 [0,2,0,0,0,0|0,0,0]=2 11080 B18R0.171 CCCCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210757 [0,2,0,0,0,0|0,0,0]=2 11081 B18R0.171 CCCCCNCCCCCCCCCC(=O)OC 2230a_100000209983_100009813843 [0,2,0,0,0,0|0,0,0]=2 11082 B18R0.171 CCCCCNCCOCCCCCCC(=O)OC 34a_100000224656_100009815986 [0,2,0,0,0,0|0,0,0]=2 11083 B18R0.171 CCCCCOCCCCCCCCCC(=O)OC 34a_100000210253_100009813843 [0,2,0,0,0,0|0,0,0]=2 11084 B18R0.171 CCCCCOCCCCCCCCCC(=O)OC 7a_100000210253_100009813843 [0,2,0,0,0,0|0,0,0]=2 11085 B18R0.171 CCCCCOCCOCCCCCCC(=O)OC 34a_100011215259_100009815986 [0,2,0,0,0,0|0,0,0]=2 11086 B18R0.171 CCCCCOCCOCCCCCCC(=O)OC 7a_100011215259_100009815986 [0,2,0,0,0,0|0,0,0]=2 11087 B18R0.171 CCCCCSCCCCCCCCCC(=O)OC 62a_100000210326_100009813843 [0,2,0,0,0,0|0,0,0]=2 11088 B18R0.171 CCCCNCCCCCCCCCCC(=O)OC 2230a_100000102301_100009812566 [0,2,0,0,0,0|0,0,0]=2 11089 B18R0.171 CCCCNCCCCCCCCCCC(=O)OC 7a_106832991798_100009812566 [0,2,0,0,0,0|0,0,0]=2 11090 B18R0.171 CCCCNCCCCOCCCCCC(=O)OC 34a_200011216965_100009816466 [0,2,0,0,0,0|0,0,0]=2 11091 B18R0.171 CCCCNN=CCCCCCCCCC(=O)OC 4a_100025702795_200010166605 [0,2,0,0,0,0|0,0,1]=3 11092 B18R0.171 CCCCOCCCCCCCCCCC(=O)OC 34a_100000210227_100009812566 [0,2,0,0,0,0|0,0,0]=2 11093 B18R0.171 CCCCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210210 [0,2,0,0,0,0|0,0,0]=2 11094 B18R0.171 CCCCOCCCCCCCCCCC(=O)OC 7a_100000210227_100009812566 [0,2,0,0,0,0|0,0,0]=2 11095 B18R0.171 CCCCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210211 [0,2,0,0,0,0|0,0,0]=2 11096 B18R0.171 CCCCOCCCCOCCCCCC(=O)OC 34a_200000760531_100009816466 [0,2,0,0,0,0|0,0,0]=2 11097 B18R0.171 CCCCOCCCCOCCCCCC(=O)OC 7a_200000760531_100009816466 [0,2,0,0,0,0|0,0,0]=2 11098 B18R0.171 CCCCOCCCNCCCCCCC(=O)OC 2230a_200000211371_100009815986 [0,2,0,0,0,0|0,0,0]=2 11099 B18R0.171 CCCCOCCCNCCCCCCC(=O)OC 34a_200000211371_100009815986 [0,2,0,0,0,0|0,0,0]=2 11100 B18R0.171 CCCCOCCCOCCCCCCC(=O)OC 34a_200011215613_100009815986 [0,2,0,0,0,0|0,0,0]=2 11101 B18R0.171 CCCCOCCCOCCCCCCC(=O)OC 7a_200011215613_100009815986 [0,2,0,0,0,0|0,0,0]=2 11102 B18R0.171 CCCCOCCOCCCCCCCC(=O)OC 34a_100000210238_100010004213 [0,2,0,0,0,0|0,0,0]=2 11103 B18R0.171 CCCCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000743108 [0,2,0,0,0,0|0,0,0]=2 11104 B18R0.171 CCCCOCCOCCCCCCCC(=O)OC 7a_100000210238_100010004213 [0,2,0,0,0,0|0,0,0]=2 11105 B18R0.171 CCCCOCCOCCCCCCCC(=O)OC 7a_100011022521_100000743108 [0,2,0,0,0,0|0,0,0]=2 11106 B18R0.171 CCCCOCCOCCOCCCCC(=O)OC 34a_100011215186_100000204269 [0,2,0,0,0,0|1,0,0]=3 11107 B18R0.171 CCCCOCCOCCOCCCCC(=O)OC 7a_100011215186_100000204269 [0,2,0,0,0,0|1,0,0]=3 11108 B18R0.171 CCCCOCCOCCOCCOCC(=O)OC 34a_100000700218_100000747449 [0,2,0,0,0,0|2,0,0]=4 11109 B18R0.171 CCCCOCCOCCOCCOCC(=O)OC 34a_100011023656_100000743108 [0,2,0,0,0,0|2,0,0]=4 11110 B18R0.171 CCCCOCCOCCOCCOCC(=O)OC 34a_100011215186_100000090808 [0,2,0,0,0,0|2,0,0]=4 11111 B18R0.171 CCCCOCCOCCOCCOCC(=O)OC 7a_100000700218_100000747449 [0,2,0,0,0,0|2,0,0]=4 11112 B18R0.171 CCCCOCCOCCOCCOCC(=O)OC 7a_100011023656_100000743108 [0,2,0,0,0,0|2,0,0]=4 11113 B18R0.171 CCCCOCCOCCOCCOCC(=O)OC 7a_100011215186_100000090808 [0,2,0,0,0,0|2,0,0]=4 11114 B18R0.171 CCCCOCCSCCCCCCCC(=O)OC 62a_100000743108_100010004213 [0,2,0,0,0,0|0,0,0]=2 11115 B18R0.171 CCCCOCCSCCCCCCCC(=O)OC 62a_100010004213_100000743108 [0,2,0,0,0,0|0,0,0]=2 11116 B18R0.171 CCCCOCOCCCCCCCCC(=O)OC 34a_100000035544_100011995733 [0,2,0,0,0,0|0,0,0]=2 11117 B18R0.171 CCCCOCOCCOCCOCCC(=O)OC 34a_100010982084_100011995733 [0,2,0,0,0,0|2,0,0]=4 11118 B18R0.171 CCCCOCSCCCCCCCCC(=O)OC 62a_100010282707_100011995733 [0,2,0,0,0,0|0,0,0]=2 11119 B18R0.171 CCCCOCSCCCCCCCCC(=O)OC 62a_100011995733_100010282707 [0,2,0,0,0,0|0,0,0]=2 11120 B18R0.171 CCCCSCCCCCCCCCCC(=O)OC 62a_100000210211_100009812566 [0,2,0,0,0,0|0,0,0]=2 11121 B18R0.171 CCCCSCCNCCCCCCCC(=O)OC 2230a_100025743550_100010004213 [0,2,0,0,0,0|0,0,0]=2 11122 B18R0.171 CCCCSCCOCCCCCCCC(=O)OC 34a_200000230436_100010004213 [0,2,0,0,0,0|0,0,0]=2 11123 B18R0.171 CCCCSCCOCCCCCCCC(=O)OC 7a_200000230436_100010004213 [0,2,0,0,0,0|0,0,0]=2 11124 B18R0.171 CCCOCCCCCCCCCCCC(=O)OC 34a_100000210258_100010983606 [0,2,0,0,0,0|0,0,0]=2 11125 B18R0.171 CCCOCCCNCCCCCCCC(=O)OC 2230a_100011217757_100010004213 [0,2,0,0,0,0|0,0,0]=2 11126 B18R0.171 CCCOCCCNCCCCCCCC(=O)OC 34a_100011217757_100010004213 [0,2,0,0,0,0|0,0,0]=2 11127 B18R0.171 CCCOCCNCCCCCCCCC(=O)OC 2230a_100161115042_100010282707 [0,2,0,0,0,0|0,0,0]=2 11128 B18R0.171 CCCOCCNCCCCCCCCC(=O)OC 34a_100161115042_100010282707 [0,2,0,0,0,0|0,0,0]=2 11129 B18R0.171 CCCOCCOCCCCCCCCC(=O)OC 34a_100000035544_100011215938 [0,2,0,0,0,0|0,0,0]=2 11130 B18R0.171 CCCOCCOCCCCCCCCC(=O)OC 34a_100000752267_100010282707 [0,2,0,0,0,0|0,0,0]=2 11131 B18R0.171 CCCOCCOCCCCCCCCC(=O)OC 7a_100000035544_100011215938 [0,2,0,0,0,0|0,0,0]=2 11132 B18R0.171 CCCOCCOCCCCCCCCC(=O)OC 7a_100000752267_100010282707 [0,2,0,0,0,0|0,0,0]=2 11133 B18R0.171 CCCOCCOCCNCCCCCC(=O)OC 2230a_200011904461_100009816466 [0,2,0,0,0,0|1,0,0]=3 11134 B18R0.171 CCCOCCOCCNCCCCCC(=O)OC 34a_200011904461_100009816466 [0,2,0,0,0,0|1,0,0]=3 11135 B18R0.171 CCCOCCOCCOCCOCCC(=O)OC 34a_100010982084_100011215938 [0,2,0,0,0,0|2,0,0]=4 11136 B18R0.171 CCCOCCOCCOCCOCCC(=O)OC 7a_100010982084_100011215938 [0,2,0,0,0,0|2,0,0]=4 11137 B18R0.171 CCCOCCSCCCCCCCCC(=O)OC 62a_100010282707_100011215938 [0,2,0,0,0,0|0,0,0]=2 11138 B18R0.171 CCCOCCSCCCCCCCCC(=O)OC 62a_100011215938_100010282707 [0,2,0,0,0,0|0,0,0]=2 11139 B18R0.171 CCCSCCCCCCCCCCCC(=O)OC 62a_100000210303_100010983606 [0,2,0,0,0,0|0,0,0]=2 11140 B18R0.171 CCCSCCNCCCCCCCCC(=O)OC 2230a_100020603323_100010282707 [0,2,0,0,0,0|0,0,0]=2 11141 B18R0.171 CCCSCCOCCCCCCCCC(=O)OC 34a_200000230433_100010282707 [0,2,0,0,0,0|0,0,0]=2 11142 B18R0.171 CCCSCCOCCCCCCCCC(=O)OC 7a_200000230433_100010282707 [0,2,0,0,0,0|0,0,0]=2 11143 B18R0.171 CCNCCCCCCCCCCCCC(=O)OC 2230a_100015525214_209314222159 [0,2,0,0,0,0|0,0,0]=2 11144 B18R0.171 CCOCCCCCCCCCCCCC(=O)OC 34a_100121572206_209314222159 [0,2,0,0,0,0|0,0,0]=2 11145 B18R0.171 CCOCCCCCCCCCOCCC(=O)NC 34a_100009875440_100012179268 [0,2,0,0,0,0|1,0,0]=3 11146 B18R0.171 CCOCCCCCCCCCOCCC(=O)NC 7a_100009875440_100000737683 [0,2,0,0,0,0|1,0,0]=3 11147 B18R0.171 CCOCCCCCCCCCOCCC(=O)OC 34a_100009875440_100000742370 [0,2,0,0,0,0|0,0,0]=2 11148 B18R0.171 CCOCCCCCCCCCOCCC(=O)OC 7a_100009875440_100000204255 [0,2,0,0,0,0|0,0,0]=2 11149 B18R0.171 CCOCCCNCCCCCCCCC(=O)OC 2230a_100000210961_100010282707 [0,2,0,0,0,0|0,0,0]=2 11150 B18R0.171 CCOCCCNCCCCCCCCC(=O)OC 34a_100000210961_100010282707 [0,2,0,0,0,0|0,0,0]=2 11151 B18R0.171 CCOCCCOCCCCCCCCC(=O)OC 34a_100000035544_100012232248 [0,2,0,0,0,0|0,0,0]=2 11152 B18R0.171 CCOCCCOCCCCCCCCC(=O)OC 34a_100000757476_100010282707 [0,2,0,0,0,0|0,0,0]=2 11153 B18R0.171 CCOCCCOCCCCCCCCC(=O)OC 7a_100000035544_100012232248 [0,2,0,0,0,0|0,0,0]=2 11154 B18R0.171 CCOCCCOCCCCCCCCC(=O)OC 7a_100000757476_100010282707 [0,2,0,0,0,0|0,0,0]=2 11155 B18R0.171 CCOCCCOCCOCCOCCC(=O)OC 34a_100010982084_100012232248 [0,2,0,0,0,0|2,0,0]=4 11156 B18R0.171 CCOCCCOCCOCCOCCC(=O)OC 7a_100010982084_100012232248 [0,2,0,0,0,0|2,0,0]=4 11157 B18R0.171 CCOCCCSCCCCCCCCC(=O)OC 62a_100010282707_100012232248 [0,2,0,0,0,0|0,0,0]=2 11158 B18R0.171 CCOCCCSCCCCCCCCC(=O)OC 62a_100012232248_100010282707 [0,2,0,0,0,0|0,0,0]=2 11159 B18R0.171 CCOCCNCCCCCCCCCC(=O)OC 2230a_102516460346_100009813843 [0,2,0,0,0,0|0,0,0]=2 11160 B18R0.171 CCOCCNCCCCCCCCCC(=O)OC 34a_102516460346_100009813843 [0,2,0,0,0,0|0,0,0]=2 11161 B18R0.171 CCOCCOCCCCCCCCCC(=O)OC 34a_100000210136_100009813843 [0,2,0,0,0,0|0,0,0]=2 11162 B18R0.171 CCOCCOCCCCCCCCCC(=O)OC 7a_100000210136_100009813843 [0,2,0,0,0,0|0,0,0]=2 11163 B18R0.171 CCOCCOCCNCCCCCCC(=O)OC 2230a_100102712874_100009815986 [0,2,0,0,0,0|1,0,0]=3 11164 B18R0.171 CCOCCOCCNCCCCCCC(=O)OC 34a_100102712874_100009815986 [0,2,0,0,0,0|1,0,0]=3 11165 B18R0.171 CCOCCOCCOCCCCCCC(=O)OC 34a_100000210240_100009815986 [0,2,0,0,0,0|1,0,0]=3 11166 B18R0.171 CCOCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011211534 [0,2,0,0,0,0|1,0,0]=3 11167 B18R0.171 CCOCCOCCOCCCCCCC(=O)OC 7a_100000210240_100009815986 [0,2,0,0,0,0|1,0,0]=3 11168 B18R0.171 CCOCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011211534 [0,2,0,0,0,0|1,0,0]=3 11169 B18R0.171 CCOCCOCCOCCNCCCC(=O)OC 2230a_100012282185_100011218270 [0,2,0,0,0,0|2,0,0]=4 11170 B18R0.171 CCOCCOCCOCCNCCCC(=O)OC 34a_100012282185_100000742333 [0,2,0,0,0,0|2,0,0]=4 11171 B18R0.171 CCOCCOCCOCCOCCCC(=O)OC 34a_100000033264_100000742333 [0,2,0,0,0,0|2,0,0]=4 11172 B18R0.171 CCOCCOCCOCCOCCCC(=O)OC 7a_100000033264_100011218270 [0,2,0,0,0,0|2,0,0]=4 11173 B18R0.171 CCOCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011211534 [0,2,0,0,0,0|1,0,0]=3 11174 B18R0.171 CCOCCOCCSCCCCCCC(=O)OC 62a_100011211534_100009815986 [0,2,0,0,0,0|1,0,0]=3 11175 B18R0.171 CCOCCSCCCCCCCCCC(=O)OC 62a_100000210147_100009813843 [0,2,0,0,0,0|0,0,0]=2 11176 B18R0.171 CCOCSCCCCCCCCCCC(=O)OC 62a_100000739092_100009812566 [0,2,0,0,0,0|0,0,0]=2 11177 B18R0.171 CCSCCCCCCCCCCCCC(=O)OC 62a_100000210202_209314222159 [0,2,0,0,0,0|0,0,0]=2 11178 B18R0.171 CCSCCCOCCCCCCCCC(=O)OC 34a_100011216438_100010282707 [0,2,0,0,0,0|0,0,0]=2 11179 B18R0.171 CCSCCCOCCCCCCCCC(=O)OC 7a_100011216438_100010282707 [0,2,0,0,0,0|0,0,0]=2 11180 B18R0.171 CCSCCNCCCCCCCCCC(=O)OC 2230a_100000106463_100009813843 [0,2,0,0,0,0|0,0,0]=2 11181 B18R0.171 CCSCCOCCCCCCCCCC(=O)OC 34a_100000212035_100009813843 [0,2,0,0,0,0|0,0,0]=2 11182 B18R0.171 CCSCCOCCCCCCCCCC(=O)OC 7a_100000212035_100009813843 [0,2,0,0,0,0|0,0,0]=2 11183 B18R0.171 CCSCCSCCCCCCCCCC(=O)OC 62a_100000757381_100009813843 [0,2,0,0,0,0|0,0,0]=2 11184 B18R0.171 CNC(=O)CCCCCCCCCCCCCCO 240690a_100102657272_100000122395 [0,2,0,0,0,0|1,0,0]=3 11185 B18R0.171 CNC(=O)CCCNCCCCCCCCCCO 2230a_100000066964_100000741757 [0,2,0,0,0,0|1,0,0]=3 11186 B18R0.171 CNC(=O)CCCNCCCCCCCCCCO 2230a_100000740002_100009813290 [0,2,0,0,0,0|1,0,0]=3 11187 B18R0.171 CNC(=O)CCCNCCCCCCCCCCO 34a_100000066964_100000741757 [0,2,0,0,0,0|1,0,0]=3 11188 B18R0.171 CNC(=O)CCCNCCCCCCCCCCO 34a_100000740002_100009813290 [0,2,0,0,0,0|1,0,0]=3 11189 B18R0.171 CNC(=O)CCCOCCCCCCCCCCBr 34a_100009813290_100000741757 [0,2,0,0,0,0|1,0,0]=3 11190 B18R0.171 CNC(=O)CCCOCCCCCCCCCCBr 7a_100009813290_100000741757 [0,2,0,0,0,0|1,0,0]=3 11191 B18R0.171 CNC(=O)CCCOCCCCCCCCCCCl 34a_200000033068_100000741757 [0,2,0,0,0,0|1,0,0]=3 11192 B18R0.171 CNC(=O)CCCOCCCCCCCCCCCl 7a_200000033068_100000741757 [0,2,0,0,0,0|1,0,0]=3 11193 B18R0.171 CNC(=O)CCCOCCCCCCCCCCN 34a_100000066964_100000741757 [0,2,0,0,0,0|1,0,0]=3 11194 B18R0.171 CNC(=O)CCCSCCCCCCCCCCO 62a_100000741757_200000033068 [0,2,0,0,0,0|1,0,0]=3 11195 B18R0.171 CNC(=O)CCCSCCCCCCCCCCO 62a_100009813290_100000741757 [0,2,0,0,0,0|1,0,0]=3 11196 B18R0.171 CNC(=O)CCNCCCCCCCCCCCO 2230a_100000738227_100009812471 [0,2,0,0,0,0|1,0,0]=3 11197 B18R0.171 CNC(=O)CCNCCCCCCCCCCCO 34a_100000738227_100009812471 [0,2,0,0,0,0|1,0,0]=3 11198 B18R0.171 CNC(=O)CCOCCCCCCCCCCCBr 34a_100009812471_100012179268 [0,2,0,0,0,0|1,0,0]=3 11199 B18R0.171 CNC(=O)CCOCCCCCCCCCCCBr 7a_100009812471_100000737683 [0,2,0,0,0,0|1,0,0]=3 11200 B18R0.171 CNC(=O)CCOCCCCCCCCCCCO 34a_100000754576_100009812471 [0,2,0,0,0,0|1,0,0]=3 11201 B18R0.171 CNC(=O)CCSCCCCCCCCCCCO 62a_100009812471_100000737683 [0,2,0,0,0,0|1,0,0]=3 11202 B18R0.171 CNC(=O)CNCCCCCCCCCCCCO 2230a_100000066677_100000183359 [0,2,0,0,0,0|1,0,0]=3 11203 B18R0.171 CNC(=O)CNCCCCCCCCCCCCO 2230a_100000693194_100009813331 [0,2,0,0,0,0|1,0,0]=3 11204 B18R0.171 CNC(=O)CNCCCCCCCCCCCCO 34a_100000066677_100000183359 [0,2,0,0,0,0|1,0,0]=3 11205 B18R0.171 CNC(=O)CNCCCCCCOCCCCCO 2230a_100000693194_200132310570 [0,2,0,0,0,0|2,0,0]=4 11206 B18R0.171 CNC(=O)COCCCCCCCCCCCCBr 34a_100009813331_100000183359 [0,2,0,0,0,0|1,0,0]=3 11207 B18R0.171 CNC(=O)COCCCCCCCCCCCCBr 7a_100009813331_100000183359 [0,2,0,0,0,0|1,0,0]=3 11208 B18R0.171 CNC(=O)COCCCCCCCCCCCCN 34a_100000066677_100000183359 [0,2,0,0,0,0|1,0,0]=3 11209 B18R0.171 CNC(=O)COCCCCCCCCCCCCO 34a_100000750040_100009813331 [0,2,0,0,0,0|1,0,0]=3 11210 B18R0.171 CNC(=O)COCCCCCCOCCCCCO 34a_100000750040_200132310570 [0,2,0,0,0,0|2,0,0]=4 11211 B18R0.171 CNC(=O)COCCCCCOCCCCCCCl 34a_200132310570_100000183359 [0,2,0,0,0,0|2,0,0]=4 11212 B18R0.171 CNC(=O)COCCCCCOCCCCCCCl 7a_200132310570_100000183359 [0,2,0,0,0,0|2,0,0]=4 11213 B18R0.171 CNC(=O)CSCCCCCCCCCCCCO 62a_100009813331_100000183359 [0,2,0,0,0,0|1,0,0]=3 11214 B18R0.171 CNC(=O)CSCCCCCCOCCCCCO 62a_100000183359_200132310570 [0,2,0,0,0,0|2,0,0]=4 11215 B18R0.171 CNC(=O)CSCCCCCCOCCCCCO 62a_200132310570_100000183359 [0,2,0,0,0,0|2,0,0]=4 11216 B18R0.171 CNC(=O)NCCNCCCCCCCCCCO 34a_100015205895_100009813290 [0,2,0,0,0,0|2,0,0]=4 11217 B18R0.171 CNC(=O)OCCNCCCCCCCCCCO 34a_100000066964_200011997002 [0,2,0,0,0,0|2,0,0]=4 11218 B18R0.171 CNC(=O)OCCOCCCCCCCCCCBr 34a_100009813290_200011997002 [0,2,0,0,0,0|2,0,0]=4 11219 B18R0.171 CNC(=O)OCCOCCCCCCCCCCBr 7a_100009813290_200011997002 [0,2,0,0,0,0|2,0,0]=4 11220 B18R0.171 CNC(=O)OCCOCCCCCCCCCCCl 34a_200000033068_200011997002 [0,2,0,0,0,0|2,0,0]=4 11221 B18R0.171 CNC(=O)OCCOCCCCCCCCCCCl 7a_200000033068_200011997002 [0,2,0,0,0,0|2,0,0]=4 11222 B18R0.171 CNC(=O)OCCOCCCCCCCCCCN 34a_100000066964_200011997002 [0,2,0,0,0,0|2,0,0]=4 11223 B18R0.171 CNC(=O)OCCSCCCCCCCCCCO 62a_100009813290_200011997002 [0,2,0,0,0,0|2,0,0]=4 11224 B18R0.171 CNC(=O)OCCSCCCCCCCCCCO 62a_200011997002_200000033068 [0,2,0,0,0,0|2,0,0]=4 11225 B18R0.171 CNCCCCCOCCCCCCCC(=O)OC 34a_100000722520_100010004213 [0,2,0,0,0,0|0,0,0]=2 11226 B18R0.171 CNCCCOCCCCCCCCCC(=O)OC 34a_100000213112_100009813843 [0,2,0,0,0,0|0,0,0]=2 11227 B18R0.171 CNCCOCCOCCCCCCCC(=O)OC 34a_100000228057_100010004213 [0,2,0,0,0,0|1,0,0]=3 11228 B18R0.171 CNCCOCCOCCOCCCCC(=O)OC 34a_200014138305_100000204269 [0,2,0,0,0,0|2,0,0]=4 11229 B18R0.171 COC(=O)/C=C/CNCCCCCCCCCCO 2230a_100000066964_100000742655 [0,2,0,0,0,0|0,0,2]=4 11230 B18R0.171 COC(=O)/C=C/CNCCCCCCCCCCO 34a_100000066964_100000742655 [0,2,0,0,0,0|0,0,2]=4 11231 B18R0.171 COC(=O)/C=C/COCCCCCCCCCCBr 34a_100009813290_100000742655 [0,2,0,0,0,0|0,0,2]=4 11232 B18R0.171 COC(=O)/C=C/COCCCCCCCCCCBr 7a_100009813290_100000742655 [0,2,0,0,0,0|0,0,2]=4 11233 B18R0.171 COC(=O)/C=C/COCCCCCCCCCCCl 34a_200000033068_100000742655 [0,2,0,0,0,0|0,0,2]=4 11234 B18R0.171 COC(=O)/C=C/COCCCCCCCCCCCl 7a_200000033068_100000742655 [0,2,0,0,0,0|0,0,2]=4 11235 B18R0.171 COC(=O)/C=C/COCCCCCCCCCCN 34a_100000066964_100000742655 [0,2,0,0,0,0|0,0,2]=4 11236 B18R0.171 COC(=O)/C=C/CSCCCCCCCCCCO 62a_100000742655_200000033068 [0,2,0,0,0,0|0,0,2]=4 11237 B18R0.171 COC(=O)/C=C/CSCCCCCCCCCCO 62a_100009813290_100000742655 [0,2,0,0,0,0|0,0,2]=4 11238 B18R0.171 COC(=O)CCCCCCCCCCCCSCF 62a_100015361967_209314222159 [0,2,0,0,0,0|0,0,0]=2 11239 B18R0.171 COC(=O)CCCCCCCCCCCNCCF 34a_100000724931_100010983606 [0,2,0,0,0,0|0,0,0]=2 11240 B18R0.171 COC(=O)CCCCCCCCCCCNCCO 2230a_100016997473_100010983606 [0,2,0,0,0,0|0,0,0]=2 11241 B18R0.171 COC(=O)CCCCCCCCCCCNCCO 34a_100016990907_100010983606 [0,2,0,0,0,0|0,0,0]=2 11242 B18R0.171 COC(=O)CCCCCCCCCCCOCCBr 34a_100000211926_100010983606 [0,2,0,0,0,0|0,0,0]=2 11243 B18R0.171 COC(=O)CCCCCCCCCCCOCCN 34a_100000210304_100010983606 [0,2,0,0,0,0|0,0,0]=2 11244 B18R0.171 COC(=O)CCCCCCCCCCCSCC#N 62a_100011215382_100010983606 [0,2,0,0,0,0|0,0,1]=3 11245 B18R0.171 COC(=O)CCCCCCCCCCCSCC=O 62a_200015260668_100010983606 [0,2,0,0,0,0|0,0,1]=3 11246 B18R0.171 COC(=O)CCCCCCCCCCCSCCF 62a_100011217306_100010983606 [0,2,0,0,0,0|0,0,0]=2 11247 B18R0.171 COC(=O)CCCCCCCCCCCSCCO 62a_100000211926_100010983606 [0,2,0,0,0,0|0,0,0]=2 11248 B18R0.171 COC(=O)CCCCCCCCCCCSCSC 62a_100011218213_100010983606 [0,2,0,0,0,0|0,0,0]=2 11249 B18R0.171 COC(=O)CCCCCCCCCCNCCCF 2230a_100015189416_100009812566 [0,2,0,0,0,0|0,0,0]=2 11250 B18R0.171 COC(=O)CCCCCCCCCCNCCCF 34a_100015189416_100009812566 [0,2,0,0,0,0|0,0,0]=2 11251 B18R0.171 COC(=O)CCCCCCCCCCNCCSC 2230a_100020590264_100009812566 [0,2,0,0,0,0|0,0,0]=2 11252 B18R0.171 COC(=O)CCCCCCCCCCOCCC#N 7a_100011003013_100000184422 [0,2,0,0,0,0|0,0,1]=3 11253 B18R0.171 COC(=O)CCCCCCCCCCOCCCBr 34a_100011217188_100009812566 [0,2,0,0,0,0|0,0,0]=2 11254 B18R0.171 COC(=O)CCCCCCCCCCOCCCCl 34a_100000230001_100009812566 [0,2,0,0,0,0|0,0,0]=2 11255 B18R0.171 COC(=O)CCCCCCCCCCOCCCF 34a_100000759539_100009812566 [0,2,0,0,0,0|0,0,0]=2 11256 B18R0.171 COC(=O)CCCCCCCCCCOCCCF 34a_100011003013_100011934791 [0,2,0,0,0,0|0,0,0]=2 11257 B18R0.171 COC(=O)CCCCCCCCCCOCCCF 7a_100011003013_100011934791 [0,2,0,0,0,0|0,0,0]=2 11258 B18R0.171 COC(=O)CCCCCCCCCCOCCCN 34a_100000182051_100009812566 [0,2,0,0,0,0|0,0,0]=2 11259 B18R0.171 COC(=O)CCCCCCCCCCOCCCO 34a_100011003013_100000230001 [0,2,0,0,0,0|0,0,0]=2 11260 B18R0.171 COC(=O)CCCCCCCCCCOCCCO 7a_100011003013_100011215043 [0,2,0,0,0,0|0,0,0]=2 11261 B18R0.171 COC(=O)CCCCCCCCCCOCCON 34a_100000700252_100009812566 [0,2,0,0,0,0|1,0,0]=3 11262 B18R0.171 COC(=O)CCCCCCCCCCOCCSC 34a_100000230434_100009812566 [0,2,0,0,0,0|0,0,0]=2 11263 B18R0.171 COC(=O)CCCCCCCCCCOCCSC 34a_100011003013_100000212216 [0,2,0,0,0,0|0,0,0]=2 11264 B18R0.171 COC(=O)CCCCCCCCCCOCCSC 7a_100000230434_100009812566 [0,2,0,0,0,0|0,0,0]=2 11265 B18R0.171 COC(=O)CCCCCCCCCCOCCSC 7a_100011003013_100000212216 [0,2,0,0,0,0|0,0,0]=2 11266 B18R0.171 COC(=O)CCCCCCCCCCSCCC#N 62a_100011215226_100009812566 [0,2,0,0,0,0|0,0,1]=3 11267 B18R0.171 COC(=O)CCCCCCCCCCSCCCF 62a_100011934791_100009812566 [0,2,0,0,0,0|0,0,0]=2 11268 B18R0.171 COC(=O)CCCCCCCCCCSCCCO 62a_100011215043_100009812566 [0,2,0,0,0,0|0,0,0]=2 11269 B18R0.171 COC(=O)CCCCCCCCCCSCCSC 62a_100000212216_100009812566 [0,2,0,0,0,0|0,0,0]=2 11270 B18R0.171 COC(=O)CCCCCCCCCCSCSC#N 62a_100000211825_100009812566 [0,2,0,0,0,0|1,0,1]=4 11271 B18R0.171 COC(=O)CCCCCCCCCNCCCCO 2230a_100000750430_100009813843 [0,2,0,0,0,0|0,0,0]=2 11272 B18R0.171 COC(=O)CCCCCCCCCNCCCCO 34a_100000750430_100009813843 [0,2,0,0,0,0|0,0,0]=2 11273 B18R0.171 COC(=O)CCCCCCCCCNCCCSC 2230a_100000749238_100009813843 [0,2,0,0,0,0|0,0,0]=2 11274 B18R0.171 COC(=O)CCCCCCCCCOCC#CCCl 34a_200000047223_100009813843 [0,2,0,0,0,0|0,0,2]=4 11275 B18R0.171 COC(=O)CCCCCCCCCOCCCCBr 34a_100011216708_100009813843 [0,2,0,0,0,0|0,0,0]=2 11276 B18R0.171 COC(=O)CCCCCCCCCOCCCCCl 34a_100000210776_100009813843 [0,2,0,0,0,0|0,0,0]=2 11277 B18R0.171 COC(=O)CCCCCCCCCOCCCCCl 7a_100000210776_100009813843 [0,2,0,0,0,0|0,0,0]=2 11278 B18R0.171 COC(=O)CCCCCCCCCOCCCCF 34a_100011995726_100009813843 [0,2,0,0,0,0|0,0,0]=2 11279 B18R0.171 COC(=O)CCCCCCCCCOCCCCF 7a_100011995726_100009813843 [0,2,0,0,0,0|0,0,0]=2 11280 B18R0.171 COC(=O)CCCCCCCCCOCCCCI 34a_200012148704_100009813843 [0,2,0,0,0,0|0,0,0]=2 11281 B18R0.171 COC(=O)CCCCCCCCCOCCCCN 34a_100000750430_100009813843 [0,2,0,0,0,0|0,0,0]=2 11282 B18R0.171 COC(=O)CCCCCCCCCOCCCSC 34a_100000690336_100009813843 [0,2,0,0,0,0|0,0,0]=2 11283 B18R0.171 COC(=O)CCCCCCCCCOCCCSC 7a_100000690336_100009813843 [0,2,0,0,0,0|0,0,0]=2 11284 B18R0.171 COC(=O)CCCCCCCCCSCC#CCO 62a_200000047223_100009813843 [0,2,0,0,0,0|0,0,2]=4 11285 B18R0.171 COC(=O)CCCCCCCCCSCCCC#N 62a_100000687738_100009813843 [0,2,0,0,0,0|0,0,1]=3 11286 B18R0.171 COC(=O)CCCCCCCCCSCCCC=O 62a_200011292268_100009813843 [0,2,0,0,0,0|0,0,1]=3 11287 B18R0.171 COC(=O)CCCCCCCCCSCCCCF 62a_100000729493_100009813843 [0,2,0,0,0,0|0,0,0]=2 11288 B18R0.171 COC(=O)CCCCCCCCCSCCCCO 62a_100000210776_100009813843 [0,2,0,0,0,0|0,0,0]=2 11289 B18R0.171 COC(=O)CCCCCCCCCSCCSC#N 62a_100000034367_100009813843 [0,2,0,0,0,0|1,0,1]=4 11290 B18R0.171 COC(=O)CCCCCCCCNCCCCCO 2230a_100000762737_100010282707 [0,2,0,0,0,0|0,0,0]=2 11291 B18R0.171 COC(=O)CCCCCCCCNCCCCCO 34a_100000762737_100010282707 [0,2,0,0,0,0|0,0,0]=2 11292 B18R0.171 COC(=O)CCCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100010282707 [0,2,0,0,0,0|2,0,0]=4 11293 B18R0.171 COC(=O)CCCCCCCCNCCOCCO 2230a_100000211614_100010282707 [0,2,0,0,0,0|1,0,0]=3 11294 B18R0.171 COC(=O)CCCCCCCCNCCOCCO 34a_100000211614_100010282707 [0,2,0,0,0,0|1,0,0]=3 11295 B18R0.171 COC(=O)CCCCCCCCNCCSCCO 2230a_100011219999_100010282707 [0,2,0,0,0,0|1,0,0]=3 11296 B18R0.171 COC(=O)CCCCCCCCOCCCCC#N 7a_100000035544_100000211819 [0,2,0,0,0,0|0,0,1]=3 11297 B18R0.171 COC(=O)CCCCCCCCOCCCCC=O 7a_100000035544_100000139335 [0,2,0,0,0,0|0,0,1]=3 11298 B18R0.171 COC(=O)CCCCCCCCOCCCCCBr 34a_100000746331_100010282707 [0,2,0,0,0,0|0,0,0]=2 11299 B18R0.171 COC(=O)CCCCCCCCOCCCCCBr 7a_100000746331_100010282707 [0,2,0,0,0,0|0,0,0]=2 11300 B18R0.171 COC(=O)CCCCCCCCOCCCCCCl 34a_100000746330_100010282707 [0,2,0,0,0,0|0,0,0]=2 11301 B18R0.171 COC(=O)CCCCCCCCOCCCCCCl 7a_100000746330_100010282707 [0,2,0,0,0,0|0,0,0]=2 11302 B18R0.171 COC(=O)CCCCCCCCOCCCCCF 34a_100000035544_100000729378 [0,2,0,0,0,0|0,0,0]=2 11303 B18R0.171 COC(=O)CCCCCCCCOCCCCCF 7a_100000035544_100000729378 [0,2,0,0,0,0|0,0,0]=2 11304 B18R0.171 COC(=O)CCCCCCCCOCCCCCI 34a_200012148887_100010282707 [0,2,0,0,0,0|0,0,0]=2 11305 B18R0.171 COC(=O)CCCCCCCCOCCCCCI 7a_200012148887_100010282707 [0,2,0,0,0,0|0,0,0]=2 11306 B18R0.171 COC(=O)CCCCCCCCOCCCCCN 34a_100000762737_100010282707 [0,2,0,0,0,0|0,0,0]=2 11307 B18R0.171 COC(=O)CCCCCCCCOCCCCCO 34a_100000035544_100000746330 [0,2,0,0,0,0|0,0,0]=2 11308 B18R0.171 COC(=O)CCCCCCCCOCCCCCO 7a_100000035544_100000746330 [0,2,0,0,0,0|0,0,0]=2 11309 B18R0.171 COC(=O)CCCCCCCCOCCCCSC 34a_100011217163_100010282707 [0,2,0,0,0,0|0,0,0]=2 11310 B18R0.171 COC(=O)CCCCCCCCOCCCCSC 7a_100011217163_100010282707 [0,2,0,0,0,0|0,0,0]=2 11311 B18R0.171 COC(=O)CCCCCCCCOCCOCC#N 7a_100000035544_200000047693 [0,2,0,0,0,0|1,0,1]=4 11312 B18R0.171 COC(=O)CCCCCCCCOCCOCCBr 34a_100000692535_100010282707 [0,2,0,0,0,0|1,0,0]=3 11313 B18R0.171 COC(=O)CCCCCCCCOCCOCCBr 7a_100000692535_100010282707 [0,2,0,0,0,0|1,0,0]=3 11314 B18R0.171 COC(=O)CCCCCCCCOCCOCCCl 34a_100011215305_100010282707 [0,2,0,0,0,0|1,0,0]=3 11315 B18R0.171 COC(=O)CCCCCCCCOCCOCCCl 7a_100011215305_100010282707 [0,2,0,0,0,0|1,0,0]=3 11316 B18R0.171 COC(=O)CCCCCCCCOCCOCCF 34a_200015357709_100010282707 [0,2,0,0,0,0|1,0,0]=3 11317 B18R0.171 COC(=O)CCCCCCCCOCCOCCF 7a_200015357709_100010282707 [0,2,0,0,0,0|1,0,0]=3 11318 B18R0.171 COC(=O)CCCCCCCCOCCOCCI 34a_100012149058_100010282707 [0,2,0,0,0,0|1,0,0]=3 11319 B18R0.171 COC(=O)CCCCCCCCOCCOCCI 7a_100012149058_100010282707 [0,2,0,0,0,0|1,0,0]=3 11320 B18R0.171 COC(=O)CCCCCCCCOCCOCCN 34a_100000211614_100010282707 [0,2,0,0,0,0|1,0,0]=3 11321 B18R0.171 COC(=O)CCCCCCCCOCCOCCO 34a_100000035544_100000692535 [0,2,0,0,0,0|1,0,0]=3 11322 B18R0.171 COC(=O)CCCCCCCCOCCOCCO 7a_100000035544_100011215305 [0,2,0,0,0,0|1,0,0]=3 11323 B18R0.171 COC(=O)CCCCCCCCSCCCCC#N 62a_100010282707_100000211819 [0,2,0,0,0,0|0,0,1]=3 11324 B18R0.171 COC(=O)CCCCCCCCSCCCCC#N 62a_100011219923_100010282707 [0,2,0,0,0,0|0,0,1]=3 11325 B18R0.171 COC(=O)CCCCCCCCSCCCCC=O 62a_100000139335_100010282707 [0,2,0,0,0,0|0,0,1]=3 11326 B18R0.171 COC(=O)CCCCCCCCSCCCCC=O 62a_100010282707_100000139335 [0,2,0,0,0,0|0,0,1]=3 11327 B18R0.171 COC(=O)CCCCCCCCSCCCCCF 62a_100000729378_100010282707 [0,2,0,0,0,0|0,0,0]=2 11328 B18R0.171 COC(=O)CCCCCCCCSCCCCCF 62a_100010282707_100000729378 [0,2,0,0,0,0|0,0,0]=2 11329 B18R0.171 COC(=O)CCCCCCCCSCCCCCO 62a_100000746330_100010282707 [0,2,0,0,0,0|0,0,0]=2 11330 B18R0.171 COC(=O)CCCCCCCCSCCCCCO 62a_100010282707_100000746330 [0,2,0,0,0,0|0,0,0]=2 11331 B18R0.171 COC(=O)CCCCCCCCSCCOCC#N 62a_100010282707_200000047693 [0,2,0,0,0,0|1,0,1]=4 11332 B18R0.171 COC(=O)CCCCCCCCSCCOCC#N 62a_200000047693_100010282707 [0,2,0,0,0,0|1,0,1]=4 11333 B18R0.171 COC(=O)CCCCCCCCSCCOCCO 62a_100010282707_100011215305 [0,2,0,0,0,0|1,0,0]=3 11334 B18R0.171 COC(=O)CCCCCCCCSCCOCCO 62a_100011215305_100010282707 [0,2,0,0,0,0|1,0,0]=3 11335 B18R0.171 COC(=O)CCCCCCCNCCCCCCO 2230a_100000686447_100010004213 [0,2,0,0,0,0|0,0,0]=2 11336 B18R0.171 COC(=O)CCCCCCCNCCCCCCO 34a_100000686447_100010004213 [0,2,0,0,0,0|0,0,0]=2 11337 B18R0.171 COC(=O)CCCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100010004213 [0,2,0,0,0,0|2,0,0]=4 11338 B18R0.171 COC(=O)CCCCCCCOCCCCCC#N 7a_100011022521_100009813376 [0,2,0,0,0,0|0,0,1]=3 11339 B18R0.171 COC(=O)CCCCCCCOCCCCCC=O 7a_100011022521_100000139337 [0,2,0,0,0,0|0,0,1]=3 11340 B18R0.171 COC(=O)CCCCCCCOCCCCCCBr 34a_100011215345_100010004213 [0,2,0,0,0,0|0,0,0]=2 11341 B18R0.171 COC(=O)CCCCCCCOCCCCCCBr 7a_100011215345_100010004213 [0,2,0,0,0,0|0,0,0]=2 11342 B18R0.171 COC(=O)CCCCCCCOCCCCCCCl 34a_100000766143_100010004213 [0,2,0,0,0,0|0,0,0]=2 11343 B18R0.171 COC(=O)CCCCCCCOCCCCCCCl 7a_100000766143_100010004213 [0,2,0,0,0,0|0,0,0]=2 11344 B18R0.171 COC(=O)CCCCCCCOCCCCCCF 34a_100000732779_100010004213 [0,2,0,0,0,0|0,0,0]=2 11345 B18R0.171 COC(=O)CCCCCCCOCCCCCCF 34a_100011022521_100015922095 [0,2,0,0,0,0|0,0,0]=2 11346 B18R0.171 COC(=O)CCCCCCCOCCCCCCF 7a_100000732779_100010004213 [0,2,0,0,0,0|0,0,0]=2 11347 B18R0.171 COC(=O)CCCCCCCOCCCCCCF 7a_100011022521_100015922095 [0,2,0,0,0,0|0,0,0]=2 11348 B18R0.171 COC(=O)CCCCCCCOCCCCCCN 34a_100000686447_100010004213 [0,2,0,0,0,0|0,0,0]=2 11349 B18R0.171 COC(=O)CCCCCCCOCCCCCCO 34a_100011022521_100000766143 [0,2,0,0,0,0|0,0,0]=2 11350 B18R0.171 COC(=O)CCCCCCCOCCCCCCO 7a_100011022521_100000766143 [0,2,0,0,0,0|0,0,0]=2 11351 B18R0.171 COC(=O)CCCCCCCSCCCCCC#N 62a_100009813376_100010004213 [0,2,0,0,0,0|0,0,1]=3 11352 B18R0.171 COC(=O)CCCCCCCSCCCCCC#N 62a_100010004213_100009813376 [0,2,0,0,0,0|0,0,1]=3 11353 B18R0.171 COC(=O)CCCCCCCSCCCCCC=O 62a_100000139337_100010004213 [0,2,0,0,0,0|0,0,1]=3 11354 B18R0.171 COC(=O)CCCCCCCSCCCCCC=O 62a_100010004213_100000139337 [0,2,0,0,0,0|0,0,1]=3 11355 B18R0.171 COC(=O)CCCCCCCSCCCCCCF 62a_100010004213_100015922095 [0,2,0,0,0,0|0,0,0]=2 11356 B18R0.171 COC(=O)CCCCCCCSCCCCCCF 62a_100015922095_100010004213 [0,2,0,0,0,0|0,0,0]=2 11357 B18R0.171 COC(=O)CCCCCCCSCCCCCCO 62a_100000766143_100010004213 [0,2,0,0,0,0|0,0,0]=2 11358 B18R0.171 COC(=O)CCCCCCCSCCCCCCO 62a_100010004213_100000766143 [0,2,0,0,0,0|0,0,0]=2 11359 B18R0.171 COC(=O)CCCCCCNCCCCCCCO 2230a_100011996573_100009815986 [0,2,0,0,0,0|0,0,0]=2 11360 B18R0.171 COC(=O)CCCCCCNCCCCCCCO 34a_100011996573_100009815986 [0,2,0,0,0,0|0,0,0]=2 11361 B18R0.171 COC(=O)CCCCCCNCCCOCCCO 2230a_100011310245_100009815986 [0,2,0,0,0,0|1,0,0]=3 11362 B18R0.171 COC(=O)CCCCCCNCCCOCCCO 34a_100011310245_100009815986 [0,2,0,0,0,0|1,0,0]=3 11363 B18R0.171 COC(=O)CCCCCCOCCCCCCC#N 7a_100009863599_100009813337 [0,2,0,0,0,0|0,0,1]=3 11364 B18R0.171 COC(=O)CCCCCCOCCCCCCCBr 34a_100000760002_100009815986 [0,2,0,0,0,0|0,0,0]=2 11365 B18R0.171 COC(=O)CCCCCCOCCCCCCCBr 7a_100000760002_100009815986 [0,2,0,0,0,0|0,0,0]=2 11366 B18R0.171 COC(=O)CCCCCCOCCCCCCCN 34a_100011996573_100009815986 [0,2,0,0,0,0|0,0,0]=2 11367 B18R0.171 COC(=O)CCCCCCOCCCCCCCO 34a_100009863599_100000760002 [0,2,0,0,0,0|0,0,0]=2 11368 B18R0.171 COC(=O)CCCCCCOCCCCCCCO 7a_100009863599_100000760002 [0,2,0,0,0,0|0,0,0]=2 11369 B18R0.171 COC(=O)CCCCCCOCCCOCCCN 34a_100011310245_100009815986 [0,2,0,0,0,0|1,0,0]=3 11370 B18R0.171 COC(=O)CCCCCCSCCCCCCC#N 62a_100009813337_100009815986 [0,2,0,0,0,0|0,0,1]=3 11371 B18R0.171 COC(=O)CCCCCCSCCCCCCC#N 62a_100009815986_100009813337 [0,2,0,0,0,0|0,0,1]=3 11372 B18R0.171 COC(=O)CCCCCCSCCCCCCCO 62a_100000760002_100009815986 [0,2,0,0,0,0|0,0,0]=2 11373 B18R0.171 COC(=O)CCCCCCSCCCCCCCO 62a_100009815986_100000760002 [0,2,0,0,0,0|0,0,0]=2 11374 B18R0.171 COC(=O)CCCCCNCCCCCCCCO 2230a_102515433106_100009816466 [0,2,0,0,0,0|0,0,0]=2 11375 B18R0.171 COC(=O)CCCCCNCCCCCCCCO 34a_102515433106_100009816466 [0,2,0,0,0,0|0,0,0]=2 11376 B18R0.171 COC(=O)CCCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100009816466 [0,2,0,0,0,0|2,0,0]=4 11377 B18R0.171 COC(=O)CCCCCNCCOCCOCCO 2230a_100011998139_100009816466 [0,2,0,0,0,0|2,0,0]=4 11378 B18R0.171 COC(=O)CCCCCNCCOCCOCCO 34a_100011998139_100009816466 [0,2,0,0,0,0|2,0,0]=4 11379 B18R0.171 COC(=O)CCCCCOCCCCCCCCBr 34a_100009813846_100009816466 [0,2,0,0,0,0|0,0,0]=2 11380 B18R0.171 COC(=O)CCCCCOCCCCCCCCBr 7a_100009813846_100009816466 [0,2,0,0,0,0|0,0,0]=2 11381 B18R0.171 COC(=O)CCCCCOCCCCCCCCCl 34a_100000033203_100009816466 [0,2,0,0,0,0|0,0,0]=2 11382 B18R0.171 COC(=O)CCCCCOCCCCCCCCCl 7a_100000033203_100009816466 [0,2,0,0,0,0|0,0,0]=2 11383 B18R0.171 COC(=O)CCCCCOCCCCCCCCN 34a_102515433106_100009816466 [0,2,0,0,0,0|0,0,0]=2 11384 B18R0.171 COC(=O)CCCCCOCCCCCCCCO 34a_100000074720_100000033203 [0,2,0,0,0,0|0,0,0]=2 11385 B18R0.171 COC(=O)CCCCCOCCCCCCCCO 7a_100000074720_100000033203 [0,2,0,0,0,0|0,0,0]=2 11386 B18R0.171 COC(=O)CCCCCOCCCCCNCCN 34a_103619048469_100009816466 [0,2,0,0,0,0|1,0,0]=3 11387 B18R0.171 COC(=O)CCCCCOCCOCCOCCBr 34a_100010132937_100009816466 [0,2,0,0,0,0|2,0,0]=4 11388 B18R0.171 COC(=O)CCCCCOCCOCCOCCBr 7a_100010132937_100009816466 [0,2,0,0,0,0|2,0,0]=4 11389 B18R0.171 COC(=O)CCCCCOCCOCCOCCCl 34a_100000032323_100009816466 [0,2,0,0,0,0|2,0,0]=4 11390 B18R0.171 COC(=O)CCCCCOCCOCCOCCCl 7a_100000032323_100009816466 [0,2,0,0,0,0|2,0,0]=4 11391 B18R0.171 COC(=O)CCCCCOCCOCCOCCN 34a_100011998139_100009816466 [0,2,0,0,0,0|2,0,0]=4 11392 B18R0.171 COC(=O)CCCCCOCCOCCOCCO 34a_100000074720_100000032323 [0,2,0,0,0,0|2,0,0]=4 11393 B18R0.171 COC(=O)CCCCCOCCOCCOCCO 7a_100000074720_100000032323 [0,2,0,0,0,0|2,0,0]=4 11394 B18R0.171 COC(=O)CCCCCSCCCCCCCCO 62a_100000033203_100009816466 [0,2,0,0,0,0|0,0,0]=2 11395 B18R0.171 COC(=O)CCCCCSCCCCCCCCO 62a_100009816466_100000033203 [0,2,0,0,0,0|0,0,0]=2 11396 B18R0.171 COC(=O)CCCCCSCCOCCOCCO 62a_100000032323_100009816466 [0,2,0,0,0,0|2,0,0]=4 11397 B18R0.171 COC(=O)CCCCCSCCOCCOCCO 62a_100009816466_100000032323 [0,2,0,0,0,0|2,0,0]=4 11398 B18R0.171 COC(=O)CCCCNCCCCCCCCCO 2230a_100000078944_100000204269 [0,2,0,0,0,0|0,0,0]=2 11399 B18R0.171 COC(=O)CCCCNCCCCCCCCCO 34a_100000078944_100000204269 [0,2,0,0,0,0|0,0,0]=2 11400 B18R0.171 COC(=O)CCCCNCCCOCCOCCO 2230a_100011996194_100000204269 [0,2,0,0,0,0|2,0,0]=4 11401 B18R0.171 COC(=O)CCCCNCCCOCCOCCO 34a_100011996194_100000204269 [0,2,0,0,0,0|2,0,0]=4 11402 B18R0.171 COC(=O)CCCCOCCCCCCCCCBr 34a_100009813782_100000204269 [0,2,0,0,0,0|0,0,0]=2 11403 B18R0.171 COC(=O)CCCCOCCCCCCCCCBr 7a_100009813782_100000204269 [0,2,0,0,0,0|0,0,0]=2 11404 B18R0.171 COC(=O)CCCCOCCCCCCCCCCl 34a_100009868337_100000204269 [0,2,0,0,0,0|0,0,0]=2 11405 B18R0.171 COC(=O)CCCCOCCCCCCCCCCl 7a_100009868337_100000204269 [0,2,0,0,0,0|0,0,0]=2 11406 B18R0.171 COC(=O)CCCCOCCCCCCCCCN 34a_100000078944_100000204269 [0,2,0,0,0,0|0,0,0]=2 11407 B18R0.171 COC(=O)CCCCOCCCCCCCCCO 34a_100000059025_100009813782 [0,2,0,0,0,0|0,0,0]=2 11408 B18R0.171 COC(=O)CCCCOCCCCCCCCCO 7a_100000059025_100009813782 [0,2,0,0,0,0|0,0,0]=2 11409 B18R0.171 COC(=O)CCCCOCCOCCOCCCN 34a_100011996194_100000204269 [0,2,0,0,0,0|2,0,0]=4 11410 B18R0.171 COC(=O)CCCCSCCCCCCCCCO 62a_100000204269_100009813782 [0,2,0,0,0,0|0,0,0]=2 11411 B18R0.171 COC(=O)CCCCSCCCCCCCCCO 62a_100009813782_100000204269 [0,2,0,0,0,0|0,0,0]=2 11412 B18R0.171 COC(=O)CCCNCCCCCCCCCCO 2230a_100000066964_100011218270 [0,2,0,0,0,0|0,0,0]=2 11413 B18R0.171 COC(=O)CCCNCCCCCCCCCCO 34a_100000066964_100000742333 [0,2,0,0,0,0|0,0,0]=2 11414 B18R0.171 COC(=O)CCCOCCCCCCCCCCBr 34a_100009813290_100000742333 [0,2,0,0,0,0|0,0,0]=2 11415 B18R0.171 COC(=O)CCCOCCCCCCCCCCBr 7a_100009813290_100011218270 [0,2,0,0,0,0|0,0,0]=2 11416 B18R0.171 COC(=O)CCCOCCCCCCCCCCCl 34a_200000033068_100000742333 [0,2,0,0,0,0|0,0,0]=2 11417 B18R0.171 COC(=O)CCCOCCCCCCCCCCCl 7a_200000033068_100011218270 [0,2,0,0,0,0|0,0,0]=2 11418 B18R0.171 COC(=O)CCCOCCCCCCCCCCN 34a_100000066964_100000742333 [0,2,0,0,0,0|0,0,0]=2 11419 B18R0.171 COC(=O)CCCSCCCCCCCCCCO 62a_100009813290_100011218270 [0,2,0,0,0,0|0,0,0]=2 11420 B18R0.171 COC(=O)CCCSCCCCCCCCCCO 62a_100011218270_200000033068 [0,2,0,0,0,0|0,0,0]=2 11421 B18R0.171 COC(=O)CCOCCCCCCCCCCCBr 34a_100009812471_100000742370 [0,2,0,0,0,0|0,0,0]=2 11422 B18R0.171 COC(=O)CCOCCCCCCCCCCCBr 7a_100009812471_100000204255 [0,2,0,0,0,0|0,0,0]=2 11423 B18R0.171 COC(=O)CCOCCOCCOCCCCCF 34a_100010982084_100000729378 [0,2,0,0,0,0|2,0,0]=4 11424 B18R0.171 COC(=O)CCOCCOCCOCCCCCF 7a_100010982084_100000729378 [0,2,0,0,0,0|2,0,0]=4 11425 B18R0.171 COC(=O)CCOCCOCCOCCCCCO 34a_100010982084_100000746330 [0,2,0,0,0,0|2,0,0]=4 11426 B18R0.171 COC(=O)CCOCCOCCOCCCCCO 7a_100010982084_100000746330 [0,2,0,0,0,0|2,0,0]=4 11427 B18R0.171 COC(=O)CCSCCCCCCCCCCCO 62a_100009812471_100000204255 [0,2,0,0,0,0|0,0,0]=2 11428 B18R0.171 COC(=O)CNCCCCCCCCCCCCO 2230a_100000066677_100000747449 [0,2,0,0,0,0|0,0,0]=2 11429 B18R0.171 COC(=O)CNCCCCCCCCCCCCO 34a_100000066677_100000747449 [0,2,0,0,0,0|0,0,0]=2 11430 B18R0.171 COC(=O)COCCCCCCCCCCCCBr 34a_100009813331_100000747449 [0,2,0,0,0,0|0,0,0]=2 11431 B18R0.171 COC(=O)COCCCCCCCCCCCCBr 7a_100009813331_100000747449 [0,2,0,0,0,0|0,0,0]=2 11432 B18R0.171 COC(=O)COCCCCCCCCCCCCN 34a_100000066677_100000747449 [0,2,0,0,0,0|0,0,0]=2 11433 B18R0.171 COC(=O)COCCCCCOCCCCCCCl 34a_200132310570_100000747449 [0,2,0,0,0,0|1,0,0]=3 11434 B18R0.171 COC(=O)COCCCCCOCCCCCCCl 7a_200132310570_100000747449 [0,2,0,0,0,0|1,0,0]=3 11435 B18R0.171 COC(=O)COCCNCCCCCCCCCO 2230a_100000078944_100000090808 [0,2,0,0,0,0|1,0,0]=3 11436 B18R0.171 COC(=O)COCCNCCCCCCCCCO 34a_100000078944_100000090808 [0,2,0,0,0,0|1,0,0]=3 11437 B18R0.171 COC(=O)COCCOCCCCCCCCCBr 34a_100009813782_100000090808 [0,2,0,0,0,0|1,0,0]=3 11438 B18R0.171 COC(=O)COCCOCCCCCCCCCBr 7a_100009813782_100000090808 [0,2,0,0,0,0|1,0,0]=3 11439 B18R0.171 COC(=O)COCCOCCCCCCCCCCl 34a_100009868337_100000090808 [0,2,0,0,0,0|1,0,0]=3 11440 B18R0.171 COC(=O)COCCOCCCCCCCCCCl 7a_100009868337_100000090808 [0,2,0,0,0,0|1,0,0]=3 11441 B18R0.171 COC(=O)COCCOCCCCCCCCCN 34a_100000078944_100000090808 [0,2,0,0,0,0|1,0,0]=3 11442 B18R0.171 COC(=O)COCCOCCOCCCCCCF 34a_100011023656_100015922095 [0,2,0,0,0,0|2,0,0]=4 11443 B18R0.171 COC(=O)COCCOCCOCCCCCCF 7a_100011023656_100015922095 [0,2,0,0,0,0|2,0,0]=4 11444 B18R0.171 COC(=O)COCCOCCOCCCCCCO 34a_100011023656_100000766143 [0,2,0,0,0,0|2,0,0]=4 11445 B18R0.171 COC(=O)COCCOCCOCCCCCCO 7a_100011023656_100000766143 [0,2,0,0,0,0|2,0,0]=4 11446 B18R0.171 COC(=O)COCCSCCCCCCCCCO 62a_100000090808_100009813782 [0,2,0,0,0,0|1,0,0]=3 11447 B18R0.171 COC(=O)COCCSCCCCCCCCCO 62a_100009813782_100000090808 [0,2,0,0,0,0|1,0,0]=3 11448 B18R0.171 COC(=O)CSCCCCCCCCCCCCO 62a_100009813331_100000747449 [0,2,0,0,0,0|0,0,0]=2 11449 B18R0.171 COC(=O)CSCCCCCCOCCCCCO 62a_100000747449_200132310570 [0,2,0,0,0,0|1,0,0]=3 11450 B18R0.171 COC(=O)CSCCCCCCOCCCCCO 62a_200132310570_100000747449 [0,2,0,0,0,0|1,0,0]=3 11451 B18R0.171 COC(=O)NCCOCCCCCCCCCCO 34a_100000757965_100009813290 [0,2,0,0,0,0|1,0,0]=3 11452 B18R0.171 COC(=O)OCCOCCCCCCCCCCO 34a_100010262106_100009813290 [0,2,0,0,0,0|1,0,0]=3 11453 B18R0.171 COC(=O)OCSCCCCCCCCCCCO 62a_100009812471_100000139417 [0,2,0,0,0,0|1,0,0]=3 11454 B18R0.171 COCCCCCCOCCCCCCC(=O)OC 34a_100009863599_100011998445 [0,2,0,0,0,0|0,0,0]=2 11455 B18R0.171 COCCCCCCOCCCCCCC(=O)OC 34a_200012092642_100009815986 [0,2,0,0,0,0|0,0,0]=2 11456 B18R0.171 COCCCCCCOCCCCCCC(=O)OC 7a_100009863599_100011998445 [0,2,0,0,0,0|0,0,0]=2 11457 B18R0.171 COCCCCCCOCCCCCCC(=O)OC 7a_200012092642_100009815986 [0,2,0,0,0,0|0,0,0]=2 11458 B18R0.171 COCCCCCCSCCCCCCC(=O)OC 62a_100009815986_100011998445 [0,2,0,0,0,0|0,0,0]=2 11459 B18R0.171 COCCCCCCSCCCCCCC(=O)OC 62a_100011998445_100009815986 [0,2,0,0,0,0|0,0,0]=2 11460 B18R0.171 COCCCCCNCCCCCCCC(=O)OC 2230a_100000747528_100010004213 [0,2,0,0,0,0|0,0,0]=2 11461 B18R0.171 COCCCCCNCCCCCCCC(=O)OC 34a_100000747528_100010004213 [0,2,0,0,0,0|0,0,0]=2 11462 B18R0.171 COCCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000755781 [0,2,0,0,0,0|0,0,0]=2 11463 B18R0.171 COCCCCOCCCCCCCCC(=O)OC 34a_100000740925_100010282707 [0,2,0,0,0,0|0,0,0]=2 11464 B18R0.171 COCCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000730899 [0,2,0,0,0,0|0,0,0]=2 11465 B18R0.171 COCCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000755781 [0,2,0,0,0,0|2,0,0]=4 11466 B18R0.171 COCCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000730899 [0,2,0,0,0,0|2,0,0]=4 11467 B18R0.171 COCCCCSCCCCCCCCC(=O)OC 62a_100000730899_100010282707 [0,2,0,0,0,0|0,0,0]=2 11468 B18R0.171 COCCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000730899 [0,2,0,0,0,0|0,0,0]=2 11469 B18R0.171 COCCCNCCCCCCCCCC(=O)OC 34a_100150723488_100009813843 [0,2,0,0,0,0|0,0,0]=2 11470 B18R0.171 COCCCOCCCCCCCCCC(=O)OC 34a_100000740835_100009813843 [0,2,0,0,0,0|0,0,0]=2 11471 B18R0.171 COCCCOCCCOCCCCCC(=O)OC 34a_200011215475_100009816466 [0,2,0,0,0,0|1,0,0]=3 11472 B18R0.171 COCCCOCCCOCCCCCC(=O)OC 7a_200011215475_100009816466 [0,2,0,0,0,0|1,0,0]=3 11473 B18R0.171 COCCCSCCCCCCCCCC(=O)OC 62a_100000709357_100009813843 [0,2,0,0,0,0|0,0,0]=2 11474 B18R0.171 COCCNCCCCCCCCCCC(=O)OC 2230a_100000209980_100009812566 [0,2,0,0,0,0|0,0,0]=2 11475 B18R0.171 COCCOCCCCCCCCCCC(=O)OC 34a_100000210237_100009812566 [0,2,0,0,0,0|0,0,0]=2 11476 B18R0.171 COCCOCCCCCCCCCCC(=O)OC 34a_100011003013_100011201679 [0,2,0,0,0,0|0,0,0]=2 11477 B18R0.171 COCCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000233755 [0,2,0,0,0,0|0,0,0]=2 11478 B18R0.171 COCCOCCCNCCCCCCC(=O)OC 2230a_100000206027_100009815986 [0,2,0,0,0,0|1,0,0]=3 11479 B18R0.171 COCCOCCCNCCCCCCC(=O)OC 34a_100000206027_100009815986 [0,2,0,0,0,0|1,0,0]=3 11480 B18R0.171 COCCOCCCOCCCCCCC(=O)OC 34a_100009863599_100011216529 [0,2,0,0,0,0|1,0,0]=3 11481 B18R0.171 COCCOCCCOCCCCCCC(=O)OC 7a_100009863599_100011216529 [0,2,0,0,0,0|1,0,0]=3 11482 B18R0.171 COCCOCCCSCCCCCCC(=O)OC 62a_100009815986_100011216529 [0,2,0,0,0,0|1,0,0]=3 11483 B18R0.171 COCCOCCCSCCCCCCC(=O)OC 62a_100011216529_100009815986 [0,2,0,0,0,0|1,0,0]=3 11484 B18R0.171 COCCOCCNCCCCCCCC(=O)OC 2230a_100000745349_100010004213 [0,2,0,0,0,0|1,0,0]=3 11485 B18R0.171 COCCOCCNCCCCCCCC(=O)OC 34a_100000745349_100010004213 [0,2,0,0,0,0|1,0,0]=3 11486 B18R0.171 COCCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000695917 [0,2,0,0,0,0|1,0,0]=3 11487 B18R0.171 COCCOCCOCCCCCCCC(=O)OC 34a_100011215163_100010004213 [0,2,0,0,0,0|1,0,0]=3 11488 B18R0.171 COCCOCCOCCCCCCCC(=O)OC 7a_100011022521_100000695917 [0,2,0,0,0,0|1,0,0]=3 11489 B18R0.171 COCCOCCOCCCCCCCC(=O)OC 7a_100011215163_100010004213 [0,2,0,0,0,0|1,0,0]=3 11490 B18R0.171 COCCOCCOCCNCCCCC(=O)OC 2230a_100012028300_100000204269 [0,2,0,0,0,0|2,0,0]=4 11491 B18R0.171 COCCOCCOCCNCCCCC(=O)OC 34a_100012028300_100000204269 [0,2,0,0,0,0|2,0,0]=4 11492 B18R0.171 COCCOCCOCCOCCCCC(=O)OC 34a_100000059025_100013367474 [0,2,0,0,0,0|2,0,0]=4 11493 B18R0.171 COCCOCCOCCOCCCCC(=O)OC 34a_100000688194_100000204269 [0,2,0,0,0,0|2,0,0]=4 11494 B18R0.171 COCCOCCOCCOCCCCC(=O)OC 7a_100000059025_100013367474 [0,2,0,0,0,0|2,0,0]=4 11495 B18R0.171 COCCOCCOCCOCCCCC(=O)OC 7a_100000688194_100000204269 [0,2,0,0,0,0|2,0,0]=4 11496 B18R0.171 COCCOCCOCCSCCCCC(=O)OC 62a_100000204269_100013367474 [0,2,0,0,0,0|2,0,0]=4 11497 B18R0.171 COCCOCCOCCSCCCCC(=O)OC 62a_100013367474_100000204269 [0,2,0,0,0,0|2,0,0]=4 11498 B18R0.171 COCCOCCSCCCCCCCC(=O)OC 62a_100000695917_100010004213 [0,2,0,0,0,0|1,0,0]=3 11499 B18R0.171 COCCOCCSCCCCCCCC(=O)OC 62a_100010004213_100000695917 [0,2,0,0,0,0|1,0,0]=3 11500 B18R0.171 COCCOCSCCCCCCCCC(=O)OC 62a_100000231047_100010282707 [0,2,0,0,0,0|1,0,0]=3 11501 B18R0.171 COCCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000231047 [0,2,0,0,0,0|1,0,0]=3 11502 B18R0.171 COCCSCCCCCCCCCCC(=O)OC 62a_100000233755_100009812566 [0,2,0,0,0,0|0,0,0]=2 11503 B18R0.171 COCSCCCCCCCCCCCC(=O)OC 62a_100000766300_100010983606 [0,2,0,0,0,0|0,0,0]=2 11504 B18R0.171 NNC(=O)CCCOCCCCCCCCCCO 34a_100000211488_100009813290 [0,2,0,0,0,0|2,0,0]=4 11505 B18R0.174 C=C(Br)C(=O)NCCCCCCCCCCCCC 11a_100011215765_100009813364 [0,2,0,0,0,0|1,0,1]=4 11506 B18R0.174 C=C(Br)C(=O)NCCCCCCCCCCCCC 1626a_100011215765_100009813364 [0,2,0,0,0,0|1,0,1]=4 11507 B18R0.174 C=C(C)C(=O)CCCCCCCCCCCCCO 1458a_100000185857_100009812470 [0,2,0,0,0,0|1,0,0]=3 11508 B18R0.174 C=C(C)C(=O)NCCCCCCCCCCCCC 11a_100011215765_100000185857 [0,2,0,0,0,0|1,0,0]=3 11509 B18R0.174 C=C(C)C(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000185857 [0,2,0,0,0,0|1,0,0]=3 11510 B18R0.174 C=C(C)C(=O)NCCCNCCCCCCCCC 2230a_100016987756_100011214924 [0,2,0,0,0,0|2,0,0]=4 11511 B18R0.174 C=C(C)C(=O)NCCNCCCCCCCCCC 2230a_100102636416_100000210320 [0,2,0,0,0,0|2,0,0]=4 11512 B18R0.174 C=C(C)C(=O)OCCCCCCNCCCCCC 2230a_100000210581_200010402237 [0,2,0,0,0,0|2,0,0]=4 11513 B18R0.174 C=C(C)C(=O)OCCCCCCOCCCCCC 34a_100000210259_200010402237 [0,2,0,0,0,0|2,0,0]=4 11514 B18R0.174 C=C(C)C(=O)OCCCCCCOCCCCCC 7a_100000210259_200010402237 [0,2,0,0,0,0|2,0,0]=4 11515 B18R0.174 C=C(C)C(=O)OCCCCCCSCCCCCC 62a_100000210314_200010402237 [0,2,0,0,0,0|2,0,0]=4 11516 B18R0.174 C=C(C)C(=O)OCCCCCCSCCCCCC 62a_200010402237_100000210757 [0,2,0,0,0,0|2,0,0]=4 11517 B18R0.174 C=C(C)C(=O)OCCCCOCCCCCCCC 7a_100000065474_100000210759 [0,2,0,0,0,0|2,0,0]=4 11518 B18R0.174 C=C(C)C(=O)OCCCOCCCCCCCCC 7a_100000032641_100000210328 [0,2,0,0,0,0|2,0,0]=4 11519 B18R0.174 C=C(C)C(=O)OCCNCCCCCCCCCC 2230a_100000684558_100009816335 [0,2,0,0,0,0|2,0,0]=4 11520 B18R0.174 C=C(C)C(=O)OCCNCCCCCCCCCC 34a_100000684558_100009816335 [0,2,0,0,0,0|2,0,0]=4 11521 B18R0.174 C=C(C)C(=O)OCCOCCCCCCCCCC 34a_100000210711_100009816335 [0,2,0,0,0,0|2,0,0]=4 11522 B18R0.174 C=C(C)C(=O)OCCOCCCCCCCCCC 7a_100000210711_100009816335 [0,2,0,0,0,0|2,0,0]=4 11523 B18R0.174 C=C(C)C(=O)OCCSCCCCCCCCCC 62a_100009816335_100000210320 [0,2,0,0,0,0|2,0,0]=4 11524 B18R0.174 C=C(Cl)C(=O)NCCCCCCCCCCCCC 11a_100011215765_100000039160 [0,2,0,0,0,0|1,0,1]=4 11525 B18R0.174 C=C(Cl)C(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000039160 [0,2,0,0,0,0|1,0,1]=4 11526 B18R0.174 C=C(F)C(=O)NCCCCCCCCCCCCC 11a_100011215765_100000036797 [0,2,0,0,0,0|1,0,1]=4 11527 B18R0.174 C=C(F)C(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000036797 [0,2,0,0,0,0|1,0,1]=4 11528 B18R0.174 CC(=O)C(=O)COCCCCCCCCCCCBr 34a_100009812471_100011261029 [0,2,0,0,0,0|2,0,0]=4 11529 B18R0.174 CC(=O)C(=O)CSCCCCCCCCCCCO 62a_100009812471_100011261029 [0,2,0,0,0,0|2,0,0]=4 11530 B18R0.174 CC(C)C(=O)CCCCCCCCCCCCCO 1458a_100000210198_100009812470 [0,2,0,0,0,0|1,0,0]=3 11531 B18R0.174 CC(C)C(=O)COCCCCCCCCCCCBr 34a_100009812471_100000753385 [0,2,0,0,0,0|2,0,0]=4 11532 B18R0.174 CC(C)C(=O)COCCCCCCCCCCCBr 7a_100009812471_100000753385 [0,2,0,0,0,0|2,0,0]=4 11533 B18R0.174 CC(C)C(=O)CSCCCCCCCCCCCO 62a_100009812471_100000753385 [0,2,0,0,0,0|2,0,0]=4 11534 B18R0.174 CC(C)C(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000210198 [0,2,0,0,0,0|2,0,0]=4 11535 B18R0.174 CC(F)C(=O)CCCCCCCCCCCCCO 1458a_100000062450_100009812470 [0,2,0,0,0,0|1,0,0]=3 11536 B18R0.174 CC(F)C(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000062450 [0,2,0,0,0,0|2,0,0]=4 11537 B18R0.174 CCCCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100011215471 [0,2,0,0,0,0|2,0,0]=4 11538 B18R0.174 CCCCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100000297455 [0,2,0,0,0,0|1,0,0]=3 11539 B18R0.174 CCCCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100000297455 [0,2,0,0,0,0|1,0,0]=3 11540 B18R0.174 CCCCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100000297455 [0,2,0,0,0,0|1,0,0]=3 11541 B18R0.174 CCCCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100011215471 [0,2,0,0,0,0|1,0,0]=3 11542 B18R0.174 CCCCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100011215471 [0,2,0,0,0,0|1,0,0]=3 11543 B18R0.174 CCCCCCCCCCCCCNC(=O)C(=O)N 240690a_100011215765_100011215815 [0,2,0,0,0,0|2,0,0]=4 11544 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C 11a_100011215765_100000210198 [0,2,0,0,0,0|1,0,0]=3 11545 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C 1626a_100011215765_100000210198 [0,2,0,0,0,0|1,0,0]=3 11546 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C 240690a_100011215765_100000210198 [0,2,0,0,0,0|1,0,0]=3 11547 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C 527a_100011215765_100000210198 [0,2,0,0,0,0|1,0,0]=3 11548 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)F 11a_100011215765_100000062450 [0,2,0,0,0,0|1,0,0]=3 11549 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)F 1626a_100011215765_100000062450 [0,2,0,0,0,0|1,0,0]=3 11550 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)F 240690a_100011215765_100000062450 [0,2,0,0,0,0|1,0,0]=3 11551 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)F 527a_100011215765_100000062450 [0,2,0,0,0,0|1,0,0]=3 11552 B18R0.174 CCCCCCCCCCCCCNC(=O)C(F)F 11a_100011215765_100000210393 [0,2,0,0,0,0|2,0,0]=4 11553 B18R0.174 CCCCCCCCCCCCCNC(=O)C(F)F 1626a_100011215765_100000210393 [0,2,0,0,0,0|2,0,0]=4 11554 B18R0.174 CCCCCCCCCCCCCNC(=O)C(F)F 240690a_100011215765_100000210393 [0,2,0,0,0,0|2,0,0]=4 11555 B18R0.174 CCCCCCCCCCCCCNC(=O)C(F)F 527a_100011215765_100000210393 [0,2,0,0,0,0|2,0,0]=4 11556 B18R0.174 CCCCCCCCCCCCCNC(=O)C(O)O 240690a_100011215765_100000233687 [0,2,0,0,0,0|2,0,0]=4 11557 B18R0.174 CCCCCCCCCCCCCNC(=O)N(C)C 2708a_100011215765_100102631434 [0,2,0,0,0,0|1,0,0]=3 11558 B18R0.174 CCCCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_100011215765_100000717761 [0,2,0,0,0,0|1,0,0]=3 11559 B18R0.174 CCCCCCCCCCCCCNC(=O)[C@H](C)O 1626a_100011215765_217856618621 [0,2,0,0,0,0|1,0,0]=3 11560 B18R0.174 CCCCCCCCCCCCCNC(=O)[C@H](C)O 240690a_100011215765_217856618621 [0,2,0,0,0,0|1,0,0]=3 11561 B18R0.174 CCCCCCCCCCCCNCC(=O)C(=O)C 34a_100000210451_100011261029 [0,2,0,0,0,0|1,0,0]=3 11562 B18R0.174 CCCCCCCCCCCCNCC(=O)C(C)C 2230a_100000210451_100000753385 [0,2,0,0,0,0|1,0,0]=3 11563 B18R0.174 CCCCCCCCCCCCNCC(=O)C(C)C 34a_100000210451_100000753385 [0,2,0,0,0,0|1,0,0]=3 11564 B18R0.174 CCCCCCCCCCCCNCC(=O)N(C)C 2230a_100000210451_100000185267 [0,2,0,0,0,0|1,0,0]=3 11565 B18R0.174 CCCCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100011215052 [0,2,0,0,0,0|1,0,0]=3 11566 B18R0.174 CCCCCCCCCCCCNCC(=O)N(C)C 270004a_100015183351_100011218549 [0,2,0,0,0,0|1,0,0]=3 11567 B18R0.174 CCCCCCCCCCCCNCC(=O)N(C)C 34a_100000210451_100000692301 [0,2,0,0,0,0|1,0,0]=3 11568 B18R0.174 CCCCCCCCCCCCOCC(=O)C(=O)C 34a_100000210810_100011261029 [0,2,0,0,0,0|1,0,0]=3 11569 B18R0.174 CCCCCCCCCCCCOCC(=O)C(C)C 34a_100000210810_100000753385 [0,2,0,0,0,0|1,0,0]=3 11570 B18R0.174 CCCCCCCCCCCCOCC(=O)C(C)C 7a_100000210810_100000753385 [0,2,0,0,0,0|1,0,0]=3 11571 B18R0.174 CCCCCCCCCCCCOCC(=O)N(C)C 34a_100000210810_100000692301 [0,2,0,0,0,0|1,0,0]=3 11572 B18R0.174 CCCCCCCCCCCCOCC(=O)N(C)C 7a_100000210810_100000692301 [0,2,0,0,0,0|1,0,0]=3 11573 B18R0.174 CCCCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000759014 [0,2,0,0,0,0|1,0,0]=3 11574 B18R0.174 CCCCCCCCCCCCSCC(=O)C(C)C 62a_100000753385_100000759014 [0,2,0,0,0,0|1,0,0]=3 11575 B18R0.174 CCCCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100000759014 [0,2,0,0,0,0|1,0,0]=3 11576 B18R0.174 CCCCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100011215454 [0,2,0,0,0,0|1,0,0]=3 11577 B18R0.174 CCCCCCCCCCCNCCC(=O)N(C)C 2230a_200011215754_100000737620 [0,2,0,0,0,0|1,0,0]=3 11578 B18R0.174 CCCCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100011215454 [0,2,0,0,0,0|1,0,0]=3 11579 B18R0.174 CCCCCCCCCCCOCCC(=O)N(C)C 7a_100000210809_100000737620 [0,2,0,0,0,0|1,0,0]=3 11580 B18R0.174 CCCCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100011215454 [0,2,0,0,0,0|1,0,0]=3 11581 B18R0.174 CCCCCCCCCCCSCOC(=O)C(C)C 62a_100000139345_100011215454 [0,2,0,0,0,0|2,0,0]=4 11582 B18R0.174 CCCCCCCCCCNCCCC(=O)N(C)C 2230a_100000684558_100000737642 [0,2,0,0,0,0|1,0,0]=3 11583 B18R0.174 CCCCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210320 [0,2,0,0,0,0|1,0,0]=3 11584 B18R0.174 CCCCCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100000210320 [0,2,0,0,0,0|2,0,0]=4 11585 B18R0.174 CCCCCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100000210320 [0,2,0,0,0,0|2,0,0]=4 11586 B18R0.174 CCCCCCCCCCOCCCC(=O)N(C)C 7a_100000210711_100000737642 [0,2,0,0,0,0|1,0,0]=3 11587 B18R0.174 CCCCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210320 [0,2,0,0,0,0|1,0,0]=3 11588 B18R0.174 CCCCCCCCCNCCCCC(=O)N(C)C 34a_100000212291_100000752486 [0,2,0,0,0,0|1,0,0]=3 11589 B18R0.174 CCCCCCCCCOCCCCC(=O)N(C)C 34a_100000210712_100000752486 [0,2,0,0,0,0|1,0,0]=3 11590 B18R0.174 CCCCCCCCCOCCCCC(=O)N(C)C 7a_100000210712_100000752486 [0,2,0,0,0,0|1,0,0]=3 11591 B18R0.174 CCCCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210670 [0,2,0,0,0,0|1,0,0]=3 11592 B18R0.174 CCCCCCOCCOCCCCC(=O)N(C)C 34a_100000691444_100000752486 [0,2,0,0,0,0|2,0,0]=4 11593 B18R0.174 CCCCCCOCCOCCCCC(=O)N(C)C 7a_100000691444_100000752486 [0,2,0,0,0,0|2,0,0]=4 11594 B18R0.174 CCCCNCCCCOCCCCC(=O)N(C)C 34a_200011216965_100000752486 [0,2,0,0,0,0|2,0,0]=4 11595 B18R0.174 CCCCOCCCCOCCCCC(=O)N(C)C 34a_200000760531_100000752486 [0,2,0,0,0,0|2,0,0]=4 11596 B18R0.174 CCCCOCCCCOCCCCC(=O)N(C)C 7a_200000760531_100000752486 [0,2,0,0,0,0|2,0,0]=4 11597 B18R0.174 CCOCCCCCCCCCOCC(=O)C(=O)C 34a_100009875440_100011261029 [0,2,0,0,0,0|2,0,0]=4 11598 B18R0.174 CCOCCCCCCCCCOCC(=O)C(C)C 34a_100009875440_100000753385 [0,2,0,0,0,0|2,0,0]=4 11599 B18R0.174 CCOCCCCCCCCCOCC(=O)C(C)C 7a_100009875440_100000753385 [0,2,0,0,0,0|2,0,0]=4 11600 B18R0.174 CCOCCCCCCCCCOCC(=O)N(C)C 34a_100009875440_100000692301 [0,2,0,0,0,0|2,0,0]=4 11601 B18R0.174 CCOCCCCCCCCCOCC(=O)N(C)C 7a_100009875440_100000692301 [0,2,0,0,0,0|2,0,0]=4 11602 B18R0.174 CN(C)C(=O)CCCCCCCCCCCCCO 240690a_100102631434_100020644313 [0,2,0,0,0,0|1,0,0]=3 11603 B18R0.174 CN(C)C(=O)CCCCNCCCCCCCCO 34a_102515433106_100000752486 [0,2,0,0,0,0|2,0,0]=4 11604 B18R0.174 CN(C)C(=O)CCCCOCCCCCCCCBr 34a_100009813846_100000752486 [0,2,0,0,0,0|2,0,0]=4 11605 B18R0.174 CN(C)C(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000752486 [0,2,0,0,0,0|2,0,0]=4 11606 B18R0.174 CN(C)C(=O)CCCCOCCCCCCCCCl 34a_100000033203_100000752486 [0,2,0,0,0,0|2,0,0]=4 11607 B18R0.174 CN(C)C(=O)CCCCOCCCCCCCCCl 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B18R0.174 CN(C)C(=O)CCNCCCCCCCCCCO 2230a_100000738053_100009813290 [0,2,0,0,0,0|2,0,0]=4 11619 B18R0.174 CN(C)C(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000737620 [0,2,0,0,0,0|2,0,0]=4 11620 B18R0.174 CN(C)C(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000737620 [0,2,0,0,0,0|2,0,0]=4 11621 B18R0.174 CN(C)C(=O)CCOCCCCCCCCCCO 34a_200000747469_100009813290 [0,2,0,0,0,0|2,0,0]=4 11622 B18R0.174 CN(C)C(=O)CCSCCCCCCCCCCO 62a_100000737620_200000033068 [0,2,0,0,0,0|2,0,0]=4 11623 B18R0.174 CN(C)C(=O)CCSCCCCCCCCCCO 62a_100009813290_100000737620 [0,2,0,0,0,0|2,0,0]=4 11624 B18R0.174 CN(C)C(=O)CNCCCCCCCCCCCO 2230a_100015183351_100009812471 [0,2,0,0,0,0|2,0,0]=4 11625 B18R0.174 CN(C)C(=O)COCCCCCCCCCCCBr 34a_100009812471_100000692301 [0,2,0,0,0,0|2,0,0]=4 11626 B18R0.174 CN(C)C(=O)COCCCCCCCCCCCBr 7a_100009812471_100000692301 [0,2,0,0,0,0|2,0,0]=4 11627 B18R0.174 CN(C)C(=O)CSCCCCCCCCCCCO 62a_100009812471_100000692301 [0,2,0,0,0,0|2,0,0]=4 11628 B18R0.174 CN(C)C(=O)NCCCCCCCCCCCCO 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[0,2,0,0,0,0|0,0,2]=4 11649 B18R0.175 C=CCCCCCCCCSC[C@H](O)CC(=O)OC 62a_100011933949_100000754131 [0,2,0,0,0,0|0,0,2]=4 11650 B18R0.175 CCC#CCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_200000036426 [0,2,0,0,0,0|0,0,2]=4 11651 B18R0.175 CCC#CCCCCCCSC[C@H](O)CC(=O)OC 62a_200000036426_100000754131 [0,2,0,0,0,0|0,0,2]=4 11652 B18R0.175 CCCC/C=C/CCCCOC[C@H](O)CC(=O)OC 34a_200020645093_100000754131 [0,2,0,0,0,0|0,0,2]=4 11653 B18R0.175 CCCC/C=C/CCCCOC[C@H](O)CC(=O)OC 7a_200020645093_100000754131 [0,2,0,0,0,0|0,0,2]=4 11654 B18R0.175 CCCCC#CCCCCCCC(=O)CC(=O)OC 1458a_100000211351_200000043322 [0,2,0,0,0,0|0,0,2]=4 11655 B18R0.175 CCCCC#CCCCCCCN(C)CC(=O)OC 2230a_100000198492_200000043322 [0,2,0,0,0,0|0,0,2]=4 11656 B18R0.175 CCCCC#CCCCCOC[C@H](O)CC(=O)OC 34a_200000066234_100000754131 [0,2,0,0,0,0|0,0,2]=4 11657 B18R0.175 CCCCC#CCCCCOC[C@H](O)CC(=O)OC 7a_200000066234_100000754131 [0,2,0,0,0,0|0,0,2]=4 11658 B18R0.175 CCCCC/C=C\CCCOC[C@H](O)CC(=O)OC 34a_100020655193_100000754131 [0,2,0,0,0,0|0,0,2]=4 11659 B18R0.175 CCCCC/C=C\CCCOC[C@H](O)CC(=O)OC 7a_100020655193_100000754131 [0,2,0,0,0,0|0,0,2]=4 11660 B18R0.175 CCCCCCC#CCCOC[C@H](O)CC(=O)OC 34a_200000033163_100000754131 [0,2,0,0,0,0|0,0,2]=4 11661 B18R0.175 CCCCCCC#CCCOC[C@H](O)CC(=O)OC 7a_200000033163_100000754131 [0,2,0,0,0,0|0,0,2]=4 11662 B18R0.175 CCCCCCCC#CCOC[C@H](O)CC(=O)OC 34a_200000061759_100000754131 [0,2,0,0,0,0|0,0,2]=4 11663 B18R0.175 CCCCCCCC#CCOC[C@H](O)CC(=O)OC 7a_200000061759_100000754131 [0,2,0,0,0,0|0,0,2]=4 11664 B18R0.175 CCCCCCCC/C=C/COC(C)CC(=O)OC 34a_200020667288_100009817358 [0,2,0,0,0,0|0,0,2]=4 11665 B18R0.175 CCCCCCCC/C=C/COC(C)CC(=O)OC 7a_200020667288_100009817358 [0,2,0,0,0,0|0,0,2]=4 11666 B18R0.175 CCCCCCCCCCCCC(=O)CC(=O)CC 1458a_100011215791_100000747405 [0,2,0,0,0,0|1,0,0]=3 11667 B18R0.175 CCCCCCCCCCCCC(=O)CC(=O)NC 1458a_100011215791_100000183359 [0,2,0,0,0,0|1,0,0]=3 11668 B18R0.175 CCCCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000759014 [0,2,0,0,0,0|0,0,0]=2 11669 B18R0.175 CCCCCCCCCCCCC(=O)CC(=O)OC 1458a_100011215791_100000747449 [0,2,0,0,0,0|0,0,0]=2 11670 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)CC 269982a_100000227908_100000747405 [0,2,0,0,0,0|1,0,0]=3 11671 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100011215052 [0,2,0,0,0,0|1,0,0]=3 11672 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)NC 2230a_100000227908_100000183359 [0,2,0,0,0,0|1,0,0]=3 11673 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)NC 269982a_100000227908_100000183359 [0,2,0,0,0,0|1,0,0]=3 11674 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)NC 270004a_100000189611_100011218549 [0,2,0,0,0,0|1,0,0]=3 11675 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011215052 [0,2,0,0,0,0|0,0,0]=2 11676 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)OC 2230a_100000227908_100000747449 [0,2,0,0,0,0|0,0,0]=2 11677 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)OC 269982a_100000227908_100000747449 [0,2,0,0,0,0|0,0,0]=2 11678 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)OC 270004a_100000198492_100011218549 [0,2,0,0,0,0|0,0,0]=2 11679 B18R0.175 CCCCCCCCCCCNC(=O)CC(=O)OC 240690a_200011215754_100000211351 [0,2,0,0,0,0|0,0,1]=3 11680 B18R0.175 CCCCCCCCCCCNC(C)CC(=O)OC 2230a_200011215754_100009817358 [0,2,0,0,0,0|0,0,0]=2 11681 B18R0.175 CCCCCCCCCCCNC(C)CC(=O)OC 34a_200011215754_100009817358 [0,2,0,0,0,0|0,0,0]=2 11682 B18R0.175 CCCCCCCCCCCOC(C)CC(=O)OC 34a_100000210809_100009817358 [0,2,0,0,0,0|0,0,0]=2 11683 B18R0.175 CCCCCCCCCCCOC(C)CC(=O)OC 7a_100000210809_100009817358 [0,2,0,0,0,0|0,0,0]=2 11684 B18R0.175 CCCCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100011215454 [0,2,0,0,0,0|0,0,0]=2 11685 B18R0.175 CCCCCCCCCCNC[C@H](O)CC(=O)OC 34a_100000684558_100000754131 [0,2,0,0,0,0|0,0,0]=2 11686 B18R0.175 CCCCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000210711_100000754131 [0,2,0,0,0,0|0,0,0]=2 11687 B18R0.175 CCCCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000210711_100000754131 [0,2,0,0,0,0|0,0,0]=2 11688 B18R0.175 CCCCCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210320 [0,2,0,0,0,0|0,0,1]=3 11689 B18R0.175 CCCCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210320 [0,2,0,0,0,0|0,0,0]=2 11690 B18R0.175 CCCCOCCOCCOC[C@H](O)CC(=O)OC 34a_100011215186_100000754131 [0,2,0,0,0,0|2,0,0]=4 11691 B18R0.175 CCCCOCCOCCOC[C@H](O)CC(=O)OC 7a_100011215186_100000754131 [0,2,0,0,0,0|2,0,0]=4 11692 B18R0.175 CNC(=O)CN(C)CCCCCCCCCCCO 2230a_100000189611_100009812471 [0,2,0,0,0,0|2,0,0]=4 11693 B18R0.175 COC(=O)CC(=O)CCCCCCCCCCCO 1458a_100000211351_100009812471 [0,2,0,0,0,0|0,0,1]=3 11694 B18R0.175 COC(=O)CC(=O)CSCCCCCCCCCO 62a_100000210525_100009813782 [0,2,0,0,0,0|1,0,1]=4 11695 B18R0.175 COC(=O)CC(=O)CSCCCCCCCCCO 62a_100009813782_100000210525 [0,2,0,0,0,0|1,0,1]=4 11696 B18R0.175 COC(=O)CC(=O)NCCCCCCCCCCO 240690a_100000066964_100000211351 [0,2,0,0,0,0|1,0,1]=4 11697 B18R0.175 COC(=O)CC(C)NCCCCCCCCCCO 2230a_100000066964_100009817358 [0,2,0,0,0,0|1,0,0]=3 11698 B18R0.175 COC(=O)CC(C)NCCCCCCCCCCO 34a_100000066964_100009817358 [0,2,0,0,0,0|1,0,0]=3 11699 B18R0.175 COC(=O)CC(C)OCCCCCCCCCCBr 34a_100009813290_100009817358 [0,2,0,0,0,0|1,0,0]=3 11700 B18R0.175 COC(=O)CC(C)OCCCCCCCCCCBr 7a_100009813290_100009817358 [0,2,0,0,0,0|1,0,0]=3 11701 B18R0.175 COC(=O)CC(C)OCCCCCCCCCCCl 34a_200000033068_100009817358 [0,2,0,0,0,0|1,0,0]=3 11702 B18R0.175 COC(=O)CC(C)OCCCCCCCCCCCl 7a_200000033068_100009817358 [0,2,0,0,0,0|1,0,0]=3 11703 B18R0.175 COC(=O)CC(C)OCCCCCCCCCCN 34a_100000066964_100009817358 [0,2,0,0,0,0|1,0,0]=3 11704 B18R0.175 COC(=O)CC(C)SCCCCCCCCCCO 62a_100009813290_100009817358 [0,2,0,0,0,0|1,0,0]=3 11705 B18R0.175 COC(=O)CC(C)SCCCCCCCCCCO 62a_100009817358_200000033068 [0,2,0,0,0,0|1,0,0]=3 11706 B18R0.175 COC(=O)CN(C)CCCCCCCCCCCO 2230a_100000198492_100009812471 [0,2,0,0,0,0|1,0,0]=3 11707 B18R0.175 COC(=O)C[C@@H](O)CNCCCCCCCCCO 34a_100000078944_100000754131 [0,2,0,0,0,0|1,0,0]=3 11708 B18R0.175 COC(=O)C[C@@H](O)COCCCCCCCCCBr 34a_100009813782_100000754131 [0,2,0,0,0,0|1,0,0]=3 11709 B18R0.175 COC(=O)C[C@@H](O)COCCCCCCCCCBr 7a_100009813782_100000754131 [0,2,0,0,0,0|1,0,0]=3 11710 B18R0.175 COC(=O)C[C@@H](O)COCCCCCCCCCCl 34a_100009868337_100000754131 [0,2,0,0,0,0|1,0,0]=3 11711 B18R0.175 COC(=O)C[C@@H](O)COCCCCCCCCCCl 7a_100009868337_100000754131 [0,2,0,0,0,0|1,0,0]=3 11712 B18R0.175 COC(=O)C[C@@H](O)COCCCCCCCCCN 34a_100000078944_100000754131 [0,2,0,0,0,0|1,0,0]=3 11713 B18R0.175 COC(=O)C[C@@H](O)CSCCCCCCCCCO 62a_100000754131_100009813782 [0,2,0,0,0,0|1,0,0]=3 11714 B18R0.175 COC(=O)C[C@@H](O)CSCCCCCCCCCO 62a_100009813782_100000754131 [0,2,0,0,0,0|1,0,0]=3 11715 B18R0.189 C#CC(C)C(=O)CCCCCCCCCCCCC 1458a_100000756256_200000035995 [0,2,0,0,0,0|1,0,0]=3 11716 B18R0.189 C#CCCCCCCCCCCOC(C)C(=O)OC 34a_100000054667_100000211248 [0,2,0,0,0,0|0,0,2]=4 11717 B18R0.189 C#CCCCCCCCCCCOC(C)C(=O)OC 7a_100000054667_100000211248 [0,2,0,0,0,0|0,0,2]=4 11718 B18R0.189 C#CCCCCCCCCCOCC(C)C(=O)OC 34a_100000034437_100000698445 [0,2,0,0,0,0|0,0,2]=4 11719 B18R0.189 C#CCCCCCCCCOCCC(C)C(=O)OC 34a_100000065265_100000034942 [0,2,0,0,0,0|0,0,2]=4 11720 B18R0.189 C#CCCCCCCCCOCCC(C)C(=O)OC 7a_100000065265_100000034942 [0,2,0,0,0,0|0,0,2]=4 11721 B18R0.189 C/C=C(\C)/C(=O)CCCCCCCCCCCCO 1458a_100020587367_100009813331 [0,2,0,0,0,0|2,0,0]=4 11722 B18R0.189 C/C=C(\C)/C(=O)NCCCCCCCCCCCC 11a_100000210451_100020587367 [0,2,0,0,0,0|2,0,0]=4 11723 B18R0.189 C/C=C(\C)/C(=O)NCCCCCCCCCCCC 1626a_100000210451_100020587367 [0,2,0,0,0,0|2,0,0]=4 11724 B18R0.189 C/C=C(\C)/C(C)NCCCCCCCCCCCC 269862a_100000210451_100020675665 [0,2,0,0,0,0|2,0,0]=4 11725 B18R0.189 C=C(CNCCCCCCCCCCC)C(=O)OC 34a_200011215754_100009813391 [0,2,0,0,0,0|0,0,1]=3 11726 B18R0.189 C=C(CNCCCCCCCCCCO)C(=O)OC 34a_100000066964_100009813391 [0,2,0,0,0,0|1,0,1]=4 11727 B18R0.189 C=C(COCCCCCCCCCCBr)C(=O)OC 34a_100009813290_100009813391 [0,2,0,0,0,0|1,0,1]=4 11728 B18R0.189 C=C(COCCCCCCCCCCC)C(=O)OC 34a_100000210809_100009813391 [0,2,0,0,0,0|0,0,1]=3 11729 B18R0.189 C=C(COCCCCCCCCCCCl)C(=O)OC 34a_200000033068_100009813391 [0,2,0,0,0,0|1,0,1]=4 11730 B18R0.189 C=C(COCCCCCCCCCCN)C(=O)OC 34a_100000066964_100009813391 [0,2,0,0,0,0|1,0,1]=4 11731 B18R0.189 C=C(CSCCCCCCCCCCC)C(=O)OC 62a_100009813391_100011215454 [0,2,0,0,0,0|0,0,1]=3 11732 B18R0.189 C=C(CSCCCCCCCCCCO)C(=O)OC 62a_100009813290_100009813391 [0,2,0,0,0,0|1,0,1]=4 11733 B18R0.189 C=C(CSCCCCCCCCCCO)C(=O)OC 62a_100009813391_200000033068 [0,2,0,0,0,0|1,0,1]=4 11734 B18R0.189 C=CC(C)C(=O)CCCCCCCCCCCCO 1458a_100011216780_100009813331 [0,2,0,0,0,0|2,0,0]=4 11735 B18R0.189 C=CC(C)C(=O)NCCCCCCCCCCCC 11a_100000210451_100011216780 [0,2,0,0,0,0|2,0,0]=4 11736 B18R0.189 C=CC(C)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100011216780 [0,2,0,0,0,0|2,0,0]=4 11737 B18R0.189 C=CC(C)C(=O)NCCCCCCCCCCCC 240690a_100000210451_100011216780 [0,2,0,0,0,0|2,0,0]=4 11738 B18R0.189 C=CC(C)C(=O)NCCCCCCCCCCCC 527a_100000210451_100011216780 [0,2,0,0,0,0|2,0,0]=4 11739 B18R0.189 C=CCCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_102130925996 [0,2,0,0,0,0|0,0,2]=4 11740 B18R0.189 C=CCCCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100011093070 [0,2,0,0,0,0|0,0,2]=4 11741 B18R0.189 C=CCCCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100011093070 [0,2,0,0,0,0|0,0,2]=4 11742 B18R0.189 C=CCCCCCCCCCCSC(C)C(=O)OC 62a_100011093070_100000211248 [0,2,0,0,0,0|0,0,2]=4 11743 B18R0.189 C=CCCCCCCCCCNCC(C)C(=O)OC 34a_100000081888_100000698445 [0,2,0,0,0,0|0,0,2]=4 11744 B18R0.189 C=CCCCCCCCCCOCC(C)C(=O)OC 34a_100000038209_100000698445 [0,2,0,0,0,0|0,0,2]=4 11745 B18R0.189 C=CCCCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100009814027 [0,2,0,0,0,0|0,0,2]=4 11746 B18R0.189 C=CCCCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100009814027 [0,2,0,0,0,0|0,0,2]=4 11747 B18R0.189 C=CCCCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100009814027 [0,2,0,0,0,0|0,0,2]=4 11748 B18R0.189 C=CCCCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100009814027 [0,2,0,0,0,0|0,0,2]=4 11749 B18R0.189 C=CCCCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100009814027 [0,2,0,0,0,0|0,0,2]=4 11750 B18R0.189 C=CCCCCCCCCCSCC(C)C(=O)OC 62a_100009814027_100000698445 [0,2,0,0,0,0|0,0,2]=4 11751 B18R0.189 C=CCCCCCCCCOCCC(C)C(=O)OC 34a_100011215194_100000034942 [0,2,0,0,0,0|0,0,2]=4 11752 B18R0.189 C=CCCCCCCCCOCCC(C)C(=O)OC 7a_100011215194_100000034942 [0,2,0,0,0,0|0,0,2]=4 11753 B18R0.189 C=CCCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100011933949 [0,2,0,0,0,0|0,0,2]=4 11754 B18R0.189 C=CCCCCCCCCSCCC(C)C(=O)OC 62a_100011933949_100000034942 [0,2,0,0,0,0|0,0,2]=4 11755 B18R0.189 CC(C#N)C(=O)CCCCCCCCCCCCO 1458a_100000753662_100009813331 [0,2,0,0,0,0|2,0,0]=4 11756 B18R0.189 CCC#CCCCCCCCCOC(C)C(=O)OC 34a_200000031908_100000211248 [0,2,0,0,0,0|0,0,2]=4 11757 B18R0.189 CCC#CCCCCCCCCOC(C)C(=O)OC 7a_200000031908_100000211248 [0,2,0,0,0,0|0,0,2]=4 11758 B18R0.189 CCC#CCCCCCCSCCC(C)C(=O)OC 62a_100000034942_200000036426 [0,2,0,0,0,0|0,0,2]=4 11759 B18R0.189 CCC#CCCCCCCSCCC(C)C(=O)OC 62a_200000036426_100000034942 [0,2,0,0,0,0|0,0,2]=4 11760 B18R0.189 CCC(=O)C(C)OCCCCCCCCCCCBr 7a_100009812471_100000742827 [0,2,0,0,0,0|2,0,0]=4 11761 B18R0.189 CCC(=O)C(C)SCCCCCCCCCCCO 62a_100009812471_100000742827 [0,2,0,0,0,0|2,0,0]=4 11762 B18R0.189 CCC(C)C(=O)CCCCCCCCCCCCO 1458a_100011192722_100009813331 [0,2,0,0,0,0|2,0,0]=4 11763 B18R0.189 CCC(O)C(=O)CCCCCCCCCCCCO 1458a_100011196387_100009813331 [0,2,0,0,0,0|2,0,0]=4 11764 B18R0.189 CCCC/C=C/CCCCOCCC(C)C(=O)OC 34a_200020645093_100000034942 [0,2,0,0,0,0|0,0,2]=4 11765 B18R0.189 CCCC/C=C/CCCCOCCC(C)C(=O)OC 7a_200020645093_100000034942 [0,2,0,0,0,0|0,0,2]=4 11766 B18R0.189 CCCCC#CCCCCCCOC(C)C(=O)OC 34a_100011215400_200000043322 [0,2,0,0,0,0|0,0,2]=4 11767 B18R0.189 CCCCC#CCCCCCCSC(C)C(=O)OC 62a_100000211248_200000043322 [0,2,0,0,0,0|0,0,2]=4 11768 B18R0.189 CCCCC#CCCCCCCSC(C)C(=O)OC 62a_200000043322_100000211248 [0,2,0,0,0,0|0,0,2]=4 11769 B18R0.189 CCCCC#CCCCCOCCC(C)C(=O)OC 34a_200000066234_100000034942 [0,2,0,0,0,0|0,0,2]=4 11770 B18R0.189 CCCCC#CCCCCOCCC(C)C(=O)OC 7a_200000066234_100000034942 [0,2,0,0,0,0|0,0,2]=4 11771 B18R0.189 CCCCC/C=C\CCCOCCC(C)C(=O)OC 34a_100020655193_100000034942 [0,2,0,0,0,0|0,0,2]=4 11772 B18R0.189 CCCCC/C=C\CCCOCCC(C)C(=O)OC 7a_100020655193_100000034942 [0,2,0,0,0,0|0,0,2]=4 11773 B18R0.189 CCCCCCC#CCCOCCC(C)C(=O)OC 34a_200000033163_100000034942 [0,2,0,0,0,0|0,0,2]=4 11774 B18R0.189 CCCCCCC#CCCOCCC(C)C(=O)OC 7a_200000033163_100000034942 [0,2,0,0,0,0|0,0,2]=4 11775 B18R0.189 CCCCCCCC#CCOCCC(C)C(=O)OC 34a_200000061759_100000034942 [0,2,0,0,0,0|0,0,2]=4 11776 B18R0.189 CCCCCCCC#CCOCCC(C)C(=O)OC 7a_200000061759_100000034942 [0,2,0,0,0,0|0,0,2]=4 11777 B18R0.189 CCCCCCCC/C=C/COCC(C)C(=O)OC 34a_200020667288_100000698445 [0,2,0,0,0,0|0,0,2]=4 11778 B18R0.189 CCCCCCCCC/C=C/COC(C)C(=O)OC 34a_100015232335_100000211248 [0,2,0,0,0,0|0,0,2]=4 11779 B18R0.189 CCCCCCCCC/C=C/COC(C)C(=O)OC 7a_100015232335_100000211248 [0,2,0,0,0,0|0,0,2]=4 11780 B18R0.189 CCCCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210684 [0,2,0,0,0,0|1,0,0]=3 11781 B18R0.189 CCCCCCCCCCCCCC(=O)C(C)C#N 1458a_100000753662_100000210684 [0,2,0,0,0,0|1,0,0]=3 11782 B18R0.189 CCCCCCCCCCCCCC(=O)C(C)C#N 1458a_100000756256_100000703298 [0,2,0,0,0,0|1,0,0]=3 11783 B18R0.189 CCCCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000210684 [0,2,0,0,0,0|0,0,0]=2 11784 B18R0.189 CCCCCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100000210684 [0,2,0,0,0,0|1,0,0]=3 11785 B18R0.189 CCCCCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100000210684 [0,2,0,0,0,0|1,0,0]=3 11786 B18R0.189 CCCCCCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000756256 [0,2,0,0,0,0|1,0,0]=3 11787 B18R0.189 CCCCCCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000756256 [0,2,0,0,0,0|1,0,0]=3 11788 B18R0.189 CCCCCCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000756256 [0,2,0,0,0,0|1,0,0]=3 11789 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)NC 1626a_100000210451_100011218921 [0,2,0,0,0,0|1,0,1]=4 11790 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)NC 240690a_100000210451_100011218921 [0,2,0,0,0,0|1,0,1]=4 11791 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)NC 527a_100000210451_100011218921 [0,2,0,0,0,0|1,0,1]=4 11792 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)OC 11a_100000210451_100000024059 [0,2,0,0,0,0|0,0,1]=3 11793 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)OC 1626a_100000210451_100000024059 [0,2,0,0,0,0|0,0,1]=3 11794 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)OC 240690a_100000210451_100000024059 [0,2,0,0,0,0|0,0,1]=3 11795 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)OC 527a_100000210451_100000024059 [0,2,0,0,0,0|0,0,1]=3 11796 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)C#N 11a_100000210451_100000753662 [0,2,0,0,0,0|2,0,0]=4 11797 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)C#N 1626a_100000210451_100000753662 [0,2,0,0,0,0|2,0,0]=4 11798 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)C#N 240690a_100000210451_100000753662 [0,2,0,0,0,0|2,0,0]=4 11799 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)C#N 527a_100000210451_100000753662 [0,2,0,0,0,0|2,0,0]=4 11800 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC 11a_100000210451_100011192722 [0,2,0,0,0,0|2,0,0]=4 11801 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC 1626a_100000210451_100011192722 [0,2,0,0,0,0|2,0,0]=4 11802 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC 240690a_100000210451_100011192722 [0,2,0,0,0,0|2,0,0]=4 11803 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC 527a_100000210451_100011192722 [0,2,0,0,0,0|2,0,0]=4 11804 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)OC 11a_100000210451_100000743197 [0,2,0,0,0,0|1,0,0]=3 11805 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)OC 1626a_100000210451_100000743197 [0,2,0,0,0,0|1,0,0]=3 11806 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)OC 240690a_100000210451_100000743197 [0,2,0,0,0,0|1,0,0]=3 11807 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)OC 527a_100000210451_100000743197 [0,2,0,0,0,0|1,0,0]=3 11808 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)SC 11a_100000210451_100000149566 [0,2,0,0,0,0|1,1,0]=4 11809 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)SC 1626a_100000210451_100000149566 [0,2,0,0,0,0|1,1,0]=4 11810 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)SC 240690a_100000210451_100000149566 [0,2,0,0,0,0|1,1,0]=4 11811 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)SC 527a_100000210451_100000149566 [0,2,0,0,0,0|1,1,0]=4 11812 B18R0.189 CCCCCCCCCCCCNC(=O)C(O)CC 240690a_100000210451_100011196387 [0,2,0,0,0,0|2,0,0]=4 11813 B18R0.189 CCCCCCCCCCCCNC(=O)C(O)CO 240690a_100000210451_100011215603 [0,2,0,0,0,0|2,0,0]=4 11814 B18R0.189 CCCCCCCCCCCCNC(=O)N(C)CC 2708a_100000210451_100000225621 [0,2,0,0,0,0|2,0,0]=4 11815 B18R0.189 CCCCCCCCCCCCNC(=O)N(C)CC 273464a_100000210451_100000225621 [0,2,0,0,0,0|2,0,0]=4 11816 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)CC 2230a_100000210451_100000742827 [0,2,0,0,0,0|1,0,0]=3 11817 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)NC 2230a_100000210451_100000731044 [0,2,0,0,0,0|1,0,0]=3 11818 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)NC 34a_100000210451_100000731044 [0,2,0,0,0,0|1,0,0]=3 11819 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)OC 2230a_100000210451_100000211248 [0,2,0,0,0,0|0,0,0]=2 11820 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)OC 34a_100000210451_100000211248 [0,2,0,0,0,0|0,0,0]=2 11821 B18R0.189 CCCCCCCCCCCCNC(F)C(=O)NC 2230a_100000210451_100009813575 [0,2,0,0,0,0|1,0,0]=3 11822 B18R0.189 CCCCCCCCCCCCNC(F)C(=O)NC 34a_100000210451_100009813575 [0,2,0,0,0,0|1,0,0]=3 11823 B18R0.189 CCCCCCCCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100011215052 [0,2,0,0,0,0|1,0,0]=3 11824 B18R0.189 CCCCCCCCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100000759014 [0,2,0,0,0,0|1,0,0]=3 11825 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)CC 7a_100000210810_100000742827 [0,2,0,0,0,0|1,0,0]=3 11826 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)NC 34a_100000210810_100000731044 [0,2,0,0,0,0|1,0,0]=3 11827 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)NC 7a_100000210810_100000209862 [0,2,0,0,0,0|1,0,0]=3 11828 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)NN 34a_100000725659_100000759014 [0,2,0,0,0,0|2,0,0]=4 11829 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)OC 34a_100000210810_100000211248 [0,2,0,0,0,0|0,0,0]=2 11830 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)OC 34a_100011215400_100000759014 [0,2,0,0,0,0|0,0,0]=2 11831 B18R0.189 CCCCCCCCCCCCOC(C)C(=O)OC 7a_100000210810_100000211248 [0,2,0,0,0,0|0,0,0]=2 11832 B18R0.189 CCCCCCCCCCCCOC(F)C(=O)NC 34a_100000210810_100009813575 [0,2,0,0,0,0|1,0,0]=3 11833 B18R0.189 CCCCCCCCCCCCOC(F)C(=O)NC 7a_100000210810_100009813575 [0,2,0,0,0,0|1,0,0]=3 11834 B18R0.189 CCCCCCCCCCCCSC(C)C(=O)NC 62a_100000209862_100000759014 [0,2,0,0,0,0|1,0,0]=3 11835 B18R0.189 CCCCCCCCCCCCSC(C)C(=O)OC 62a_100000211248_100000759014 [0,2,0,0,0,0|0,0,0]=2 11836 B18R0.189 CCCCCCCCCCCCSC(F)C(=O)NC 62a_100009813575_100000759014 [0,2,0,0,0,0|1,0,0]=3 11837 B18R0.189 CCCCCCCCCCCNCC(=O)C(=O)OC 34a_200011215754_100011610305 [0,2,0,0,0,0|0,0,1]=3 11838 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)CC 2230a_200011215754_100000738999 [0,2,0,0,0,0|2,0,0]=4 11839 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)CC 34a_200011215754_100000738999 [0,2,0,0,0,0|2,0,0]=4 11840 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)OC 2230a_100015207273_100011215454 [0,2,0,0,0,0|1,0,0]=3 11841 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)OC 2230a_200011215754_100000764215 [0,2,0,0,0,0|1,0,0]=3 11842 B18R0.189 CCCCCCCCCCCNCC(C)C(=O)NC 2230a_100015187722_100011215454 [0,2,0,0,0,0|1,0,0]=3 11843 B18R0.189 CCCCCCCCCCCNCC(C)C(=O)NC 34a_100015187722_100011215454 [0,2,0,0,0,0|1,0,0]=3 11844 B18R0.189 CCCCCCCCCCCNCC(C)C(=O)OC 34a_200011215754_100000698445 [0,2,0,0,0,0|0,0,0]=2 11845 B18R0.189 CCCCCCCCCCCOCC(=O)C(=O)OC 34a_100000210809_100011610305 [0,2,0,0,0,0|0,0,1]=3 11846 B18R0.189 CCCCCCCCCCCOCC(=O)N(C)CC 34a_100000210809_100000738999 [0,2,0,0,0,0|2,0,0]=4 11847 B18R0.189 CCCCCCCCCCCOCC(=O)N(C)CC 7a_100000210809_100000738999 [0,2,0,0,0,0|2,0,0]=4 11848 B18R0.189 CCCCCCCCCCCOCC(=O)N(C)OC 7a_100000210809_100000764215 [0,2,0,0,0,0|1,0,0]=3 11849 B18R0.189 CCCCCCCCCCCOCC(C)C(=O)OC 34a_100000210809_100000698445 [0,2,0,0,0,0|0,0,0]=2 11850 B18R0.189 CCCCCCCCCCCOCC(C)C(=O)OC 34a_100000749362_100011215454 [0,2,0,0,0,0|0,0,0]=2 11851 B18R0.189 CCCCCCCCCCCOCC(C)C(=O)OC 7a_100000749362_100011215454 [0,2,0,0,0,0|0,0,0]=2 11852 B18R0.189 CCCCCCCCCCCOCC(F)C(=O)OC 34a_200009849844_100011215454 [0,2,0,0,0,0|0,0,0]=2 11853 B18R0.189 CCCCCCCCCCCOCC(N)C(=O)NN 34a_100016989258_100011215454 [0,2,0,0,0,0|2,0,0]=4 11854 B18R0.189 CCCCCCCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011215454 [0,2,0,0,0,0|0,0,0]=2 11855 B18R0.189 CCCCCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100011215454 [0,2,0,0,0,0|0,0,1]=3 11856 B18R0.189 CCCCCCCCCCCSCC(=O)N(C)CC 62a_100000738999_100011215454 [0,2,0,0,0,0|2,0,0]=4 11857 B18R0.189 CCCCCCCCCCCSCC(=O)N(C)OC 62a_100000764215_100011215454 [0,2,0,0,0,0|1,0,0]=3 11858 B18R0.189 CCCCCCCCCCCSCC(C)C(=O)OC 62a_100000698445_100011215454 [0,2,0,0,0,0|0,0,0]=2 11859 B18R0.189 CCCCCCCCCCNCCC(C)C(=O)OC 2230a_100000684558_100000034942 [0,2,0,0,0,0|0,0,0]=2 11860 B18R0.189 CCCCCCCCCCNCCC(C)C(=O)OC 34a_100000684558_100000034942 [0,2,0,0,0,0|0,0,0]=2 11861 B18R0.189 CCCCCCCCCCOCCC(C)C(=O)OC 34a_100000210711_100000034942 [0,2,0,0,0,0|0,0,0]=2 11862 B18R0.189 CCCCCCCCCCOCCC(C)C(=O)OC 7a_100000210711_100000034942 [0,2,0,0,0,0|0,0,0]=2 11863 B18R0.189 CCCCCCCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210320 [0,2,0,0,0,0|0,0,0]=2 11864 B18R0.189 CCCCCCCCCOCCCC(=O)N(C)OC 7a_100000210712_100011842776 [0,2,0,0,0,0|1,0,0]=3 11865 B18R0.189 CCCCCCCCCSCCCC(=O)N(C)OC 62a_100011842776_100000210670 [0,2,0,0,0,0|1,0,0]=3 11866 B18R0.189 CCCCCCOCCOCCCC(=O)N(C)OC 7a_100000691444_100011842776 [0,2,0,0,0,0|2,0,0]=4 11867 B18R0.189 CCCCCCOCCOCCOC(C)C(=O)OC 34a_100000032842_100000211248 [0,2,0,0,0,0|2,0,0]=4 11868 B18R0.189 CCCCCCOCCOCCOC(C)C(=O)OC 7a_100000032842_100000211248 [0,2,0,0,0,0|2,0,0]=4 11869 B18R0.189 CCCCOCCCCOCCCC(=O)N(C)OC 7a_200000760531_100011842776 [0,2,0,0,0,0|2,0,0]=4 11870 B18R0.189 CCCCOCCOCCOCCC(C)C(=O)OC 34a_100011215186_100000034942 [0,2,0,0,0,0|2,0,0]=4 11871 B18R0.189 CCCCOCCOCCOCCC(C)C(=O)OC 7a_100011215186_100000034942 [0,2,0,0,0,0|2,0,0]=4 11872 B18R0.189 CCN(C)C(=O)CCCCCCCCCCCCO 240690a_100000225621_100102582631 [0,2,0,0,0,0|2,0,0]=4 11873 B18R0.189 CCOCCCCCCCCCOC(C)C(=O)CC 7a_100009875440_100000742827 [0,2,0,0,0,0|2,0,0]=4 11874 B18R0.189 CCOCCCCCCCCCOC(C)C(=O)NC 34a_100009875440_100000731044 [0,2,0,0,0,0|2,0,0]=4 11875 B18R0.189 CCOCCCCCCCCCOC(C)C(=O)NC 7a_100009875440_100000209862 [0,2,0,0,0,0|2,0,0]=4 11876 B18R0.189 CCOCCCCCCCCCOC(C)C(=O)OC 34a_100009875440_100000211248 [0,2,0,0,0,0|1,0,0]=3 11877 B18R0.189 CCOCCCCCCCCCOC(C)C(=O)OC 7a_100009875440_100000211248 [0,2,0,0,0,0|1,0,0]=3 11878 B18R0.189 CCOCCCCCCCCCOC(F)C(=O)NC 34a_100009875440_100009813575 [0,2,0,0,0,0|2,0,0]=4 11879 B18R0.189 CCOCCCCCCCCCOC(F)C(=O)NC 7a_100009875440_100009813575 [0,2,0,0,0,0|2,0,0]=4 11880 B18R0.189 CNC(=O)C(=O)CCCCCCCCCCCCO 1458a_100011218921_100009813331 [0,2,0,0,0,0|1,0,1]=4 11881 B18R0.189 CNC(=O)C(C)CNCCCCCCCCCCO 2230a_100015187722_100009813290 [0,2,0,0,0,0|2,0,0]=4 11882 B18R0.189 CNC(=O)C(C)CNCCCCCCCCCCO 34a_100015187722_100009813290 [0,2,0,0,0,0|2,0,0]=4 11883 B18R0.189 CNC(=O)C(C)OCCCCCCCCCCCBr 34a_100009812471_100000731044 [0,2,0,0,0,0|2,0,0]=4 11884 B18R0.189 CNC(=O)C(C)OCCCCCCCCCCCBr 7a_100009812471_100000209862 [0,2,0,0,0,0|2,0,0]=4 11885 B18R0.189 CNC(=O)C(C)SCCCCCCCCCCCO 62a_100009812471_100000731044 [0,2,0,0,0,0|2,0,0]=4 11886 B18R0.189 CNC(=O)C(F)OCCCCCCCCCCCBr 34a_100009812471_100009813575 [0,2,0,0,0,0|2,0,0]=4 11887 B18R0.189 CNC(=O)C(F)OCCCCCCCCCCCBr 7a_100009812471_100009813575 [0,2,0,0,0,0|2,0,0]=4 11888 B18R0.189 CNC(=O)C(F)SCCCCCCCCCCCO 62a_100009812471_100009813575 [0,2,0,0,0,0|2,0,0]=4 11889 B18R0.189 CNC(=O)[C@@H](C)NCCCCCCCCCCCO 2230a_100000684985_100009812471 [0,2,0,0,0,0|2,0,0]=4 11890 B18R0.189 CNC(=O)[C@@H](C)NCCCCCCCCCCCO 34a_100000684985_100009812471 [0,2,0,0,0,0|2,0,0]=4 11891 B18R0.189 COC(=O)C(=O)CNCCCCCCCCCCO 34a_100000066964_100011610305 [0,2,0,0,0,0|1,0,1]=4 11892 B18R0.189 COC(=O)C(=O)COCCCCCCCCCCBr 34a_100009813290_100011610305 [0,2,0,0,0,0|1,0,1]=4 11893 B18R0.189 COC(=O)C(=O)COCCCCCCCCCCCl 34a_200000033068_100011610305 [0,2,0,0,0,0|1,0,1]=4 11894 B18R0.189 COC(=O)C(=O)COCCCCCCCCCCN 34a_100000066964_100011610305 [0,2,0,0,0,0|1,0,1]=4 11895 B18R0.189 COC(=O)C(=O)CSCCCCCCCCCCO 62a_100009813290_100011610305 [0,2,0,0,0,0|1,0,1]=4 11896 B18R0.189 COC(=O)C(=O)CSCCCCCCCCCCO 62a_100011610305_200000033068 [0,2,0,0,0,0|1,0,1]=4 11897 B18R0.189 COC(=O)C(C)CCNCCCCCCCCCO 2230a_100000078944_100000034942 [0,2,0,0,0,0|1,0,0]=3 11898 B18R0.189 COC(=O)C(C)CCNCCCCCCCCCO 34a_100000078944_100000034942 [0,2,0,0,0,0|1,0,0]=3 11899 B18R0.189 COC(=O)C(C)CCOCCCCCCCCCBr 34a_100009813782_100000034942 [0,2,0,0,0,0|1,0,0]=3 11900 B18R0.189 COC(=O)C(C)CCOCCCCCCCCCBr 7a_100009813782_100000034942 [0,2,0,0,0,0|1,0,0]=3 11901 B18R0.189 COC(=O)C(C)CCOCCCCCCCCCCl 34a_100009868337_100000034942 [0,2,0,0,0,0|1,0,0]=3 11902 B18R0.189 COC(=O)C(C)CCOCCCCCCCCCCl 7a_100009868337_100000034942 [0,2,0,0,0,0|1,0,0]=3 11903 B18R0.189 COC(=O)C(C)CCOCCCCCCCCCN 34a_100000078944_100000034942 [0,2,0,0,0,0|1,0,0]=3 11904 B18R0.189 COC(=O)C(C)CCSCCCCCCCCCO 62a_100000034942_100009813782 [0,2,0,0,0,0|1,0,0]=3 11905 B18R0.189 COC(=O)C(C)CCSCCCCCCCCCO 62a_100009813782_100000034942 [0,2,0,0,0,0|1,0,0]=3 11906 B18R0.189 COC(=O)C(C)CNCCCCCCCCCCO 34a_100000066964_100000698445 [0,2,0,0,0,0|1,0,0]=3 11907 B18R0.189 COC(=O)C(C)COCCCCCCCCCCBr 34a_100009813290_100000698445 [0,2,0,0,0,0|1,0,0]=3 11908 B18R0.189 COC(=O)C(C)COCCCCCCCCCCCl 34a_200000033068_100000698445 [0,2,0,0,0,0|1,0,0]=3 11909 B18R0.189 COC(=O)C(C)COCCCCCCCCCCN 34a_100000066964_100000698445 [0,2,0,0,0,0|1,0,0]=3 11910 B18R0.189 COC(=O)C(C)COCCCCCCCCCCO 34a_100000749362_100009813290 [0,2,0,0,0,0|1,0,0]=3 11911 B18R0.189 COC(=O)C(C)COCCCCCCCCCCO 7a_100000749362_100009813290 [0,2,0,0,0,0|1,0,0]=3 11912 B18R0.189 COC(=O)C(C)CSCCCCCCCCCCO 62a_100000698445_200000033068 [0,2,0,0,0,0|1,0,0]=3 11913 B18R0.189 COC(=O)C(C)CSCCCCCCCCCCO 62a_100009813290_100000698445 [0,2,0,0,0,0|1,0,0]=3 11914 B18R0.189 COC(=O)C(C)OCCCCCCCCCCCBr 34a_100009812471_100000211248 [0,2,0,0,0,0|1,0,0]=3 11915 B18R0.189 COC(=O)C(C)OCCCCCCCCCCCBr 7a_100009812471_100000211248 [0,2,0,0,0,0|1,0,0]=3 11916 B18R0.189 COC(=O)C(C)OCCCCCCCCCCCO 34a_100011215400_100009812471 [0,2,0,0,0,0|1,0,0]=3 11917 B18R0.189 COC(=O)C(C)SCCCCCCCCCCCO 62a_100009812471_100000211248 [0,2,0,0,0,0|1,0,0]=3 11918 B18R0.189 COC(=O)C(F)COCCCCCCCCCCO 34a_200009849844_100009813290 [0,2,0,0,0,0|1,0,0]=3 11919 B18R0.189 COC(=O)[C@H](N)COCCCCCCCCCCO 34a_100000003586_100009813290 [0,2,0,0,0,0|1,0,0]=3 11920 B18R0.189 COC(C)C(=O)CCCCCCCCCCCCO 1458a_100000743197_100009813331 [0,2,0,0,0,0|1,0,0]=3 11921 B18R0.189 COC(C)C(=O)CCCCCCOCCCCCO 1458a_100000743197_200132310570 [0,2,0,0,0,0|2,0,0]=4 11922 B18R0.189 CON(C)C(=O)CCCOCCCCCCCCBr 7a_100009813846_100011842776 [0,2,0,0,0,0|2,0,0]=4 11923 B18R0.189 CON(C)C(=O)CCCOCCCCCCCCCl 7a_100000033203_100011842776 [0,2,0,0,0,0|2,0,0]=4 11924 B18R0.189 CON(C)C(=O)CCCSCCCCCCCCO 62a_100000033203_100011842776 [0,2,0,0,0,0|2,0,0]=4 11925 B18R0.189 CON(C)C(=O)CCCSCCCCCCCCO 62a_100011842776_100000033203 [0,2,0,0,0,0|2,0,0]=4 11926 B18R0.189 CON(C)C(=O)CNCCCCCCCCCCO 2230a_100000066964_100000764215 [0,2,0,0,0,0|2,0,0]=4 11927 B18R0.189 CON(C)C(=O)CNCCCCCCCCCCO 2230a_100015207273_100009813290 [0,2,0,0,0,0|2,0,0]=4 11928 B18R0.189 CON(C)C(=O)COCCCCCCCCCCBr 7a_100009813290_100000764215 [0,2,0,0,0,0|2,0,0]=4 11929 B18R0.189 CON(C)C(=O)COCCCCCCCCCCCl 7a_200000033068_100000764215 [0,2,0,0,0,0|2,0,0]=4 11930 B18R0.189 CON(C)C(=O)CSCCCCCCCCCCO 62a_100000764215_200000033068 [0,2,0,0,0,0|2,0,0]=4 11931 B18R0.189 CON(C)C(=O)CSCCCCCCCCCCO 62a_100009813290_100000764215 [0,2,0,0,0,0|2,0,0]=4 11932 B18R0.189 CSC(C)C(=O)CCCCCCCCCCCCO 1458a_100000149566_100009813331 [0,2,0,0,0,0|1,1,0]=4 11933 B18R0.189 O=C(CCCCCCCCCCCCO)C(O)CO 1458a_100011215603_100009813331 [0,2,0,0,0,0|2,0,0]=4 11934 B18R0.1436 C#CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100011220946_100009812566 [0,2,0,0,0,0|0,0,2]=4 11935 B18R0.1436 C#CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100016987261_100000184674 [0,2,0,0,0,0|0,0,2]=4 11936 B18R0.1436 C#CCC(C)OCCCCCCCCCC(=O)OC 34a_100000685586_100009813843 [0,2,0,0,0,0|0,0,2]=4 11937 B18R0.1436 C#CCC(C)OCCCCCCCCCC(=O)OC 7a_100000685586_100009813843 [0,2,0,0,0,0|0,0,2]=4 11938 B18R0.1436 C#CCN(C)CCCCCCCCCCC(=O)OC 2230a_100000225692_100009812566 [0,2,0,0,0,0|0,0,2]=4 11939 B18R0.1436 C#CCN(C)CCCCCCCCCCC(=O)OC 34a_100000225692_100009812566 [0,2,0,0,0,0|0,0,2]=4 11940 B18R0.1436 C/C=C/C(C)OCCCCCCCCCC(=O)OC 34a_200102604097_100009813843 [0,2,0,0,0,0|0,0,2]=4 11941 B18R0.1436 C=CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100000210193_100009812566 [0,2,0,0,0,0|0,0,2]=4 11942 B18R0.1436 C=CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100016987261_100000210623 [0,2,0,0,0,0|0,0,2]=4 11943 B18R0.1436 C=CCC(C)COCCCCCCCCC(=O)OC 34a_100009832082_100010282707 [0,2,0,0,0,0|0,0,2]=4 11944 B18R0.1436 C=CCC(C)COCCCCCCCCC(=O)OC 7a_100009832082_100010282707 [0,2,0,0,0,0|0,0,2]=4 11945 B18R0.1436 C=CCN(C)CCCCCCCCCCC(=O)OC 2230a_100000225617_100009812566 [0,2,0,0,0,0|0,0,2]=4 11946 B18R0.1436 C=CCN(C)CCCCCCCCCCC(=O)OC 269982a_100000225617_100009812566 [0,2,0,0,0,0|0,0,2]=4 11947 B18R0.1436 C=CC[C@@H](C)OCCCCCCCCCC(=O)OC 34a_100000731007_100009813843 [0,2,0,0,0,0|0,0,2]=4 11948 B18R0.1436 C=CC[C@@H](C)OCCCCCCCCCC(=O)OC 7a_100000731007_100009813843 [0,2,0,0,0,0|0,0,2]=4 11949 B18R0.1436 C=CC[C@@H](N)COCCCCCCCCC(=O)OC 34a_100020615467_100010282707 [0,2,0,0,0,0|0,0,2]=4 11950 B18R0.1436 CC#CC(=O)CCCCCCCCCCC(=O)OC 1458a_100000763181_100009812566 [0,2,0,0,0,0|0,0,2]=4 11951 B18R0.1436 CC#CC(C)OCCCCCCCCCC(=O)OC 34a_100011216543_100009813843 [0,2,0,0,0,0|0,0,2]=4 11952 B18R0.1436 CC=CC(=O)CCCCCCCCCCC(=O)OC 1458a_100000210699_100009812566 [0,2,0,0,0,0|0,0,2]=4 11953 B18R0.1436 CCCC(=O)CCCCCCCCCCC(=O)OC 1458a_100000211992_100009812566 [0,2,0,0,0,0|0,0,0]=2 11954 B18R0.1436 CCCC(=O)CCCCCCCCCCC(=O)OC 1458a_100016987261_100000210303 [0,2,0,0,0,0|0,0,0]=2 11955 B18R0.1436 CCCC(=O)COCCCCCCCCC(=O)OC 7a_100000035544_100000747444 [0,2,0,0,0,0|0,0,1]=3 11956 B18R0.1436 CCCC(=O)CSCCCCCCCCC(=O)OC 62a_100000747444_100010282707 [0,2,0,0,0,0|0,0,1]=3 11957 B18R0.1436 CCCC(=O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000747444 [0,2,0,0,0,0|0,0,1]=3 11958 B18R0.1436 CCCC(=O)OCOCCCCCCCC(=O)OC 34a_100011022521_100000034017 [0,2,0,0,0,0|1,0,1]=4 11959 B18R0.1436 CCCC(=O)OCSCCCCCCCC(=O)OC 62a_100010004213_100000034017 [0,2,0,0,0,0|1,0,1]=4 11960 B18R0.1436 CCCC(C)CCCOCCCCCCC(=O)OC 34a_100011713154_100009815986 [0,2,0,0,0,0|0,0,0]=2 11961 B18R0.1436 CCCC(C)CCCOCCCCCCC(=O)OC 7a_100011713154_100009815986 [0,2,0,0,0,0|0,0,0]=2 11962 B18R0.1436 CCCC(C)CCOCCCCCCCC(=O)OC 34a_100011217855_100010004213 [0,2,0,0,0,0|0,0,0]=2 11963 B18R0.1436 CCCC(C)CCOCCCCCCCC(=O)OC 7a_100011217855_100010004213 [0,2,0,0,0,0|0,0,0]=2 11964 B18R0.1436 CCCC(C)COCCCCCCCCC(=O)OC 34a_100000035544_100011216630 [0,2,0,0,0,0|0,0,0]=2 11965 B18R0.1436 CCCC(C)COCCCCCCCCC(=O)OC 34a_100000688023_100010282707 [0,2,0,0,0,0|0,0,0]=2 11966 B18R0.1436 CCCC(C)COCCCCCCCCC(=O)OC 7a_100000035544_100011216630 [0,2,0,0,0,0|0,0,0]=2 11967 B18R0.1436 CCCC(C)COCCCCCCCCC(=O)OC 7a_100000688023_100010282707 [0,2,0,0,0,0|0,0,0]=2 11968 B18R0.1436 CCCC(C)COCCOCCOCCC(=O)OC 34a_100010982084_100011216630 [0,2,0,0,0,0|2,0,0]=4 11969 B18R0.1436 CCCC(C)COCCOCCOCCC(=O)OC 7a_100010982084_100011216630 [0,2,0,0,0,0|2,0,0]=4 11970 B18R0.1436 CCCC(C)CSCCCCCCCCC(=O)OC 62a_100010282707_100011216630 [0,2,0,0,0,0|0,0,0]=2 11971 B18R0.1436 CCCC(C)CSCCCCCCCCC(=O)OC 62a_100011216630_100010282707 [0,2,0,0,0,0|0,0,0]=2 11972 B18R0.1436 CCCC(C)NCCCCCCCCCC(=O)OC 2230a_100000741246_100009813843 [0,2,0,0,0,0|0,0,0]=2 11973 B18R0.1436 CCCC(C)OCCCCCCCCCC(=O)OC 34a_100000764384_100009813843 [0,2,0,0,0,0|0,0,0]=2 11974 B18R0.1436 CCCC(C)OCCCCCCCCCC(=O)OC 7a_100000764384_100009813843 [0,2,0,0,0,0|0,0,0]=2 11975 B18R0.1436 CCCC(C)SCCCCCCCCCC(=O)OC 62a_100000766640_100009813843 [0,2,0,0,0,0|0,0,0]=2 11976 B18R0.1436 CCCN(C)CCCCCCCCCCC(=O)OC 2230a_100000747261_100009812566 [0,2,0,0,0,0|0,0,0]=2 11977 B18R0.1436 CCCN(C)CCCCCCCCCCC(=O)OC 269982a_100000747261_100009812566 [0,2,0,0,0,0|0,0,0]=2 11978 B18R0.1436 CCC[C@H](N)CCOCCCCCCCC(=O)OC 34a_100015193777_100010004213 [0,2,0,0,0,0|0,0,0]=2 11979 B18R0.1436 CCC[C@H](N)COCCCCCCCCC(=O)OC 34a_100000732646_100010282707 [0,2,0,0,0,0|0,0,0]=2 11980 B18R0.1436 CCNC(=O)CCCCCCCCCCC(=O)OC 11a_100015525214_100016987261 [0,2,0,0,0,0|0,0,1]=3 11981 B18R0.1436 CCNC(=O)CCCCCCCCCCC(=O)OC 240690a_100015525214_100016987261 [0,2,0,0,0,0|0,0,1]=3 11982 B18R0.1436 CCNC(=O)CCNCCCCCCCC(=O)OC 34a_100025743525_100010004213 [0,2,0,0,0,0|1,0,1]=4 11983 B18R0.1436 CCNC(=O)CCOCCCCCCCC(=O)OC 7a_100011022521_100000737597 [0,2,0,0,0,0|1,0,1]=4 11984 B18R0.1436 CCNC(=O)CCSCCCCCCCC(=O)OC 62a_100000737597_100010004213 [0,2,0,0,0,0|1,0,1]=4 11985 B18R0.1436 CCNC(=O)CCSCCCCCCCC(=O)OC 62a_100010004213_100000737597 [0,2,0,0,0,0|1,0,1]=4 11986 B18R0.1436 CCNC(=O)CNCCCCCCCCC(=O)OC 2230a_100016988866_100010282707 [0,2,0,0,0,0|1,0,1]=4 11987 B18R0.1436 CCNC(=O)COCCCCCCCCC(=O)OC 34a_100000035544_100000183381 [0,2,0,0,0,0|1,0,1]=4 11988 B18R0.1436 CCNC(=O)COCCCCCCCCC(=O)OC 7a_100000035544_100000183381 [0,2,0,0,0,0|1,0,1]=4 11989 B18R0.1436 CCNC(=O)CSCCCCCCCCC(=O)OC 62a_100000183381_100010282707 [0,2,0,0,0,0|1,0,1]=4 11990 B18R0.1436 CCNC(=O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000183381 [0,2,0,0,0,0|1,0,1]=4 11991 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CC 1458a_100000210414_100009827693 [0,2,0,0,0,0|0,0,1]=3 11992 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CC 1458a_200020656980_100000210202 [0,2,0,0,0,0|0,0,1]=3 11993 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CF 1458a_200020656980_100015361967 [0,2,0,0,0,0|1,0,1]=4 11994 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CO 1458a_100000210174_100009827693 [0,2,0,0,0,0|1,0,1]=4 11995 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)NC 11a_106832991635_200020656980 [0,2,0,0,0,0|1,0,1]=4 11996 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)NC 1626a_100102657272_200020656980 [0,2,0,0,0,0|1,0,1]=4 11997 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)NC 240690a_100102657272_200020656980 [0,2,0,0,0,0|1,0,1]=4 11998 B18R0.1436 CCOC(=O)CCCCCCCCCCN(C)CC 2230a_100000225621_100009827693 [0,2,0,0,0,0|1,0,0]=3 11999 B18R0.1436 CCOC(=O)CCCCCCCCCCN(C)CC 269982a_100000225621_100009827693 [0,2,0,0,0,0|1,0,0]=3 12000 B18R0.1436 CCOC(=O)CCCCCCCCCNC(C)CC 2230a_100000209981_100009828014 [0,2,0,0,0,0|1,0,0]=3 12001 B18R0.1436 CCOC(=O)CCCCCCCCCN[C@H](C)CO 2230a_100000737577_100009828014 [0,2,0,0,0,0|2,0,0]=4 12002 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CC 7a_100000210228_100009828014 [0,2,0,0,0,0|1,0,0]=3 12003 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CF 34a_100016041109_100009828014 [0,2,0,0,0,0|2,0,0]=4 12004 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CF 7a_100016041109_100009828014 [0,2,0,0,0,0|2,0,0]=4 12005 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CN 34a_100000210904_100009828014 [0,2,0,0,0,0|2,0,0]=4 12006 B18R0.1436 CCOC(=O)CCCCCCCCCSC(C)CC 62a_100000758301_100009828014 [0,2,0,0,0,0|1,0,0]=3 12007 B18R0.1436 CCOC(=O)CCCCCCCCCSC(C)CO 62a_100012180447_100009828014 [0,2,0,0,0,0|2,0,0]=4 12008 B18R0.1436 CCOC(=O)CCCCCCCCCSC(C)OC 62a_100009879195_100009828014 [0,2,0,0,0,0|2,0,0]=4 12009 B18R0.1436 CCOC(=O)CCCCCCCCCS[C@H](C)CO 62a_100016084084_100009828014 [0,2,0,0,0,0|2,0,0]=4 12010 B18R0.1436 CCOC(=O)CCCCCCCCNCC(C)CC 2230a_100020588543_100010175975 [0,2,0,0,0,0|1,0,0]=3 12011 B18R0.1436 CCOC(=O)CCCCCCCCNCC(C)CO 34a_100000744482_100010175975 [0,2,0,0,0,0|2,0,0]=4 12012 B18R0.1436 CCOC(=O)CCCCCCCCNCC(O)CC 2230a_100011218483_100010175975 [0,2,0,0,0,0|1,0,0]=3 12013 B18R0.1436 CCOC(=O)CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100010175975 [0,2,0,0,0,0|2,0,0]=4 12014 B18R0.1436 CCOC(=O)CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100010175975 [0,2,0,0,0,0|2,0,0]=4 12015 B18R0.1436 CCOC(=O)CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100010175975 [0,2,0,0,0,0|2,0,0]=4 12016 B18R0.1436 CCOC(=O)CCCCCCCCOCC(=O)CC 34a_100000725409_100010175975 [0,2,0,0,0,0|1,0,1]=4 12017 B18R0.1436 CCOC(=O)CCCCCCCCOCC(C)CN 34a_100000744482_100010175975 [0,2,0,0,0,0|2,0,0]=4 12018 B18R0.1436 CCOC(=O)CCCCCCCCOCC(C)OC 34a_100000690652_100010175975 [0,2,0,0,0,0|2,0,0]=4 12019 B18R0.1436 CCOC(=O)CCCCCCCCOCC(Cl)CCl 34a_100000033668_100010175975 [0,2,0,0,0,0|2,0,0]=4 12020 B18R0.1436 CCOC(=O)CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100010175975 [0,2,0,0,0,0|1,0,0]=3 12021 B18R0.1436 CCOC(=O)CCCCCCCCOC[C@H](F)CN 34a_100015665980_100010175975 [0,2,0,0,0,0|2,0,0]=4 12022 B18R0.1436 CCOC(=O)CCCCCCCCSCC(=O)CC 62a_100000747405_100010175975 [0,2,0,0,0,0|1,0,1]=4 12023 B18R0.1436 CCOC(=O)CCCCCCCCSCC(=O)OC 62a_100000747449_100010175975 [0,2,0,0,0,0|1,0,1]=4 12024 B18R0.1436 CCOC(=O)CCCCCCCCSCC(C)CC 62a_100000748023_100010175975 [0,2,0,0,0,0|1,0,0]=3 12025 B18R0.1436 CCOC(=O)CCCCCCCCSCC(O)CC 62a_100011218378_100010175975 [0,2,0,0,0,0|1,0,0]=3 12026 B18R0.1436 CCOC(=O)CCCCCCCCSCC(O)CO 62a_100011219619_100010175975 [0,2,0,0,0,0|2,0,0]=4 12027 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](C)CC 62a_100009816398_100010175975 [0,2,0,0,0,0|1,0,0]=3 12028 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100010175975 [0,2,0,0,0,0|2,0,0]=4 12029 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](O)CF 62a_100015614560_100010175975 [0,2,0,0,0,0|2,0,0]=4 12030 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100010175975 [0,2,0,0,0,0|2,0,0]=4 12031 B18R0.1436 CCOC(=O)CCCCCCCNCCC(C)CC 2230a_100020591266_100009991516 [0,2,0,0,0,0|1,0,0]=3 12032 B18R0.1436 CCOC(=O)CCCCCCCNCCC(C)CO 2230a_106354213184_100009991516 [0,2,0,0,0,0|2,0,0]=4 12033 B18R0.1436 CCOC(=O)CCCCCCCNCCC(C)CO 34a_106354213184_100009991516 [0,2,0,0,0,0|2,0,0]=4 12034 B18R0.1436 CCOC(=O)CCCCCCCOCCC(C)CC 7a_100011215188_100009991516 [0,2,0,0,0,0|1,0,0]=3 12035 B18R0.1436 CCOC(=O)CCCCCCCOCCC(C)OC 7a_100000764861_100009991516 [0,2,0,0,0,0|2,0,0]=4 12036 B18R0.1436 CCOC(=O)CCCCCCCSCCC(=O)OC 62a_100000204255_100009991516 [0,2,0,0,0,0|1,0,1]=4 12037 B18R0.1436 CCOC(=O)CCCCCCOCCCC(C)CC 7a_100011216074_100009814379 [0,2,0,0,0,0|1,0,0]=3 12038 B18R0.1436 CCOC(=O)CCCCCCOCCC[C@@H](C)CN 34a_100160569302_100009814379 [0,2,0,0,0,0|2,0,0]=4 12039 B18R0.1436 CCOC(=O)CCCCCCSCCCC(=O)OC 62a_100011218270_100009814379 [0,2,0,0,0,0|1,0,1]=4 12040 B18R0.1436 CCOC(=O)CCCCCOCCCCC(=O)OC 34a_100000059025_100000755133 [0,2,0,0,0,0|1,0,1]=4 12041 B18R0.1436 CCOC(=O)CCCCCOCCCCC(=O)OC 7a_100000059025_100000755133 [0,2,0,0,0,0|1,0,1]=4 12042 B18R0.1436 CCOC(=O)CCCCCOCCCCC(=O)OC 7a_100011214988_100000204269 [0,2,0,0,0,0|1,0,1]=4 12043 B18R0.1436 CCOC(=O)CCCCCSCCCCC(=O)OC 62a_100000204269_100000755133 [0,2,0,0,0,0|1,0,1]=4 12044 B18R0.1436 CCOC(=O)CCCCCSCCCCC(=O)OC 62a_100000755133_100000204269 [0,2,0,0,0,0|1,0,1]=4 12045 B18R0.1436 CCOC(=O)CCCCOCCCCCC(=O)OC 34a_100000074720_100000750268 [0,2,0,0,0,0|1,0,1]=4 12046 B18R0.1436 CCOC(=O)CCCCOCCCCCC(=O)OC 7a_100000074720_100000750268 [0,2,0,0,0,0|1,0,1]=4 12047 B18R0.1436 CCOC(=O)CCCCOCCCCCC(C)CC 7a_200000035636_100000750268 [0,2,0,0,0,0|1,0,0]=3 12048 B18R0.1436 CCOC(=O)CCCCSCCCCCC(=O)OC 62a_100000750268_100009816466 [0,2,0,0,0,0|1,0,1]=4 12049 B18R0.1436 CCOC(=O)CCCCSCCCCCC(=O)OC 62a_100009816466_100000750268 [0,2,0,0,0,0|1,0,1]=4 12050 B18R0.1436 CCOC(=O)CCCOCCCCCCC(=O)OC 34a_100009863599_100009991533 [0,2,0,0,0,0|1,0,1]=4 12051 B18R0.1436 CCOC(=O)CCCOCCCCCCC(=O)OC 7a_100009863599_100011215271 [0,2,0,0,0,0|1,0,1]=4 12052 B18R0.1436 CCOC(=O)CCCOCCCCCCC(=O)OC 7a_100012001163_100009815986 [0,2,0,0,0,0|1,0,1]=4 12053 B18R0.1436 CCOC(=O)CCCSCCCCCCC(=O)OC 62a_100009815986_100009991533 [0,2,0,0,0,0|1,0,1]=4 12054 B18R0.1436 CCOC(=O)CCCSCCCCCCC(=O)OC 62a_100009991533_100009815986 [0,2,0,0,0,0|1,0,1]=4 12055 B18R0.1436 CCOC(=O)CCOCCCCCCCC(=O)OC 34a_100011022521_100000765890 [0,2,0,0,0,0|1,0,1]=4 12056 B18R0.1436 CCOC(=O)CCOCCCCCCCC(=O)OC 7a_100011022521_100011206558 [0,2,0,0,0,0|1,0,1]=4 12057 B18R0.1436 CCOC(=O)CCSCCCCCCCC(=O)OC 62a_100000765890_100010004213 [0,2,0,0,0,0|1,0,1]=4 12058 B18R0.1436 CCOC(=O)CCSCCCCCCCC(=O)OC 62a_100010004213_100000765890 [0,2,0,0,0,0|1,0,1]=4 12059 B18R0.1436 CCOC(=O)COCCCCCCCCC(=O)OC 34a_100000035544_100000188475 [0,2,0,0,0,0|1,0,1]=4 12060 B18R0.1436 CCOC(=O)COCCCCCCCCC(=O)OC 7a_100000035544_100000188475 [0,2,0,0,0,0|1,0,1]=4 12061 B18R0.1436 CCOC(=O)COCCOCCCCCC(C)CC 7a_200000035636_100000088970 [0,2,0,0,0,0|2,0,0]=4 12062 B18R0.1436 CCOC(=O)CSCCCCCCCCC(=O)OC 62a_100000188475_100010282707 [0,2,0,0,0,0|1,0,1]=4 12063 B18R0.1436 CCOC(=O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000188475 [0,2,0,0,0,0|1,0,1]=4 12064 B18R0.1436 COC(=O)CCCCCCCCCCC(=O)CC#N 1458a_100016987261_100011214920 [0,2,0,0,0,0|0,0,2]=4 12065 B18R0.1436 COC(=O)CCCCCCCCCCC(=O)CC#N 1458a_100051588842_100009812566 [0,2,0,0,0,0|0,0,2]=4 12066 B18R0.1436 COC(=O)CCCCCCCCCCC(=O)CCF 1458a_100016987261_100011217306 [0,2,0,0,0,0|0,0,1]=3 12067 B18R0.1436 COC(=O)CCCCCCCCCCC(=O)CCO 1458a_100011216618_100009812566 [0,2,0,0,0,0|0,0,1]=3 12068 B18R0.1436 COC(=O)CCCCCCCCCCC(=O)CCO 1458a_100016987261_100000211926 [0,2,0,0,0,0|0,0,1]=3 12069 B18R0.1436 COC(=O)CCCCCCCCCCC(=O)CSC 1458a_100000184570_100009812566 [0,2,0,0,0,0|0,0,1]=3 12070 B18R0.1436 COC(=O)CCCCCCCCCCN(C)CC#N 2230a_100000748184_100009812566 [0,2,0,0,0,0|1,0,1]=4 12071 B18R0.1436 COC(=O)CCCCCCCCCCN(C)CCO 2230a_100000210263_100009812566 [0,2,0,0,0,0|1,0,0]=3 12072 B18R0.1436 COC(=O)CCCCCCCCCCN(C)CCO 269982a_100000210263_100009812566 [0,2,0,0,0,0|1,0,0]=3 12073 B18R0.1436 COC(=O)CCCCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100009813843 [0,2,0,0,0,0|1,0,1]=4 12074 B18R0.1436 COC(=O)CCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100009813843 [0,2,0,0,0,0|1,0,0]=3 12075 B18R0.1436 COC(=O)CCCCCCCCCN[C@H](C)CCO 34a_100000706166_100009813843 [0,2,0,0,0,0|1,0,0]=3 12076 B18R0.1436 COC(=O)CCCCCCCCCOC(C)CCBr 34a_100012276601_100009813843 [0,2,0,0,0,0|1,0,0]=3 12077 B18R0.1436 COC(=O)CCCCCCCCCSC(C)CC#N 62a_100009813641_100009813843 [0,2,0,0,0,0|1,0,1]=4 12078 B18R0.1436 COC(=O)CCCCCCCCCSC(C)CCO 62a_100009893172_100009813843 [0,2,0,0,0,0|1,0,0]=3 12079 B18R0.1436 COC(=O)CCCCCCCCOCC(C)CCN 34a_106354213184_100010282707 [0,2,0,0,0,0|1,0,0]=3 12080 B18R0.1436 COC(=O)CCCCCCCCOC[C@@H](O)CC#N 7a_100000035544_100000001066 [0,2,0,0,0,0|1,0,1]=4 12081 B18R0.1436 COC(=O)CCCCCCCCSC[C@@H](O)CC#N 62a_100000001066_100010282707 [0,2,0,0,0,0|1,0,1]=4 12082 B18R0.1436 COC(=O)CCCCCCCCSC[C@@H](O)CC#N 62a_100010282707_100000001066 [0,2,0,0,0,0|1,0,1]=4 12083 B18R0.1436 COCC(=O)CCCCCCCCCCC(=O)OC 1458a_100000210968_100009812566 [0,2,0,0,0,0|0,0,1]=3 12084 B18R0.1436 COCC(C)SCCCCCCCCCC(=O)OC 62a_100000765312_100009813843 [0,2,0,0,0,0|1,0,0]=3 12085 B18R0.1436 COCC(N)COCCCCCCCCC(=O)OC 34a_100000724102_100010282707 [0,2,0,0,0,0|1,0,0]=3 12086 B18R0.1436 COCC(O)CNCCCCCCCCC(=O)OC 2230a_100000756049_100010282707 [0,2,0,0,0,0|1,0,0]=3 12087 B18R0.1436 COCC(O)CNCCCCCCCCC(=O)OC 34a_100000756049_100010282707 [0,2,0,0,0,0|1,0,0]=3 12088 B18R0.1436 COCC(O)COCCCCCCCCC(=O)OC 34a_100000035544_100011215053 [0,2,0,0,0,0|1,0,0]=3 12089 B18R0.1436 COCC(O)COCCCCCCCCC(=O)OC 7a_100000035544_100011215053 [0,2,0,0,0,0|1,0,0]=3 12090 B18R0.1436 COCC(O)CSCCCCCCCCC(=O)OC 62a_100010282707_100011215053 [0,2,0,0,0,0|1,0,0]=3 12091 B18R0.1436 COCC(O)CSCCCCCCCCC(=O)OC 62a_100011215053_100010282707 [0,2,0,0,0,0|1,0,0]=3 12092 B18R0.1436 COC[C@@H](C)NCCCCCCCCCC(=O)OC 2230a_100000764878_100009813843 [0,2,0,0,0,0|1,0,0]=3 12093 B18R0.1436 COC[C@@H](C)OCCCCCCCCCC(=O)OC 34a_100011934205_100009813843 [0,2,0,0,0,0|1,0,0]=3 12094 B18R0.7795 C=CCCCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100009814027 [0,2,0,0,0,0|0,0,2]=4 12095 B18R0.7795 C=CCCCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100009814027 [0,2,0,0,0,0|0,0,2]=4 12096 B18R0.7795 CCCCCCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100011215454 [0,2,0,0,0,0|1,0,0]=3 12097 B18R0.7795 CCCCCCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100011215454 [0,2,0,0,0,0|0,0,0]=2 12098 B18R0.7795 CCCCCCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100011215454 [0,2,0,0,0,0|2,0,0]=4 12099 B18R0.7795 CCCCCCCCCCCC(=O)CNC(=O)CC 1458a_100000194589_100011215454 [0,2,0,0,0,0|1,0,1]=4 12100 B18R0.7795 CCCCCCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100011215454 [0,2,0,0,0,0|0,0,1]=3 12101 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)CC 1458a_100001278556_100000210202 [0,2,0,0,0,0|1,0,1]=4 12102 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)NC 11a_100000693194_100000210736 [0,2,0,0,0,0|1,0,1]=4 12103 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)NC 11a_106832991635_100001278556 [0,2,0,0,0,0|1,0,1]=4 12104 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)NC 1626a_100102657272_100001278556 [0,2,0,0,0,0|1,0,1]=4 12105 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)NC 240690a_100000693194_100000210736 [0,2,0,0,0,0|1,0,1]=4 12106 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)NC 240690a_100102657272_100001278556 [0,2,0,0,0,0|1,0,1]=4 12107 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000210736 [0,2,0,0,0,0|0,0,1]=3 12108 B18R0.7795 CCCCCCCCCCCC(=O)OCC(=O)CC 1458a_100000210414_100020644155 [0,2,0,0,0,0|1,0,1]=4 12109 B18R0.7795 CCCCCCCCCCCC(C)NCC(=O)NC 270004a_100000693194_100011216755 [0,2,0,0,0,0|1,0,0]=3 12110 B18R0.7795 CCCCCCCCCCCC(C)NC[C@@H](C)OC 270004a_100020591295_100011216755 [0,2,0,0,0,0|1,0,1]=4 12111 B18R0.7795 CCCCCCCCCCCC(C)OCC(=O)CC 7a_100011217895_100000747405 [0,2,0,0,0,0|1,0,0]=3 12112 B18R0.7795 CCCCCCCCCCCC(C)OCC(=O)NC 34a_100011217895_100000183359 [0,2,0,0,0,0|1,0,0]=3 12113 B18R0.7795 CCCCCCCCCCCC(C)OCC(=O)NC 7a_100011217895_100000183359 [0,2,0,0,0,0|1,0,0]=3 12114 B18R0.7795 CCCCCCCCCCCC(C)OCC(=O)OC 34a_100011217895_100000747449 [0,2,0,0,0,0|0,0,0]=2 12115 B18R0.7795 CCCCCCCCCCCC(C)OCC(=O)OC 7a_100011217895_100000747449 [0,2,0,0,0,0|0,0,0]=2 12116 B18R0.7795 CCCCCCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100011215454 [0,2,0,0,0,0|1,0,0]=3 12117 B18R0.7795 CCCCCCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100011215454 [0,2,0,0,0,0|1,0,0]=3 12118 B18R0.7795 CCCCCCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100011215454 [0,2,0,0,0,0|0,0,0]=2 12119 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)NC 11a_100000684558_100011309844 [0,2,0,0,0,0|1,0,1]=4 12120 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)NC 1626a_100000684558_100011309844 [0,2,0,0,0,0|1,0,1]=4 12121 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)NC 240690a_100000684558_100011309844 [0,2,0,0,0,0|1,0,1]=4 12122 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)NC 527a_100000684558_100011309844 [0,2,0,0,0,0|1,0,1]=4 12123 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)OC 11a_100000684558_100000187943 [0,2,0,0,0,0|0,0,1]=3 12124 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)OC 1626a_100000684558_100000187943 [0,2,0,0,0,0|0,0,1]=3 12125 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)OC 240690a_100000684558_100000187943 [0,2,0,0,0,0|0,0,1]=3 12126 B18R0.7795 CCCCCCCCCCNC(=O)CCC(=O)OC 527a_100000684558_100000187943 [0,2,0,0,0,0|0,0,1]=3 12127 B18R0.7795 CCCCCCCCCCNC(=O)CNC(=O)OC 11a_100000684558_100000215747 [0,2,0,0,0,0|1,0,1]=4 12128 B18R0.7795 CCCCCCCCCCNC(=O)CNC(=O)OC 1626a_100000684558_100000215747 [0,2,0,0,0,0|1,0,1]=4 12129 B18R0.7795 CCCCCCCCCCNC(=O)CNC(=O)OC 240690a_100000684558_100000215747 [0,2,0,0,0,0|1,0,1]=4 12130 B18R0.7795 CCCCCCCCCCNC(=O)CNC(=O)OC 527a_100000684558_100000215747 [0,2,0,0,0,0|1,0,1]=4 12131 B18R0.7795 CCCCCCCCCNCC(=O)CCC(=O)OC 2230a_100000212291_100000691467 [0,2,0,0,0,0|0,0,1]=3 12132 B18R0.7795 CCCCCCCCCNCC(=O)CCC(=O)OC 34a_100000212291_100000691467 [0,2,0,0,0,0|0,0,1]=3 12133 B18R0.7795 CCCCCCCCCNCC(=O)NCC(=O)OC 2230a_100000212291_100000182966 [0,2,0,0,0,0|1,0,1]=4 12134 B18R0.7795 CCCCCCCCCNCC(=O)NCC(=O)OC 34a_100000212291_100000182966 [0,2,0,0,0,0|1,0,1]=4 12135 B18R0.7795 CCCCCCCCCOCC(=O)CCC(=O)OC 34a_100000210712_100000691467 [0,2,0,0,0,0|0,0,1]=3 12136 B18R0.7795 CCCCCCCCCOCC(=O)CCC(=O)OC 7a_100000210712_100000691467 [0,2,0,0,0,0|0,0,1]=3 12137 B18R0.7795 CCCCCCCCCOCC(=O)NCC(=O)OC 34a_100000210712_100000182966 [0,2,0,0,0,0|1,0,1]=4 12138 B18R0.7795 CCCCCCCCCOCC(=O)NCC(=O)OC 7a_100000210712_100000182966 [0,2,0,0,0,0|1,0,1]=4 12139 B18R0.7795 CCCCCCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210670 [0,2,0,0,0,0|0,0,1]=3 12140 B18R0.7795 CCCCCCCCCSCC(=O)NCC(=O)OC 62a_100000182966_100000210670 [0,2,0,0,0,0|1,0,1]=4 12141 B18R0.7795 CCCCCCOCCOCC(=O)CCC(=O)OC 34a_100000691444_100000691467 [0,2,0,0,0,0|1,0,1]=4 12142 B18R0.7795 CCCCCCOCCOCC(=O)CCC(=O)OC 7a_100000691444_100000691467 [0,2,0,0,0,0|1,0,1]=4 12143 B18R0.7795 CCCCNCCCCOCC(=O)CCC(=O)OC 34a_200011216965_100000691467 [0,2,0,0,0,0|1,0,1]=4 12144 B18R0.7795 CCCCOCCCCOCC(=O)CCC(=O)OC 34a_200000760531_100000691467 [0,2,0,0,0,0|1,0,1]=4 12145 B18R0.7795 CCCCOCCCCOCC(=O)CCC(=O)OC 7a_200000760531_100000691467 [0,2,0,0,0,0|1,0,1]=4 12146 B18R0.7795 CNC(=O)CCC(=O)CCCCCCCCCCO 1458a_100011309844_100009813290 [0,2,0,0,0,0|1,0,1]=4 12147 B18R0.7795 CNC(=O)CCN(C)CCCCCCCCCCO 2230a_100000750875_100009813290 [0,2,0,0,0,0|2,0,0]=4 12148 B18R0.7795 CNC(=O)CCN(C)CCCCCCCCCCO 269982a_100000750875_100009813290 [0,2,0,0,0,0|2,0,0]=4 12149 B18R0.7795 COC(=O)CCC(=O)CCCCCCCCCCO 1458a_100000187943_100009813290 [0,2,0,0,0,0|0,0,1]=3 12150 B18R0.7795 COC(=O)CCC(=O)CNCCCCCCCCO 2230a_102515433106_100000691467 [0,2,0,0,0,0|1,0,1]=4 12151 B18R0.7795 COC(=O)CCC(=O)CNCCCCCCCCO 34a_102515433106_100000691467 [0,2,0,0,0,0|1,0,1]=4 12152 B18R0.7795 COC(=O)CCC(=O)COCCCCCCCCBr 34a_100009813846_100000691467 [0,2,0,0,0,0|1,0,1]=4 12153 B18R0.7795 COC(=O)CCC(=O)COCCCCCCCCBr 7a_100009813846_100000691467 [0,2,0,0,0,0|1,0,1]=4 12154 B18R0.7795 COC(=O)CCC(=O)COCCCCCCCCCl 34a_100000033203_100000691467 [0,2,0,0,0,0|1,0,1]=4 12155 B18R0.7795 COC(=O)CCC(=O)COCCCCCCCCCl 7a_100000033203_100000691467 [0,2,0,0,0,0|1,0,1]=4 12156 B18R0.7795 COC(=O)CCC(=O)COCCCCCCCCN 34a_102515433106_100000691467 [0,2,0,0,0,0|1,0,1]=4 12157 B18R0.7795 COC(=O)CCC(=O)CSCCCCCCCCO 62a_100000033203_100000691467 [0,2,0,0,0,0|1,0,1]=4 12158 B18R0.7795 COC(=O)CCC(=O)CSCCCCCCCCO 62a_100000691467_100000033203 [0,2,0,0,0,0|1,0,1]=4 12159 B18R0.7795 COC(=O)CCC(=O)NCCCCCCCCCO 240690a_100000078944_100000187943 [0,2,0,0,0,0|1,0,1]=4 12160 B18R0.7795 COC(=O)CCN(C)CCCCCCCCCCO 269982a_100025711912_100009813290 [0,2,0,0,0,0|1,0,0]=3 12161 B18R0.7795 COC(=O)CNC(=O)CCCCCCCCCCO 188690a_100000185156_200000016029 [0,2,0,0,0,0|1,0,1]=4 12162 B18R0.7795 COC(=O)NCC(=O)CCCCCCCCCCO 1458a_100000215747_100009813290 [0,2,0,0,0,0|1,0,1]=4 12163 B18R0.15765 C#CC(=O)CCCCCCCCCCCC(=O)OC 1458a_100000211873_100010983606 [0,2,0,0,0,0|0,0,2]=4 12164 B18R0.15765 C#CC(C)NCCCCCCCCCCC(=O)OC 2230a_100000707721_100009812566 [0,2,0,0,0,0|1,0,0]=3 12165 B18R0.15765 C#CC(C)NCCCCCCCCCCC(=O)OC 34a_100000707721_100009812566 [0,2,0,0,0,0|1,0,0]=3 12166 B18R0.15765 C#CC(C)OCCCCCCCCCCC(=O)OC 34a_100011003013_200000035995 [0,2,0,0,0,0|1,0,0]=3 12167 B18R0.15765 C#CC(C)SCCCCCCCCCCC(=O)OC 62a_200000035995_100009812566 [0,2,0,0,0,0|1,0,0]=3 12168 B18R0.15765 C#CC(O)CCCCCOCCCCCC(=O)OC 34a_100000074720_200010408556 [0,2,0,0,0,0|0,0,2]=4 12169 B18R0.15765 C#CC(O)CCCCCOCCCCCC(=O)OC 7a_100000074720_200010408556 [0,2,0,0,0,0|0,0,2]=4 12170 B18R0.15765 C#CC(O)CCCCCSCCCCCC(=O)OC 62a_100009816466_200010408556 [0,2,0,0,0,0|0,0,2]=4 12171 B18R0.15765 C#CC(O)CCCCCSCCCCCC(=O)OC 62a_200010408556_100009816466 [0,2,0,0,0,0|0,0,2]=4 12172 B18R0.15765 C#C[C@@H](C)OCCCCCCCCCCC(=O)OC 34a_100009815206_100009812566 [0,2,0,0,0,0|1,0,0]=3 12173 B18R0.15765 C#C[C@@H](C)OCCCCCCCCCCC(=O)OC 7a_100009815206_100009812566 [0,2,0,0,0,0|1,0,0]=3 12174 B18R0.15765 C=CC(=O)CCCCCCCCCCCC(=O)OC 1458a_100000185746_100010983606 [0,2,0,0,0,0|0,0,2]=4 12175 B18R0.15765 C=CC(C)COCCCCCCCCCC(=O)OC 34a_100011215527_100009813843 [0,2,0,0,0,0|1,0,0]=3 12176 B18R0.15765 C=CC(C)COCCCCCCCCCC(=O)OC 7a_100011215527_100009813843 [0,2,0,0,0,0|1,0,0]=3 12177 B18R0.15765 C=CC(C)OCCCCCCCCCCC(=O)OC 34a_100000695699_100009812566 [0,2,0,0,0,0|1,0,0]=3 12178 B18R0.15765 C=CC(C)SCCCCCCCCCCC(=O)OC 62a_100011215867_100009812566 [0,2,0,0,0,0|1,0,0]=3 12179 B18R0.15765 C=CC(O)CSCCCCCCCCCC(=O)OC 62a_100000730141_100009813843 [0,2,0,0,0,0|0,0,2]=4 12180 B18R0.15765 C=C[C@H](N)COCCCCCCCCCC(=O)OC 34a_100016989147_100009813843 [0,2,0,0,0,0|0,0,2]=4 12181 B18R0.15765 CCC(=O)CCCCCCCCCCCC(=O)OC 1458a_100000210414_100010983606 [0,2,0,0,0,0|0,0,0]=2 12182 B18R0.15765 CCC(=O)COCCCCCCCCCC(=O)OC 34a_100000725409_100009813843 [0,2,0,0,0,0|0,0,1]=3 12183 B18R0.15765 CCC(=O)CSCCCCCCCCCC(=O)OC 62a_100000747405_100009813843 [0,2,0,0,0,0|0,0,1]=3 12184 B18R0.15765 CCC(=O)NCCCCCCCCCCC(=O)OC 188690a_202495363284_100000210414 [0,2,0,0,0,0|0,0,1]=3 12185 B18R0.15765 CCC(=O)NCCNCCCCCCCC(=O)OC 34a_100132302217_100010004213 [0,2,0,0,0,0|1,0,1]=4 12186 B18R0.15765 CCC(=O)NCCOCCCCCCCC(=O)OC 34a_200000158885_100010004213 [0,2,0,0,0,0|1,0,1]=4 12187 B18R0.15765 CCC(=O)NCCOCCCCCCCC(=O)OC 7a_200000158885_100010004213 [0,2,0,0,0,0|1,0,1]=4 12188 B18R0.15765 CCC(=O)OCCOCCCCCCCC(=O)OC 7a_200000031056_100010004213 [0,2,0,0,0,0|1,0,1]=4 12189 B18R0.15765 CCC(C)CCCCCOCCCCCC(=O)OC 7a_200000035636_100009816466 [0,2,0,0,0,0|0,0,0]=2 12190 B18R0.15765 CCC(C)CCCOCCCCCCCC(=O)OC 7a_100011216074_100010004213 [0,2,0,0,0,0|0,0,0]=2 12191 B18R0.15765 CCC(C)CCNCCCCCCCCC(=O)OC 2230a_100020591266_100010282707 [0,2,0,0,0,0|0,0,0]=2 12192 B18R0.15765 CCC(C)CCOCCCCCCCCC(=O)OC 7a_100011215188_100010282707 [0,2,0,0,0,0|0,0,0]=2 12193 B18R0.15765 CCC(C)CNCCCCCCCCCC(=O)OC 2230a_100020588543_100009813843 [0,2,0,0,0,0|0,0,0]=2 12194 B18R0.15765 CCC(C)CSCCCCCCCCCC(=O)OC 62a_100000748023_100009813843 [0,2,0,0,0,0|0,0,0]=2 12195 B18R0.15765 CCC(C)NCCCCCCCCCCC(=O)OC 2230a_100000209981_100009812566 [0,2,0,0,0,0|0,0,0]=2 12196 B18R0.15765 CCC(C)NN=CCCCCCCCCC(=O)OC 4a_100000718999_200010166605 [0,2,0,0,0,0|1,0,1]=4 12197 B18R0.15765 CCC(C)OCCCCCCCCCCC(=O)OC 34a_100011003013_100011215416 [0,2,0,0,0,0|0,0,0]=2 12198 B18R0.15765 CCC(C)OCCCCCCCCCCC(=O)OC 7a_100000210228_100009812566 [0,2,0,0,0,0|0,0,0]=2 12199 B18R0.15765 CCC(C)OCCCCCCCCCCC(=O)OC 7a_100011003013_100000758301 [0,2,0,0,0,0|0,0,0]=2 12200 B18R0.15765 CCC(C)SCCCCCCCCCCC(=O)OC 62a_100000758301_100009812566 [0,2,0,0,0,0|0,0,0]=2 12201 B18R0.15765 CCC(O)CNCCCCCCCCCC(=O)OC 2230a_100011218483_100009813843 [0,2,0,0,0,0|0,0,0]=2 12202 B18R0.15765 CCC(O)CSCCCCCCCCCC(=O)OC 62a_100011218378_100009813843 [0,2,0,0,0,0|0,0,0]=2 12203 B18R0.15765 CCN(C)CCCCCCCCCCCC(=O)OC 2230a_100000225621_100010983606 [0,2,0,0,0,0|0,0,0]=2 12204 B18R0.15765 CCN(C)CCCCCCCCCCCC(=O)OC 269982a_100000225621_100010983606 [0,2,0,0,0,0|0,0,0]=2 12205 B18R0.15765 CCN(C)CCCOCCCCCCCC(=O)OC 7a_100011022521_100015186262 [0,2,0,0,0,0|1,0,0]=3 12206 B18R0.15765 CCN(C)CCCSCCCCCCCC(=O)OC 62a_100010004213_100015186262 [0,2,0,0,0,0|1,0,0]=3 12207 B18R0.15765 CC[C@H](C)COCCCCCCCCCC(=O)OC 7a_100009816381_100009813843 [0,2,0,0,0,0|0,0,0]=2 12208 B18R0.15765 CC[C@H](C)CSCCCCCCCCCC(=O)OC 62a_100009816398_100009813843 [0,2,0,0,0,0|0,0,0]=2 12209 B18R0.15765 CNC(=O)CCCNCCCCCCCC(=O)OC 2230a_100000740002_100010004213 [0,2,0,0,0,0|1,0,1]=4 12210 B18R0.15765 CNC(=O)CCCNCCCCCCCC(=O)OC 34a_100000740002_100010004213 [0,2,0,0,0,0|1,0,1]=4 12211 B18R0.15765 CNC(=O)CCCOCCCCCCCC(=O)OC 34a_100011022521_100000741757 [0,2,0,0,0,0|1,0,1]=4 12212 B18R0.15765 CNC(=O)CCCOCCCCCCCC(=O)OC 7a_100011022521_100000741757 [0,2,0,0,0,0|1,0,1]=4 12213 B18R0.15765 CNC(=O)CCCSCCCCCCCC(=O)OC 62a_100000741757_100010004213 [0,2,0,0,0,0|1,0,1]=4 12214 B18R0.15765 CNC(=O)CCCSCCCCCCCC(=O)OC 62a_100010004213_100000741757 [0,2,0,0,0,0|1,0,1]=4 12215 B18R0.15765 CNC(=O)CCNCCCCCCCCC(=O)OC 2230a_100000738227_100010282707 [0,2,0,0,0,0|1,0,1]=4 12216 B18R0.15765 CNC(=O)CCNCCCCCCCCC(=O)OC 34a_100000738227_100010282707 [0,2,0,0,0,0|1,0,1]=4 12217 B18R0.15765 CNC(=O)CCOCCCCCCCCC(=O)OC 34a_100000035544_100012179268 [0,2,0,0,0,0|1,0,1]=4 12218 B18R0.15765 CNC(=O)CCOCCCCCCCCC(=O)OC 34a_100000754576_100010282707 [0,2,0,0,0,0|1,0,1]=4 12219 B18R0.15765 CNC(=O)CCOCCCCCCCCC(=O)OC 7a_100000035544_100000737683 [0,2,0,0,0,0|1,0,1]=4 12220 B18R0.15765 CNC(=O)CCSCCCCCCCCC(=O)OC 62a_100000737683_100010282707 [0,2,0,0,0,0|1,0,1]=4 12221 B18R0.15765 CNC(=O)CCSCCCCCCCCC(=O)OC 62a_100010282707_100000737683 [0,2,0,0,0,0|1,0,1]=4 12222 B18R0.15765 CNC(=O)CNCCCCCCCCCC(=O)OC 2230a_100000693194_100009813843 [0,2,0,0,0,0|1,0,1]=4 12223 B18R0.15765 CNC(=O)COCCCCCCCCCC(=O)OC 34a_100000750040_100009813843 [0,2,0,0,0,0|1,0,1]=4 12224 B18R0.15765 CNC(=O)CSCCCCCCCCCC(=O)OC 62a_100000183359_100009813843 [0,2,0,0,0,0|1,0,1]=4 12225 B18R0.15765 COC(=O)CCCCCCCCCCCC(=O)CO 1458a_100000210174_100010983606 [0,2,0,0,0,0|0,0,1]=3 12226 B18R0.15765 COC(=O)CCCCCCCCCCNC(=O)CO 188690a_202495363284_100000210174 [0,2,0,0,0,0|1,0,1]=4 12227 B18R0.15765 COC(=O)CCCCCCCCCCNC(C)C#N 2230a_100000737613_100009812566 [0,2,0,0,0,0|1,0,0]=3 12228 B18R0.15765 COC(=O)CCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100009812566 [0,2,0,0,0,0|1,0,0]=3 12229 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)C#N 34a_100011218135_100009812566 [0,2,0,0,0,0|1,0,0]=3 12230 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)C#N 7a_100011003013_100000703298 [0,2,0,0,0,0|1,0,0]=3 12231 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)CF 34a_100016041109_100009812566 [0,2,0,0,0,0|1,0,0]=3 12232 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)CF 7a_100016041109_100009812566 [0,2,0,0,0,0|1,0,0]=3 12233 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)CN 34a_100000210904_100009812566 [0,2,0,0,0,0|1,0,0]=3 12234 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)CO 34a_100011003013_100012180447 [0,2,0,0,0,0|1,0,0]=3 12235 B18R0.15765 COC(=O)CCCCCCCCCCOC(C)CO 7a_100011003013_100012180447 [0,2,0,0,0,0|1,0,0]=3 12236 B18R0.15765 COC(=O)CCCCCCCCCCSC(C)C#N 62a_100000703298_100009812566 [0,2,0,0,0,0|1,0,0]=3 12237 B18R0.15765 COC(=O)CCCCCCCCCCSC(C)CO 62a_100012180447_100009812566 [0,2,0,0,0,0|1,0,0]=3 12238 B18R0.15765 COC(=O)CCCCCCCCCCSC(C)OC 62a_100009879195_100009812566 [0,2,0,0,0,0|1,0,0]=3 12239 B18R0.15765 COC(=O)CCCCCCCCCCSC(F)C#N 62a_200000117898_100009812566 [0,2,0,0,0,0|1,0,1]=4 12240 B18R0.15765 COC(=O)CCCCCCCCCCS[C@H](C)CO 62a_100016084084_100009812566 [0,2,0,0,0,0|1,0,0]=3 12241 B18R0.15765 COC(=O)CCCCCCCCCNCC(C)CO 34a_100000744482_100009813843 [0,2,0,0,0,0|1,0,0]=3 12242 B18R0.15765 COC(=O)CCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100009813843 [0,2,0,0,0,0|1,0,0]=3 12243 B18R0.15765 COC(=O)CCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100009813843 [0,2,0,0,0,0|1,0,0]=3 12244 B18R0.15765 COC(=O)CCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100009813843 [0,2,0,0,0,0|1,0,0]=3 12245 B18R0.15765 COC(=O)CCCCCCCCCOCC(C)CN 34a_100000744482_100009813843 [0,2,0,0,0,0|1,0,0]=3 12246 B18R0.15765 COC(=O)CCCCCCCCCOCC(C)OC 34a_100000690652_100009813843 [0,2,0,0,0,0|1,0,0]=3 12247 B18R0.15765 COC(=O)CCCCCCCCCOCC(Cl)CCl 34a_100000033668_100009813843 [0,2,0,0,0,0|1,0,0]=3 12248 B18R0.15765 COC(=O)CCCCCCCCCOC[C@H](F)CN 34a_100015665980_100009813843 [0,2,0,0,0,0|1,0,0]=3 12249 B18R0.15765 COC(=O)CCCCCCCCCSCC(=O)OC 62a_100000747449_100009813843 [0,2,0,0,0,0|1,0,1]=4 12250 B18R0.15765 COC(=O)CCCCCCCCCSCC(O)CO 62a_100011219619_100009813843 [0,2,0,0,0,0|1,0,0]=3 12251 B18R0.15765 COC(=O)CCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100009813843 [0,2,0,0,0,0|1,0,0]=3 12252 B18R0.15765 COC(=O)CCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100009813843 [0,2,0,0,0,0|1,0,0]=3 12253 B18R0.15765 COC(=O)CCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100009813843 [0,2,0,0,0,0|1,0,0]=3 12254 B18R0.15765 COC(=O)CCCCCCCCNCCC(C)CO 2230a_106354213184_100010282707 [0,2,0,0,0,0|1,0,0]=3 12255 B18R0.15765 COC(=O)CCCCCCCCNCCC(C)CO 34a_106354213184_100010282707 [0,2,0,0,0,0|1,0,0]=3 12256 B18R0.15765 COC(=O)CCCCCCCCOCCC(=O)OC 34a_100000035544_100000742370 [0,2,0,0,0,0|1,0,1]=4 12257 B18R0.15765 COC(=O)CCCCCCCCOCCC(=O)OC 7a_100000035544_100000204255 [0,2,0,0,0,0|1,0,1]=4 12258 B18R0.15765 COC(=O)CCCCCCCCOCCC(C)OC 7a_100000764861_100010282707 [0,2,0,0,0,0|1,0,0]=3 12259 B18R0.15765 COC(=O)CCCCCCCCSCCC(=O)OC 62a_100000204255_100010282707 [0,2,0,0,0,0|1,0,1]=4 12260 B18R0.15765 COC(=O)CCCCCCCCSCCC(=O)OC 62a_100010282707_100000204255 [0,2,0,0,0,0|1,0,1]=4 12261 B18R0.15765 COC(=O)CCCCCCCOCCCC(=O)OC 34a_100011022521_100000742333 [0,2,0,0,0,0|1,0,1]=4 12262 B18R0.15765 COC(=O)CCCCCCCOCCCC(=O)OC 7a_100011022521_100011218270 [0,2,0,0,0,0|1,0,1]=4 12263 B18R0.15765 COC(=O)CCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100010004213 [0,2,0,0,0,0|1,0,0]=3 12264 B18R0.15765 COC(=O)CCCCCCCSCCCC(=O)OC 62a_100010004213_100011218270 [0,2,0,0,0,0|1,0,1]=4 12265 B18R0.15765 COC(=O)CCCCCCCSCCCC(=O)OC 62a_100011218270_100010004213 [0,2,0,0,0,0|1,0,1]=4 12266 B18R0.15765 COC(=O)CCCCCCOCCCCC(=O)OC 34a_100000059025_100009815986 [0,2,0,0,0,0|1,0,1]=4 12267 B18R0.15765 COC(=O)CCCCCCOCCCCC(=O)OC 34a_100009863599_100000204269 [0,2,0,0,0,0|1,0,1]=4 12268 B18R0.15765 COC(=O)CCCCCCOCCCCC(=O)OC 7a_100000059025_100009815986 [0,2,0,0,0,0|1,0,1]=4 12269 B18R0.15765 COC(=O)CCCCCCOCCCCC(=O)OC 7a_100009863599_100000204269 [0,2,0,0,0,0|1,0,1]=4 12270 B18R0.15765 COC(=O)CCCCCCSCCCCC(=O)OC 62a_100000204269_100009815986 [0,2,0,0,0,0|1,0,1]=4 12271 B18R0.15765 COC(=O)CCCCCCSCCCCC(=O)OC 62a_100009815986_100000204269 [0,2,0,0,0,0|1,0,1]=4 12272 B18R0.15765 COC(=O)CCCCCOCCCCCC(=O)OC 34a_100000074720_100009816466 [0,2,0,0,0,0|1,0,1]=4 12273 B18R0.15765 COC(=O)CCCCCOCCCCCC(=O)OC 7a_100000074720_100009816466 [0,2,0,0,0,0|1,0,1]=4 12274 B18R0.15765 COC(=O)CCCCCSCCCCCC(=O)OC 62a_100009816466_100009816466 [0,2,0,0,0,0|1,0,1]=4 12275 B18R0.17427 C#CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000029693_100011218270 [0,2,0,0,0,0|0,0,2]=4 12276 B18R0.17427 C=CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000211349_100011218270 [0,2,0,0,0,0|0,0,2]=4 12277 B18R0.17427 C=CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100011933949 [0,2,0,0,0,0|0,0,2]=4 12278 B18R0.17427 C=CCCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100011933949 [0,2,0,0,0,0|0,0,2]=4 12279 B18R0.17427 CC#CCCCCCCCC(=O)CCCC(=O)OC 1458a_100000066323_100011218270 [0,2,0,0,0,0|0,0,2]=4 12280 B18R0.17427 CCC#CCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_200000036426 [0,2,0,0,0,0|0,0,2]=4 12281 B18R0.17427 CCC#CCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_200000036426 [0,2,0,0,0,0|0,0,2]=4 12282 B18R0.17427 CCCCCCCCC=CC(=O)CCCC(=O)OC 1458a_100015345288_100011218270 [0,2,0,0,0,0|0,0,2]=4 12283 B18R0.17427 CCCCCCCCCCC(=O)CCCC(=O)NC 1458a_100000210375_100000741757 [0,2,0,0,0,0|1,0,0]=3 12284 B18R0.17427 CCCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000210375_100011218270 [0,2,0,0,0,0|0,0,0]=2 12285 B18R0.17427 CCCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210319 [0,2,0,0,0,0|0,0,0]=2 12286 B18R0.17427 CCCCCCCCCCC(=O)CCOC(=O)NC 1458a_100000210375_200011997002 [0,2,0,0,0,0|1,0,1]=4 12287 B18R0.17427 CCCCCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210319 [0,2,0,0,0,0|0,0,1]=3 12288 B18R0.17427 CCCCCCCCCCC(=O)NCCC(=O)NC 11a_100000738227_100000210375 [0,2,0,0,0,0|1,0,1]=4 12289 B18R0.17427 CCCCCCCCCCC(=O)NCCC(=O)NC 240690a_100000738227_100000210375 [0,2,0,0,0,0|1,0,1]=4 12290 B18R0.17427 CCCCCCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000210375 [0,2,0,0,0,0|0,0,1]=3 12291 B18R0.17427 CCCCCCCCCCC(C)NCCC(=O)NC 270004a_100000738227_200011219864 [0,2,0,0,0,0|1,0,0]=3 12292 B18R0.17427 CCCCCCCCCCC(C)OCCC(=O)NC 34a_100011215000_100012179268 [0,2,0,0,0,0|1,0,0]=3 12293 B18R0.17427 CCCCCCCCCCC(C)OCCC(=O)NC 7a_100011215000_100000737683 [0,2,0,0,0,0|1,0,0]=3 12294 B18R0.17427 CCCCCCCCCCC(C)OCCC(=O)OC 34a_100011215000_100000742370 [0,2,0,0,0,0|0,0,0]=2 12295 B18R0.17427 CCCCCCCCCCC(C)OCCC(=O)OC 7a_100011215000_100000204255 [0,2,0,0,0,0|0,0,0]=2 12296 B18R0.17427 CCCCCCCCCCN(C)C/C=C/C(=O)OC 2230a_100000207566_100000742655 [0,2,0,0,0,0|0,0,2]=4 12297 B18R0.17427 CCCCCCCCCCN(C)C/C=C/C(=O)OC 269982a_100000207566_100000742655 [0,2,0,0,0,0|0,0,2]=4 12298 B18R0.17427 CCCCCCCCCCN(C)CCCC(=O)NC 2230a_100000207566_100000741757 [0,2,0,0,0,0|1,0,0]=3 12299 B18R0.17427 CCCCCCCCCCN(C)CCCC(=O)NC 269982a_100000207566_100000741757 [0,2,0,0,0,0|1,0,0]=3 12300 B18R0.17427 CCCCCCCCCCN(C)CCCC(=O)OC 2230a_100000207566_100011218270 [0,2,0,0,0,0|0,0,0]=2 12301 B18R0.17427 CCCCCCCCCCN(C)CCCC(=O)OC 269982a_100000207566_100011218270 [0,2,0,0,0,0|0,0,0]=2 12302 B18R0.17427 CCCCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210320 [0,2,0,0,0,0|0,0,0]=2 12303 B18R0.17427 CCCCCCCCCCN(C)CCOC(=O)NC 269982a_100000207566_200011997002 [0,2,0,0,0,0|2,0,0]=4 12304 B18R0.17427 CCCCCCCCCNC(=O)CCCC(=O)OC 11a_100000212291_100000239890 [0,2,0,0,0,0|0,0,1]=3 12305 B18R0.17427 CCCCCCCCCNC(=O)CCCC(=O)OC 1626a_100000212291_100000239890 [0,2,0,0,0,0|0,0,1]=3 12306 B18R0.17427 CCCCCCCCCNC(=O)CCCC(=O)OC 240690a_100000212291_100000239890 [0,2,0,0,0,0|0,0,1]=3 12307 B18R0.17427 CCCCCCCCCNC(=O)CCCC(=O)OC 527a_100000212291_100000239890 [0,2,0,0,0,0|0,0,1]=3 12308 B18R0.17427 CCCCCCCCCNC(=O)CSCC(=O)OC 11a_100000212291_100000191316 [0,2,0,0,0,0|1,0,1]=4 12309 B18R0.17427 CCCCCCCCCNC(=O)CSCC(=O)OC 1626a_100000212291_100000191316 [0,2,0,0,0,0|1,0,1]=4 12310 B18R0.17427 CCCCCCCCCNC(=O)CSCC(=O)OC 240690a_100000212291_100000191316 [0,2,0,0,0,0|1,0,1]=4 12311 B18R0.17427 CCCCCCCCNCC(=O)NCCC(=O)OC 2230a_100000229939_100000230212 [0,2,0,0,0,0|1,0,1]=4 12312 B18R0.17427 CCCCCCCCNCC(=O)NCCC(=O)OC 34a_100000229939_100000230212 [0,2,0,0,0,0|1,0,1]=4 12313 B18R0.17427 CCCCCCCCOCC(=O)CCCC(=O)NC 1458a_100000759886_100000741757 [0,2,0,0,0,0|1,0,1]=4 12314 B18R0.17427 CCCCCCCCOCC(=O)CCCC(=O)OC 1458a_100000759886_100011218270 [0,2,0,0,0,0|0,0,1]=3 12315 B18R0.17427 CCCCCCCCOCC(=O)NCCC(=O)OC 188690a_100000683876_100000759886 [0,2,0,0,0,0|1,0,1]=4 12316 B18R0.17427 CCCCCCCCOCC(=O)NCCC(=O)OC 34a_100000210232_100000230212 [0,2,0,0,0,0|1,0,1]=4 12317 B18R0.17427 CCCCCCCCOCC(=O)NCCC(=O)OC 7a_100000210232_100000230212 [0,2,0,0,0,0|1,0,1]=4 12318 B18R0.17427 CCCCCCCCSCC(=O)NCCC(=O)OC 62a_100000210759_100000230212 [0,2,0,0,0,0|1,0,1]=4 12319 B18R0.17427 CCCCCCCCSCC(=O)NCCC(=O)OC 62a_100000230212_100000210317 [0,2,0,0,0,0|1,0,1]=4 12320 B18R0.17427 CNC(=O)CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000741757 [0,2,0,0,0,0|1,0,1]=4 12321 B18R0.17427 COC(=O)CCCC(=O)CCCCCCCCCF 1458a_200009909015_100011218270 [0,2,0,0,0,0|0,0,1]=3 12322 B18R0.17427 COC(=O)CCCC(=O)CCCCCCCCCO 1458a_100000239890_100009813782 [0,2,0,0,0,0|0,0,1]=3 12323 B18R0.17427 COC(=O)CCCC(=O)NCCCCCCCCO 240690a_102515433106_100000239890 [0,2,0,0,0,0|1,0,1]=4 12324 B18R0.17427 COC(=O)CCCN(C)CCCCCCCCCO 269982a_100000739225_100009813782 [0,2,0,0,0,0|1,0,0]=3 12325 B18R0.17427 COC(=O)CCNC(=O)CCCCCCCCCF 188690a_100000683876_200009909015 [0,2,0,0,0,0|1,0,1]=4 12326 B18R0.17427 COC(=O)CCNC(=O)CCCCCCCCCO 188690a_100000683876_100000032657 [0,2,0,0,0,0|1,0,1]=4 12327 B18R0.17427 COC(=O)CSCC(=O)CCCCCCCCCO 1458a_100000191316_100009813782 [0,2,0,0,0,0|1,0,1]=4 12328 B18R0.19358 CCCCCCCCCCCCCNS(=O)(=O)CC 270084a_100011215765_100000211323 [0,2,0,0,0,0|2,0,0]=4 12329 B18R0.19358 CCCCCCCCCCCCCNS(=O)(=O)CC 274078a_100011215765_100000211323 [0,2,0,0,0,0|2,0,0]=4 12330 B18R0.19358 CCCCCCCCCCCCCNS(=O)(=O)CC 40a_100011215765_100000053943 [0,2,0,0,0,0|2,0,0]=4 12331 B18R0.19358 CCCCCCCCCCCCNCC(C)(C)OC 2230a_100000763424_100011215052 [0,2,0,0,0,0|1,0,1]=4 12332 B18R0.19358 CCCCCCCCCCCCNCC(C)(C)OC 270004a_100000763424_100011218549 [0,2,0,0,0,0|1,0,1]=4 12333 B18R0.19358 CCCCCCCCCCCCNCC(C)(C)OC 34a_100000210451_100000701081 [0,2,0,0,0,0|1,0,1]=4 12334 B18R0.19358 CCCCCCCCCCCCOCC(C)(C)OC 34a_100000210810_100000701081 [0,2,0,0,0,0|1,0,1]=4 12335 B18R0.19358 CCCCCCCCCCCNCCS(=O)(=O)CC 2230a_100000751051_100011215454 [0,2,0,0,0,0|2,0,0]=4 12336 B18R0.19358 CCCCCCCCCCCNCCS(=O)(=O)CC 2230a_200011215754_100000756660 [0,2,0,0,0,0|2,0,0]=4 12337 B18R0.19358 CCCCCCCCCCCNCCS(=O)(=O)CC 34a_100000751051_100011215454 [0,2,0,0,0,0|2,0,0]=4 12338 B18R0.19358 CCCCCCCCCCCNCCS(=O)(=O)CC 34a_200011215754_100000756660 [0,2,0,0,0,0|2,0,0]=4 12339 B18R0.19358 CCCCCCCCCCCNCCS(=O)(=O)NC 2230a_100000710037_100011215454 [0,2,0,0,0,0|2,0,0]=4 12340 B18R0.19358 CCCCCCCCCCCNCCS(=O)(=O)NC 34a_100000710037_100011215454 [0,2,0,0,0,0|2,0,0]=4 12341 B18R0.19358 CCCCCCCCCCCOCCC(C)(C)OC 7a_100000699976_100011215454 [0,2,0,0,0,0|1,0,1]=4 12342 B18R0.19358 CCCCCCCCCCCOCCS(=O)(=O)CC 34a_100000210809_100000756660 [0,2,0,0,0,0|2,0,0]=4 12343 B18R0.19358 CCCCCCCCCCCOCCS(=O)(=O)CC 34a_200011216379_100011215454 [0,2,0,0,0,0|2,0,0]=4 12344 B18R0.19358 CCCCCCCCCCCOCCS(=O)(=O)CC 7a_100000210809_100000756660 [0,2,0,0,0,0|2,0,0]=4 12345 B18R0.19358 CCCCCCCCCCCOCCS(=O)(=O)CC 7a_200011216379_100011215454 [0,2,0,0,0,0|2,0,0]=4 12346 B18R0.19358 CCCCCCCCCCCSCCS(=O)(=O)CC 62a_100000756660_100011215454 [0,2,0,0,0,0|2,0,0]=4 12347 B18R0.19859 C#CCCC(=O)CCCCCCCCCC(=O)OC 1458a_100000692101_100009813843 [0,2,0,0,0,0|0,0,2]=4 12348 B18R0.19859 C#CCCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000753159 [0,2,0,0,0,0|0,0,2]=4 12349 B18R0.19859 C/C=C/CC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100102629194 [0,2,0,0,0,0|0,0,2]=4 12350 B18R0.19859 C=CCCC(=O)CCCCCCCCCC(=O)OC 1458a_100000749702_100009813843 [0,2,0,0,0,0|0,0,2]=4 12351 B18R0.19859 C=CCCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000754431 [0,2,0,0,0,0|0,0,2]=4 12352 B18R0.19859 C=CCCC(C)OCCCCCCCCC(=O)OC 34a_100000765329_100010282707 [0,2,0,0,0,0|0,0,2]=4 12353 B18R0.19859 C=CCCC(C)OCCCCCCCCC(=O)OC 7a_100000765329_100010282707 [0,2,0,0,0,0|0,0,2]=4 12354 B18R0.19859 C=CCCN(C)CCCCCCCCCC(=O)OC 2230a_100020639649_100009813843 [0,2,0,0,0,0|0,0,2]=4 12355 B18R0.19859 C=CCCN(C)CCCCCCCCCC(=O)OC 269982a_100020639649_100009813843 [0,2,0,0,0,0|0,0,2]=4 12356 B18R0.19859 CC#CCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000748600 [0,2,0,0,0,0|0,0,2]=4 12357 B18R0.19859 CC=CCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000070051 [0,2,0,0,0,0|0,0,2]=4 12358 B18R0.19859 CC=CCC(=O)CCCCCCCCCC(=O)OC 1458a_100121576822_100009813843 [0,2,0,0,0,0|0,0,2]=4 12359 B18R0.19859 CCC#CC(=O)CCCCCCCCCC(=O)OC 1458a_100011827653_100009813843 [0,2,0,0,0,0|0,0,2]=4 12360 B18R0.19859 CCC#CC(C)OCCCCCCCCC(=O)OC 34a_100000033903_100010282707 [0,2,0,0,0,0|0,0,2]=4 12361 B18R0.19859 CCC#CC(C)OCCCCCCCCC(=O)OC 7a_100000033903_100010282707 [0,2,0,0,0,0|0,0,2]=4 12362 B18R0.19859 CCC=CC(=O)CCCCCCCCCC(=O)OC 1458a_100000212282_100009813843 [0,2,0,0,0,0|0,0,2]=4 12363 B18R0.19859 CCCCC(=O)CCCCCCCCCC(=O)OC 1458a_100000210183_100009813843 [0,2,0,0,0,0|0,0,0]=2 12364 B18R0.19859 CCCCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000210211 [0,2,0,0,0,0|0,0,0]=2 12365 B18R0.19859 CCCCC(C)CCCCOCCCCC(=O)OC 34a_200011021034_100000204269 [0,2,0,0,0,0|0,0,0]=2 12366 B18R0.19859 CCCCC(C)CCCCOCCCCC(=O)OC 7a_200011021034_100000204269 [0,2,0,0,0,0|0,0,0]=2 12367 B18R0.19859 CCCCC(C)CCCCOCCOCC(=O)OC 34a_200011021034_100000090808 [0,2,0,0,0,0|1,0,0]=3 12368 B18R0.19859 CCCCC(C)CCCCOCCOCC(=O)OC 7a_200011021034_100000090808 [0,2,0,0,0,0|1,0,0]=3 12369 B18R0.19859 CCCCC(C)COCCCCCCCC(=O)OC 34a_100011995851_100010004213 [0,2,0,0,0,0|0,0,0]=2 12370 B18R0.19859 CCCCC(C)COCCCCCCCC(=O)OC 7a_100011995851_100010004213 [0,2,0,0,0,0|0,0,0]=2 12371 B18R0.19859 CCCCC(C)NCCCCCCCCC(=O)OC 2230a_100000126638_100010282707 [0,2,0,0,0,0|0,0,0]=2 12372 B18R0.19859 CCCCC(C)OCCCCCCCCC(=O)OC 34a_100000035544_200011215066 [0,2,0,0,0,0|0,0,0]=2 12373 B18R0.19859 CCCCC(C)OCCCCCCCCC(=O)OC 34a_100000687866_100010282707 [0,2,0,0,0,0|0,0,0]=2 12374 B18R0.19859 CCCCC(C)OCCCCCCCCC(=O)OC 7a_100000035544_200011215066 [0,2,0,0,0,0|0,0,0]=2 12375 B18R0.19859 CCCCC(C)OCCCCCCCCC(=O)OC 7a_100000687866_100010282707 [0,2,0,0,0,0|0,0,0]=2 12376 B18R0.19859 CCCCC(C)OCCOCCOCCC(=O)OC 34a_100010982084_200011215066 [0,2,0,0,0,0|2,0,0]=4 12377 B18R0.19859 CCCCC(C)OCCOCCOCCC(=O)OC 7a_100010982084_200011215066 [0,2,0,0,0,0|2,0,0]=4 12378 B18R0.19859 CCCCC(C)SCCCCCCCCC(=O)OC 62a_100010282707_200011215066 [0,2,0,0,0,0|0,0,0]=2 12379 B18R0.19859 CCCCC(C)SCCCCCCCCC(=O)OC 62a_200011215066_100010282707 [0,2,0,0,0,0|0,0,0]=2 12380 B18R0.19859 CCCCN(C)CCCCCCCCCC(=O)OC 2230a_100000207549_100009813843 [0,2,0,0,0,0|0,0,0]=2 12381 B18R0.19859 CCCCN(C)CCCCCCCCCC(=O)OC 269982a_100000207549_100009813843 [0,2,0,0,0,0|0,0,0]=2 12382 B18R0.19859 CCCC[C@H](N)COCCCCCCCC(=O)OC 34a_100011934283_100010004213 [0,2,0,0,0,0|0,0,0]=2 12383 B18R0.19859 CCCNC(=O)CCCCCCCCCC(=O)OC 11a_100020643023_100009997464 [0,2,0,0,0,0|0,0,1]=3 12384 B18R0.19859 CCCNC(=O)CCCCCCCCCC(=O)OC 1626a_100020643023_100009997464 [0,2,0,0,0,0|0,0,1]=3 12385 B18R0.19859 CCCNC(=O)CCCCCCCCCC(=O)OC 240690a_100020643023_100009997464 [0,2,0,0,0,0|0,0,1]=3 12386 B18R0.19859 CCCNC(=O)CCCOCCCCCC(=O)OC 7a_100000074720_100011194427 [0,2,0,0,0,0|1,0,1]=4 12387 B18R0.19859 CCCNC(=O)CCCSCCCCCC(=O)OC 62a_100009816466_100011194427 [0,2,0,0,0,0|1,0,1]=4 12388 B18R0.19859 CCCNC(=O)CCCSCCCCCC(=O)OC 62a_100011194427_100009816466 [0,2,0,0,0,0|1,0,1]=4 12389 B18R0.19859 CCCNC(=O)CNCCCCCCCC(=O)OC 2230a_100000174927_100010004213 [0,2,0,0,0,0|1,0,1]=4 12390 B18R0.19859 CCCNC(=O)COCCCCCCCC(=O)OC 34a_100011022521_100000183358 [0,2,0,0,0,0|1,0,1]=4 12391 B18R0.19859 CCCNC(=O)COCCCCCCCC(=O)OC 7a_100011022521_100000183358 [0,2,0,0,0,0|1,0,1]=4 12392 B18R0.19859 CCCNC(=O)CSCCCCCCCC(=O)OC 62a_100000183358_100010004213 [0,2,0,0,0,0|1,0,1]=4 12393 B18R0.19859 CCCNC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_100000183358 [0,2,0,0,0,0|1,0,1]=4 12394 B18R0.19859 CCCOC(=O)COCCCCCCCC(=O)OC 34a_100011022521_200011215008 [0,2,0,0,0,0|1,0,1]=4 12395 B18R0.19859 CCCOC(=O)COCCCCCCCC(=O)OC 7a_100011022521_200011215008 [0,2,0,0,0,0|1,0,1]=4 12396 B18R0.19859 CCCOC(=O)CSCCCCCCCC(=O)OC 62a_100010004213_200011215008 [0,2,0,0,0,0|1,0,1]=4 12397 B18R0.19859 CCCOC(=O)CSCCCCCCCC(=O)OC 62a_200011215008_100010004213 [0,2,0,0,0,0|1,0,1]=4 12398 B18R0.19859 CCCOC(C)CNCCCCCCCC(=O)OC 2230a_100015185124_100010004213 [0,2,0,0,0,0|1,0,0]=3 12399 B18R0.19859 CCCOC(C)CNCCCCCCCC(=O)OC 34a_100015185124_100010004213 [0,2,0,0,0,0|1,0,0]=3 12400 B18R0.19859 CCOCC(=O)CCCCCCCCCC(=O)OC 1458a_100000211967_100009813843 [0,2,0,0,0,0|0,0,1]=3 12401 B18R0.19859 CCOCC(C)OCCCCCCCCC(=O)OC 34a_100000718985_100010282707 [0,2,0,0,0,0|1,0,0]=3 12402 B18R0.19859 CCOCC(C)OCCCCCCCCC(=O)OC 7a_100000718985_100010282707 [0,2,0,0,0,0|1,0,0]=3 12403 B18R0.19859 CCOCC(O)CNCCCCCCCC(=O)OC 2230a_102515437182_100010004213 [0,2,0,0,0,0|1,0,0]=3 12404 B18R0.19859 CCOCC(O)CNCCCCCCCC(=O)OC 34a_102515437182_100010004213 [0,2,0,0,0,0|1,0,0]=3 12405 B18R0.19859 CCSCC(=O)CCCCCCCCCC(=O)OC 1458a_100000230394_100009813843 [0,2,0,0,0,0|0,0,1]=3 12406 B18R0.19859 COC(=O)CCCCCCCCCC(=O)CCC#N 1458a_100009997464_100011215226 [0,2,0,0,0,0|0,0,2]=4 12407 B18R0.19859 COC(=O)CCCCCCCCCC(=O)CCC#N 1458a_100011934036_100009813843 [0,2,0,0,0,0|0,0,2]=4 12408 B18R0.19859 COC(=O)CCCCCCCCCC(=O)CCCF 1458a_100009997464_100011934791 [0,2,0,0,0,0|0,0,1]=3 12409 B18R0.19859 COC(=O)CCCCCCCCCC(=O)CCCO 1458a_100009997464_100011215043 [0,2,0,0,0,0|0,0,1]=3 12410 B18R0.19859 COC(=O)CCCCCCCCCC(=O)CCSC 1458a_100000174002_100009813843 [0,2,0,0,0,0|0,0,1]=3 12411 B18R0.19859 COC(=O)CCCCCCCCCC(=O)CCSC 1458a_100009997464_100000751147 [0,2,0,0,0,0|0,0,1]=3 12412 B18R0.19859 COC(=O)CCCCCCCCCC(=O)NCCF 11a_100000724931_100009997464 [0,2,0,0,0,0|1,0,1]=4 12413 B18R0.19859 COC(=O)CCCCCCCCCC(=O)NCCF 1626a_100000724931_100009997464 [0,2,0,0,0,0|1,0,1]=4 12414 B18R0.19859 COC(=O)CCCCCCCCCC(=O)NCCF 240690a_100000724931_100009997464 [0,2,0,0,0,0|1,0,1]=4 12415 B18R0.19859 COC(=O)CCCCCCCCCC(=O)NCCO 240690a_100000210304_100009997464 [0,2,0,0,0,0|1,0,1]=4 12416 B18R0.19859 COC(=O)CCCCCCCCCN(C)CCC#N 2230a_100000184479_100009813843 [0,2,0,0,0,0|1,0,1]=4 12417 B18R0.19859 COC(=O)CCCCCCCCCN(C)CCCO 2230a_100000213112_100009813843 [0,2,0,0,0,0|1,0,0]=3 12418 B18R0.19859 COC(=O)CCCCCCCCCN(C)CCCO 269982a_100000213112_100009813843 [0,2,0,0,0,0|1,0,0]=3 12419 B18R0.19859 COC(=O)CCCCCCCCCN(C)CCSC 2230a_100000686725_100009813843 [0,2,0,0,0,0|1,0,0]=3 12420 B18R0.19859 COC(=O)CCCCCCCCCN(C)CCSC 269982a_100000686725_100009813843 [0,2,0,0,0,0|1,0,0]=3 12421 B18R0.19859 COC(=O)CCCCCCCCOC(C)CCCCl 34a_200000718107_100010282707 [0,2,0,0,0,0|1,0,0]=3 12422 B18R0.19859 COC(=O)CCCCCCCCOC(C)CCCCl 7a_200000718107_100010282707 [0,2,0,0,0,0|1,0,0]=3 12423 B18R0.19859 COC(=O)CCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100010004213 [0,2,0,0,0,0|1,0,0]=3 12424 B18R0.19859 COC(=O)CCCCCCCNC[C@H](C)CCCO 34a_100160569302_100010004213 [0,2,0,0,0,0|1,0,0]=3 12425 B18R0.19859 COC(=O)CCCCCCCOC[C@@H](N)CCSC 34a_100011827619_100010004213 [0,2,0,0,0,0|1,0,0]=3 12426 B18R0.19859 COCCC(=O)CCCCCCCCCC(=O)OC 1458a_100000749529_100009813843 [0,2,0,0,0,0|0,0,1]=3 12427 B18R0.19859 COCCC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000233755 [0,2,0,0,0,0|0,0,1]=3 12428 B18R0.19859 COCCN(C)CCCCCCCCCC(=O)OC 2230a_100000743101_100009813843 [0,2,0,0,0,0|1,0,0]=3 12429 B18R0.19859 COCCN(C)CCCCCCCCCC(=O)OC 269982a_100000743101_100009813843 [0,2,0,0,0,0|1,0,0]=3 12430 B18R0.19859 COCO[C@H](C)COCCCCCCCC(=O)OC 34a_100016172286_100010004213 [0,2,0,0,0,0|2,0,0]=4 12431 B18R0.19859 COCO[C@H](C)COCCCCCCCC(=O)OC 7a_100016172286_100010004213 [0,2,0,0,0,0|2,0,0]=4 12432 B18R0.20486 C#CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000731252 [0,2,0,0,0,0|0,0,2]=4 12433 B18R0.20486 C#CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000690238_100010282707 [0,2,0,0,0,0|0,0,2]=4 12434 B18R0.20486 C=CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000757094 [0,2,0,0,0,0|0,0,2]=4 12435 B18R0.20486 C=CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000766728_100010282707 [0,2,0,0,0,0|0,0,2]=4 12436 B18R0.20486 CC/C=C/CC(=O)CCCCCCCCC(=O)OC 1458a_100016274230_100010282707 [0,2,0,0,0,0|0,0,2]=4 12437 B18R0.20486 CC/C=C\CC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100103147603 [0,2,0,0,0,0|0,0,2]=4 12438 B18R0.20486 CCC#CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100009813939 [0,2,0,0,0,0|0,0,2]=4 12439 B18R0.20486 CCC#CCC(C)OCCCCCCCC(=O)OC 34a_200000035118_100010004213 [0,2,0,0,0,0|0,0,2]=4 12440 B18R0.20486 CCC#CCC(C)OCCCCCCCC(=O)OC 7a_200000035118_100010004213 [0,2,0,0,0,0|0,0,2]=4 12441 B18R0.20486 CCCC#CC(=O)CCCCCCCCC(=O)OC 1458a_200011218047_100010282707 [0,2,0,0,0,0|0,0,2]=4 12442 B18R0.20486 CCCC=CC(=O)CCCCCCCCC(=O)OC 1458a_100000212230_100010282707 [0,2,0,0,0,0|0,0,2]=4 12443 B18R0.20486 CCCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210326 [0,2,0,0,0,0|0,0,0]=2 12444 B18R0.20486 CCCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000212188_100010282707 [0,2,0,0,0,0|0,0,0]=2 12445 B18R0.20486 CCCCCC(=O)CCOCCOCCC(=O)OC 1458a_200020673210_100000210326 [0,2,0,0,0,0|1,0,1]=4 12446 B18R0.20486 CCCCCC(=O)COCCCCCCC(=O)OC 34a_100009863599_200012276598 [0,2,0,0,0,0|0,0,1]=3 12447 B18R0.20486 CCCCCC(=O)COCCCCCCC(=O)OC 7a_100009863599_200012276598 [0,2,0,0,0,0|0,0,1]=3 12448 B18R0.20486 CCCCCC(=O)CSCCCCCCC(=O)OC 62a_100009815986_200012276598 [0,2,0,0,0,0|0,0,1]=3 12449 B18R0.20486 CCCCCC(=O)CSCCCCCCC(=O)OC 62a_200012276598_100009815986 [0,2,0,0,0,0|0,0,1]=3 12450 B18R0.20486 CCCCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000212188 [0,2,0,0,0,0|0,0,1]=3 12451 B18R0.20486 CCCCCC(C)NCCCCCCCC(=O)OC 2230a_100000211957_100010004213 [0,2,0,0,0,0|0,0,0]=2 12452 B18R0.20486 CCCCCC(C)OCCCCCCCC(=O)OC 34a_100011022521_200011218191 [0,2,0,0,0,0|0,0,0]=2 12453 B18R0.20486 CCCCCC(C)OCCCCCCCC(=O)OC 34a_100011215632_100010004213 [0,2,0,0,0,0|0,0,0]=2 12454 B18R0.20486 CCCCCC(C)OCCCCCCCC(=O)OC 7a_100011022521_200011218191 [0,2,0,0,0,0|0,0,0]=2 12455 B18R0.20486 CCCCCC(C)OCCCCCCCC(=O)OC 7a_100011215632_100010004213 [0,2,0,0,0,0|0,0,0]=2 12456 B18R0.20486 CCCCCC(C)OCCOCCOCC(=O)OC 34a_100011023656_200011218191 [0,2,0,0,0,0|2,0,0]=4 12457 B18R0.20486 CCCCCC(C)OCCOCCOCC(=O)OC 7a_100011023656_200011218191 [0,2,0,0,0,0|2,0,0]=4 12458 B18R0.20486 CCCCCC(C)SCCCCCCCC(=O)OC 62a_100010004213_200011218191 [0,2,0,0,0,0|0,0,0]=2 12459 B18R0.20486 CCCCCC(C)SCCCCCCCC(=O)OC 62a_200011218191_100010004213 [0,2,0,0,0,0|0,0,0]=2 12460 B18R0.20486 CCCCCN(C)CCCCCCCCC(=O)OC 2230a_100000223495_100010282707 [0,2,0,0,0,0|0,0,0]=2 12461 B18R0.20486 CCCCCN(C)CCCCCCCCC(=O)OC 269982a_100000223495_100010282707 [0,2,0,0,0,0|0,0,0]=2 12462 B18R0.20486 CCCCNC(=O)CCCCCCCCC(=O)OC 11a_100000102301_100000036616 [0,2,0,0,0,0|0,0,1]=3 12463 B18R0.20486 CCCCNC(=O)CCCCCCCCC(=O)OC 1626a_100000102301_100000036616 [0,2,0,0,0,0|0,0,1]=3 12464 B18R0.20486 CCCCNC(=O)CCCCCCCCC(=O)OC 240690a_100000102301_100000036616 [0,2,0,0,0,0|0,0,1]=3 12465 B18R0.20486 CCCCNC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000182744 [0,2,0,0,0,0|1,0,1]=4 12466 B18R0.20486 CCCCNC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000182744 [0,2,0,0,0,0|1,0,1]=4 12467 B18R0.20486 CCCCNC(=O)CSCCCCCCC(=O)OC 62a_100000182744_100009815986 [0,2,0,0,0,0|1,0,1]=4 12468 B18R0.20486 CCCCNC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000182744 [0,2,0,0,0,0|1,0,1]=4 12469 B18R0.20486 CCCCOC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000211628 [0,2,0,0,0,0|1,0,1]=4 12470 B18R0.20486 CCCCOC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000211628 [0,2,0,0,0,0|1,0,1]=4 12471 B18R0.20486 CCCCOC(=O)CSCCCCCCC(=O)OC 62a_100000211628_100009815986 [0,2,0,0,0,0|1,0,1]=4 12472 B18R0.20486 CCCCOC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000211628 [0,2,0,0,0,0|1,0,1]=4 12473 B18R0.20486 CCCOCC(=O)CCCCCCCCC(=O)OC 1458a_100000745993_100010282707 [0,2,0,0,0,0|0,0,1]=3 12474 B18R0.20486 CCCOCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000745993 [0,2,0,0,0,0|1,0,1]=4 12475 B18R0.20486 CCCSCC(=O)CCCCCCCCC(=O)OC 1458a_100000217233_100010282707 [0,2,0,0,0,0|0,0,1]=3 12476 B18R0.20486 CCCSCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000217233 [0,2,0,0,0,0|1,0,1]=4 12477 B18R0.20486 CCOCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100011215890 [0,2,0,0,0,0|0,0,1]=3 12478 B18R0.20486 CCOCCC(=O)CCCCCCCCC(=O)OC 1458a_100000749530_100010282707 [0,2,0,0,0,0|0,0,1]=3 12479 B18R0.20486 CCOCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000749530 [0,2,0,0,0,0|1,0,1]=4 12480 B18R0.20486 CCSCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000757381 [0,2,0,0,0,0|0,0,1]=3 12481 B18R0.20486 CCSCCC(=O)CCCCCCCCC(=O)OC 1458a_100000230768_100010282707 [0,2,0,0,0,0|0,0,1]=3 12482 B18R0.20486 CCSCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000230768 [0,2,0,0,0,0|1,0,1]=4 12483 B18R0.20486 COC(=O)CCCCCCCCC(=O)CCCC#N 1458a_100000036616_100000211468 [0,2,0,0,0,0|0,0,2]=4 12484 B18R0.20486 COC(=O)CCCCCCCCC(=O)CCCC#N 1458a_100000075515_100010282707 [0,2,0,0,0,0|0,0,2]=4 12485 B18R0.20486 COC(=O)CCCCCCCCC(=O)CCCCF 1458a_100000036616_100000729493 [0,2,0,0,0,0|0,0,1]=3 12486 B18R0.20486 COC(=O)CCCCCCCCC(=O)CCCCO 1458a_100000036616_100000210776 [0,2,0,0,0,0|0,0,1]=3 12487 B18R0.20486 COC(=O)CCCCCCCCC(=O)CCCCO 1458a_100000695505_100010282707 [0,2,0,0,0,0|0,0,1]=3 12488 B18R0.20486 COC(=O)CCCCCCCCC(=O)CCCSC 1458a_100000173376_100010282707 [0,2,0,0,0,0|0,0,1]=3 12489 B18R0.20486 COC(=O)CCCCCCCCC(=O)COCCO 1458a_100000708028_100010282707 [0,2,0,0,0,0|1,0,1]=4 12490 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCCF 11a_100015189416_100000036616 [0,2,0,0,0,0|1,0,1]=4 12491 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCCF 1626a_100015189416_100000036616 [0,2,0,0,0,0|1,0,1]=4 12492 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCCF 240690a_100015189416_100000036616 [0,2,0,0,0,0|1,0,1]=4 12493 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCCO 240690a_100000182051_100000036616 [0,2,0,0,0,0|1,0,1]=4 12494 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCSC 11a_100020590264_100000036616 [0,2,0,0,0,0|1,0,1]=4 12495 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCSC 1626a_100020590264_100000036616 [0,2,0,0,0,0|1,0,1]=4 12496 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCSC 240690a_100020590264_100000036616 [0,2,0,0,0,0|1,0,1]=4 12497 B18R0.20486 COC(=O)CCCCCCCCN(C)CCCCO 2230a_100000717598_100010282707 [0,2,0,0,0,0|1,0,0]=3 12498 B18R0.20486 COC(=O)CCCCCCCCN(C)CCCCO 269982a_100000717598_100010282707 [0,2,0,0,0,0|1,0,0]=3 12499 B18R0.20486 COC(=O)CCCCCCCNC(=O)CCCCO 188690a_100000687944_100000695505 [0,2,0,0,0,0|1,0,1]=4 12500 B18R0.20486 COC(=O)CCCCCCCNC(=O)CCCSC 188690a_100000687944_100000173376 [0,2,0,0,0,0|1,0,1]=4 12501 B18R0.20486 COC(=O)CCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100009815986 [0,2,0,0,0,0|1,0,0]=3 12502 B18R0.20486 COCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000740836 [0,2,0,0,0,0|0,0,1]=3 12503 B18R0.20486 COCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000741012_100010282707 [0,2,0,0,0,0|0,0,1]=3 12504 B18R0.20486 COCCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000741012 [0,2,0,0,0,0|1,0,1]=4 12505 B18R0.20486 COCCCC(C)OCCCCCCCC(=O)OC 34a_200011539412_100010004213 [0,2,0,0,0,0|1,0,0]=3 12506 B18R0.20486 COCCCC(C)OCCCCCCCC(=O)OC 7a_200011539412_100010004213 [0,2,0,0,0,0|1,0,0]=3 12507 B18R0.20486 COCCCN(C)CCCCCCCCC(=O)OC 2230a_100000224831_100010282707 [0,2,0,0,0,0|1,0,0]=3 12508 B18R0.20486 COCCCN(C)CCCCCCCCC(=O)OC 269982a_100000224831_100010282707 [0,2,0,0,0,0|1,0,0]=3 12509 B18R0.20486 COCCNC(=O)CCCCCCCCC(=O)OC 1626a_100000209980_100000036616 [0,2,0,0,0,0|1,0,1]=4 12510 B18R0.20486 COCCNC(=O)CCCCCCCCC(=O)OC 240690a_100000209980_100000036616 [0,2,0,0,0,0|1,0,1]=4 12511 B18R0.45 C=COC(=O)CC(=O)CCCCCCCCCCC 1458a_100000210736_100000036128 [0,2,0,0,0,0|0,0,2]=4 12512 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)CCC 1458a_100000210736_100000747444 [0,2,0,0,0,0|1,0,1]=4 12513 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)NCC 1458a_100000210736_100000183381 [0,2,0,0,0,0|1,0,1]=4 12514 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)NCO 1458a_100000210736_100000185155 [0,2,0,0,0,0|1,0,1]=4 12515 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)OCC 1458a_100000210736_100000188475 [0,2,0,0,0,0|0,0,1]=3 12516 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100011215454 [0,2,0,0,0,0|0,0,1]=3 12517 B18R0.45 CCCCCCCCCCCC(O)CC(=O)NCC 240690a_100015525214_100000082106 [0,2,0,0,0,0|1,0,0]=3 12518 B18R0.45 CCCCCCCCCCCC(O)CC(=O)NNC 22a_100016993582_100000082106 [0,2,0,0,0,0|1,0,0]=3 12519 B18R0.45 CCCCCCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100011215454 [0,2,0,0,0,0|2,0,0]=4 12520 B18R0.45 CCCCCCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100011215454 [0,2,0,0,0,0|2,0,0]=4 12521 B18R0.45 CCCCCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100011215454 [0,2,0,0,0,0|1,0,0]=3 12522 B18R0.45 CCCCCCCCCCNC(=O)CC(=O)OCC 240690a_100000684558_100000243816 [0,2,0,0,0,0|1,0,1]=4 12523 B18R0.45 CCCCCCCCCCNC(C)CC(=O)OCC 2230a_100000684558_100009817359 [0,2,0,0,0,0|1,0,0]=3 12524 B18R0.45 CCCCCCCCCCOC(=O)CC(=O)COC 1458a_100000210968_100000210668 [0,2,0,0,0,0|1,0,1]=4 12525 B18R0.45 CCCCCCCCCCOC(C)CC(=O)OCC 7a_100000210711_100009817359 [0,2,0,0,0,0|1,0,0]=3 12526 B18R0.45 CCCCCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210320 [0,2,0,0,0,0|1,0,0]=3 12527 B18R0.45 CCCCCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000210320 [0,2,0,0,0,0|1,0,0]=3 12528 B18R0.45 CCCCCCCCCCSC(C)OC(=O)OCC 62a_100000036008_100000210320 [0,2,0,0,0,0|2,0,0]=4 12529 B18R0.45 CCCCCCCCCNC[C@@H](O)CC(=O)OCC 34a_100000212291_100000688340 [0,2,0,0,0,0|1,0,0]=3 12530 B18R0.45 CCCCCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210712_100000688340 [0,2,0,0,0,0|1,0,0]=3 12531 B18R0.45 CCCCCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210712_100000688340 [0,2,0,0,0,0|1,0,0]=3 12532 B18R0.45 CCCCCCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210670 [0,2,0,0,0,0|1,0,1]=4 12533 B18R0.45 CCCCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210670 [0,2,0,0,0,0|1,0,0]=3 12534 B18R0.45 CCCCCCOCCOC[C@@H](O)CC(=O)OCC 34a_100000691444_100000688340 [0,2,0,0,0,0|2,0,0]=4 12535 B18R0.45 CCCCCCOCCOC[C@@H](O)CC(=O)OCC 7a_100000691444_100000688340 [0,2,0,0,0,0|2,0,0]=4 12536 B18R0.45 CCCCNCCCCOC[C@@H](O)CC(=O)OCC 34a_200011216965_100000688340 [0,2,0,0,0,0|2,0,0]=4 12537 B18R0.45 CCCCOCCCCOC[C@@H](O)CC(=O)OCC 34a_200000760531_100000688340 [0,2,0,0,0,0|2,0,0]=4 12538 B18R0.45 CCCCOCCCCOC[C@@H](O)CC(=O)OCC 7a_200000760531_100000688340 [0,2,0,0,0,0|2,0,0]=4 12539 B18R0.45 CCOC(=O)CC(=O)CCCCCCCCCCO 1458a_100000243816_100009813290 [0,2,0,0,0,0|1,0,1]=4 12540 B18R0.45 CCOC(=O)CC(C)NCCCCCCCCCO 2230a_100000078944_100009817359 [0,2,0,0,0,0|2,0,0]=4 12541 B18R0.45 CCOC(=O)CC(C)OCCCCCCCCCBr 7a_100009813782_100009817359 [0,2,0,0,0,0|2,0,0]=4 12542 B18R0.45 CCOC(=O)CC(C)OCCCCCCCCCCl 7a_100009868337_100009817359 [0,2,0,0,0,0|2,0,0]=4 12543 B18R0.45 CCOC(=O)CC(C)SCCCCCCCCCO 62a_100009813782_100009817359 [0,2,0,0,0,0|2,0,0]=4 12544 B18R0.45 CCOC(=O)CC(C)SCCCCCCCCCO 62a_100009817359_100009813782 [0,2,0,0,0,0|2,0,0]=4 12545 B18R0.45 CCOC(=O)CN(C)CCCCCCCCCCO 2230a_100000220588_100009813290 [0,2,0,0,0,0|2,0,0]=4 12546 B18R0.45 CCOC(=O)C[C@@H](C)OCCCCCCCCCO 7a_100009816390_100009813782 [0,2,0,0,0,0|2,0,0]=4 12547 B18R0.45 CCOC(=O)C[C@H](O)CNCCCCCCCCO 34a_102515433106_100000688340 [0,2,0,0,0,0|2,0,0]=4 12548 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCBr 34a_100009813846_100000688340 [0,2,0,0,0,0|2,0,0]=4 12549 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCBr 7a_100009813846_100000688340 [0,2,0,0,0,0|2,0,0]=4 12550 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCCl 34a_100000033203_100000688340 [0,2,0,0,0,0|2,0,0]=4 12551 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCCl 7a_100000033203_100000688340 [0,2,0,0,0,0|2,0,0]=4 12552 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCN 34a_102515433106_100000688340 [0,2,0,0,0,0|2,0,0]=4 12553 B18R0.45 CCOC(=O)C[C@H](O)CSCCCCCCCCO 62a_100000033203_100000688340 [0,2,0,0,0,0|2,0,0]=4 12554 B18R0.45 CCOC(=O)C[C@H](O)CSCCCCCCCCO 62a_100000688340_100000033203 [0,2,0,0,0,0|2,0,0]=4 12555 B18R0.73 CCCC(=O)CCCCCCCCCC(=O)OCC 1458a_100000211992_100009828014 [0,2,0,0,0,0|0,0,1]=3 12556 B18R0.73 CCCC(=O)CSCCCCCCCC(=O)OCC 62a_100000747444_100009991516 [0,2,0,0,0,0|1,0,1]=4 12557 B18R0.73 CCCC(C)CCCOCCCCCC(=O)OCC 34a_100011713154_100000755133 [0,2,0,0,0,0|1,0,0]=3 12558 B18R0.73 CCCC(C)CCCOCCCCCC(=O)OCC 7a_100011713154_100000755133 [0,2,0,0,0,0|1,0,0]=3 12559 B18R0.73 CCCC(C)CCCOCCCOCC(=O)OCC 34a_100011713154_100009893628 [0,2,0,0,0,0|2,0,0]=4 12560 B18R0.73 CCCC(C)CCCOCCCOCC(=O)OCC 7a_100011713154_100009893628 [0,2,0,0,0,0|2,0,0]=4 12561 B18R0.73 CCCC(C)CCOCCCCCCC(=O)OCC 34a_100011217855_100009814379 [0,2,0,0,0,0|1,0,0]=3 12562 B18R0.73 CCCC(C)CCOCCCCCCC(=O)OCC 7a_100011217855_100009814379 [0,2,0,0,0,0|1,0,0]=3 12563 B18R0.73 CCCC(C)COCCCCCCCC(=O)OCC 34a_100000688023_100009991516 [0,2,0,0,0,0|1,0,0]=3 12564 B18R0.73 CCCC(C)COCCCCCCCC(=O)OCC 7a_100000688023_100009991516 [0,2,0,0,0,0|1,0,0]=3 12565 B18R0.73 CCCC(C)CSCCCCCCCC(=O)OCC 62a_100011216630_100009991516 [0,2,0,0,0,0|1,0,0]=3 12566 B18R0.73 CCCC(C)NCCCCCCCCC(=O)OCC 2230a_100000741246_100010175975 [0,2,0,0,0,0|1,0,0]=3 12567 B18R0.73 CCCC(C)OCCCCCCCCC(=O)OCC 34a_100000764384_100010175975 [0,2,0,0,0,0|1,0,0]=3 12568 B18R0.73 CCCC(C)OCCCCCCCCC(=O)OCC 7a_100000764384_100010175975 [0,2,0,0,0,0|1,0,0]=3 12569 B18R0.73 CCCC(C)SCCCCCCCCC(=O)OCC 62a_100000766640_100010175975 [0,2,0,0,0,0|1,0,0]=3 12570 B18R0.73 CCCN(C)CCCCCCCCCC(=O)OCC 2230a_100000747261_100009828014 [0,2,0,0,0,0|1,0,0]=3 12571 B18R0.73 CCCN(C)CCCCCCCCCC(=O)OCC 269982a_100000747261_100009828014 [0,2,0,0,0,0|1,0,0]=3 12572 B18R0.73 CCC[C@H](N)CCOCCCCCCC(=O)OCC 34a_100015193777_100009814379 [0,2,0,0,0,0|1,0,0]=3 12573 B18R0.73 CCC[C@H](N)COCCCCCCCC(=O)OCC 34a_100000732646_100009991516 [0,2,0,0,0,0|1,0,0]=3 12574 B18R0.73 CCOC(=O)CCCCCCCCCC(=O)CCO 1458a_100011216618_100009828014 [0,2,0,0,0,0|1,0,1]=4 12575 B18R0.73 CCOC(=O)CCCCCCCCCC(=O)COC 1458a_100000210968_100009828014 [0,2,0,0,0,0|1,0,1]=4 12576 B18R0.73 CCOC(=O)CCCCCCCCCC(=O)CSC 1458a_100000184570_100009828014 [0,2,0,0,0,0|1,0,1]=4 12577 B18R0.73 CCOC(=O)CCCCCCCCCN(C)CCO 2230a_100000210263_100009828014 [0,2,0,0,0,0|2,0,0]=4 12578 B18R0.73 CCOC(=O)CCCCCCCCCN(C)CCO 269982a_100000210263_100009828014 [0,2,0,0,0,0|2,0,0]=4 12579 B18R0.73 CCOC(=O)CCCCCCCCN[C@H](C)CCO 2230a_100000706166_100010175975 [0,2,0,0,0,0|2,0,0]=4 12580 B18R0.73 CCOC(=O)CCCCCCCCN[C@H](C)CCO 34a_100000706166_100010175975 [0,2,0,0,0,0|2,0,0]=4 12581 B18R0.73 CCOC(=O)CCCCCCCCN[C@H](C)COC 2230a_100000764878_100010175975 [0,2,0,0,0,0|2,0,0]=4 12582 B18R0.73 CCOC(=O)CCCCCCCCOC(C)CCBr 34a_100012276601_100010175975 [0,2,0,0,0,0|2,0,0]=4 12583 B18R0.73 CCOC(=O)CCCCCCCCO[C@H](C)COC 34a_100011934205_100010175975 [0,2,0,0,0,0|2,0,0]=4 12584 B18R0.73 CCOC(=O)CCCCCCCCSC(C)CCO 62a_100009893172_100010175975 [0,2,0,0,0,0|2,0,0]=4 12585 B18R0.73 CCOC(=O)CCCCCCCCSC(C)COC 62a_100000765312_100010175975 [0,2,0,0,0,0|2,0,0]=4 12586 B18R0.73 CCOC(=O)CCCCCCCNCC(O)COC 2230a_100000756049_100009991516 [0,2,0,0,0,0|2,0,0]=4 12587 B18R0.73 CCOC(=O)CCCCCCCNCC(O)COC 34a_100000756049_100009991516 [0,2,0,0,0,0|2,0,0]=4 12588 B18R0.73 CCOC(=O)CCCCCCCOCC(C)CCN 34a_106354213184_100009991516 [0,2,0,0,0,0|2,0,0]=4 12589 B18R0.73 CCOC(=O)CCCCCCCOCC(N)COC 34a_100000724102_100009991516 [0,2,0,0,0,0|2,0,0]=4 12590 B18R0.73 CCOC(=O)CCCCCCCSCC(O)COC 62a_100011215053_100009991516 [0,2,0,0,0,0|2,0,0]=4 12591 B18R0.161 CCCCC(=O)CCCCCCCCC(=O)OCC 1458a_100000210183_100010175975 [0,2,0,0,0,0|0,0,1]=3 12592 B18R0.161 CCCCC(=O)CCCCCCCCC(=O)OCC 1458a_200000016031_100000210211 [0,2,0,0,0,0|0,0,1]=3 12593 B18R0.161 CCCCC(C)CCCCOCCCC(=O)OCC 34a_200011021034_100009991533 [0,2,0,0,0,0|1,0,0]=3 12594 B18R0.161 CCCCC(C)CCCCOCCCC(=O)OCC 7a_200011021034_100011215271 [0,2,0,0,0,0|1,0,0]=3 12595 B18R0.161 CCCCC(C)CCCCOCCNC(=O)OCC 7a_200011021034_200011445536 [0,2,0,0,0,0|2,0,0]=4 12596 B18R0.161 CCCCC(C)COCCCCCCC(=O)OCC 34a_100011995851_100009814379 [0,2,0,0,0,0|1,0,0]=3 12597 B18R0.161 CCCCC(C)COCCCCCCC(=O)OCC 7a_100011995851_100009814379 [0,2,0,0,0,0|1,0,0]=3 12598 B18R0.161 CCCCC(C)NCCCCCCCC(=O)OCC 2230a_100000126638_100009991516 [0,2,0,0,0,0|1,0,0]=3 12599 B18R0.161 CCCCC(C)OCCCCCCCC(=O)OCC 34a_100000687866_100009991516 [0,2,0,0,0,0|1,0,0]=3 12600 B18R0.161 CCCCC(C)OCCCCCCCC(=O)OCC 7a_100000687866_100009991516 [0,2,0,0,0,0|1,0,0]=3 12601 B18R0.161 CCCCC(C)SCCCCCCCC(=O)OCC 62a_200011215066_100009991516 [0,2,0,0,0,0|1,0,0]=3 12602 B18R0.161 CCCCN(C)CCCCCCCCC(=O)OCC 2230a_100000207549_100010175975 [0,2,0,0,0,0|1,0,0]=3 12603 B18R0.161 CCCCN(C)CCCCCCCCC(=O)OCC 269982a_100000207549_100010175975 [0,2,0,0,0,0|1,0,0]=3 12604 B18R0.161 CCCC[C@H](N)COCCCCCCC(=O)OCC 34a_100011934283_100009814379 [0,2,0,0,0,0|1,0,0]=3 12605 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 11a_100020643023_200000016031 [0,2,0,0,0,0|1,0,1]=4 12606 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 1626a_100020643023_200000016031 [0,2,0,0,0,0|1,0,1]=4 12607 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 240690a_100020643023_200000016031 [0,2,0,0,0,0|1,0,1]=4 12608 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 527a_100020643023_200000016031 [0,2,0,0,0,0|1,0,1]=4 12609 B18R0.161 CCCOC(C)CNCCCCCCC(=O)OCC 2230a_100015185124_100009814379 [0,2,0,0,0,0|2,0,0]=4 12610 B18R0.161 CCCOC(C)CNCCCCCCC(=O)OCC 34a_100015185124_100009814379 [0,2,0,0,0,0|2,0,0]=4 12611 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCCF 1458a_200000016031_100011934791 [0,2,0,0,0,0|1,0,1]=4 12612 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCCO 1458a_200000016031_100011215043 [0,2,0,0,0,0|1,0,1]=4 12613 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCOC 1458a_100000749529_100010175975 [0,2,0,0,0,0|1,0,1]=4 12614 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCOC 1458a_200000016031_100000233755 [0,2,0,0,0,0|1,0,1]=4 12615 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCSC 1458a_100000174002_100010175975 [0,2,0,0,0,0|1,0,1]=4 12616 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCSC 1458a_200000016031_100000751147 [0,2,0,0,0,0|1,0,1]=4 12617 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CSCC 1458a_100000230394_100010175975 [0,2,0,0,0,0|1,0,1]=4 12618 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCCO 2230a_100000213112_100010175975 [0,2,0,0,0,0|2,0,0]=4 12619 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCCO 269982a_100000213112_100010175975 [0,2,0,0,0,0|2,0,0]=4 12620 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCOC 2230a_100000743101_100010175975 [0,2,0,0,0,0|2,0,0]=4 12621 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCOC 269982a_100000743101_100010175975 [0,2,0,0,0,0|2,0,0]=4 12622 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCSC 2230a_100000686725_100010175975 [0,2,0,0,0,0|2,0,0]=4 12623 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCSC 269982a_100000686725_100010175975 [0,2,0,0,0,0|2,0,0]=4 12624 B18R0.161 CCOC(=O)CCCCCCCOC(C)CCCCl 34a_200000718107_100009991516 [0,2,0,0,0,0|2,0,0]=4 12625 B18R0.161 CCOC(=O)CCCCCCCOC(C)CCCCl 7a_200000718107_100009991516 [0,2,0,0,0,0|2,0,0]=4 12626 B18R0.161 CCOC(=O)CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100009814379 [0,2,0,0,0,0|2,0,0]=4 12627 B18R0.161 CCOC(=O)CCCCCCNC[C@H](C)CCCO 34a_100160569302_100009814379 [0,2,0,0,0,0|2,0,0]=4 12628 B18R0.161 CCOC(=O)CCCCCCOC[C@@H](N)CCSC 34a_100011827619_100009814379 [0,2,0,0,0,0|2,0,0]=4 12629 B18R0.161 CCOCC(=O)CCCCCCCCC(=O)OCC 1458a_100000211967_100010175975 [0,2,0,0,0,0|1,0,1]=4 12630 B18R0.161 CCOCC(C)OCCCCCCCC(=O)OCC 34a_100000718985_100009991516 [0,2,0,0,0,0|2,0,0]=4 12631 B18R0.161 CCOCC(C)OCCCCCCCC(=O)OCC 7a_100000718985_100009991516 [0,2,0,0,0,0|2,0,0]=4 12632 B18R0.161 CCOCC(O)CNCCCCCCC(=O)OCC 2230a_102515437182_100009814379 [0,2,0,0,0,0|2,0,0]=4 12633 B18R0.161 CCOCC(O)CNCCCCCCC(=O)OCC 34a_102515437182_100009814379 [0,2,0,0,0,0|2,0,0]=4 12634 B18R0.166 CCCCCC(=O)CCCCCCCC(=O)OCC 1458a_100000212188_100009991516 [0,2,0,0,0,0|0,0,1]=3 12635 B18R0.166 CCCCCC(=O)COCCCCCC(=O)OCC 7a_100011214988_200012276598 [0,2,0,0,0,0|1,0,1]=4 12636 B18R0.166 CCCCCC(=O)CSCCCCCC(=O)OCC 62a_100000755133_200012276598 [0,2,0,0,0,0|1,0,1]=4 12637 B18R0.166 CCCCCC(=O)CSCCCCCC(=O)OCC 62a_200012276598_100000755133 [0,2,0,0,0,0|1,0,1]=4 12638 B18R0.166 CCCCCC(=O)NCCCCCCC(=O)OCC 188690a_100000741137_100000212188 [0,2,0,0,0,0|1,0,1]=4 12639 B18R0.166 CCCCCC(C)NCCCCCCC(=O)OCC 2230a_100000211957_100009814379 [0,2,0,0,0,0|1,0,0]=3 12640 B18R0.166 CCCCCC(C)OCCCCCCC(=O)OCC 34a_100011215632_100009814379 [0,2,0,0,0,0|1,0,0]=3 12641 B18R0.166 CCCCCC(C)OCCCCCCC(=O)OCC 7a_100011215632_100009814379 [0,2,0,0,0,0|1,0,0]=3 12642 B18R0.166 CCCCCC(C)SCCCCCCC(=O)OCC 62a_200011218191_100009814379 [0,2,0,0,0,0|1,0,0]=3 12643 B18R0.166 CCCCCN(C)CCCCCCCC(=O)OCC 2230a_100000223495_100009991516 [0,2,0,0,0,0|1,0,0]=3 12644 B18R0.166 CCCCCN(C)CCCCCCCC(=O)OCC 269982a_100000223495_100009991516 [0,2,0,0,0,0|1,0,0]=3 12645 B18R0.166 CCCOCC(=O)CCCCCCCC(=O)OCC 1458a_100000745993_100009991516 [0,2,0,0,0,0|1,0,1]=4 12646 B18R0.166 CCCSCC(=O)CCCCCCCC(=O)OCC 1458a_100000217233_100009991516 [0,2,0,0,0,0|1,0,1]=4 12647 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCCCO 1458a_100000695505_100009991516 [0,2,0,0,0,0|1,0,1]=4 12648 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCCOC 1458a_100000741012_100009991516 [0,2,0,0,0,0|1,0,1]=4 12649 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCCSC 1458a_100000173376_100009991516 [0,2,0,0,0,0|1,0,1]=4 12650 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCSCC 1458a_100000230768_100009991516 [0,2,0,0,0,0|1,0,1]=4 12651 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCCO 2230a_100000717598_100009991516 [0,2,0,0,0,0|2,0,0]=4 12652 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCCO 269982a_100000717598_100009991516 [0,2,0,0,0,0|2,0,0]=4 12653 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCOC 2230a_100000224831_100009991516 [0,2,0,0,0,0|2,0,0]=4 12654 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCOC 269982a_100000224831_100009991516 [0,2,0,0,0,0|2,0,0]=4 12655 B18R0.166 CCOC(=O)CCCCCCOC(C)CCCOC 34a_200011539412_100009814379 [0,2,0,0,0,0|2,0,0]=4 12656 B18R0.166 CCOC(=O)CCCCCCOC(C)CCCOC 7a_200011539412_100009814379 [0,2,0,0,0,0|2,0,0]=4 12657 B18R0.166 CCOC(=O)CCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000755133 [0,2,0,0,0,0|2,0,0]=4 12658 B18R0.166 CCOCCC(=O)CCCCCCCC(=O)OCC 1458a_100000749530_100009991516 [0,2,0,0,0,0|1,0,1]=4 12659 B18R0.177 C#CCC(=O)C(C)CCCCCCCCCCCC 1458a_100011220946_200011217028 [0,2,0,0,0,0|1,0,1]=4 12660 B18R0.177 C=C(CNCCCCCCCCCC)C(=O)OCC 34a_100000684558_100000755967 [0,2,0,0,0,0|1,0,1]=4 12661 B18R0.177 C=C(COCCCCCCCCCC)C(=O)OCC 34a_100000210711_100000755967 [0,2,0,0,0,0|1,0,1]=4 12662 B18R0.177 C=C(COCCCCCCCCCC)C(=O)OCC 7a_100000210711_100000755967 [0,2,0,0,0,0|1,0,1]=4 12663 B18R0.177 C=C(CSCCCCCCCCCC)C(=O)OCC 62a_100000755967_100000210320 [0,2,0,0,0,0|1,0,1]=4 12664 B18R0.177 CC#CC(=O)C(C)CCCCCCCCCCCC 1458a_100000763181_200011217028 [0,2,0,0,0,0|1,0,0]=3 12665 B18R0.177 CC=CC(=O)N(C)CCCCCCCCCCCC 11a_100000227908_100000210699 [0,2,0,0,0,0|2,0,0]=4 12666 B18R0.177 CC=CC(=O)N(C)CCCCCCCCCCCC 1626a_100000227908_100000210699 [0,2,0,0,0,0|2,0,0]=4 12667 B18R0.177 CC=CC(=O)N(C)CCCCCCCCCCCC 240690a_100000227908_100000210699 [0,2,0,0,0,0|2,0,0]=4 12668 B18R0.177 CCCCCCCCCCCCC(=O)/C(=N/OC)/C 1458a_100160996864_100000759014 [0,2,0,0,0,0|1,0,1]=4 12669 B18R0.177 CCCCCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000759014 [0,2,0,0,0,0|1,0,1]=4 12670 B18R0.177 CCCCCCCCCCCCC(C)C(=O)CC#N 1458a_100051588842_200011217028 [0,2,0,0,0,0|1,0,1]=4 12671 B18R0.177 CCCCCCCCCCCCC(C)C(=O)CCO 1458a_100011216618_200011217028 [0,2,0,0,0,0|1,0,0]=3 12672 B18R0.177 CCCCCCCCCCCCC(C)C(=O)COC 1458a_100000210968_200011217028 [0,2,0,0,0,0|0,0,0]=2 12673 B18R0.177 CCCCCCCCCCCCC(C)C(=O)CSC 1458a_100000184570_200011217028 [0,2,0,0,0,0|0,1,0]=3 12674 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CCC 11a_100000227908_100000211992 [0,2,0,0,0,0|2,0,0]=4 12675 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CCC 1626a_100000227908_100000211992 [0,2,0,0,0,0|2,0,0]=4 12676 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CCC 240690a_100000227908_100000211992 [0,2,0,0,0,0|2,0,0]=4 12677 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CCC 527a_100000227908_100000211992 [0,2,0,0,0,0|2,0,0]=4 12678 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CCO 240690a_100000227908_100011216618 [0,2,0,0,0,0|2,0,0]=4 12679 B18R0.177 CCCCCCCCCCCCN(C)C(=O)COC 11a_100000227908_100000210968 [0,2,0,0,0,0|1,0,0]=3 12680 B18R0.177 CCCCCCCCCCCCN(C)C(=O)COC 1626a_100000227908_100000210968 [0,2,0,0,0,0|1,0,0]=3 12681 B18R0.177 CCCCCCCCCCCCN(C)C(=O)COC 240690a_100000227908_100000210968 [0,2,0,0,0,0|1,0,0]=3 12682 B18R0.177 CCCCCCCCCCCCN(C)C(=O)COC 527a_100000227908_100000210968 [0,2,0,0,0,0|1,0,0]=3 12683 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CSC 11a_100000227908_100000184570 [0,2,0,0,0,0|1,1,0]=4 12684 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CSC 1626a_100000227908_100000184570 [0,2,0,0,0,0|1,1,0]=4 12685 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CSC 240690a_100000227908_100000184570 [0,2,0,0,0,0|1,1,0]=4 12686 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CSC 527a_100000227908_100000184570 [0,2,0,0,0,0|1,1,0]=4 12687 B18R0.177 CCCCCCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000227908 [0,2,0,0,0,0|2,0,0]=4 12688 B18R0.177 CCCCCCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000227908 [0,2,0,0,0,0|2,0,0]=4 12689 B18R0.177 CCCCCCCCCCCNC(=O)C(=O)OCC 11a_200011215754_100014798877 [0,2,0,0,0,0|1,0,1]=4 12690 B18R0.177 CCCCCCCCCCCNC(=O)C(=O)OCC 1626a_200011215754_100014798877 [0,2,0,0,0,0|1,0,1]=4 12691 B18R0.177 CCCCCCCCCCCNC(=O)C(=O)OCC 240690a_200011215754_100014798877 [0,2,0,0,0,0|1,0,1]=4 12692 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100011215454 [0,2,0,0,0,0|2,0,0]=4 12693 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 2230a_200011215754_100000230173 [0,2,0,0,0,0|2,0,0]=4 12694 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 34a_100000736553_100011215454 [0,2,0,0,0,0|2,0,0]=4 12695 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 34a_200011215754_100000230173 [0,2,0,0,0,0|2,0,0]=4 12696 B18R0.177 CCCCCCCCCCCNC(C)C(=O)OCC 2230a_200011215754_100011215307 [0,2,0,0,0,0|1,0,0]=3 12697 B18R0.177 CCCCCCCCCCCNC(C)C(=O)OCC 34a_200011215754_100011216346 [0,2,0,0,0,0|1,0,0]=3 12698 B18R0.177 CCCCCCCCCCCNC(F)C(=O)OCC 2230a_200011215754_100000760018 [0,2,0,0,0,0|1,0,0]=3 12699 B18R0.177 CCCCCCCCCCCNC(F)C(=O)OCC 34a_200011215754_100000760018 [0,2,0,0,0,0|1,0,0]=3 12700 B18R0.177 CCCCCCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100011215454 [0,2,0,0,0,0|1,1,0]=4 12701 B18R0.177 CCCCCCCCCCCOC(C)C(=O)NCC 34a_100000210809_100000230173 [0,2,0,0,0,0|2,0,0]=4 12702 B18R0.177 CCCCCCCCCCCOC(C)C(=O)NCC 7a_100000210809_100000230173 [0,2,0,0,0,0|2,0,0]=4 12703 B18R0.177 CCCCCCCCCCCOC(C)C(=O)OCC 34a_100000210809_100011216346 [0,2,0,0,0,0|1,0,0]=3 12704 B18R0.177 CCCCCCCCCCCOC(C)C(=O)OCC 7a_100000210809_100011216346 [0,2,0,0,0,0|1,0,0]=3 12705 B18R0.177 CCCCCCCCCCCOC(F)C(=O)OCC 34a_100000210809_100000760018 [0,2,0,0,0,0|1,0,0]=3 12706 B18R0.177 CCCCCCCCCCCOC(F)C(=O)OCC 7a_100000210809_100000040065 [0,2,0,0,0,0|1,0,0]=3 12707 B18R0.177 CCCCCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100011215454 [0,2,0,0,0,0|1,0,0]=3 12708 B18R0.177 CCCCCCCCCCCSC(C)C(=O)NCC 62a_100000230173_100011215454 [0,2,0,0,0,0|2,0,0]=4 12709 B18R0.177 CCCCCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100011215454 [0,2,0,0,0,0|1,0,0]=3 12710 B18R0.177 CCCCCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100011215454 [0,2,0,0,0,0|1,0,0]=3 12711 B18R0.177 CCCCCCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210320 [0,2,0,0,0,0|1,0,1]=4 12712 B18R0.177 CCCCCCNCCCCCC(=O)C(=O)OCC 2230a_100000210581_100000068741 [0,2,0,0,0,0|1,0,1]=4 12713 B18R0.177 CCCCCCSCCCCCC(=O)C(=O)OCC 62a_100000210314_100000068741 [0,2,0,0,0,0|1,0,1]=4 12714 B18R0.177 CCOC(=O)C(C)NCCCCCCCCCCO 2230a_100000066964_100011215307 [0,2,0,0,0,0|2,0,0]=4 12715 B18R0.177 CCOC(=O)C(C)NCCCCCCCCCCO 34a_100000066964_100011216346 [0,2,0,0,0,0|2,0,0]=4 12716 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCBr 34a_100009813290_100011216346 [0,2,0,0,0,0|2,0,0]=4 12717 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCBr 7a_100009813290_100011216346 [0,2,0,0,0,0|2,0,0]=4 12718 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCCl 34a_200000033068_100011216346 [0,2,0,0,0,0|2,0,0]=4 12719 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCCl 7a_200000033068_100011216346 [0,2,0,0,0,0|2,0,0]=4 12720 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCN 34a_100000066964_100011216346 [0,2,0,0,0,0|2,0,0]=4 12721 B18R0.177 CCOC(=O)C(C)SCCCCCCCCCCO 62a_100009813290_100011216346 [0,2,0,0,0,0|2,0,0]=4 12722 B18R0.177 CCOC(=O)C(C)SCCCCCCCCCCO 62a_100011216346_200000033068 [0,2,0,0,0,0|2,0,0]=4 12723 B18R0.177 CCOC(=O)C(F)NCCCCCCCCCCO 2230a_100000066964_100000760018 [0,2,0,0,0,0|2,0,0]=4 12724 B18R0.177 CCOC(=O)C(F)NCCCCCCCCCCO 34a_100000066964_100000760018 [0,2,0,0,0,0|2,0,0]=4 12725 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCBr 34a_100009813290_100000760018 [0,2,0,0,0,0|2,0,0]=4 12726 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCBr 7a_100009813290_100000040065 [0,2,0,0,0,0|2,0,0]=4 12727 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCCl 34a_200000033068_100000760018 [0,2,0,0,0,0|2,0,0]=4 12728 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCCl 7a_200000033068_100000040065 [0,2,0,0,0,0|2,0,0]=4 12729 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCN 34a_100000066964_100000760018 [0,2,0,0,0,0|2,0,0]=4 12730 B18R0.177 CCOC(=O)C(F)SCCCCCCCCCCO 62a_100000760018_200000033068 [0,2,0,0,0,0|2,0,0]=4 12731 B18R0.177 CCOC(=O)C(F)SCCCCCCCCCCO 62a_100009813290_100000760018 [0,2,0,0,0,0|2,0,0]=4 12732 B18R0.177 CCOC(=O)[C@H](C)OCCCCCCCCCCO 7a_100000751109_100009813290 [0,2,0,0,0,0|2,0,0]=4 12733 B18R0.220 CC(=CC(=O)CCCCCCCCCCCCO)C 1458a_100000211388_100009813331 [0,2,0,0,0,0|2,0,0]=4 12734 B18R0.220 CC(=CC(=O)CCCCCCCCCCCCO)Cl 1458a_200042562850_100009813331 [0,2,0,0,0,0|2,0,0]=4 12735 B18R0.220 CC(=CC(=O)CCCCCCCCCCCCO)I 1458a_100025716642_100009813331 [0,2,0,0,0,0|2,0,0]=4 12736 B18R0.220 CC(C)CC(=O)CCCCCCCCCCCCO 1458a_100000210554_100009813331 [0,2,0,0,0,0|2,0,0]=4 12737 B18R0.220 CC(C)NC(=O)CCCCCCCCCCCCO 240690a_100138425928_100102582631 [0,2,0,0,0,0|2,0,0]=4 12738 B18R0.220 CC(C)OC(=O)CCCCCNCCCCCCO 2230a_100000686447_200010986244 [0,2,0,0,0,0|2,0,0]=4 12739 B18R0.220 CC(C)OC(=O)CCCCCNCCCCCCO 34a_100000686447_200010986244 [0,2,0,0,0,0|2,0,0]=4 12740 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCBr 34a_100011215345_200010986244 [0,2,0,0,0,0|2,0,0]=4 12741 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCBr 7a_100011215345_200010986244 [0,2,0,0,0,0|2,0,0]=4 12742 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCCl 34a_100000766143_200010986244 [0,2,0,0,0,0|2,0,0]=4 12743 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCCl 7a_100000766143_200010986244 [0,2,0,0,0,0|2,0,0]=4 12744 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCF 34a_100000732779_200010986244 [0,2,0,0,0,0|2,0,0]=4 12745 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCF 7a_100000732779_200010986244 [0,2,0,0,0,0|2,0,0]=4 12746 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCN 34a_100000686447_200010986244 [0,2,0,0,0,0|2,0,0]=4 12747 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCF 62a_100015922095_200010986244 [0,2,0,0,0,0|2,0,0]=4 12748 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCF 62a_200010986244_100015922095 [0,2,0,0,0,0|2,0,0]=4 12749 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCO 62a_100000766143_200010986244 [0,2,0,0,0,0|2,0,0]=4 12750 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCO 62a_200010986244_100000766143 [0,2,0,0,0,0|2,0,0]=4 12751 B18R0.220 CC(C)OC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000760027 [0,2,0,0,0,0|2,0,0]=4 12752 B18R0.220 CC(C)OC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000760027 [0,2,0,0,0,0|2,0,0]=4 12753 B18R0.220 CC(C)OC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000760027 [0,2,0,0,0,0|2,0,0]=4 12754 B18R0.220 CC(C)OC(=O)CCSCCCCCCCCCO 62a_100000760027_100009813782 [0,2,0,0,0,0|2,0,0]=4 12755 B18R0.220 CC(C)OC(=O)CCSCCCCCCCCCO 62a_100009813782_100000760027 [0,2,0,0,0,0|2,0,0]=4 12756 B18R0.220 CC(C)OC(=O)CNCCCCCCCCCCO 2230a_100000066964_100011215430 [0,2,0,0,0,0|2,0,0]=4 12757 B18R0.220 CC(C)OC(=O)CNCCCCCCCCCCO 34a_100000066964_100011215430 [0,2,0,0,0,0|2,0,0]=4 12758 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCBr 34a_100009813290_100011215430 [0,2,0,0,0,0|2,0,0]=4 12759 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCBr 7a_100009813290_100011215430 [0,2,0,0,0,0|2,0,0]=4 12760 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCCl 34a_200000033068_100011215430 [0,2,0,0,0,0|2,0,0]=4 12761 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCCl 7a_200000033068_100011215430 [0,2,0,0,0,0|2,0,0]=4 12762 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCN 34a_100000066964_100011215430 [0,2,0,0,0,0|2,0,0]=4 12763 B18R0.220 CC(C)OC(=O)CSCCCCCCCCCCO 62a_100009813290_100011215430 [0,2,0,0,0,0|2,0,0]=4 12764 B18R0.220 CC(C)OC(=O)CSCCCCCCCCCCO 62a_100011215430_200000033068 [0,2,0,0,0,0|2,0,0]=4 12765 B18R0.220 CCCCCCCCCCCCCC(=O)CC(=O)N 1458a_100000756256_100000187820 [0,2,0,0,0,0|1,0,1]=4 12766 B18R0.220 CCCCCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100000210684 [0,2,0,0,0,0|1,0,1]=4 12767 B18R0.220 CCCCCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000756256_100020667443 [0,2,0,0,0,0|1,0,1]=4 12768 B18R0.220 CCCCCCCCCCCCCC(=O)CC(C)O 1458a_100000756256_100011218427 [0,2,0,0,0,0|1,0,0]=3 12769 B18R0.220 CCCCCCCCCCCCCC(=O)CC(F)F 1458a_100000756256_100011934356 [0,2,0,0,0,0|1,0,0]=3 12770 B18R0.220 CCCCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100000210684 [0,2,0,0,0,0|1,0,0]=3 12771 B18R0.220 CCCCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210684 [0,2,0,0,0,0|1,0,0]=3 12772 B18R0.220 CCCCCCCCCCCCCC(=O)C[N+](=O)[O-] 1458a_100000756256_100000761209 [0,2,0,0,0,0|2,0,0]=4 12773 B18R0.220 CCCCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000210684 [0,2,0,0,0,0|0,1,0]=3 12774 B18R0.220 CCCCCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000756256 [0,2,0,0,0,0|1,0,0]=3 12775 B18R0.220 CCCCCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000756256 [0,2,0,0,0,0|1,0,0]=3 12776 B18R0.220 CCCCCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000756256 [0,2,0,0,0,0|1,0,0]=3 12777 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C 11a_100000210451_100000211388 [0,2,0,0,0,0|2,0,0]=4 12778 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C 1626a_100000210451_100000211388 [0,2,0,0,0,0|2,0,0]=4 12779 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C 240690a_100000210451_100000211388 [0,2,0,0,0,0|2,0,0]=4 12780 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)Cl 11a_100000210451_200042562850 [0,2,0,0,0,0|2,0,0]=4 12781 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)Cl 1626a_100000210451_200042562850 [0,2,0,0,0,0|2,0,0]=4 12782 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)Cl 240690a_100000210451_200042562850 [0,2,0,0,0,0|2,0,0]=4 12783 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)I 11a_100000210451_100025716642 [0,2,0,0,0,0|2,0,0]=4 12784 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)I 1626a_100000210451_100025716642 [0,2,0,0,0,0|2,0,0]=4 12785 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C 11a_100000210451_100000210554 [0,2,0,0,0,0|2,0,0]=4 12786 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C 1626a_100000210451_100000210554 [0,2,0,0,0,0|2,0,0]=4 12787 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C 240690a_100000210451_100000210554 [0,2,0,0,0,0|2,0,0]=4 12788 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C 527a_100000210451_100000210554 [0,2,0,0,0,0|2,0,0]=4 12789 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C 11a_100000210451_100000750896 [0,2,0,0,0,0|2,0,0]=4 12790 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C 240690a_100000210451_100000750896 [0,2,0,0,0,0|2,0,0]=4 12791 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C 527a_100000210451_100000750896 [0,2,0,0,0,0|2,0,0]=4 12792 B18R0.220 CCCCCCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000210451_100011933948 [0,2,0,0,0,0|2,0,0]=4 12793 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 11a_100000210451_200159257847 [0,2,0,0,0,0|1,1,0]=4 12794 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 1626a_100000210451_200159257847 [0,2,0,0,0,0|1,1,0]=4 12795 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 240690a_100000210451_200159257847 [0,2,0,0,0,0|1,1,0]=4 12796 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 527a_100000210451_200159257847 [0,2,0,0,0,0|1,1,0]=4 12797 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 2708a_100000210451_100138425928 [0,2,0,0,0,0|2,0,0]=4 12798 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000210451 [0,2,0,0,0,0|2,0,0]=4 12799 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000210451 [0,2,0,0,0,0|2,0,0]=4 12800 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 512a_100000210451_100138425928 [0,2,0,0,0,0|2,0,0]=4 12801 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000210451 [0,2,0,0,0,0|2,0,0]=4 12802 B18R0.220 CCCCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100011215454 [0,2,0,0,0,0|2,0,0]=4 12803 B18R0.220 CCCCCCCCCCCNCC(=O)NC(C)C 2230a_200011215754_100000183996 [0,2,0,0,0,0|2,0,0]=4 12804 B18R0.220 CCCCCCCCCCCNCC(=O)NC(C)C 34a_200011215754_100000183996 [0,2,0,0,0,0|2,0,0]=4 12805 B18R0.220 CCCCCCCCCCCNCC(=O)OC(C)C 2230a_200011215754_100011215430 [0,2,0,0,0,0|1,0,0]=3 12806 B18R0.220 CCCCCCCCCCCNCC(=O)OC(C)C 34a_200011215754_100011215430 [0,2,0,0,0,0|1,0,0]=3 12807 B18R0.220 CCCCCCCCCCCOCC(=O)NC(=O)C 7a_100000210809_100000183797 [0,2,0,0,0,0|2,0,0]=4 12808 B18R0.220 CCCCCCCCCCCOCC(=O)NC(C)C 34a_100000210809_100000183996 [0,2,0,0,0,0|2,0,0]=4 12809 B18R0.220 CCCCCCCCCCCOCC(=O)NC(C)C 7a_100000210809_100000183996 [0,2,0,0,0,0|2,0,0]=4 12810 B18R0.220 CCCCCCCCCCCOCC(=O)OC(C)C 34a_100000210809_100011215430 [0,2,0,0,0,0|1,0,0]=3 12811 B18R0.220 CCCCCCCCCCCOCC(=O)OC(C)C 7a_100000210809_100011215430 [0,2,0,0,0,0|1,0,0]=3 12812 B18R0.220 CCCCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100011215454 [0,2,0,0,0,0|2,0,0]=4 12813 B18R0.220 CCCCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100011215454 [0,2,0,0,0,0|1,0,0]=3 12814 B18R0.220 CCCCCCCCCCNCCC(=O)NC(C)C 2230a_100000684558_100000737564 [0,2,0,0,0,0|2,0,0]=4 12815 B18R0.220 CCCCCCCCCCNCCC(=O)OC(C)C 2230a_100000684558_100000760027 [0,2,0,0,0,0|1,0,0]=3 12816 B18R0.220 CCCCCCCCCCOCCC(=O)NC(C)C 7a_100000210711_100000737564 [0,2,0,0,0,0|2,0,0]=4 12817 B18R0.220 CCCCCCCCCCOCCC(=O)OC(C)C 7a_100000210711_100000760027 [0,2,0,0,0,0|1,0,0]=3 12818 B18R0.220 CCCCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210320 [0,2,0,0,0,0|2,0,0]=4 12819 B18R0.220 CCCCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210320 [0,2,0,0,0,0|1,0,0]=3 12820 B18R0.220 CCCCCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210320 [0,2,0,0,0,0|2,0,0]=4 12821 B18R0.220 CCCCCCCNCCCCCC(=O)OC(C)C 2230a_100000229938_200010986244 [0,2,0,0,0,0|1,0,0]=3 12822 B18R0.220 CCCCCCCOCCCCCC(=O)OC(C)C 34a_100000210272_200010986244 [0,2,0,0,0,0|1,0,0]=3 12823 B18R0.220 CCCCCCCOCCCCCC(=O)OC(C)C 7a_100000210272_200010986244 [0,2,0,0,0,0|1,0,0]=3 12824 B18R0.220 CCCCCCCSCCCCCC(=O)OC(C)C 62a_100000210614_200010986244 [0,2,0,0,0,0|1,0,0]=3 12825 B18R0.220 CCCCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210316 [0,2,0,0,0,0|1,0,0]=3 12826 B18R0.220 CCCCOCCOCCCCCC(=O)OC(C)C 34a_100000210238_200010986244 [0,2,0,0,0,0|2,0,0]=4 12827 B18R0.220 CCCCOCCOCCCCCC(=O)OC(C)C 7a_100000210238_200010986244 [0,2,0,0,0,0|2,0,0]=4 12828 B18R0.220 CCCCOCCSCCCCCC(=O)OC(C)C 62a_100000743108_200010986244 [0,2,0,0,0,0|2,0,0]=4 12829 B18R0.220 CCCCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000743108 [0,2,0,0,0,0|2,0,0]=4 12830 B18R0.220 CCCCSCCNCCCCCC(=O)OC(C)C 2230a_100025743550_200010986244 [0,2,0,0,0,0|2,0,0]=4 12831 B18R0.220 CCCCSCCOCCCCCC(=O)OC(C)C 34a_200000230436_200010986244 [0,2,0,0,0,0|2,0,0]=4 12832 B18R0.220 CCCCSCCOCCCCCC(=O)OC(C)C 7a_200000230436_200010986244 [0,2,0,0,0,0|2,0,0]=4 12833 B18R0.220 CCCOCCCNCCCCCC(=O)OC(C)C 2230a_100011217757_200010986244 [0,2,0,0,0,0|2,0,0]=4 12834 B18R0.220 CCCOCCCNCCCCCC(=O)OC(C)C 34a_100011217757_200010986244 [0,2,0,0,0,0|2,0,0]=4 12835 B18R0.220 CN(C)CC(=O)CCCCCCCCCCCCO 1458a_100000750896_100009813331 [0,2,0,0,0,0|2,0,0]=4 12836 B18R0.220 CNCCCCCOCCCCCC(=O)OC(C)C 34a_100000722520_200010986244 [0,2,0,0,0,0|2,0,0]=4 12837 B18R0.220 COCCCCCNCCCCCC(=O)OC(C)C 2230a_100000747528_200010986244 [0,2,0,0,0,0|2,0,0]=4 12838 B18R0.220 COCCCCCNCCCCCC(=O)OC(C)C 34a_100000747528_200010986244 [0,2,0,0,0,0|2,0,0]=4 12839 B18R0.220 C[C@@H](O)CC(=O)CCCCCCCCCCCCO 1458a_100011933948_100009813331 [0,2,0,0,0,0|2,0,0]=4 12840 B18R0.220 C[S+](C)CC(=O)CCCCCCCCCCCCO 1458a_200159257847_100009813331 [0,2,0,0,0,0|1,1,0]=4 12841 B18R0.3155 C#CCCC(=O)CCCCCCCCCCCCC 1458a_100000692101_100000210684 [0,2,0,0,0,0|1,0,0]=3 12842 B18R0.3155 C#CCCC(=O)CCCCCCCCCCCCC 1458a_100000756256_100000753159 [0,2,0,0,0,0|1,0,0]=3 12843 B18R0.3155 C#CCCC(=O)CCCCCCCCCCCCO 1458a_100000692101_100009813331 [0,2,0,0,0,0|2,0,0]=4 12844 B18R0.3155 C#CCCC(=O)CCOCCCCCCCCCC 34a_100011064465_100000210320 [0,2,0,0,0,0|2,0,0]=4 12845 B18R0.3155 C#CCCC(=O)CCOCCCCCCCCCC 7a_100011064465_100000210320 [0,2,0,0,0,0|2,0,0]=4 12846 B18R0.3155 C#CCCC(=O)NCCCCCCCCCCCC 11a_100000210451_100000692101 [0,2,0,0,0,0|2,0,0]=4 12847 B18R0.3155 C#CCCC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000692101 [0,2,0,0,0,0|2,0,0]=4 12848 B18R0.3155 C#CCCC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000692101 [0,2,0,0,0,0|2,0,0]=4 12849 B18R0.3155 C#CCCC(=O)NCCCCCCCCCCCC 527a_100000210451_100000692101 [0,2,0,0,0,0|2,0,0]=4 12850 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC 11a_100000212058_100000756256 [0,2,0,0,0,0|1,0,0]=3 12851 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC 1626a_100000212058_100000756256 [0,2,0,0,0,0|1,0,0]=3 12852 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC 240690a_100000212058_100000756256 [0,2,0,0,0,0|1,0,0]=3 12853 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCO 240690a_100000212058_100102582631 [0,2,0,0,0,0|2,0,0]=4 12854 B18R0.3155 C#CCNC(=O)CNCCCCCCCCCCC 2230a_100000747989_100011215454 [0,2,0,0,0,0|2,0,0]=4 12855 B18R0.3155 C#CCNC(=O)CNCCCCCCCCCCC 34a_100000747989_100011215454 [0,2,0,0,0,0|2,0,0]=4 12856 B18R0.3155 C#CCNC(=O)NCCCCCCCCCCCC 2708a_100000210451_100000212058 [0,2,0,0,0,0|2,0,0]=4 12857 B18R0.3155 C#CCNC(=O)NCCCCCCCCCCCC 2708a_100000212058_100000210451 [0,2,0,0,0,0|2,0,0]=4 12858 B18R0.3155 C#CCNC(=O)NCCCCCCCCCCCC 273464a_100000210451_100000212058 [0,2,0,0,0,0|2,0,0]=4 12859 B18R0.3155 C#CCNC(=O)NCCCCCCCCCCCC 273464a_100000212058_100000210451 [0,2,0,0,0,0|2,0,0]=4 12860 B18R0.3155 C#CCNC(=O)NCCCCCCCCCCCC 512a_100000210451_100000212058 [0,2,0,0,0,0|2,0,0]=4 12861 B18R0.3155 C#CCNC(=O)NCCCCCCCCCCCC 512a_100000212058_100000210451 [0,2,0,0,0,0|2,0,0]=4 12862 B18R0.3155 C=CCCC(=O)NCCCCCCCCCCCC 11a_100000210451_100000749702 [0,2,0,0,0,0|2,0,0]=4 12863 B18R0.3155 C=CCCC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000749702 [0,2,0,0,0,0|2,0,0]=4 12864 B18R0.3155 C=CCCC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000749702 [0,2,0,0,0,0|2,0,0]=4 12865 B18R0.3155 C=CCCC(=O)NCCCCCCCCCCCC 527a_100000210451_100000749702 [0,2,0,0,0,0|2,0,0]=4 12866 B18R0.3155 C=CCCCCCCCCCCCC(=O)C=COC 1458a_100016268678_102130925996 [0,2,0,0,0,0|0,0,2]=4 12867 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCC 1626a_100020586998_100000756256 [0,2,0,0,0,0|1,0,0]=3 12868 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCC 240690a_100020586998_100000756256 [0,2,0,0,0,0|1,0,0]=3 12869 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCO 240690a_100020586998_100102582631 [0,2,0,0,0,0|2,0,0]=4 12870 B18R0.3155 C=CCNC(=O)CCNCCCCCCCCCC 2230a_100000684558_100011222895 [0,2,0,0,0,0|2,0,0]=4 12871 B18R0.3155 C=CCNC(=O)CCOCCCCCCCCCC 7a_100000210711_100011222895 [0,2,0,0,0,0|2,0,0]=4 12872 B18R0.3155 C=CCNC(=O)CCSCCCCCCCCCC 62a_100011222895_100000210320 [0,2,0,0,0,0|2,0,0]=4 12873 B18R0.3155 C=CCNC(=O)CNCCCCCCCCCCC 2230a_200011215754_100000183597 [0,2,0,0,0,0|2,0,0]=4 12874 B18R0.3155 C=CCNC(=O)COCCCCCCCCCCC 7a_100000210809_100000183597 [0,2,0,0,0,0|2,0,0]=4 12875 B18R0.3155 C=CCNC(=O)CSCCCCCCCCCCC 62a_100000183597_100011215454 [0,2,0,0,0,0|2,0,0]=4 12876 B18R0.3155 C=CCNC(=O)NCCCCCCCCCCCC 2708a_100000210451_100020586998 [0,2,0,0,0,0|2,0,0]=4 12877 B18R0.3155 C=CCNC(=O)NCCCCCCCCCCCC 273464a_100000210451_100020586998 [0,2,0,0,0,0|2,0,0]=4 12878 B18R0.3155 C=CCNC(=O)NCCCCCCCCCCCC 273464a_100020586998_100000210451 [0,2,0,0,0,0|2,0,0]=4 12879 B18R0.3155 C=CCNC(=O)NCCCCCCCCCCCC 512a_100000210451_100020586998 [0,2,0,0,0,0|2,0,0]=4 12880 B18R0.3155 C=CCNC(=O)NCCCCCCCCCCCC 512a_100020586998_100000210451 [0,2,0,0,0,0|2,0,0]=4 12881 B18R0.3155 C=CCOC(=O)CNCCCCCCCCCCC 2230a_200011215754_100000033060 [0,2,0,0,0,0|1,0,0]=3 12882 B18R0.3155 C=CCOC(=O)CNCCCCCCCCCCC 34a_200011215754_100000033060 [0,2,0,0,0,0|1,0,0]=3 12883 B18R0.3155 C=CCOC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000033060 [0,2,0,0,0,0|2,0,0]=4 12884 B18R0.3155 C=CCOC(=O)CNCCCCCCCCCCO 34a_100000066964_100000033060 [0,2,0,0,0,0|2,0,0]=4 12885 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCBr 34a_100009813290_100000033060 [0,2,0,0,0,0|2,0,0]=4 12886 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCBr 7a_100009813290_100000033060 [0,2,0,0,0,0|2,0,0]=4 12887 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCC 34a_100000210809_100000033060 [0,2,0,0,0,0|1,0,0]=3 12888 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCC 7a_100000210809_100000033060 [0,2,0,0,0,0|1,0,0]=3 12889 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCCl 34a_200000033068_100000033060 [0,2,0,0,0,0|2,0,0]=4 12890 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCCl 7a_200000033068_100000033060 [0,2,0,0,0,0|2,0,0]=4 12891 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCN 34a_100000066964_100000033060 [0,2,0,0,0,0|2,0,0]=4 12892 B18R0.3155 C=CCOC(=O)CSCCCCCCCCCCC 62a_100000033060_100011215454 [0,2,0,0,0,0|1,0,0]=3 12893 B18R0.3155 C=CCOC(=O)CSCCCCCCCCCCO 62a_100000033060_200000033068 [0,2,0,0,0,0|2,0,0]=4 12894 B18R0.3155 C=CCOC(=O)CSCCCCCCCCCCO 62a_100009813290_100000033060 [0,2,0,0,0,0|2,0,0]=4 12895 B18R0.3155 CC#CCC(=O)CCCCCCCCCCCCC 1458a_100000756256_100000748600 [0,2,0,0,0,0|1,0,0]=3 12896 B18R0.3155 CC=CCC(=O)CCCCCCCCCCCCO 1458a_100121576822_100009813331 [0,2,0,0,0,0|2,0,0]=4 12897 B18R0.3155 CC=CCC(=O)NCCCCCCCCCCCC 11a_100000210451_100121576822 [0,2,0,0,0,0|2,0,0]=4 12898 B18R0.3155 CC=CCC(=O)NCCCCCCCCCCCC 1626a_100000210451_100121576822 [0,2,0,0,0,0|2,0,0]=4 12899 B18R0.3155 CC=CCC(=O)NCCCCCCCCCCCC 240690a_100000210451_100121576822 [0,2,0,0,0,0|2,0,0]=4 12900 B18R0.3155 CC=CCC(=O)NCCCCCCCCCCCC 527a_100000210451_100121576822 [0,2,0,0,0,0|2,0,0]=4 12901 B18R0.3155 CCC#CC(=O)CCCCCCCCCCCCC 1458a_100011827653_100000210684 [0,2,0,0,0,0|1,0,0]=3 12902 B18R0.3155 CCC#CC(=O)CCCCCCCCCCCCO 1458a_100011827653_100009813331 [0,2,0,0,0,0|2,0,0]=4 12903 B18R0.3155 CCC=CC(=O)CCCCCCCCCCCCO 1458a_100000212282_100009813331 [0,2,0,0,0,0|2,0,0]=4 12904 B18R0.3155 CCC=CC(=O)NCCCCCCCCCCCC 11a_100000210451_100000212282 [0,2,0,0,0,0|2,0,0]=4 12905 B18R0.3155 CCC=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000212282 [0,2,0,0,0,0|2,0,0]=4 12906 B18R0.3155 CCC=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000212282 [0,2,0,0,0,0|2,0,0]=4 12907 B18R0.3155 CCCCCCCCCCCCCC(=NNCC)C 4a_100000756455_100011216122 [0,2,0,0,0,0|2,0,0]=4 12908 B18R0.3155 CCCCCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100000210684 [0,2,0,0,0,0|1,0,0]=3 12909 B18R0.3155 CCCCCCCCCCCCCC(=O)C=COC 1458a_100016268678_100000210684 [0,2,0,0,0,0|0,0,0]=2 12910 B18R0.3155 CCCCCCCCCCCCCC(=O)CCC#N 1458a_100000756256_100011215226 [0,2,0,0,0,0|1,0,0]=3 12911 B18R0.3155 CCCCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210684 [0,2,0,0,0,0|1,0,0]=3 12912 B18R0.3155 CCCCCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000756256 [0,2,0,0,0,0|1,0,0]=3 12913 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCC 11a_100020643023_100000756256 [0,2,0,0,0,0|1,0,0]=3 12914 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000756256 [0,2,0,0,0,0|1,0,0]=3 12915 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000756256 [0,2,0,0,0,0|1,0,0]=3 12916 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF 11a_100000724931_100000756256 [0,2,0,0,0,0|1,0,0]=3 12917 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000756256 [0,2,0,0,0,0|1,0,0]=3 12918 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000756256 [0,2,0,0,0,0|1,0,0]=3 12919 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000756256 [0,2,0,0,0,0|1,0,0]=3 12920 B18R0.3155 CCCCCCCCCCCCCC(=O)NNCC 22a_100000756455_100000756256 [0,2,0,0,0,0|1,0,0]=3 12921 B18R0.3155 CCCCCCCCCCCCNC(=O)C=COC 1626a_100000210451_100016268678 [0,2,0,0,0,0|1,0,0]=3 12922 B18R0.3155 CCCCCCCCCCCCNC(=O)C=COC 240690a_100000210451_100016268678 [0,2,0,0,0,0|1,0,0]=3 12923 B18R0.3155 CCCCCCCCCCCCNC(=O)CCC#N 11a_100000210451_100011934036 [0,2,0,0,0,0|2,0,0]=4 12924 B18R0.3155 CCCCCCCCCCCCNC(=O)CCC#N 1626a_100000210451_100011934036 [0,2,0,0,0,0|2,0,0]=4 12925 B18R0.3155 CCCCCCCCCCCCNC(=O)CCC#N 240690a_100000210451_100011934036 [0,2,0,0,0,0|2,0,0]=4 12926 B18R0.3155 CCCCCCCCCCCCNC(=O)CCC#N 527a_100000210451_100011934036 [0,2,0,0,0,0|2,0,0]=4 12927 B18R0.3155 CCCCCCCCCCCCNC(=O)CCCC 11a_100000210451_100000210183 [0,2,0,0,0,0|2,0,0]=4 12928 B18R0.3155 CCCCCCCCCCCCNC(=O)CCCC 1626a_100000210451_100000210183 [0,2,0,0,0,0|2,0,0]=4 12929 B18R0.3155 CCCCCCCCCCCCNC(=O)CCCC 240690a_100000210451_100000210183 [0,2,0,0,0,0|2,0,0]=4 12930 B18R0.3155 CCCCCCCCCCCCNC(=O)CCCC 527a_100000210451_100000210183 [0,2,0,0,0,0|2,0,0]=4 12931 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 11a_100000210451_100000749529 [0,2,0,0,0,0|1,0,0]=3 12932 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 1626a_100000210451_100000749529 [0,2,0,0,0,0|1,0,0]=3 12933 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 240690a_100000210451_100000749529 [0,2,0,0,0,0|1,0,0]=3 12934 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 527a_100000210451_100000749529 [0,2,0,0,0,0|1,0,0]=3 12935 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 11a_100000210451_100000174002 [0,2,0,0,0,0|1,1,0]=4 12936 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 1626a_100000210451_100000174002 [0,2,0,0,0,0|1,1,0]=4 12937 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 240690a_100000210451_100000174002 [0,2,0,0,0,0|1,1,0]=4 12938 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 527a_100000210451_100000174002 [0,2,0,0,0,0|1,1,0]=4 12939 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 11a_100000210451_100000211967 [0,2,0,0,0,0|1,0,0]=3 12940 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 1626a_100000210451_100000211967 [0,2,0,0,0,0|1,0,0]=3 12941 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 240690a_100000210451_100000211967 [0,2,0,0,0,0|1,0,0]=3 12942 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 527a_100000210451_100000211967 [0,2,0,0,0,0|1,0,0]=3 12943 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 11a_100000210451_100000230394 [0,2,0,0,0,0|1,1,0]=4 12944 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 1626a_100000210451_100000230394 [0,2,0,0,0,0|1,1,0]=4 12945 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 240690a_100000210451_100000230394 [0,2,0,0,0,0|1,1,0]=4 12946 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 527a_100000210451_100000230394 [0,2,0,0,0,0|1,1,0]=4 12947 B18R0.3155 CCCCCCCCCCCCNC(=O)NCC#N 2708a_100000734998_100000210451 [0,2,0,0,0,0|2,0,0]=4 12948 B18R0.3155 CCCCCCCCCCCCNC(=O)NCC#N 273464a_100000210451_100000734998 [0,2,0,0,0,0|2,0,0]=4 12949 B18R0.3155 CCCCCCCCCCCCNC(=O)NCC#N 273464a_100000734998_100000210451 [0,2,0,0,0,0|2,0,0]=4 12950 B18R0.3155 CCCCCCCCCCCCNC(=O)NCC#N 512a_100000210451_100000734998 [0,2,0,0,0,0|2,0,0]=4 12951 B18R0.3155 CCCCCCCCCCCCNC(=O)NCC#N 512a_100000734998_100000210451 [0,2,0,0,0,0|2,0,0]=4 12952 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 2708a_100000210451_100020643023 [0,2,0,0,0,0|2,0,0]=4 12953 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000210451 [0,2,0,0,0,0|2,0,0]=4 12954 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 273464a_100000210451_100020643023 [0,2,0,0,0,0|2,0,0]=4 12955 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000210451 [0,2,0,0,0,0|2,0,0]=4 12956 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 512a_100000210451_100020643023 [0,2,0,0,0,0|2,0,0]=4 12957 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 512a_100020643023_100000210451 [0,2,0,0,0,0|2,0,0]=4 12958 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 2708a_100000210451_100000724931 [0,2,0,0,0,0|2,0,0]=4 12959 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 273464a_100000210451_100000724931 [0,2,0,0,0,0|2,0,0]=4 12960 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000210451 [0,2,0,0,0,0|2,0,0]=4 12961 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 512a_100000210451_100000724931 [0,2,0,0,0,0|2,0,0]=4 12962 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 2708a_100000210451_100000210304 [0,2,0,0,0,0|2,0,0]=4 12963 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000210451 [0,2,0,0,0,0|2,0,0]=4 12964 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 273464a_100000210451_100000210304 [0,2,0,0,0,0|2,0,0]=4 12965 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 512a_100000210451_100000210304 [0,2,0,0,0,0|2,0,0]=4 12966 B18R0.3155 CCCCCCCCCCCCNC(=O)NNCC 273464a_100000210451_100000756455 [0,2,0,0,0,0|2,0,0]=4 12967 B18R0.3155 CCCCCCCCCCCCNC(=O)NNCC 512a_100000210451_100000756455 [0,2,0,0,0,0|2,0,0]=4 12968 B18R0.3155 CCCCCCCCCCCCNC(=O)NNCC 512a_100000756455_100000210451 [0,2,0,0,0,0|2,0,0]=4 12969 B18R0.3155 CCCCCCCCCCCNCC(=O)NCC#N 2230a_200011215754_100000736037 [0,2,0,0,0,0|2,0,0]=4 12970 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100011215454 [0,2,0,0,0,0|2,0,0]=4 12971 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCC 2230a_200011215754_100000183358 [0,2,0,0,0,0|2,0,0]=4 12972 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCC 34a_200011215754_100000183358 [0,2,0,0,0,0|2,0,0]=4 12973 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCF 2230a_100000725713_100011215454 [0,2,0,0,0,0|2,0,0]=4 12974 B18R0.3155 CCCCCCCCCCCNCC(=O)OCCC 2230a_200011215754_200011215008 [0,2,0,0,0,0|1,0,0]=3 12975 B18R0.3155 CCCCCCCCCCCNCC(=O)OCCC 34a_200011215754_200011215008 [0,2,0,0,0,0|1,0,0]=3 12976 B18R0.3155 CCCCCCCCCCCOCC(=O)NCC#N 7a_100000210809_100000736037 [0,2,0,0,0,0|2,0,0]=4 12977 B18R0.3155 CCCCCCCCCCCOCC(=O)NCCC 34a_100000210809_100000183358 [0,2,0,0,0,0|2,0,0]=4 12978 B18R0.3155 CCCCCCCCCCCOCC(=O)NCCC 7a_100000210809_100000183358 [0,2,0,0,0,0|2,0,0]=4 12979 B18R0.3155 CCCCCCCCCCCOCC(=O)OCCC 34a_100000210809_200011215008 [0,2,0,0,0,0|1,0,0]=3 12980 B18R0.3155 CCCCCCCCCCCOCC(=O)OCCC 7a_100000210809_200011215008 [0,2,0,0,0,0|1,0,0]=3 12981 B18R0.3155 CCCCCCCCCCCSCC(=O)NCC#N 62a_100000736037_100011215454 [0,2,0,0,0,0|2,0,0]=4 12982 B18R0.3155 CCCCCCCCCCCSCC(=O)NCCC 62a_100000183358_100011215454 [0,2,0,0,0,0|2,0,0]=4 12983 B18R0.3155 CCCCCCCCCCCSCC(=O)OCCC 62a_200011215008_100011215454 [0,2,0,0,0,0|1,0,0]=3 12984 B18R0.3155 CCCCCCCCCCNCOC(=O)OCCC 34a_100000684558_200000139673 [0,2,0,0,0,0|2,0,0]=4 12985 B18R0.3155 CCCCCCCCCCOCOC(=O)OCCC 34a_100000210711_200000139673 [0,2,0,0,0,0|2,0,0]=4 12986 B18R0.3155 CCCCCCCCCCOCOC(=O)OCCC 7a_100000210711_200000139673 [0,2,0,0,0,0|2,0,0]=4 12987 B18R0.3155 CCCCCCCCCNCCCC(=O)NCCC 2230a_100000212291_100011194427 [0,2,0,0,0,0|2,0,0]=4 12988 B18R0.3155 CCCCCCCCCOCCCC(=O)NCCC 7a_100000210712_100011194427 [0,2,0,0,0,0|2,0,0]=4 12989 B18R0.3155 CCCCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210670 [0,2,0,0,0,0|2,0,0]=4 12990 B18R0.3155 CCCNC(=O)CCCCCCCCCCCCO 240690a_100020643023_100102582631 [0,2,0,0,0,0|2,0,0]=4 12991 B18R0.3155 CCCOC(=O)CNCCCCCCCCCCO 2230a_100000066964_200011215008 [0,2,0,0,0,0|2,0,0]=4 12992 B18R0.3155 CCCOC(=O)CNCCCCCCCCCCO 34a_100000066964_200011215008 [0,2,0,0,0,0|2,0,0]=4 12993 B18R0.3155 CCCOC(=O)COCCCCCCCCCCBr 34a_100009813290_200011215008 [0,2,0,0,0,0|2,0,0]=4 12994 B18R0.3155 CCCOC(=O)COCCCCCCCCCCBr 7a_100009813290_200011215008 [0,2,0,0,0,0|2,0,0]=4 12995 B18R0.3155 CCCOC(=O)COCCCCCCCCCCCl 34a_200000033068_200011215008 [0,2,0,0,0,0|2,0,0]=4 12996 B18R0.3155 CCCOC(=O)COCCCCCCCCCCCl 7a_200000033068_200011215008 [0,2,0,0,0,0|2,0,0]=4 12997 B18R0.3155 CCCOC(=O)COCCCCCCCCCCN 34a_100000066964_200011215008 [0,2,0,0,0,0|2,0,0]=4 12998 B18R0.3155 CCCOC(=O)CSCCCCCCCCCCO 62a_100009813290_200011215008 [0,2,0,0,0,0|2,0,0]=4 12999 B18R0.3155 CCCOC(=O)CSCCCCCCCCCCO 62a_200011215008_200000033068 [0,2,0,0,0,0|2,0,0]=4 13000 B18R0.3155 CCNNC(=O)CCCCCCCCCCCCO 22a_100000756455_100102582631 [0,2,0,0,0,0|2,0,0]=4 13001 B18R0.3155 COC=CC(=O)CCCCCCCCCCCCO 1458a_100016268678_100009813331 [0,2,0,0,0,0|1,0,0]=3 13002 B18R0.3155 COC=CC(=O)CCCCCCOCCCCCO 1458a_100016268678_200132310570 [0,2,0,0,0,0|2,0,0]=4 13003 B18R0.3155 N#CCCC(=O)CCCCCCCCCCCCO 1458a_100011934036_100009813331 [0,2,0,0,0,0|2,0,0]=4 13004 B18R0.3155 O=C(C#CCO)CCCCCCCCCCCCO 1458a_100000049017_100009813331 [0,2,0,0,0,0|2,0,0]=4 13005 B18R0.3155 O=C(CCCCCCCCCCCCO)NCCF 240690a_100000724931_100102582631 [0,2,0,0,0,0|2,0,0]=4 13006 B18R0.3155 O=C(CCCCCCCCCCCCO)NCCO 240690a_100000210304_100102582631 [0,2,0,0,0,0|2,0,0]=4 13007 B18R0.11638 CCCCCCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210670 [0,2,0,0,0,0|1,0,1]=4 13008 B18R0.11638 CCCCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210558_100011215271 [0,2,0,0,0,0|0,0,1]=3 13009 B18R0.11638 CCCCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210670 [0,2,0,0,0,0|0,0,1]=3 13010 B18R0.11638 CCCCCCCCCC(=O)CCNC(=O)OCC 1458a_100000210558_200011445536 [0,2,0,0,0,0|1,0,1]=4 13011 B18R0.11638 CCCCCCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100000210558 [0,2,0,0,0,0|1,0,1]=4 13012 B18R0.11638 CCCCCCCCCC(C)CNCC(=O)NCC 270004a_100016988866_200011218516 [0,2,0,0,0,0|2,0,0]=4 13013 B18R0.11638 CCCCCCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100011215753 [0,2,0,0,0,0|2,0,0]=4 13014 B18R0.11638 CCCCCCCCCC(C)OCCC(=O)NCC 7a_100011218016_100000737597 [0,2,0,0,0,0|2,0,0]=4 13015 B18R0.11638 CCCCCCCCCC(C)OCCC(=O)OCC 34a_100011218016_100000765890 [0,2,0,0,0,0|1,0,0]=3 13016 B18R0.11638 CCCCCCCCCC(C)OCCC(=O)OCC 7a_100011218016_100011206558 [0,2,0,0,0,0|1,0,0]=3 13017 B18R0.11638 CCCCCCCCCN(C)CCCC(=O)OCC 2230a_100000232482_100009991533 [0,2,0,0,0,0|1,0,0]=3 13018 B18R0.11638 CCCCCCCCCN(C)CCCC(=O)OCC 269982a_100000232482_100009991533 [0,2,0,0,0,0|1,0,0]=3 13019 B18R0.11638 CCCCCCCCCN(C)CCNC(=O)OCC 269982a_100000232482_200011445536 [0,2,0,0,0,0|2,0,0]=4 13020 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 11a_100000229939_100000210991 [0,2,0,0,0,0|1,0,1]=4 13021 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 1626a_100000229939_100000210991 [0,2,0,0,0,0|1,0,1]=4 13022 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 240690a_100000229939_100000210991 [0,2,0,0,0,0|1,0,1]=4 13023 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 527a_100000229939_100000210991 [0,2,0,0,0,0|1,0,1]=4 13024 B18R0.11638 CCOC(=O)CCCC(=O)CCCCCCCCO 1458a_100000210991_100000033203 [0,2,0,0,0,0|1,0,1]=4 13025 B18R0.19210 C=COC(=O)COC(C)CCCCCCCCCC 34a_100011215000_100000036128 [0,2,0,0,0,0|1,0,1]=4 13026 B18R0.19210 CCCCCCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210319 [0,2,0,0,0,0|1,0,1]=4 13027 B18R0.19210 CCCCCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210319 [0,2,0,0,0,0|0,0,1]=3 13028 B18R0.19210 CCCCCCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210319 [0,2,0,0,0,0|1,0,1]=4 13029 B18R0.19210 CCCCCCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100000210375 [0,2,0,0,0,0|1,0,1]=4 13030 B18R0.19210 CCCCCCCCCCC(C)NCC(=O)NCC 270004a_100016988866_200011219864 [0,2,0,0,0,0|2,0,0]=4 13031 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)CCC 7a_100011215000_100000747444 [0,2,0,0,0,0|2,0,0]=4 13032 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)NCC 34a_100011215000_100000183381 [0,2,0,0,0,0|2,0,0]=4 13033 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)NCC 7a_100011215000_100000183381 [0,2,0,0,0,0|2,0,0]=4 13034 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)NCO 34a_100011215000_100000185155 [0,2,0,0,0,0|2,0,0]=4 13035 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)NCO 7a_100011215000_100000185155 [0,2,0,0,0,0|2,0,0]=4 13036 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)OCC 34a_100011215000_100000188475 [0,2,0,0,0,0|1,0,0]=3 13037 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)OCC 7a_100011215000_100000188475 [0,2,0,0,0,0|1,0,0]=3 13038 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)NCC 2230a_100000207566_100000737597 [0,2,0,0,0,0|2,0,0]=4 13039 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)NCC 269982a_100000207566_100000737597 [0,2,0,0,0,0|2,0,0]=4 13040 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 2230a_100000207566_100011206558 [0,2,0,0,0,0|1,0,0]=3 13041 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000210320 [0,2,0,0,0,0|1,0,0]=3 13042 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 269982a_100000207566_100011206558 [0,2,0,0,0,0|1,0,0]=3 13043 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210320 [0,2,0,0,0,0|1,0,0]=3 13044 B18R0.19210 CCCCCCCCCNC(=O)CCC(=O)OCC 11a_100000212291_100000183558 [0,2,0,0,0,0|1,0,1]=4 13045 B18R0.19210 CCCCCCCCCNC(=O)CCC(=O)OCC 1626a_100000212291_100000183558 [0,2,0,0,0,0|1,0,1]=4 13046 B18R0.19210 CCCCCCCCCNC(=O)CCC(=O)OCC 240690a_100000212291_100000183558 [0,2,0,0,0,0|1,0,1]=4 13047 B18R0.19210 CCCCCCCCCNC(C)CCC(=O)OCC 2230a_100000212291_100000748298 [0,2,0,0,0,0|1,0,0]=3 13048 B18R0.19210 CCCCCCCCCNC(C)CCC(=O)OCC 34a_100000212291_100000748298 [0,2,0,0,0,0|1,0,0]=3 13049 B18R0.19210 CCCCCCCCCOC(C)CCC(=O)OCC 34a_100000210712_100000748298 [0,2,0,0,0,0|1,0,0]=3 13050 B18R0.19210 CCCCCCCCCOC(C)CCC(=O)OCC 7a_100000210712_100000748298 [0,2,0,0,0,0|1,0,0]=3 13051 B18R0.19210 CCCCCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000210670 [0,2,0,0,0,0|1,0,0]=3 13052 B18R0.19210 CCCCCCOCCOC(C)CCC(=O)OCC 34a_100000691444_100000748298 [0,2,0,0,0,0|2,0,0]=4 13053 B18R0.19210 CCCCCCOCCOC(C)CCC(=O)OCC 7a_100000691444_100000748298 [0,2,0,0,0,0|2,0,0]=4 13054 B18R0.19210 CCCCNCCCCOC(C)CCC(=O)OCC 34a_200011216965_100000748298 [0,2,0,0,0,0|2,0,0]=4 13055 B18R0.19210 CCCCOCCCCOC(C)CCC(=O)OCC 34a_200000760531_100000748298 [0,2,0,0,0,0|2,0,0]=4 13056 B18R0.19210 CCCCOCCCCOC(C)CCC(=O)OCC 7a_200000760531_100000748298 [0,2,0,0,0,0|2,0,0]=4 13057 B18R0.19210 CCOC(=O)CCC(=O)CCCCCCCCCO 1458a_100000183558_100009813782 [0,2,0,0,0,0|1,0,1]=4 13058 B18R0.19210 CCOC(=O)CCC(C)NCCCCCCCCO 2230a_102515433106_100000748298 [0,2,0,0,0,0|2,0,0]=4 13059 B18R0.19210 CCOC(=O)CCC(C)NCCCCCCCCO 34a_102515433106_100000748298 [0,2,0,0,0,0|2,0,0]=4 13060 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCBr 34a_100009813846_100000748298 [0,2,0,0,0,0|2,0,0]=4 13061 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCBr 7a_100009813846_100000748298 [0,2,0,0,0,0|2,0,0]=4 13062 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCCl 34a_100000033203_100000748298 [0,2,0,0,0,0|2,0,0]=4 13063 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCCl 7a_100000033203_100000748298 [0,2,0,0,0,0|2,0,0]=4 13064 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCN 34a_102515433106_100000748298 [0,2,0,0,0,0|2,0,0]=4 13065 B18R0.19210 CCOC(=O)CCC(C)SCCCCCCCCO 62a_100000033203_100000748298 [0,2,0,0,0,0|2,0,0]=4 13066 B18R0.19210 CCOC(=O)CCC(C)SCCCCCCCCO 62a_100000748298_100000033203 [0,2,0,0,0,0|2,0,0]=4 13067 B18R0.19210 CCOC(=O)CCN(C)CCCCCCCCCO 2230a_100000745921_100009813782 [0,2,0,0,0,0|2,0,0]=4 13068 B18R0.19210 CCOC(=O)CCN(C)CCCCCCCCCO 269982a_100000745921_100009813782 [0,2,0,0,0,0|2,0,0]=4 13069 B18R0.19354 C=C(C)CCOCCCCCCCCC(=O)OCC 34a_100000764851_100010175975 [0,2,0,0,0,0|1,0,1]=4 13070 B18R0.19354 C=C(C)CCSCCCCCCCCC(=O)OCC 62a_100000730704_100010175975 [0,2,0,0,0,0|1,0,1]=4 13071 B18R0.19354 C=C(C)COCCCCCCCCCC(=O)OCC 34a_100000210245_100009828014 [0,2,0,0,0,0|1,0,1]=4 13072 B18R0.19354 C=C(C)CSCCCCCCCCCC(=O)OCC 62a_100000748629_100009828014 [0,2,0,0,0,0|1,0,1]=4 13073 B18R0.19354 CCOC(=O)CCCCCCCCCCCC(=O)C 1458a_100000070787_100103168309 [0,2,0,0,0,0|0,0,1]=3 13074 B18R0.19354 CCOC(=O)CCCCCCCCCCCN(C)C 2230a_100102631434_100103168309 [0,2,0,0,0,0|1,0,0]=3 13075 B18R0.19354 CCOC(=O)CCCCCCCCCCCN(C)C 269982a_100102631434_100103168309 [0,2,0,0,0,0|1,0,0]=3 13076 B18R0.19354 CCOC(=O)CCCCCCCCCCNC(C)C 2230a_100138425928_100009827693 [0,2,0,0,0,0|1,0,0]=3 13077 B18R0.19354 CCOC(=O)CCCCCCCCCCNC(C)C 34a_100138425928_100009827693 [0,2,0,0,0,0|1,0,0]=3 13078 B18R0.19354 CCOC(=O)CCCCCCCCCCOC(C)C 34a_100000212225_100009827693 [0,2,0,0,0,0|1,0,0]=3 13079 B18R0.19354 CCOC(=O)CCCCCCCCCCSC(C)C 62a_100000210206_100009827693 [0,2,0,0,0,0|1,0,0]=3 13080 B18R0.19354 CCOC(=O)CCCCCCCCCNCC(C)C 2230a_100000210953_100009828014 [0,2,0,0,0,0|1,0,0]=3 13081 B18R0.19354 CCOC(=O)CCCCCCCCCNCC(C)C 34a_100000210953_100009828014 [0,2,0,0,0,0|1,0,0]=3 13082 B18R0.19354 CCOC(=O)CCCCCCCCCNCC(C)O 2230a_100000210904_100009828014 [0,2,0,0,0,0|1,0,0]=3 13083 B18R0.19354 CCOC(=O)CCCCCCCCCNCC(C)O 34a_100000210904_100009828014 [0,2,0,0,0,0|1,0,0]=3 13084 B18R0.19354 CCOC(=O)CCCCCCCCCNCC(F)F 34a_100000765723_100009828014 [0,2,0,0,0,0|2,0,0]=4 13085 B18R0.19354 CCOC(=O)CCCCCCCCCOCC(=O)C 34a_100000211253_100009828014 [0,2,0,0,0,0|1,0,1]=4 13086 B18R0.19354 CCOC(=O)CCCCCCCCCOCC(C)Br 34a_100012180447_100009828014 [0,2,0,0,0,0|1,0,0]=3 13087 B18R0.19354 CCOC(=O)CCCCCCCCCOCC(C)C 34a_100000210257_100009828014 [0,2,0,0,0,0|1,0,0]=3 13088 B18R0.19354 CCOC(=O)CCCCCCCCCOCC(C)F 34a_100015925927_100009828014 [0,2,0,0,0,0|1,0,0]=3 13089 B18R0.19354 CCOC(=O)CCCCCCCCCOCC(F)F 34a_100000743014_100009828014 [0,2,0,0,0,0|2,0,0]=4 13090 B18R0.19354 CCOC(=O)CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009828014 [0,2,0,0,0,0|1,0,0]=3 13091 B18R0.19354 CCOC(=O)CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100009828014 [0,2,0,0,0,0|1,0,0]=3 13092 B18R0.19354 CCOC(=O)CCCCCCCCCSCC(C)C 62a_100000210624_100009828014 [0,2,0,0,0,0|1,0,0]=3 13093 B18R0.19354 CCOC(=O)CCCCCCCCCSCC(C)O 62a_100011218427_100009828014 [0,2,0,0,0,0|1,0,0]=3 13094 B18R0.19354 CCOC(=O)CCCCCCCCCSCC(F)F 62a_100011934356_100009828014 [0,2,0,0,0,0|2,0,0]=4 13095 B18R0.19354 CCOC(=O)CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100009828014 [0,2,0,0,0,0|1,0,0]=3 13096 B18R0.19354 CCOC(=O)CCCCCCCCNCCC(C)O 2230a_200000755665_100010175975 [0,2,0,0,0,0|1,0,0]=3 13097 B18R0.19354 CCOC(=O)CCCCCCCCOCCC(=O)C 34a_100000759926_100010175975 [0,2,0,0,0,0|1,0,1]=4 13098 B18R0.19354 CCOC(=O)CCCCCCCCOCCC(=O)C 7a_100000759926_100010175975 [0,2,0,0,0,0|1,0,1]=4 13099 B18R0.19354 CCOC(=O)CCCCCCCCOCCC(C)Br 34a_100009893172_100010175975 [0,2,0,0,0,0|1,0,0]=3 13100 B18R0.19354 CCOC(=O)CCCCCCCCOCCC(C)C 34a_100000210254_100010175975 [0,2,0,0,0,0|1,0,0]=3 13101 B18R0.19354 CCOC(=O)CCCCCCCCOCCC(C)C 7a_100000210254_100010175975 [0,2,0,0,0,0|1,0,0]=3 13102 B18R0.19354 CCOC(=O)CCCCCCCCOCCC(F)F 34a_100103093639_100010175975 [0,2,0,0,0,0|2,0,0]=4 13103 B18R0.19354 CCOC(=O)CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100010175975 [0,2,0,0,0,0|1,0,0]=3 13104 B18R0.19354 CCOC(=O)CCCCCCCCSCCC(=O)C 62a_100000053229_100010175975 [0,2,0,0,0,0|1,0,1]=4 13105 B18R0.19354 CCOC(=O)CCCCCCCCSCCC(C)C 62a_100000210312_100010175975 [0,2,0,0,0,0|1,0,0]=3 13106 B18R0.19354 CCOC(=O)CCCCCCCCSCCC(C)O 62a_100012276601_100010175975 [0,2,0,0,0,0|1,0,0]=3 13107 B18R0.19354 CCOC(=O)CCCCCCCCSCOC(C)C 62a_100000709892_100010175975 [0,2,0,0,0,0|2,0,0]=4 13108 B18R0.19354 CCOC(=O)CCCCCCCNCCCC(C)C 2230a_200000737386_100009991516 [0,2,0,0,0,0|1,0,0]=3 13109 B18R0.19354 CCOC(=O)CCCCCCCNCCCC(C)C 34a_200000737386_100009991516 [0,2,0,0,0,0|1,0,0]=3 13110 B18R0.19354 CCOC(=O)CCCCCCCNCCCS(=O)C 2230a_200000753449_100009991516 [0,2,0,0,0,0|2,0,0]=4 13111 B18R0.19354 CCOC(=O)CCCCCCCNCCOC(C)C 2230a_100000701111_100009991516 [0,2,0,0,0,0|2,0,0]=4 13112 B18R0.19354 CCOC(=O)CCCCCCCNCCOC(C)C 34a_100000701111_100009991516 [0,2,0,0,0,0|2,0,0]=4 13113 B18R0.19354 CCOC(=O)CCCCCCCNCCSC(C)C 2230a_100000731138_100009991516 [0,2,0,0,0,0|2,0,0]=4 13114 B18R0.19354 CCOC(=O)CCCCCCCNCCSC(C)C 34a_100000731138_100009991516 [0,2,0,0,0,0|2,0,0]=4 13115 B18R0.19354 CCOC(=O)CCCCCCCOCCCC(=O)C 34a_100000759063_100009991516 [0,2,0,0,0,0|1,0,1]=4 13116 B18R0.19354 CCOC(=O)CCCCCCCOCCCC(=O)C 7a_100000759063_100009991516 [0,2,0,0,0,0|1,0,1]=4 13117 B18R0.19354 CCOC(=O)CCCCCCCOCCCC(C)C 34a_100000210774_100009991516 [0,2,0,0,0,0|1,0,0]=3 13118 B18R0.19354 CCOC(=O)CCCCCCCOCCCC(C)C 7a_100000210774_100009991516 [0,2,0,0,0,0|1,0,0]=3 13119 B18R0.19354 CCOC(=O)CCCCCCCOCCNC(C)C 34a_100000224655_100009991516 [0,2,0,0,0,0|2,0,0]=4 13120 B18R0.19354 CCOC(=O)CCCCCCCOCCOC(C)C 34a_100000211219_100009991516 [0,2,0,0,0,0|2,0,0]=4 13121 B18R0.19354 CCOC(=O)CCCCCCCOCCOC(C)C 7a_100000211219_100009991516 [0,2,0,0,0,0|2,0,0]=4 13122 B18R0.19354 CCOC(=O)CCCCCCCOCCSC(C)C 34a_200011212901_100009991516 [0,2,0,0,0,0|2,0,0]=4 13123 B18R0.19354 CCOC(=O)CCCCCCCOCCSC(C)C 7a_200011212901_100009991516 [0,2,0,0,0,0|2,0,0]=4 13124 B18R0.19354 CCOC(=O)CCCCCCCSCCCC(=O)C 62a_100011215641_100009991516 [0,2,0,0,0,0|1,0,1]=4 13125 B18R0.19354 CCOC(=O)CCCCCCCSCCCC(C)C 62a_100011214892_100009991516 [0,2,0,0,0,0|1,0,0]=3 13126 B18R0.19354 CCOC(=O)CCCCCCCSCCCC(C)O 62a_200000718107_100009991516 [0,2,0,0,0,0|1,0,0]=3 13127 B18R0.19354 CCOC(=O)CCCCCCCSCCOC(C)C 62a_100000211751_100009991516 [0,2,0,0,0,0|2,0,0]=4 13128 B18R0.19354 CCOC(=O)CCCCCCCSCCSC(C)C 62a_100000730970_100009991516 [0,2,0,0,0,0|2,0,0]=4 13129 B18R0.19354 CCOC(=O)CCCCCCNCCCOC(C)C 2230a_100000737246_100009814379 [0,2,0,0,0,0|2,0,0]=4 13130 B18R0.19354 CCOC(=O)CCCCCCNCCCOC(C)C 34a_100000737246_100009814379 [0,2,0,0,0,0|2,0,0]=4 13131 B18R0.19354 CCOC(=O)CCCCCCOCCCCC(C)C 34a_100011214890_100009814379 [0,2,0,0,0,0|1,0,0]=3 13132 B18R0.19354 CCOC(=O)CCCCCCOCCCCC(C)C 7a_100011214890_100009814379 [0,2,0,0,0,0|1,0,0]=3 13133 B18R0.19354 CCOC(=O)CCCCCCOCCCNC(C)C 34a_100000182298_100009814379 [0,2,0,0,0,0|2,0,0]=4 13134 B18R0.19354 CCOC(=O)CCCCCCOCCNCC(C)C 34a_100015185251_100009814379 [0,2,0,0,0,0|2,0,0]=4 13135 B18R0.19354 CCOC(=O)CCCCCCOCCOCC(C)C 34a_100000703358_100009814379 [0,2,0,0,0,0|2,0,0]=4 13136 B18R0.19354 CCOC(=O)CCCCCCOCCOCC(C)C 7a_100000703358_100009814379 [0,2,0,0,0,0|2,0,0]=4 13137 B18R0.19354 CCOC(=O)CCCCCCOCCSCC(C)C 34a_200000230437_100009814379 [0,2,0,0,0,0|2,0,0]=4 13138 B18R0.19354 CCOC(=O)CCCCCCOCCSCC(C)C 7a_200000230437_100009814379 [0,2,0,0,0,0|2,0,0]=4 13139 B18R0.19354 CCOC(=O)CCCCCCSCCCCC(=O)C 62a_100000735457_100009814379 [0,2,0,0,0,0|1,0,1]=4 13140 B18R0.19354 CCOC(=O)CCCCCCSCCCCC(C)C 62a_100011216152_100009814379 [0,2,0,0,0,0|1,0,0]=3 13141 B18R0.19354 CCOC(=O)CCCCCNCCCCCC(C)C 2230a_100011290863_100000755133 [0,2,0,0,0,0|1,0,0]=3 13142 B18R0.19354 CCOC(=O)CCCCCNCCCCCC(C)C 34a_100011290863_100000755133 [0,2,0,0,0,0|1,0,0]=3 13143 B18R0.19354 CCOC(=O)CCCCCNCCCOCC(C)C 2230a_100000205972_100000755133 [0,2,0,0,0,0|2,0,0]=4 13144 B18R0.19354 CCOC(=O)CCCCCNCCCOCC(C)C 34a_100000205972_100000755133 [0,2,0,0,0,0|2,0,0]=4 13145 B18R0.19354 CCOC(=O)CCCCCOCCCCCC(C)C 34a_100011995859_100000755133 [0,2,0,0,0,0|1,0,0]=3 13146 B18R0.19354 CCOC(=O)CCCCCOCCCCCC(C)C 7a_100011214988_100000210682 [0,2,0,0,0,0|1,0,0]=3 13147 B18R0.19354 CCOC(=O)CCCCCOCCCCCC(C)C 7a_100011995859_100000755133 [0,2,0,0,0,0|1,0,0]=3 13148 B18R0.19354 CCOC(=O)CCCCCOCCCCNC(C)C 34a_100011521146_100000755133 [0,2,0,0,0,0|2,0,0]=4 13149 B18R0.19354 CCOC(=O)CCCCCSCCCCCC(C)C 62a_100000210682_100000755133 [0,2,0,0,0,0|1,0,0]=3 13150 B18R0.19354 CCOC(=O)CCCCCSCCCCCC(C)C 62a_100000755133_100000210682 [0,2,0,0,0,0|1,0,0]=3 13151 B18R0.19354 CCOC(=O)CCCCNCCCCCCC(C)C 2230a_100000211014_100000750268 [0,2,0,0,0,0|1,0,0]=3 13152 B18R0.19354 CCOC(=O)CCCCNCCCCCCC(C)C 34a_100000211014_100000750268 [0,2,0,0,0,0|1,0,0]=3 13153 B18R0.19354 CCOC(=O)CCCCOCCCCCNC(C)C 34a_100011629493_100000750268 [0,2,0,0,0,0|2,0,0]=4 13154 B18R0.19354 CCOC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100009991533 [0,2,0,0,0,0|1,0,0]=3 13155 B18R0.19354 CCOC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100011215271 [0,2,0,0,0,0|1,0,0]=3 13156 B18R0.19354 CCOC(=O)COCCCNCCCCCC(C)C 2230a_100011290863_100009893628 [0,2,0,0,0,0|2,0,0]=4 13157 B18R0.19354 CCOC(=O)COCCCNCCCCCC(C)C 34a_100011290863_100009893628 [0,2,0,0,0,0|2,0,0]=4 13158 B18R0.19354 CCOC(=O)COCCCOCCCCCC(C)C 34a_100011995859_100009893628 [0,2,0,0,0,0|2,0,0]=4 13159 B18R0.19354 CCOC(=O)COCCCOCCCCCC(C)C 7a_100011995859_100009893628 [0,2,0,0,0,0|2,0,0]=4 13160 B18R0.19354 CCOC(=O)COCCCSCCCCCC(C)C 62a_100000210682_100009893628 [0,2,0,0,0,0|2,0,0]=4 13161 B18R0.19354 CCOC(=O)COCCCSCCCCCC(C)C 62a_100009893628_100000210682 [0,2,0,0,0,0|2,0,0]=4 13162 B18R0.19354 CCOC(=O)COCCNCCCCCCC(C)C 2230a_100000211014_100000088970 [0,2,0,0,0,0|2,0,0]=4 13163 B18R0.19354 CCOC(=O)COCCNCCCCCCC(C)C 34a_100000211014_100000088970 [0,2,0,0,0,0|2,0,0]=4 13164 B18R0.19354 CCOC(=O)NCCOCCCCCCCC(C)C 7a_200000210741_200011445536 [0,2,0,0,0,0|2,0,0]=4 13165 B18R0.213 COC(=O)CCCCCCCC(=O)CCCC(=O)C 1458a_100000033222_100011215641 [0,2,0,0,0,0|0,0,2]=4 13166 B18R0.213 COC(=O)CCCCCCCC(=O)CCCC(C)C 1458a_100000033222_100011214892 [0,2,0,0,0,0|0,0,1]=3 13167 B18R0.213 COC(=O)CCCCCCCC(=O)CCCC(C)C 1458a_100011216857_100010004213 [0,2,0,0,0,0|0,0,1]=3 13168 B18R0.213 COC(=O)CCCCCCCC(=O)CCCC(C)O 1458a_100000033222_200000718107 [0,2,0,0,0,0|0,0,1]=3 13169 B18R0.213 COC(=O)CCCCCCCC(=O)CCCN(C)C 1458a_100000033222_100000695564 [0,2,0,0,0,0|1,0,1]=4 13170 B18R0.213 COC(=O)CCCCCCCC(=O)CCOC(C)C 1458a_100000033222_100000211751 [0,2,0,0,0,0|1,0,1]=4 13171 B18R0.213 COC(=O)CCCCCCCC(=O)CCSC(C)C 1458a_100000033222_100000730970 [0,2,0,0,0,0|1,0,1]=4 13172 B18R0.213 COC(=O)CCCCCCCC(=O)COCC(C)C 1458a_100011223364_100010004213 [0,2,0,0,0,0|1,0,1]=4 13173 B18R0.213 COC(=O)CCCCCCCC(=O)NCCC(C)C 11a_100000210545_100000033222 [0,2,0,0,0,0|1,0,1]=4 13174 B18R0.213 COC(=O)CCCCCCCC(=O)NCCC(C)C 1626a_100000210545_100000033222 [0,2,0,0,0,0|1,0,1]=4 13175 B18R0.213 COC(=O)CCCCCCCC(=O)NCCC(C)C 240690a_100000210545_100000033222 [0,2,0,0,0,0|1,0,1]=4 13176 B18R0.213 COC(=O)CCCCCCCC(=O)NCCC(C)O 240690a_200000755665_100000033222 [0,2,0,0,0,0|1,0,1]=4 13177 B18R0.213 COC(=O)CCCCCCCN(C)CCCN(C)C 269982a_100000225831_100010004213 [0,2,0,0,0,0|2,0,0]=4 13178 B18R0.213 COC(=O)CCCCCCNC(=O)CCCC(C)C 188690a_100000739044_100011216857 [0,2,0,0,0,0|1,0,1]=4 13179 B18R0.213 COC(=O)CCCCCCNC(=O)CCCC(C)O 188690a_100000739044_100000761597 [0,2,0,0,0,0|1,0,1]=4 13180 B18R0.213 COC(=O)CCCCCCNC(C)CCCC(C)C 2230a_100000210607_100009815986 [0,2,0,0,0,0|1,0,0]=3 13181 B18R0.213 COC(=O)CCCCCCOC(C)CCCC(C)C 34a_200011218570_100009815986 [0,2,0,0,0,0|1,0,0]=3 13182 B18R0.213 COC(=O)CCCCCCOC(C)CCCC(C)C 7a_200011218570_100009815986 [0,2,0,0,0,0|1,0,0]=3 13183 B18R0.213 COC(=O)CCCCNCCC(C)CCCC(C)C 2230a_102516457229_100000204269 [0,2,0,0,0,0|1,0,0]=3 13184 B18R0.213 COC(=O)CCCCOCCC(C)CCCC(C)C 34a_100000015991_100000204269 [0,2,0,0,0,0|1,0,0]=3 13185 B18R0.213 COC(=O)CCCCOCCC(C)CCCC(C)C 34a_100000059025_100009816328 [0,2,0,0,0,0|1,0,0]=3 13186 B18R0.213 COC(=O)CCCCOCCC(C)CCCC(C)C 7a_100000015991_100000204269 [0,2,0,0,0,0|1,0,0]=3 13187 B18R0.213 COC(=O)CCCCOCCC(C)CCCC(C)C 7a_100000059025_100009816328 [0,2,0,0,0,0|1,0,0]=3 13188 B18R0.213 COC(=O)CCCCSCCC(C)CCCC(C)C 62a_100000204269_100009816328 [0,2,0,0,0,0|1,0,0]=3 13189 B18R0.213 COC(=O)CCCCSCCC(C)CCCC(C)C 62a_100009816328_100000204269 [0,2,0,0,0,0|1,0,0]=3 13190 B18R0.213 COC(=O)COCCNCCC(C)CCCC(C)C 2230a_102516457229_100000090808 [0,2,0,0,0,0|2,0,0]=4 13191 B18R0.213 COC(=O)COCCOCCC(C)CCCC(C)C 34a_100000015991_100000090808 [0,2,0,0,0,0|2,0,0]=4 13192 B18R0.213 COC(=O)COCCOCCC(C)CCCC(C)C 7a_100000015991_100000090808 [0,2,0,0,0,0|2,0,0]=4 13193 B18R0.213 COC(=O)COCCSCCC(C)CCCC(C)C 62a_100000090808_100009816328 [0,2,0,0,0,0|2,0,0]=4 13194 B18R0.213 COC(=O)COCCSCCC(C)CCCC(C)C 62a_100009816328_100000090808 [0,2,0,0,0,0|2,0,0]=4 13195 B18R0.245 C=C(CCC)CC(=O)CCCCCCCC(=O)OC 1458a_100000138376_100010004213 [0,2,0,0,0,0|0,0,2]=4 13196 B18R0.245 CCCC(=O)CC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000747444 [0,2,0,0,0,0|0,0,2]=4 13197 B18R0.245 CCCC(C)CC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100011216630 [0,2,0,0,0,0|0,0,1]=3 13198 B18R0.245 CCCC(C)CC(=O)CCCCCCCC(=O)OC 1458a_100000748435_100010004213 [0,2,0,0,0,0|0,0,1]=3 13199 B18R0.245 CCCC(C)CC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000748435 [0,2,0,0,0,0|1,0,1]=4 13200 B18R0.245 CCCC(C)NC(=O)CCCCCCCC(=O)OC 11a_100000741246_100000033222 [0,2,0,0,0,0|1,0,1]=4 13201 B18R0.245 CCCC(C)NC(=O)CCCCCCCC(=O)OC 1626a_100000741246_100000033222 [0,2,0,0,0,0|1,0,1]=4 13202 B18R0.245 CCCC(C)NC(=O)CCCCCCCC(=O)OC 240690a_100000741246_100000033222 [0,2,0,0,0,0|1,0,1]=4 13203 B18R0.245 CCCS(=O)CC(=O)CCCCCCCC(=O)OC 1458a_100011387404_100010004213 [0,2,0,0,0,0|1,0,1]=4 13204 B18R0.245 CCSC(C)CC(=O)CCCCCCCC(=O)OC 1458a_200011311441_100010004213 [0,2,0,0,0,0|1,0,1]=4 13205 B18R0.245 COCC(O)CN(C)CCCCCCCC(=O)OC 2230a_100000739405_100010004213 [0,2,0,0,0,0|2,0,0]=4 13206 B18R0.245 COCC(O)CN(C)CCCCCCCC(=O)OC 269982a_100000739405_100010004213 [0,2,0,0,0,0|2,0,0]=4 13207 B18R0.6678 CCCCC(C)C(=O)CCCCCCCC(=O)OC 1458a_100000033222_200011215066 [0,2,0,0,0,0|0,0,1]=3 13208 B18R0.6678 CCCCC(C)C(=O)CCCCCCCC(=O)OC 1458a_100000725509_100010004213 [0,2,0,0,0,0|0,0,1]=3 13209 B18R0.6678 CCCCC(C)C(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000725509 [0,2,0,0,0,0|1,0,1]=4 13210 B18R0.6678 CCCCC(O)C(=O)CCCCCCCC(=O)OC 1458a_100000720857_100010004213 [0,2,0,0,0,0|0,0,1]=3 13211 B18R0.6678 CCCCC(O)C(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000720857 [0,2,0,0,0,0|1,0,1]=4 13212 B18R0.6678 CCCCN(C)C(=O)CCCCCCCC(=O)OC 11a_100000207549_100000033222 [0,2,0,0,0,0|1,0,1]=4 13213 B18R0.6678 CCCCN(C)C(=O)CCCCCCCC(=O)OC 1626a_100000207549_100000033222 [0,2,0,0,0,0|1,0,1]=4 13214 B18R0.6678 CCCCN(C)C(=O)CCCCCCCC(=O)OC 240690a_100000207549_100000033222 [0,2,0,0,0,0|1,0,1]=4 13215 B18R0.6678 COC(=O)CCCCCCCC(=O)C(O)CCSC 1458a_100000685904_100010004213 [0,2,0,0,0,0|1,0,1]=4 13216 B18R0.6965 C#CC(CCCCC)OCCCCCCC(=O)OC 34a_100011216489_100009815986 [0,2,0,0,0,0|1,0,0]=3 13217 B18R0.6965 C#CC(CCCCC)OCCCCCCC(=O)OC 7a_100011216489_100009815986 [0,2,0,0,0,0|1,0,0]=3 13218 B18R0.6965 C=CC(CCCCC)OCCCCCCC(=O)OC 34a_100011216863_100009815986 [0,2,0,0,0,0|1,0,0]=3 13219 B18R0.6965 C=CC(CCCCC)OCCCCCCC(=O)OC 7a_100011216863_100009815986 [0,2,0,0,0,0|1,0,0]=3 13220 B18R0.6965 CCCCCC(CC)OCCCCCCC(=O)OC 34a_100011215405_100009815986 [0,2,0,0,0,0|1,0,0]=3 13221 B18R0.6965 CCCCCC(CC)OCCCCCCC(=O)OC 7a_100011215405_100009815986 [0,2,0,0,0,0|1,0,0]=3 13222 B18R0.6965 CCN(CCCCO)CCCCCCCC(=O)OC 2230a_100011217355_100010004213 [0,2,0,0,0,0|2,0,0]=4 13223 B18R0.6965 CCN(CCCCO)CCCCCCCC(=O)OC 269982a_100011217355_100010004213 [0,2,0,0,0,0|2,0,0]=4 13224 B18R0.13485 CCC(C)CCC(=O)CCCCCCCC(=O)OC 1458a_100000701222_100010004213 [0,2,0,0,0,0|0,0,1]=3 13225 B18R0.13485 CCC(C)CCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000701222 [0,2,0,0,0,0|1,0,1]=4 13226 B18R0.13485 CCC(C)CCC(C)OCCCCCCC(=O)OC 7a_200011216552_100009815986 [0,2,0,0,0,0|1,0,0]=3 13227 B18R0.13485 CCC(C)CCCCCOCC(=O)CCC(=O)OC 7a_200000035636_100000691467 [0,2,0,0,0,0|1,0,1]=4 13228 B18R0.13485 CCC(C)CNC(=O)CCCCCCCC(=O)OC 11a_100020588543_100000033222 [0,2,0,0,0,0|1,0,1]=4 13229 B18R0.13485 CCC(C)CNC(=O)CCCCCCCC(=O)OC 1626a_100020588543_100000033222 [0,2,0,0,0,0|1,0,1]=4 13230 B18R0.13485 CCC(C)CNC(=O)CCCCCCCC(=O)OC 240690a_100020588543_100000033222 [0,2,0,0,0,0|1,0,1]=4 13231 B18R0.13485 CCC(O)CCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_203496584001 [0,2,0,0,0,0|1,0,1]=4 13232 B18R0.13485 CCC(O)CNC(=O)CCCCCCCC(=O)OC 11a_100011218483_100000033222 [0,2,0,0,0,0|1,0,1]=4 13233 B18R0.13485 CCC(O)CNC(=O)CCCCCCCC(=O)OC 240690a_100011218483_100000033222 [0,2,0,0,0,0|1,0,1]=4 13234 B18R0.13485 CCN(C)CCC(=O)CCCCCCCC(=O)OC 1458a_100000755305_100010004213 [0,2,0,0,0,0|1,0,1]=4 13235 B18R0.13485 CCS(=O)CCC(=O)CCCCCCCC(=O)OC 1458a_100011387550_100010004213 [0,2,0,0,0,0|1,0,1]=4 13236 B18R0.19101 CCCCCC(O)CCCC(=O)NCCC(=O)OC 188690a_100000683876_100020618878 [0,2,0,0,0,0|1,0,1]=4 13237 B18R0.3149 CCC(NCCCCCCCCCCO)C(=O)OC 2230a_100000066964_100000235869 [0,2,0,0,0,0|2,0,0]=4 13238 B18R0.3149 CCC(NCCCCCCCCCCO)C(=O)OC 34a_100000066964_100000235869 [0,2,0,0,0,0|2,0,0]=4 13239 B18R0.3149 CCC(OCCCCCCCCCCBr)C(=O)OC 34a_100009813290_100000235869 [0,2,0,0,0,0|2,0,0]=4 13240 B18R0.3149 CCC(OCCCCCCCCCCBr)C(=O)OC 7a_100009813290_100000742303 [0,2,0,0,0,0|2,0,0]=4 13241 B18R0.3149 CCC(OCCCCCCCCCCCl)C(=O)OC 34a_200000033068_100000235869 [0,2,0,0,0,0|2,0,0]=4 13242 B18R0.3149 CCC(OCCCCCCCCCCCl)C(=O)OC 7a_200000033068_100000742303 [0,2,0,0,0,0|2,0,0]=4 13243 B18R0.3149 CCC(OCCCCCCCCCCN)C(=O)OC 34a_100000066964_100000235869 [0,2,0,0,0,0|2,0,0]=4 13244 B18R0.3149 CCC(OCCCCCCCCCCO)C(=O)OC 34a_100000695916_100009813290 [0,2,0,0,0,0|2,0,0]=4 13245 B18R0.3149 CCC(OCCCCCCCCCCO)C(=O)OC 7a_100000695916_100009813290 [0,2,0,0,0,0|2,0,0]=4 13246 B18R0.3149 CCC(SCCCCCCCCCCO)C(=O)OC 62a_100000235869_200000033068 [0,2,0,0,0,0|2,0,0]=4 13247 B18R0.3149 CCC(SCCCCCCCCCCO)C(=O)OC 62a_100009813290_100000235869 [0,2,0,0,0,0|2,0,0]=4 13248 B18R0.3149 CCCCCCCCCCCCC(NC)C(=O)OC 2230a_106832991635_100000036989 [0,2,0,0,0,0|0,0,0]=2 13249 B18R0.3149 CCCCCCCCCCCCC(NC)C(=O)OC 34a_100102657272_100000036989 [0,2,0,0,0,0|0,0,0]=2 13250 B18R0.3149 CCCCCCCCCCCCC(NC)C(=O)OC 7a_106832991635_100000036989 [0,2,0,0,0,0|0,0,0]=2 13251 B18R0.3149 CCCCCCCCCCCCC(OC)C(=O)OC 34a_100138415774_100000036989 [0,2,0,0,0,0|0,0,0]=2 13252 B18R0.3149 CCCCCCCCCCCCC(SC)C(=O)OC 62a_100000036989_200000210301 [0,2,0,0,0,0|0,0,0]=2 13253 B18R0.3149 CCCCCCCCCCCCC(SC)C(=O)OC 62a_200000210301_100000036989 [0,2,0,0,0,0|0,0,0]=2 13254 B18R0.3149 CCCCCCCCCCCCC(S[13CH3])C(=O)OC 62a_100000036989_200025704644 [0,2,0,0,0,0|0,0,0]=2 13255 B18R0.3149 CCCCCCCCCCCCC(S[13CH3])C(=O)OC 62a_200025704644_100000036989 [0,2,0,0,0,0|0,0,0]=2 13256 B18R0.3149 CCCCCCCCCCCNC(C=O)C(=O)OC 34a_200011215754_100000046368 [0,2,0,0,0,0|1,0,0]=3 13257 B18R0.3149 CCCCCCCCCCCNC(CC)C(=O)OC 2230a_200011215754_100000235869 [0,2,0,0,0,0|1,0,0]=3 13258 B18R0.3149 CCCCCCCCCCCNC(CC)C(=O)OC 34a_200011215754_100000235869 [0,2,0,0,0,0|1,0,0]=3 13259 B18R0.3149 CCCCCCCCCCCNC(CO)C(=O)OC 34a_200011215754_100012276630 [0,2,0,0,0,0|1,0,0]=3 13260 B18R0.3149 CCCCCCCCCCCNC(OC)C(=O)OC 34a_200011215754_100000101307 [0,2,0,0,0,0|1,0,0]=3 13261 B18R0.3149 CCCCCCCCCCCN[C@@H](CC)C(=O)NC 2230a_106657271573_100011215454 [0,2,0,0,0,0|2,0,0]=4 13262 B18R0.3149 CCCCCCCCCCCN[C@@H](CC)C(=O)NC 34a_106657271573_100011215454 [0,2,0,0,0,0|2,0,0]=4 13263 B18R0.3149 CCCCCCCCCCCOC(C=O)C(=O)OC 34a_100000210809_100000046368 [0,2,0,0,0,0|1,0,0]=3 13264 B18R0.3149 CCCCCCCCCCCOC(CC)C(=O)CC 34a_200011218131_100011215454 [0,2,0,0,0,0|2,0,0]=4 13265 B18R0.3149 CCCCCCCCCCCOC(CC)C(=O)CC 7a_200011218131_100011215454 [0,2,0,0,0,0|2,0,0]=4 13266 B18R0.3149 CCCCCCCCCCCOC(CC)C(=O)OC 34a_100000210809_100000235869 [0,2,0,0,0,0|1,0,0]=3 13267 B18R0.3149 CCCCCCCCCCCOC(CC)C(=O)OC 34a_100000695916_100011215454 [0,2,0,0,0,0|1,0,0]=3 13268 B18R0.3149 CCCCCCCCCCCOC(CC)C(=O)OC 7a_100000210809_100000742303 [0,2,0,0,0,0|1,0,0]=3 13269 B18R0.3149 CCCCCCCCCCCOC(CC)C(=O)OC 7a_100000695916_100011215454 [0,2,0,0,0,0|1,0,0]=3 13270 B18R0.3149 CCCCCCCCCCCOC(CN)C(=O)OC 34a_100000695228_100011215454 [0,2,0,0,0,0|1,0,0]=3 13271 B18R0.3149 CCCCCCCCCCCOC(CO)C(=O)OC 34a_100000210809_100012276630 [0,2,0,0,0,0|1,0,0]=3 13272 B18R0.3149 CCCCCCCCCCCOC(OC)C(=O)OC 34a_100000036821_100011215454 [0,2,0,0,0,0|1,0,0]=3 13273 B18R0.3149 CCCCCCCCCCCOC(OC)C(=O)OC 34a_100000210809_100000101307 [0,2,0,0,0,0|1,0,0]=3 13274 B18R0.3149 CCCCCCCCCCCSC(C=O)C(=O)OC 62a_100000046368_100011215454 [0,2,0,0,0,0|1,0,0]=3 13275 B18R0.3149 CCCCCCCCCCCSC(CC)C(=O)OC 62a_100000235869_100011215454 [0,2,0,0,0,0|1,0,0]=3 13276 B18R0.3149 CCCCCCCCCCCSC(CO)C(=O)OC 62a_100012276630_100011215454 [0,2,0,0,0,0|1,0,0]=3 13277 B18R0.3149 CCCCCCCCCCCSC(OC)C(=O)OC 62a_100000101307_100011215454 [0,2,0,0,0,0|1,0,0]=3 13278 B18R0.3149 COC(=O)C(C=O)NCCCCCCCCCCO 34a_100000066964_100000046368 [0,2,0,0,0,0|2,0,0]=4 13279 B18R0.3149 COC(=O)C(C=O)OCCCCCCCCCCBr 34a_100009813290_100000046368 [0,2,0,0,0,0|2,0,0]=4 13280 B18R0.3149 COC(=O)C(C=O)OCCCCCCCCCCCl 34a_200000033068_100000046368 [0,2,0,0,0,0|2,0,0]=4 13281 B18R0.3149 COC(=O)C(C=O)OCCCCCCCCCCN 34a_100000066964_100000046368 [0,2,0,0,0,0|2,0,0]=4 13282 B18R0.3149 COC(=O)C(C=O)SCCCCCCCCCCO 62a_100000046368_200000033068 [0,2,0,0,0,0|2,0,0]=4 13283 B18R0.3149 COC(=O)C(C=O)SCCCCCCCCCCO 62a_100009813290_100000046368 [0,2,0,0,0,0|2,0,0]=4 13284 B18R0.3149 COC(=O)C(CN)OCCCCCCCCCCO 34a_100000695228_100009813290 [0,2,0,0,0,0|2,0,0]=4 13285 B18R0.3149 COC(=O)C(CO)NCCCCCCCCCCO 34a_100000066964_100012276630 [0,2,0,0,0,0|2,0,0]=4 13286 B18R0.3149 COC(=O)C(CO)OCCCCCCCCCCBr 34a_100009813290_100012276630 [0,2,0,0,0,0|2,0,0]=4 13287 B18R0.3149 COC(=O)C(CO)OCCCCCCCCCCCl 34a_200000033068_100012276630 [0,2,0,0,0,0|2,0,0]=4 13288 B18R0.3149 COC(=O)C(CO)OCCCCCCCCCCN 34a_100000066964_100012276630 [0,2,0,0,0,0|2,0,0]=4 13289 B18R0.3149 COC(=O)C(CO)SCCCCCCCCCCO 62a_100009813290_100012276630 [0,2,0,0,0,0|2,0,0]=4 13290 B18R0.3149 COC(=O)C(CO)SCCCCCCCCCCO 62a_100012276630_200000033068 [0,2,0,0,0,0|2,0,0]=4 13291 B18R0.3149 COC(=O)C(NCCCCCCCCCCO)OC 34a_100000066964_100000101307 [0,2,0,0,0,0|2,0,0]=4 13292 B18R0.3149 COC(=O)C(OC)OCCCCCCCCCCBr 34a_100009813290_100000101307 [0,2,0,0,0,0|2,0,0]=4 13293 B18R0.3149 COC(=O)C(OC)OCCCCCCCCCCCl 34a_200000033068_100000101307 [0,2,0,0,0,0|2,0,0]=4 13294 B18R0.3149 COC(=O)C(OC)OCCCCCCCCCCN 34a_100000066964_100000101307 [0,2,0,0,0,0|2,0,0]=4 13295 B18R0.3149 COC(=O)C(OC)OCCCCCCCCCCO 34a_100000036821_100009813290 [0,2,0,0,0,0|2,0,0]=4 13296 B18R0.3149 COC(=O)C(OC)SCCCCCCCCCCO 62a_100000101307_200000033068 [0,2,0,0,0,0|2,0,0]=4 13297 B18R0.3149 COC(=O)C(OC)SCCCCCCCCCCO 62a_100009813290_100000101307 [0,2,0,0,0,0|2,0,0]=4 13298 B18R0.6757 CCCCC(C)CCCCOCCC(C)C(=O)OC 34a_200011021034_100000034942 [0,2,0,0,0,0|1,0,0]=3 13299 B18R0.6757 CCCCC(C)CCCCOCCC(C)C(=O)OC 7a_200011021034_100000034942 [0,2,0,0,0,0|1,0,0]=3 13300 B18R0.11196 CCCCCCCCCCCC(=O)C(C)C(=O)CC 1458a_100000210736_100000742827 [0,2,0,0,0,0|1,0,1]=4 13301 B18R0.11196 CCCCCCCCCCCC(=O)C(C)C(=O)NC 1458a_100000210736_100000209862 [0,2,0,0,0,0|1,0,1]=4 13302 B18R0.11196 CCCCCCCCCCCC(=O)C(C)C(=O)OC 1458a_100000210736_100000211248 [0,2,0,0,0,0|0,0,1]=3 13303 B18R0.11196 CCCCCCCCCCCC(=O)C(C)C(=O)OC 1458a_100012027023_100011215454 [0,2,0,0,0,0|0,0,1]=3 13304 B18R0.11196 CCCCCCCCCCCC(=O)C(F)C(=O)NC 1458a_100000210736_100009813575 [0,2,0,0,0,0|1,0,1]=4 13305 B18R0.11196 CCCCCCCCCCCN(C)C(C)C(=O)OC 2230a_100000725243_100011215454 [0,2,0,0,0,0|1,0,0]=3 13306 B18R0.11196 CCCCCCCCCCCN(C)C(C)C(=O)OC 269982a_100000725243_100011215454 [0,2,0,0,0,0|1,0,0]=3 13307 B18R0.11196 CCCCCCCCCCNC(=O)C(C)C(=O)OC 11a_100000684558_100012027023 [0,2,0,0,0,0|1,0,1]=4 13308 B18R0.11196 CCCCCCCCCCNC(=O)C(C)C(=O)OC 1626a_100000684558_100012027023 [0,2,0,0,0,0|1,0,1]=4 13309 B18R0.11196 CCCCCCCCCCNC(=O)C(C)C(=O)OC 240690a_100000684558_100012027023 [0,2,0,0,0,0|1,0,1]=4 13310 B18R0.11196 CCCCCCCCCCNC(=O)C(C)C(=O)OC 527a_100000684558_100012027023 [0,2,0,0,0,0|1,0,1]=4 13311 B18R0.11196 CCCCCCCCCCNC(C)C(=O)C(=O)OC 2230a_100000684558_100000692041 [0,2,0,0,0,0|1,0,1]=4 13312 B18R0.11196 CCCCCCCCCCNC(C)C(=O)C(=O)OC 34a_100000684558_100000692041 [0,2,0,0,0,0|1,0,1]=4 13313 B18R0.11196 CCCCCCCCCCOC(C)C(=O)C(=O)OC 34a_100000210711_100000692041 [0,2,0,0,0,0|1,0,1]=4 13314 B18R0.11196 CCCCCCCCCCO[C@H](C)[C@H](N)C(=O)NC 34a_100102634413_100000210320 [0,2,0,0,0,0|2,0,0]=4 13315 B18R0.11196 CCCCCCCCCCO[C@H](C)[C@H](N)C(=O)OC 34a_100000004424_100000210320 [0,2,0,0,0,0|1,0,0]=3 13316 B18R0.11196 CCCCCCCCCCSC(C)C(=O)C(=O)OC 62a_100000692041_100000210320 [0,2,0,0,0,0|1,0,1]=4 13317 B18R0.11196 COC(=O)C(C)C(=O)CCCCCCCCCCO 1458a_100012027023_100009813290 [0,2,0,0,0,0|1,0,1]=4 13318 B18R0.11196 COC(=O)C(C)N(C)CCCCCCCCCCO 2230a_100000725243_100009813290 [0,2,0,0,0,0|2,0,0]=4 13319 B18R0.11196 COC(=O)C(C)N(C)CCCCCCCCCCO 269982a_100000725243_100009813290 [0,2,0,0,0,0|2,0,0]=4 13320 B18R0.11196 COC(=O)[C@@H](N)[C@@H](C)OCCCCCCCCCO 34a_100000004424_100009813782 [0,2,0,0,0,0|2,0,0]=4 13321 B18R0.13763 CCCCCCCCCCCNC(C)(C)C(=O)NC 2230a_200011215754_100000732697 [0,2,0,0,0,0|2,0,0]=4 13322 B18R0.13763 CCCCCCCCCCCNC(C)(C)C(=O)NC 34a_200011215754_100000732697 [0,2,0,0,0,0|2,0,0]=4 13323 B18R0.13763 CCCCCCCCCCCNC(C)(C)C(=O)OC 2230a_200011215754_100000689032 [0,2,0,0,0,0|1,0,0]=3 13324 B18R0.13763 CCCCCCCCCCCNC(C)(F)C(=O)OC 2230a_200011215754_200009867631 [0,2,0,0,0,0|1,0,0]=3 13325 B18R0.13763 CCCCCCCCCCCNC(C)(F)C(=O)OC 34a_200011215754_200009867631 [0,2,0,0,0,0|1,0,0]=3 13326 B18R0.13763 CCCCCCCCCCCNC(F)(F)C(=O)OC 34a_200011215754_100000211177 [0,2,0,0,0,0|1,0,0]=3 13327 B18R0.13763 CCCCCCCCCCCOC(C)(C)C(=O)NC 34a_100000210809_100000732697 [0,2,0,0,0,0|2,0,0]=4 13328 B18R0.13763 CCCCCCCCCCCOC(C)(C)C(=O)OC 34a_100011217581_100011215454 [0,2,0,0,0,0|1,0,0]=3 13329 B18R0.13763 CCCCCCCCCCCOC(C)(C)C(=O)OC 7a_100011217581_100011215454 [0,2,0,0,0,0|1,0,0]=3 13330 B18R0.13763 CCCCCCCCCCCOC(C)(F)C(=O)OC 34a_100000210809_200009867631 [0,2,0,0,0,0|1,0,0]=3 13331 B18R0.13763 CCCCCCCCCCCOC(F)(F)C(=O)OC 34a_100000210809_100000211177 [0,2,0,0,0,0|1,0,0]=3 13332 B18R0.13763 CCCCCCCCCCCOC(F)(F)C(=O)OC 7a_100000210809_100000211177 [0,2,0,0,0,0|1,0,0]=3 13333 B18R0.13763 CCCCCCCCCCCSC(C)(C)C(=O)NC 62a_100000732697_100011215454 [0,2,0,0,0,0|2,0,0]=4 13334 B18R0.13763 CCCCCCCCCCCSC(C)(C)C(=O)OC 62a_100000689032_100011215454 [0,2,0,0,0,0|1,0,0]=3 13335 B18R0.13763 CCCCCCCCCCCSC(C)(F)C(=O)OC 62a_200009867631_100011215454 [0,2,0,0,0,0|1,0,0]=3 13336 B18R0.13763 CCCCCCCCCCCSC(F)(F)C(=O)OC 62a_100000211177_100011215454 [0,2,0,0,0,0|1,0,0]=3 13337 B18R0.13763 CCCCCCCCCCNCC(C)(C)C(=O)NC 34a_100000684558_100000702813 [0,2,0,0,0,0|2,0,0]=4 13338 B18R0.13763 CCCCCCCCCCNCC(F)(F)C(=O)OC 34a_100000684558_100010295740 [0,2,0,0,0,0|1,0,0]=3 13339 B18R0.13763 CCCCCCCCCCOCC(C)(C)C(=O)NC 34a_100000210711_100000702813 [0,2,0,0,0,0|2,0,0]=4 13340 B18R0.13763 CCCCCCCCCCOCC(C)(C)C(=O)OC 34a_100000709632_100000210320 [0,2,0,0,0,0|1,0,0]=3 13341 B18R0.13763 CCCCCCCCCCOCC(C)(C)C(=O)OC 7a_100000709632_100000210320 [0,2,0,0,0,0|1,0,0]=3 13342 B18R0.13763 CCCCCCCCCCOCC(F)(F)C(=O)OC 34a_100000210711_100010295740 [0,2,0,0,0,0|1,0,0]=3 13343 B18R0.13763 CCCCCCCCCCSCC(C)(C)C(=O)NC 62a_100000702813_100000210320 [0,2,0,0,0,0|2,0,0]=4 13344 B18R0.13763 CCCCCCCCCCSCC(C)(C)C(=O)OC 62a_100000684552_100000210320 [0,2,0,0,0,0|1,0,0]=3 13345 B18R0.13763 CCCCCCCCCCSCC(F)(F)C(=O)OC 62a_100010295740_100000210320 [0,2,0,0,0,0|1,0,0]=3 13346 B18R0.13763 CCCCCCCCNCCCC(C)(C)C(=O)OC 2230a_100000229939_100010114820 [0,2,0,0,0,0|1,0,0]=3 13347 B18R0.13763 CCCCCCCCNCCCC(C)(C)C(=O)OC 34a_100000229939_100010114820 [0,2,0,0,0,0|1,0,0]=3 13348 B18R0.13763 CCCCCCCCOCCCC(C)(C)C(=O)OC 34a_100000210232_100010114820 [0,2,0,0,0,0|1,0,0]=3 13349 B18R0.13763 CCCCCCCCOCCCC(C)(C)C(=O)OC 7a_100000210232_100010114820 [0,2,0,0,0,0|1,0,0]=3 13350 B18R0.13763 CCCCCCCCSCCCC(C)(C)C(=O)OC 62a_100000210759_100010114820 [0,2,0,0,0,0|1,0,0]=3 13351 B18R0.13763 CCCCCCCCSCCCC(C)(C)C(=O)OC 62a_100010114820_100000210317 [0,2,0,0,0,0|1,0,0]=3 13352 B18R0.13763 CCCCCNCCOCCCC(C)(C)C(=O)OC 34a_100000224656_100010114820 [0,2,0,0,0,0|2,0,0]=4 13353 B18R0.13763 CCCCCOCCOCCCC(C)(C)C(=O)OC 34a_100011215259_100010114820 [0,2,0,0,0,0|2,0,0]=4 13354 B18R0.13763 CCCCCOCCOCCCC(C)(C)C(=O)OC 7a_100011215259_100010114820 [0,2,0,0,0,0|2,0,0]=4 13355 B18R0.13763 CCCCOCCCNCCCC(C)(C)C(=O)OC 2230a_200000211371_100010114820 [0,2,0,0,0,0|2,0,0]=4 13356 B18R0.13763 CCCCOCCCNCCCC(C)(C)C(=O)OC 34a_200000211371_100010114820 [0,2,0,0,0,0|2,0,0]=4 13357 B18R0.13763 CCCCOCCCOCCCC(C)(C)C(=O)OC 34a_200011215613_100010114820 [0,2,0,0,0,0|2,0,0]=4 13358 B18R0.13763 CCCCOCCCOCCCC(C)(C)C(=O)OC 7a_200011215613_100010114820 [0,2,0,0,0,0|2,0,0]=4 13359 B18R0.13763 COC(=O)C(C)(C)CCCNCCCCCCCO 2230a_100011996573_100010114820 [0,2,0,0,0,0|2,0,0]=4 13360 B18R0.13763 COC(=O)C(C)(C)CCCNCCCCCCCO 34a_100011996573_100010114820 [0,2,0,0,0,0|2,0,0]=4 13361 B18R0.13763 COC(=O)C(C)(C)CCCOCCCCCCCBr 34a_100000760002_100010114820 [0,2,0,0,0,0|2,0,0]=4 13362 B18R0.13763 COC(=O)C(C)(C)CCCOCCCCCCCBr 7a_100000760002_100010114820 [0,2,0,0,0,0|2,0,0]=4 13363 B18R0.13763 COC(=O)C(C)(C)CCCOCCCCCCCN 34a_100011996573_100010114820 [0,2,0,0,0,0|2,0,0]=4 13364 B18R0.13763 COC(=O)C(C)(C)CCCSCCCCCCCO 62a_100000760002_100010114820 [0,2,0,0,0,0|2,0,0]=4 13365 B18R0.13763 COC(=O)C(C)(C)CCCSCCCCCCCO 62a_100010114820_100000760002 [0,2,0,0,0,0|2,0,0]=4 13366 B18R0.13763 COC(=O)C(C)(C)COCCCCCCCCCO 34a_100000709632_100009813782 [0,2,0,0,0,0|2,0,0]=4 13367 B18R0.13763 COC(=O)C(C)(C)COCCCCCCCCCO 7a_100000709632_100009813782 [0,2,0,0,0,0|2,0,0]=4 13368 B18R0.13763 COC(=O)C(C)(C)CSCCCCCCCCCO 62a_100000684552_100009813782 [0,2,0,0,0,0|2,0,0]=4 13369 B18R0.13763 COC(=O)C(C)(C)CSCCCCCCCCCO 62a_100009813782_100000684552 [0,2,0,0,0,0|2,0,0]=4 13370 B18R0.13763 COC(=O)C(C)(C)NCCCCCCCCCCO 2230a_100000066964_100000689032 [0,2,0,0,0,0|2,0,0]=4 13371 B18R0.13763 COC(=O)C(C)(C)OCCCCCCCCCCO 34a_100011217581_100009813290 [0,2,0,0,0,0|2,0,0]=4 13372 B18R0.13763 COC(=O)C(C)(C)OCCCCCCCCCCO 7a_100011217581_100009813290 [0,2,0,0,0,0|2,0,0]=4 13373 B18R0.13763 COC(=O)C(C)(C)SCCCCCCCCCCO 62a_100000689032_200000033068 [0,2,0,0,0,0|2,0,0]=4 13374 B18R0.13763 COC(=O)C(C)(C)SCCCCCCCCCCO 62a_100009813290_100000689032 [0,2,0,0,0,0|2,0,0]=4 13375 B18R0.13763 COC(=O)C(C)(F)NCCCCCCCCCCO 2230a_100000066964_200009867631 [0,2,0,0,0,0|2,0,0]=4 13376 B18R0.13763 COC(=O)C(C)(F)NCCCCCCCCCCO 34a_100000066964_200009867631 [0,2,0,0,0,0|2,0,0]=4 13377 B18R0.13763 COC(=O)C(C)(F)OCCCCCCCCCCBr 34a_100009813290_200009867631 [0,2,0,0,0,0|2,0,0]=4 13378 B18R0.13763 COC(=O)C(C)(F)OCCCCCCCCCCCl 34a_200000033068_200009867631 [0,2,0,0,0,0|2,0,0]=4 13379 B18R0.13763 COC(=O)C(C)(F)OCCCCCCCCCCN 34a_100000066964_200009867631 [0,2,0,0,0,0|2,0,0]=4 13380 B18R0.13763 COC(=O)C(C)(F)SCCCCCCCCCCO 62a_100009813290_200009867631 [0,2,0,0,0,0|2,0,0]=4 13381 B18R0.13763 COC(=O)C(C)(F)SCCCCCCCCCCO 62a_200009867631_200000033068 [0,2,0,0,0,0|2,0,0]=4 13382 B18R0.13763 COC(=O)C(F)(F)CNCCCCCCCCCO 34a_100000078944_100010295740 [0,2,0,0,0,0|2,0,0]=4 13383 B18R0.13763 COC(=O)C(F)(F)COCCCCCCCCCBr 34a_100009813782_100010295740 [0,2,0,0,0,0|2,0,0]=4 13384 B18R0.13763 COC(=O)C(F)(F)COCCCCCCCCCCl 34a_100009868337_100010295740 [0,2,0,0,0,0|2,0,0]=4 13385 B18R0.13763 COC(=O)C(F)(F)COCCCCCCCCCN 34a_100000078944_100010295740 [0,2,0,0,0,0|2,0,0]=4 13386 B18R0.13763 COC(=O)C(F)(F)CSCCCCCCCCCO 62a_100009813782_100010295740 [0,2,0,0,0,0|2,0,0]=4 13387 B18R0.13763 COC(=O)C(F)(F)CSCCCCCCCCCO 62a_100010295740_100009813782 [0,2,0,0,0,0|2,0,0]=4 13388 B18R0.13763 COC(=O)C(F)(F)NCCCCCCCCCCO 34a_100000066964_100000211177 [0,2,0,0,0,0|2,0,0]=4 13389 B18R0.13763 COC(=O)C(F)(F)OCCCCCCCCCCBr 34a_100009813290_100000211177 [0,2,0,0,0,0|2,0,0]=4 13390 B18R0.13763 COC(=O)C(F)(F)OCCCCCCCCCCBr 7a_100009813290_100000211177 [0,2,0,0,0,0|2,0,0]=4 13391 B18R0.13763 COC(=O)C(F)(F)OCCCCCCCCCCCl 34a_200000033068_100000211177 [0,2,0,0,0,0|2,0,0]=4 13392 B18R0.13763 COC(=O)C(F)(F)OCCCCCCCCCCCl 7a_200000033068_100000211177 [0,2,0,0,0,0|2,0,0]=4 13393 B18R0.13763 COC(=O)C(F)(F)OCCCCCCCCCCN 34a_100000066964_100000211177 [0,2,0,0,0,0|2,0,0]=4 13394 B18R0.13763 COC(=O)C(F)(F)SCCCCCCCCCCO 62a_100000211177_200000033068 [0,2,0,0,0,0|2,0,0]=4 13395 B18R0.13763 COC(=O)C(F)(F)SCCCCCCCCCCO 62a_100009813290_100000211177 [0,2,0,0,0,0|2,0,0]=4 13396 B18R0.13763 COCCCCCCOCCCC(C)(C)C(=O)OC 34a_200012092642_100010114820 [0,2,0,0,0,0|2,0,0]=4 13397 B18R0.13763 COCCCCCCOCCCC(C)(C)C(=O)OC 7a_200012092642_100010114820 [0,2,0,0,0,0|2,0,0]=4 13398 B18R0.13763 COCCCCCCSCCCC(C)(C)C(=O)OC 62a_100010114820_100011998445 [0,2,0,0,0,0|2,0,0]=4 13399 B18R0.13763 COCCCCCCSCCCC(C)(C)C(=O)OC 62a_100011998445_100010114820 [0,2,0,0,0,0|2,0,0]=4 13400 B18R0.16162 CCC(=O)C(C)OCCCCCCCCC(=O)OC 7a_100000035544_100000742827 [0,2,0,0,0,0|1,0,1]=4 13401 B18R0.16162 CCC(=O)C(C)SCCCCCCCCC(=O)OC 62a_100000742827_100010282707 [0,2,0,0,0,0|1,0,1]=4 13402 B18R0.16162 CCC(=O)C(C)SCCCCCCCCC(=O)OC 62a_100010282707_100000742827 [0,2,0,0,0,0|1,0,1]=4 13403 B18R0.16162 CCC(C)C(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000758301 [0,2,0,0,0,0|0,0,1]=3 13404 B18R0.16162 CCC(C)C(=O)CCCCCCCCCC(=O)OC 1458a_100011192722_100009813843 [0,2,0,0,0,0|0,0,1]=3 13405 B18R0.16162 CCC(C)C(C)OCCCCCCCCC(=O)OC 7a_100011215189_100010282707 [0,2,0,0,0,0|1,0,0]=3 13406 B18R0.16162 CCC(C)N(C)CCCCCCCCCC(=O)OC 2230a_100000741768_100009813843 [0,2,0,0,0,0|1,0,0]=3 13407 B18R0.16162 CCC(C)N(C)CCCCCCCCCC(=O)OC 269982a_100000741768_100009813843 [0,2,0,0,0,0|1,0,0]=3 13408 B18R0.16162 CCC(O)C(=O)CCCCCCCCCC(=O)OC 1458a_100011196387_100009813843 [0,2,0,0,0,0|0,0,1]=3 13409 B18R0.16162 CCN(C)C(=O)CCCCCCCCCC(=O)OC 11a_100000225621_100009997464 [0,2,0,0,0,0|1,0,1]=4 13410 B18R0.16162 CCN(C)C(=O)CCCCCCCCCC(=O)OC 1626a_100000225621_100009997464 [0,2,0,0,0,0|1,0,1]=4 13411 B18R0.16162 CCN(C)C(=O)CCCCCCCCCC(=O)OC 240690a_100000225621_100009997464 [0,2,0,0,0,0|1,0,1]=4 13412 B18R0.16162 CCN(C)C(C)COCCCCCCCC(=O)OC 7a_100000732741_100010004213 [0,2,0,0,0,0|2,0,0]=4 13413 B18R0.16162 COC(=O)CCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100009813843 [0,2,0,0,0,0|1,0,1]=4 13414 B18R0.16162 COC(=O)CCCCCCCCCC(=O)C(C)SC 1458a_100000149566_100009813843 [0,2,0,0,0,0|1,0,1]=4 13415 B18R0.16162 COC(=O)CCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100009813843 [0,2,0,0,0,0|1,0,1]=4 13416 B18R0.16162 COC(=O)CCCCCCCCCN(C)C(C)CO 2230a_100000693034_100009813843 [0,2,0,0,0,0|2,0,0]=4 13417 B18R0.16162 COC(=O)CCCCCCCCCN(C)C(C)CO 269982a_100000693034_100009813843 [0,2,0,0,0,0|2,0,0]=4 13418 B18R0.17443 CCCCCCCCCCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210375 [0,2,0,0,0,0|1,0,1]=4 13419 B18R0.17443 CCCCCCCCCCC(C)OC(C)C(=O)CC 7a_100011215000_100000742827 [0,2,0,0,0,0|2,0,0]=4 13420 B18R0.17443 CCCCCCCCCCC(C)OC(C)C(=O)NC 34a_100011215000_100000731044 [0,2,0,0,0,0|2,0,0]=4 13421 B18R0.17443 CCCCCCCCCCC(C)OC(C)C(=O)NC 7a_100011215000_100000209862 [0,2,0,0,0,0|2,0,0]=4 13422 B18R0.17443 CCCCCCCCCCC(C)OC(C)C(=O)OC 34a_100011215000_100000211248 [0,2,0,0,0,0|1,0,0]=3 13423 B18R0.17443 CCCCCCCCCCC(C)OC(C)C(=O)OC 7a_100011215000_100000211248 [0,2,0,0,0,0|1,0,0]=3 13424 B18R0.17443 CCCCCCCCCCC(C)OC(F)C(=O)NC 34a_100011215000_100009813575 [0,2,0,0,0,0|2,0,0]=4 13425 B18R0.17443 CCCCCCCCCCC(C)OC(F)C(=O)NC 7a_100011215000_100009813575 [0,2,0,0,0,0|2,0,0]=4 13426 B18R0.17443 CCCCCCCCCCN(C)CC(C)C(=O)OC 269982a_100000207566_100000698445 [0,2,0,0,0,0|1,0,0]=3 13427 B18R0.19787 C=C(C)C(=O)N(C)CCCCCCCCCCCC 11a_100000227908_100000185857 [0,2,0,0,0,0|2,0,0]=4 13428 B18R0.19787 C=C(C)C(=O)N(C)CCCCCCCCCCCC 1626a_100000227908_100000185857 [0,2,0,0,0,0|2,0,0]=4 13429 B18R0.19787 CCCCCCCCCCCCC(=O)C(=O)N(C)C 1458a_100011218876_100000759014 [0,2,0,0,0,0|1,0,1]=4 13430 B18R0.19787 CCCCCCCCCCCCC(C)C(=O)C(C)F 1458a_100000062450_200011217028 [0,2,0,0,0,0|1,0,0]=3 13431 B18R0.19787 CCCCCCCCCCCCC(C)C(=O)C(O)O 1458a_100000233687_200011217028 [0,2,0,0,0,0|2,0,0]=4 13432 B18R0.19787 CCCCCCCCCCCCC(C)C(=O)[C@@H](C)O 1458a_100000717761_200011217028 [0,2,0,0,0,0|1,0,0]=3 13433 B18R0.19787 CCCCCCCCCCCCC(C)C(=O)[C@H](C)O 1458a_217856618621_200011217028 [0,2,0,0,0,0|1,0,0]=3 13434 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)C 11a_100000227908_100000210198 [0,2,0,0,0,0|2,0,0]=4 13435 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)C 1626a_100000227908_100000210198 [0,2,0,0,0,0|2,0,0]=4 13436 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)C 240690a_100000227908_100000210198 [0,2,0,0,0,0|2,0,0]=4 13437 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)C 527a_100000227908_100000210198 [0,2,0,0,0,0|2,0,0]=4 13438 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)F 11a_100000227908_100000062450 [0,2,0,0,0,0|2,0,0]=4 13439 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)F 1626a_100000227908_100000062450 [0,2,0,0,0,0|2,0,0]=4 13440 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)F 240690a_100000227908_100000062450 [0,2,0,0,0,0|2,0,0]=4 13441 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)F 527a_100000227908_100000062450 [0,2,0,0,0,0|2,0,0]=4 13442 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)[C@@H](C)O 240690a_100000227908_100000717761 [0,2,0,0,0,0|2,0,0]=4 13443 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)[C@H](C)O 1626a_100000227908_217856618621 [0,2,0,0,0,0|2,0,0]=4 13444 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)[C@H](C)O 240690a_100000227908_217856618621 [0,2,0,0,0,0|2,0,0]=4 13445 B18R0.19787 CCCCCCCCCCCNC(C)C(=O)C(C)C 2230a_200011215754_100009893295 [0,2,0,0,0,0|2,0,0]=4 13446 B18R0.19787 CCCCCCCCCCCNC(C)C(=O)N(C)C 2230a_200011215754_100000209910 [0,2,0,0,0,0|2,0,0]=4 13447 B18R0.19787 CCCCCCCCCCCN[C@@H](C)C(=O)N(C)C 2230a_100000697320_100011215454 [0,2,0,0,0,0|2,0,0]=4 13448 B18R0.19787 CCCCCCCCCCCN[C@@H](C)C(=O)N(C)C 34a_100000697320_100011215454 [0,2,0,0,0,0|2,0,0]=4 13449 B18R0.19787 CCCCCCCCCCCOC(C)C(=O)C(C)C 7a_100000210809_100009893295 [0,2,0,0,0,0|2,0,0]=4 13450 B18R0.19787 CCCCCCCCCCCOC(C)C(=O)N(C)C 7a_100000210809_100000209910 [0,2,0,0,0,0|2,0,0]=4 13451 B18R0.19787 CCCCCCCCCCCSC(C)C(=O)C(C)C 62a_100009893295_100011215454 [0,2,0,0,0,0|2,0,0]=4 13452 B18R0.19787 CCCCCCCCCCCSC(C)C(=O)N(C)C 62a_100000209910_100011215454 [0,2,0,0,0,0|2,0,0]=4 13453 B18R0.19822 C=C(COC(C)CCCCCCCCC)C(=O)OC 34a_100011218016_100009813391 [0,2,0,0,0,0|1,0,1]=4 13454 B18R0.19822 CCCCCCCCCC(=O)CCC(C)C(=O)OC 1458a_100000210558_100000034942 [0,2,0,0,0,0|0,0,1]=3 13455 B18R0.19822 CCCCCCCCCC(=O)NCC(O)C(=O)OC 188690a_100000695228_100000210558 [0,2,0,0,0,0|1,0,1]=4 13456 B18R0.19822 CCCCCCCCCC(C)NCC(C)C(=O)NC 270004a_100015187722_100011215753 [0,2,0,0,0,0|2,0,0]=4 13457 B18R0.19822 CCCCCCCCCC(C)OCC(=O)C(=O)OC 34a_100011218016_100011610305 [0,2,0,0,0,0|1,0,1]=4 13458 B18R0.19822 CCCCCCCCCC(C)OCC(C)C(=O)OC 34a_100011218016_100000698445 [0,2,0,0,0,0|1,0,0]=3 13459 B18R0.19822 CCCCCCCCCN(C)CCC(C)C(=O)OC 2230a_100000232482_100000034942 [0,2,0,0,0,0|1,0,0]=3 13460 B18R0.19822 CCCCCCCCCN(C)CCC(C)C(=O)OC 269982a_100000232482_100000034942 [0,2,0,0,0,0|1,0,0]=3 13461 B18R0.19881 COC(=O)C(C)CCOCCCCCCCC(C)C 34a_200000210741_100000034942 [0,2,0,0,0,0|1,0,0]=3 13462 B18R0.19881 COC(=O)C(C)CCOCCCCCCCC(C)C 7a_200000210741_100000034942 [0,2,0,0,0,0|1,0,0]=3 13463 B18R0.118 C=C(C)CC(=O)CCCCCCCCCC(=O)OC 1458a_100009997464_100000748629 [0,2,0,0,0,0|0,0,2]=4 13464 B18R0.118 C=C(C)CN(C)CCCCCCCCCC(=O)OC 2230a_100000225649_100009813843 [0,2,0,0,0,0|1,0,1]=4 13465 B18R0.118 C=C(C)CN(C)CCCCCCCCCC(=O)OC 269982a_100000225649_100009813843 [0,2,0,0,0,0|1,0,1]=4 13466 B18R0.118 COC(=O)CCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100009813843 [0,2,0,0,0,0|0,0,1]=3 13467 B18R0.118 COC(=O)CCCCCCCCCC(=O)CC(C)C 1458a_100009997464_100000210624 [0,2,0,0,0,0|0,0,1]=3 13468 B18R0.118 COC(=O)CCCCCCCCCC(=O)CC(C)O 1458a_100009997464_100011218427 [0,2,0,0,0,0|0,0,1]=3 13469 B18R0.118 COC(=O)CCCCCCCCCC(=O)CC(F)F 1458a_100009997464_100011934356 [0,2,0,0,0,0|1,0,1]=4 13470 B18R0.118 COC(=O)CCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100009813843 [0,2,0,0,0,0|1,0,1]=4 13471 B18R0.118 COC(=O)CCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100009813843 [0,2,0,0,0,0|0,0,1]=3 13472 B18R0.118 COC(=O)CCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100009813843 [0,2,0,0,0,0|1,0,1]=4 13473 B18R0.118 COC(=O)CCCCCCCCCC(=O)NC(C)C 11a_100138425928_100009997464 [0,2,0,0,0,0|1,0,1]=4 13474 B18R0.118 COC(=O)CCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100009997464 [0,2,0,0,0,0|1,0,1]=4 13475 B18R0.118 COC(=O)CCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100009997464 [0,2,0,0,0,0|1,0,1]=4 13476 B18R0.118 COC(=O)CCCCCCCCCN(C)CC(C)C 2230a_100000747067_100009813843 [0,2,0,0,0,0|1,0,0]=3 13477 B18R0.118 COC(=O)CCCCCCCCCN(C)CC(C)C 269982a_100000747067_100009813843 [0,2,0,0,0,0|1,0,0]=3 13478 B18R0.118 COC(=O)CCCCCCCCCN(C)CC(C)O 2230a_100000227577_100009813843 [0,2,0,0,0,0|1,0,0]=3 13479 B18R0.118 COC(=O)CCCCCCCCCN(C)CC(C)O 269982a_100000227577_100009813843 [0,2,0,0,0,0|1,0,0]=3 13480 B18R0.118 COC(=O)CCCCCCCCNC(C)CC(C)C 2230a_100000692259_100010282707 [0,2,0,0,0,0|1,0,0]=3 13481 B18R0.118 COC(=O)CCCCCCCCOC(C)CC(C)C 34a_100000035544_100000731052 [0,2,0,0,0,0|1,0,0]=3 13482 B18R0.118 COC(=O)CCCCCCCCOC(C)CC(C)C 34a_100000211805_100010282707 [0,2,0,0,0,0|1,0,0]=3 13483 B18R0.118 COC(=O)CCCCCCCCOC(C)CC(C)C 7a_100000035544_100000731052 [0,2,0,0,0,0|1,0,0]=3 13484 B18R0.118 COC(=O)CCCCCCCCOC(C)CC(C)C 7a_100000211805_100010282707 [0,2,0,0,0,0|1,0,0]=3 13485 B18R0.118 COC(=O)CCCCCCCCSC(C)CC(C)C 62a_100000731052_100010282707 [0,2,0,0,0,0|1,0,0]=3 13486 B18R0.118 COC(=O)CCCCCCCCSC(C)CC(C)C 62a_100010282707_100000731052 [0,2,0,0,0,0|1,0,0]=3 13487 B18R0.118 COC(=O)CCCCCCCCSC(C)CN(C)C 62a_100010282707_100020606517 [0,2,0,0,0,0|2,0,0]=4 13488 B18R0.118 COC(=O)CCCCCCCCSC(C)CN(C)C 62a_100020606517_100010282707 [0,2,0,0,0,0|2,0,0]=4 13489 B18R0.118 COC(=O)CCCCCCCOCC(C)CN(C)C 7a_100011022521_100015348159 [0,2,0,0,0,0|2,0,0]=4 13490 B18R0.118 COC(=O)CCCCCCCOC[C@@H](N)CC(C)C 34a_100011830311_100010004213 [0,2,0,0,0,0|1,0,0]=3 13491 B18R0.118 COC(=O)CCCCCCCSCC(C)CN(C)C 62a_100010004213_100015348159 [0,2,0,0,0,0|2,0,0]=4 13492 B18R0.118 COC(=O)CCCCCCCSCC(C)CN(C)C 62a_100015348159_100010004213 [0,2,0,0,0,0|2,0,0]=4 13493 B18R0.118 COC(=O)CCCCCCOCC[C@@H](N)CC(C)C 34a_100161151251_100009815986 [0,2,0,0,0,0|1,0,0]=3 13494 B18R0.1598 CCCC(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000766640 [0,2,0,0,0,0|0,0,1]=3 13495 B18R0.1598 CCCC(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000210906_100010282707 [0,2,0,0,0,0|0,0,1]=3 13496 B18R0.1598 CCCC(C)C(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000210906 [0,2,0,0,0,0|1,0,1]=4 13497 B18R0.1598 CCCC(C)C(C)OCCCCCCCC(=O)OC 34a_100000708338_100010004213 [0,2,0,0,0,0|1,0,0]=3 13498 B18R0.1598 CCCC(C)C(C)OCCCCCCCC(=O)OC 7a_100000708338_100010004213 [0,2,0,0,0,0|1,0,0]=3 13499 B18R0.1598 CCCN(C)C(=O)CCCCCCCCC(=O)OC 11a_100000747261_100000036616 [0,2,0,0,0,0|1,0,1]=4 13500 B18R0.1598 CCCN(C)C(=O)CCCCCCCCC(=O)OC 1626a_100000747261_100000036616 [0,2,0,0,0,0|1,0,1]=4 13501 B18R0.1598 CCCN(C)C(=O)CCCCCCCCC(=O)OC 240690a_100000747261_100000036616 [0,2,0,0,0,0|1,0,1]=4 13502 B18R0.1598 CCC[C@H](O)C(=O)CCCCCCCCC(=O)OC 1458a_100009822183_100010282707 [0,2,0,0,0,0|0,0,1]=3 13503 B18R0.1598 CCC[C@H](O)C(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100009822183 [0,2,0,0,0,0|1,0,1]=4 13504 B18R0.1598 CCOC(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000739345_100010282707 [0,2,0,0,0,0|1,0,1]=4 13505 B18R0.1598 CCSC(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000230601_100010282707 [0,2,0,0,0,0|1,0,1]=4 13506 B18R0.1598 COC(=O)CCCCCCCCC(=O)C(C)CCO 1458a_100000036616_100009893172 [0,2,0,0,0,0|1,0,1]=4 13507 B18R0.1598 COC(=O)CCCCCCCCC(=O)C(C)CSC 1458a_100000753918_100010282707 [0,2,0,0,0,0|1,0,1]=4 13508 B18R0.1598 COC(=O)CCCCCCCCN(C)C(C)CCO 2230a_100000731037_100010282707 [0,2,0,0,0,0|2,0,0]=4 13509 B18R0.1598 COC(=O)CCCCCCCCN(C)C(C)CCO 269982a_100000731037_100010282707 [0,2,0,0,0,0|2,0,0]=4 13510 B18R0.1598 COCC(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000765312 [0,2,0,0,0,0|1,0,1]=4 13511 B18R0.1598 COCC(C)C(=O)CCCCCCCCC(=O)OC 1458a_100000751857_100010282707 [0,2,0,0,0,0|1,0,1]=4 13512 B18R0.6823 C#CC(CCC)OCCCCCCCCC(=O)OC 34a_200011217317_100010282707 [0,2,0,0,0,0|1,0,0]=3 13513 B18R0.6823 C#CC(CCC)OCCCCCCCCC(=O)OC 7a_200011217317_100010282707 [0,2,0,0,0,0|1,0,0]=3 13514 B18R0.6823 C=CC(CCC)OCCCCCCCCC(=O)OC 34a_100011216692_100010282707 [0,2,0,0,0,0|1,0,0]=3 13515 B18R0.6823 C=CC(CCC)OCCCCCCCCC(=O)OC 7a_100011216692_100010282707 [0,2,0,0,0,0|1,0,0]=3 13516 B18R0.6823 CCC(COC)NCCCCCCCCC(=O)OC 2230a_100000757820_100010282707 [0,2,0,0,0,0|2,0,0]=4 13517 B18R0.6823 CCC(COC)OCCCCCCCCC(=O)OC 7a_200011214946_100010282707 [0,2,0,0,0,0|2,0,0]=4 13518 B18R0.6823 CCCC(C#N)OCCCCCCCCC(=O)OC 34a_100000686963_100010282707 [0,2,0,0,0,0|1,0,0]=3 13519 B18R0.6823 CCCC(C#N)OCCCCCCCCC(=O)OC 7a_100000686963_100010282707 [0,2,0,0,0,0|1,0,0]=3 13520 B18R0.6823 CCCC(CC)NCCCCCCCCC(=O)OC 2230a_100000747048_100010282707 [0,2,0,0,0,0|1,0,0]=3 13521 B18R0.6823 CCCC(CC)OCCCCCCCCC(=O)OC 34a_100000687864_100010282707 [0,2,0,0,0,0|1,0,0]=3 13522 B18R0.6823 CCCC(CC)OCCCCCCCCC(=O)OC 7a_100000035544_100011219200 [0,2,0,0,0,0|1,0,0]=3 13523 B18R0.6823 CCCC(CC)OCCCCCCCCC(=O)OC 7a_100000687864_100010282707 [0,2,0,0,0,0|1,0,0]=3 13524 B18R0.6823 CCCC(CC)SCCCCCCCCC(=O)OC 62a_100010282707_100011219200 [0,2,0,0,0,0|1,0,0]=3 13525 B18R0.6823 CCCC(CC)SCCCCCCCCC(=O)OC 62a_100011219200_100010282707 [0,2,0,0,0,0|1,0,0]=3 13526 B18R0.6823 CCCC(CCOCCCCCCC(=O)OC)SC 34a_100000032865_100009815986 [0,2,0,0,0,0|1,0,0]=3 13527 B18R0.6823 CCCC(CCOCCCCCCC(=O)OC)SC 7a_100000032865_100009815986 [0,2,0,0,0,0|1,0,0]=3 13528 B18R0.6823 CCCN(CC)CCCCCCCCCC(=O)OC 2230a_100000226822_100009813843 [0,2,0,0,0,0|1,0,0]=3 13529 B18R0.6823 CCCN(CC)CCCCCCCCCC(=O)OC 269982a_100000226822_100009813843 [0,2,0,0,0,0|1,0,0]=3 13530 B18R0.6823 CCC[C@@H](CO)NCCCCCCCCC(=O)OC 2230a_100000732646_100010282707 [0,2,0,0,0,0|1,0,0]=3 13531 B18R0.6823 CCC[C@@H](CO)NCCCCCCCCC(=O)OC 34a_100000732646_100010282707 [0,2,0,0,0,0|1,0,0]=3 13532 B18R0.6823 CCN(CCO)CCCCCCCCCC(=O)OC 2230a_100000210973_100009813843 [0,2,0,0,0,0|2,0,0]=4 13533 B18R0.6823 CCN(CCO)CCCCCCCCCC(=O)OC 269982a_100000210973_100009813843 [0,2,0,0,0,0|2,0,0]=4 13534 B18R0.6823 CCOC(CC)CNCCCCCCCC(=O)OC 2230a_100015183923_100010004213 [0,2,0,0,0,0|2,0,0]=4 13535 B18R0.6823 CCOC(CC)CNCCCCCCCC(=O)OC 34a_100015183923_100010004213 [0,2,0,0,0,0|2,0,0]=4 13536 B18R0.6823 COCC(CCl)OCCCCCCCCC(=O)OC 34a_100011215053_100010282707 [0,2,0,0,0,0|2,0,0]=4 13537 B18R0.6823 COCC(CN)OCCCCCCCCC(=O)OC 34a_100000756049_100010282707 [0,2,0,0,0,0|2,0,0]=4 13538 B18R0.6823 COCC(CO)NCCCCCCCCC(=O)OC 2230a_100000724102_100010282707 [0,2,0,0,0,0|2,0,0]=4 13539 B18R0.6823 COCC(CO)NCCCCCCCCC(=O)OC 34a_100000724102_100010282707 [0,2,0,0,0,0|2,0,0]=4 13540 B18R0.14781 CCCC(C)(C)COCCCCCCCC(=O)OC 7a_100011995695_100010004213 [0,2,0,0,0,0|1,0,0]=3 13541 B18R0.14781 CCCC(C)(C)OCCCCCCCCC(=O)OC 7a_100000748436_100010282707 [0,2,0,0,0,0|1,0,0]=3 13542 B18R0.14781 CCNC(C)(C)COCCCCCCCC(=O)OC 7a_100000747347_100010004213 [0,2,0,0,0,0|2,0,0]=4 13543 B18R0.14781 COC(=O)CCCCCCCCNC(C)(C)CSC 2230a_100000759623_100010282707 [0,2,0,0,0,0|2,0,0]=4 13544 B18R0.14781 COC(=O)CCCCCCCCNC(C)(C)CSC 7a_100000759623_100010282707 [0,2,0,0,0,0|2,0,0]=4 13545 B18R0.14781 COC(=O)CCCCCCCCOC(C)(C)CCBr 7a_100000702414_100010282707 [0,2,0,0,0,0|2,0,0]=4 13546 B18R0.14781 COCC(C)(C)CNCCCCCCCC(=O)OC 2230a_100000734190_100010004213 [0,2,0,0,0,0|2,0,0]=4 13547 B18R0.14781 COCC(C)(C)NCCCCCCCCC(=O)OC 2230a_100000752728_100010282707 [0,2,0,0,0,0|2,0,0]=4 13548 B18R0.13323 C#CC(CC)OCCCCCCCCCC(=O)OC 34a_100000758843_100009813843 [0,2,0,0,0,0|1,0,0]=3 13549 B18R0.13323 C#CC(CC)OCCCCCCCCCC(=O)OC 7a_100000758843_100009813843 [0,2,0,0,0,0|1,0,0]=3 13550 B18R0.13323 C=CC(CC)OCCCCCCCCCC(=O)OC 34a_100000766422_100009813843 [0,2,0,0,0,0|1,0,0]=3 13551 B18R0.13323 C=CC(CC)OCCCCCCCCCC(=O)OC 7a_100000766422_100009813843 [0,2,0,0,0,0|1,0,0]=3 13552 B18R0.13323 C=C[C@@H](CO)NCCCCCCCCCC(=O)OC 2230a_100016989147_100009813843 [0,2,0,0,0,0|2,0,0]=4 13553 B18R0.13323 C=C[C@@H](CO)NCCCCCCCCCC(=O)OC 34a_100016989147_100009813843 [0,2,0,0,0,0|2,0,0]=4 13554 B18R0.13323 CCC(CC)CNCCCCCCCCC(=O)OC 2230a_100102946423_100010282707 [0,2,0,0,0,0|1,0,0]=3 13555 B18R0.13323 CCC(CC)COCCCCCCCCC(=O)OC 34a_100000035544_100011215472 [0,2,0,0,0,0|1,0,0]=3 13556 B18R0.13323 CCC(CC)COCCCCCCCCC(=O)OC 7a_100000035544_100011215472 [0,2,0,0,0,0|1,0,0]=3 13557 B18R0.13323 CCC(CC)COCCCCCCCCC(=O)OC 7a_100000703878_100010282707 [0,2,0,0,0,0|1,0,0]=3 13558 B18R0.13323 CCC(CC)CSCCCCCCCCC(=O)OC 62a_100010282707_100011215472 [0,2,0,0,0,0|1,0,0]=3 13559 B18R0.13323 CCC(CC)CSCCCCCCCCC(=O)OC 62a_100011215472_100010282707 [0,2,0,0,0,0|1,0,0]=3 13560 B18R0.13323 CCC(CC)NCCCCCCCCCC(=O)OC 2230a_100000199018_100009813843 [0,2,0,0,0,0|1,0,0]=3 13561 B18R0.13323 CCC(CC)OCCCCCCCCCC(=O)OC 7a_100000688536_100009813843 [0,2,0,0,0,0|1,0,0]=3 13562 B18R0.13323 CCC(CC)SCCCCCCCCCC(=O)OC 62a_100000210505_100009813843 [0,2,0,0,0,0|1,0,0]=3 13563 B18R0.13323 CCC(COCCCCCCCCC(=O)OC)OC 34a_100011934954_100010282707 [0,2,0,0,0,0|1,0,0]=3 13564 B18R0.13323 CCC(COCCCCCCCCC(=O)OC)OC 7a_100011934954_100010282707 [0,2,0,0,0,0|1,0,0]=3 13565 B18R0.13323 CCN(CC)CCCCCCCCCCC(=O)OC 2230a_100000724800_100009812566 [0,2,0,0,0,0|1,0,0]=3 13566 B18R0.13323 CCN(CC)CCCCCCCCCCC(=O)OC 269956a_100000042499_100009812566 [0,2,0,0,0,0|1,0,0]=3 13567 B18R0.13323 CCN(CC)CCCCCCCCCCC(=O)OC 269982a_100000724800_100009812566 [0,2,0,0,0,0|1,0,0]=3 13568 B18R0.13323 CCN(CC)CCCCCCOCCCC(=O)OC 7a_100011632896_100011218270 [0,2,0,0,0,0|2,0,0]=4 13569 B18R0.13323 CCN(CC)CCCCCNCCCCC(=O)OC 2230a_100011491781_100000204269 [0,2,0,0,0,0|2,0,0]=4 13570 B18R0.13323 CCN(CC)CCCCCOCCCCC(=O)OC 7a_200011629222_100000204269 [0,2,0,0,0,0|2,0,0]=4 13571 B18R0.13323 CCN(CC)CCCCNCCCCCC(=O)OC 2230a_100000743895_100009816466 [0,2,0,0,0,0|2,0,0]=4 13572 B18R0.13323 CCN(CC)CCCCOCCCCCC(=O)OC 7a_100011305530_100009816466 [0,2,0,0,0,0|2,0,0]=4 13573 B18R0.13323 CCN(CC)CCCOCCCCCCC(=O)OC 7a_100000212844_100009815986 [0,2,0,0,0,0|2,0,0]=4 13574 B18R0.13323 CCN(CC)CCCOCCCCCCC(=O)OC 7a_100009863599_100000709985 [0,2,0,0,0,0|2,0,0]=4 13575 B18R0.13323 CCN(CC)CCCSCCCCCCC(=O)OC 62a_100009815986_100000709985 [0,2,0,0,0,0|2,0,0]=4 13576 B18R0.13323 CCN(CC)CCNCCCCCCCC(=O)OC 2230a_100015382049_100010004213 [0,2,0,0,0,0|2,0,0]=4 13577 B18R0.13323 CCN(CC)CCOCCCCCCCC(=O)OC 7a_100011022521_100000700428 [0,2,0,0,0,0|2,0,0]=4 13578 B18R0.13323 CCN(CC)CCOCCCCCCCC(=O)OC 7a_100016990331_100010004213 [0,2,0,0,0,0|2,0,0]=4 13579 B18R0.13323 CCN(CC)CCSCCCCCCCC(=O)OC 62a_100010004213_100000700428 [0,2,0,0,0,0|2,0,0]=4 13580 B18R0.13323 CCN(CC)COCCCCCCCCC(=O)OC 7a_200015374951_100010282707 [0,2,0,0,0,0|2,0,0]=4 13581 B18R0.13323 CCN(CCCCOCCCCCC(=O)OC)N=O 34a_200000035056_100009816466 [0,2,0,0,0,0|2,0,0]=4 13582 B18R0.13323 CC[C@@H](CO)NCCCCCCCCCC(=O)OC 2230a_100000709445_100009813843 [0,2,0,0,0,0|1,0,0]=3 13583 B18R0.13323 COC(=O)CCCCCCCCCNC(CO)CO 2230a_100000759517_100009813843 [0,2,0,0,0,0|2,0,0]=4 13584 B18R0.13323 COC(=O)CCCCCCCCCOC(CCl)CCl 7a_100000737055_100009813843 [0,2,0,0,0,0|2,0,0]=4 13585 B18R0.13323 COC(=O)CCCCCCCCCOC(CF)CF 34a_100000032261_100009813843 [0,2,0,0,0,0|2,0,0]=4 13586 B18R0.13323 COC(=O)CCCCCCCCCOC(CF)CF 7a_100000032261_100009813843 [0,2,0,0,0,0|2,0,0]=4 13587 B18R0.13323 COC(=O)CCCCCCCCCOC(CN)CN 34a_100000031598_100009813843 [0,2,0,0,0,0|2,0,0]=4 13588 B18R0.13323 COC(=O)CCCCCCCCCO[C@@H](CF)CCl 34a_100015614560_100009813843 [0,2,0,0,0,0|2,0,0]=4 13589 B18R0.13323 COC(=O)CCCCCCCCCO[C@@H](CF)CCl 7a_100015614560_100009813843 [0,2,0,0,0,0|2,0,0]=4 13590 B18R0.13323 COC(=O)CCCCCCCCOCC(OC)OC 34a_100000035544_100000211822 [0,2,0,0,0,0|2,0,0]=4 13591 B18R0.13323 COC(=O)CCCCCCCCOCC(OC)OC 34a_100011216393_100010282707 [0,2,0,0,0,0|2,0,0]=4 13592 B18R0.13323 COC(=O)CCCCCCCCOCC(OC)OC 7a_100000035544_100000751394 [0,2,0,0,0,0|2,0,0]=4 13593 B18R0.13323 COC(=O)CCCCCCCCSCC(OC)OC 62a_100000751394_100010282707 [0,2,0,0,0,0|2,0,0]=4 13594 B18R0.13323 COC(=O)CCCCCCCCSCC(OC)OC 62a_100010282707_100000751394 [0,2,0,0,0,0|2,0,0]=4 13595 B18R0.13323 COC(=O)CCCCCCCOCCC(OC)OC 34a_100011022521_100000139399 [0,2,0,0,0,0|2,0,0]=4 13596 B18R0.13323 COC(=O)CCCCCCCOCCC(OC)OC 7a_100011022521_100009813347 [0,2,0,0,0,0|2,0,0]=4 13597 B18R0.13323 COC(=O)CCCCCCCSCCC(OC)OC 62a_100000139399_100010004213 [0,2,0,0,0,0|2,0,0]=4 13598 B18R0.13323 COC(=O)CCCCCCCSCCC(OC)OC 62a_100010004213_100000139399 [0,2,0,0,0,0|2,0,0]=4 13599 B18R0.13323 COC(=O)CCCCCCOCCCC(OC)OC 34a_100009863599_100000069011 [0,2,0,0,0,0|2,0,0]=4 13600 B18R0.13323 COC(=O)CCCCCCOCCCC(OC)OC 7a_100009863599_100000069011 [0,2,0,0,0,0|2,0,0]=4 13601 B18R0.13323 COC(=O)CCCCCCSCCCC(OC)OC 62a_100000069011_100009815986 [0,2,0,0,0,0|2,0,0]=4 13602 B18R0.13323 COC(=O)CCCCCCSCCCC(OC)OC 62a_100009815986_100000069011 [0,2,0,0,0,0|2,0,0]=4 13603 B18R0.13769 CCCCCCCCCCCOCP(=O)(OC)OC 34a_100000101693_100011215454 [0,2,0,0,0,0|2,0,0]=4 13604 B18R0.13769 CCCCCCCCCCOCCP(=O)(OC)OC 34a_200000043213_100000210320 [0,2,0,0,0,0|2,0,0]=4 13605 B18R0.6492 C#CC(CCCC)OCCCCCCCC(=O)OC 34a_200011217967_100010004213 [0,2,0,0,0,0|1,0,0]=3 13606 B18R0.6492 C#CC(CCCC)OCCCCCCCC(=O)OC 7a_200011217967_100010004213 [0,2,0,0,0,0|1,0,0]=3 13607 B18R0.6492 C=CC(CCCC)OCCCCCCCC(=O)OC 34a_200011215037_100010004213 [0,2,0,0,0,0|1,0,0]=3 13608 B18R0.6492 C=CC(CCCC)OCCCCCCCC(=O)OC 7a_200011215037_100010004213 [0,2,0,0,0,0|1,0,0]=3 13609 B18R0.6492 CCCCC(CC)CCCCNCCCC(=O)NC 2230a_100000740002_200012094884 [0,2,0,0,0,0|2,0,0]=4 13610 B18R0.6492 CCCCC(CC)CCCCNCCCC(=O)NC 34a_100000740002_200012094884 [0,2,0,0,0,0|2,0,0]=4 13611 B18R0.6492 CCCCC(CC)CCCCOCCNC(=O)OC 34a_100000757965_200012094884 [0,2,0,0,0,0|2,0,0]=4 13612 B18R0.6492 CCCCC(CC)CCCCOCCOC(=O)OC 34a_100010262106_200012094884 [0,2,0,0,0,0|2,0,0]=4 13613 B18R0.6492 CCCCC(CC)CCCCSCCCC(=O)NC 62a_100000741757_200012094884 [0,2,0,0,0,0|2,0,0]=4 13614 B18R0.6492 CCCCC(CC)CCCCSCCCC(=O)NC 62a_200012094884_100000741757 [0,2,0,0,0,0|2,0,0]=4 13615 B18R0.6492 CCCCC(CC)CCCCSCCCC(=O)OC 62a_100011218270_200012094884 [0,2,0,0,0,0|1,0,0]=3 13616 B18R0.6492 CCCCC(CC)CCCCSCCCC(=O)OC 62a_200012094884_100011218270 [0,2,0,0,0,0|1,0,0]=3 13617 B18R0.6492 CCCCC(CC)CNCCCCCCC(=O)OC 2230a_100000209976_100009815986 [0,2,0,0,0,0|1,0,0]=3 13618 B18R0.6492 CCCCC(CC)COCCCCCCC(=O)OC 34a_100000210273_100009815986 [0,2,0,0,0,0|1,0,0]=3 13619 B18R0.6492 CCCCC(CC)COCCCCCCC(=O)OC 34a_100009863599_100000211942 [0,2,0,0,0,0|1,0,0]=3 13620 B18R0.6492 CCCCC(CC)COCCCCCCC(=O)OC 7a_100000210273_100009815986 [0,2,0,0,0,0|1,0,0]=3 13621 B18R0.6492 CCCCC(CC)COCCCCCCC(=O)OC 7a_100009863599_100000211942 [0,2,0,0,0,0|1,0,0]=3 13622 B18R0.6492 CCCCC(CC)COCCCNCCC(=O)OC 2230a_200011218343_100000204255 [0,2,0,0,0,0|2,0,0]=4 13623 B18R0.6492 CCCCC(CC)CSCCCCCCC(=O)OC 62a_100000211942_100009815986 [0,2,0,0,0,0|1,0,0]=3 13624 B18R0.6492 CCCCC(CC)CSCCCCCCC(=O)OC 62a_100009815986_100000211942 [0,2,0,0,0,0|1,0,0]=3 13625 B18R0.6492 CCCCC(CC)OCCCCCCCC(=O)OC 34a_100011022521_200011216223 [0,2,0,0,0,0|1,0,0]=3 13626 B18R0.6492 CCCCC(CC)OCCCCCCCC(=O)OC 34a_100011215227_100010004213 [0,2,0,0,0,0|1,0,0]=3 13627 B18R0.6492 CCCCC(CC)OCCCCCCCC(=O)OC 7a_100011022521_200011216223 [0,2,0,0,0,0|1,0,0]=3 13628 B18R0.6492 CCCCC(CC)OCCCCCCCC(=O)OC 7a_100011215227_100010004213 [0,2,0,0,0,0|1,0,0]=3 13629 B18R0.6492 CCCCC(CC)SCCCCCCCC(=O)OC 62a_100010004213_200011216223 [0,2,0,0,0,0|1,0,0]=3 13630 B18R0.6492 CCCCC(CC)SCCCCCCCC(=O)OC 62a_200011216223_100010004213 [0,2,0,0,0,0|1,0,0]=3 13631 B18R0.6492 CCCCN(CC)CCCCCCCCC(=O)OC 2230a_100000207695_100010282707 [0,2,0,0,0,0|1,0,0]=3 13632 B18R0.6492 CCCCN(CC)CCCCCCCCC(=O)OC 269982a_100000207695_100010282707 [0,2,0,0,0,0|1,0,0]=3 13633 B18R0.6492 CCCCN(CC)CCNCCCCCC(=O)OC 2230a_200011208488_100009816466 [0,2,0,0,0,0|2,0,0]=4 13634 B18R0.6492 CCCCN(CCCCOCCCC(=O)OC)N=O 34a_200000034022_100000742333 [0,2,0,0,0,0|2,0,0]=4 13635 B18R0.6492 CCCCN(CCCCOCCCC(=O)OC)N=O 7a_200000034022_100011218270 [0,2,0,0,0,0|2,0,0]=4 13636 B18R0.6492 CCCC[C@@H](CO)NCCCCCCCC(=O)OC 2230a_100011934283_100010004213 [0,2,0,0,0,0|1,0,0]=3 13637 B18R0.6492 CCCC[C@@H](CO)NCCCCCCCC(=O)OC 34a_100011934283_100010004213 [0,2,0,0,0,0|1,0,0]=3 13638 B18R0.6492 CCN(CCCCCCCCC(=O)OC)CCOC 2230a_100000731262_100010282707 [0,2,0,0,0,0|2,0,0]=4 13639 B18R0.6492 CCN(CCCCCCCCC(=O)OC)CCOC 269982a_100000731262_100010282707 [0,2,0,0,0,0|2,0,0]=4 13640 B18R0.6492 CCOCC(CN)OCCCCCCCC(=O)OC 34a_102515437182_100010004213 [0,2,0,0,0,0|2,0,0]=4 13641 B18R0.6492 COC(=O)CCCCCCCN[C@H](CO)CCSC 2230a_100011827619_100010004213 [0,2,0,0,0,0|2,0,0]=4 13642 B18R0.10353 CCCCC(C)CCCCOC[C@H](O)CC(=O)OC 34a_200011021034_100000754131 [0,2,0,0,0,0|1,0,0]=3 13643 B18R0.10353 CCCCC(C)CCCCOC[C@H](O)CC(=O)OC 7a_200011021034_100000754131 [0,2,0,0,0,0|1,0,0]=3 13644 B18R0.15771 C=C(C)CCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000730704 [0,2,0,0,0,0|0,0,2]=4 13645 B18R0.15771 C=C(C)CCC(=O)CCCCCCCCC(=O)OC 1458a_200000688413_100010282707 [0,2,0,0,0,0|0,0,2]=4 13646 B18R0.15771 COC(=O)CCCCCCCCC(=O)CCC(C)C 1458a_100000036616_100000210312 [0,2,0,0,0,0|0,0,1]=3 13647 B18R0.15771 COC(=O)CCCCCCCCC(=O)CCC(C)C 1458a_100000181311_100010282707 [0,2,0,0,0,0|0,0,1]=3 13648 B18R0.15771 COC(=O)CCCCCCCCC(=O)CCC(C)O 1458a_100000036616_100012276601 [0,2,0,0,0,0|0,0,1]=3 13649 B18R0.15771 COC(=O)CCCCCCCCC(=O)CC[S+](C)C 1458a_100009452791_100010282707 [0,2,0,0,0,0|1,0,1]=4 13650 B18R0.15771 COC(=O)CCCCCCCCC(=O)COC(C)C 1458a_100000745533_100010282707 [0,2,0,0,0,0|1,0,1]=4 13651 B18R0.15771 COC(=O)CCCCCCCCC(=O)CSC(C)C 1458a_100000241585_100010282707 [0,2,0,0,0,0|1,0,1]=4 13652 B18R0.15771 COC(=O)CCCCCCCCC(=O)NCC(C)C 11a_100000210953_100000036616 [0,2,0,0,0,0|1,0,1]=4 13653 B18R0.15771 COC(=O)CCCCCCCCC(=O)NCC(C)C 1626a_100000210953_100000036616 [0,2,0,0,0,0|1,0,1]=4 13654 B18R0.15771 COC(=O)CCCCCCCCC(=O)NCC(C)C 240690a_100000210953_100000036616 [0,2,0,0,0,0|1,0,1]=4 13655 B18R0.15771 COC(=O)CCCCCCCCC(=O)NCC(C)O 11a_100000210904_100000036616 [0,2,0,0,0,0|1,0,1]=4 13656 B18R0.15771 COC(=O)CCCCCCCCC(=O)NCC(C)O 240690a_100000210904_100000036616 [0,2,0,0,0,0|1,0,1]=4 13657 B18R0.15771 COC(=O)CCCCCCCCN(C)CCC(C)C 2230a_100000742789_100010282707 [0,2,0,0,0,0|1,0,0]=3 13658 B18R0.15771 COC(=O)CCCCCCCCN(C)CCC(C)C 269982a_100000742789_100010282707 [0,2,0,0,0,0|1,0,0]=3 13659 B18R0.15771 COC(=O)CCCCCCCCN(C)CCN(C)C 269982a_100000225618_100010282707 [0,2,0,0,0,0|2,0,0]=4 13660 B18R0.15771 COC(=O)CCCCCCCNC(=O)CCC(C)C 188690a_100000687944_100000181311 [0,2,0,0,0,0|1,0,1]=4 13661 B18R0.15771 COC(=O)CCCCCCCNC(=O)CCC(C)O 188690a_100000687944_100000718519 [0,2,0,0,0,0|1,0,1]=4 13662 B18R0.15771 COC(=O)CCCCCCCNC(C)CCC(C)C 2230a_100138410893_100010004213 [0,2,0,0,0,0|1,0,0]=3 13663 B18R0.15771 COC(=O)CCCCCCCOC(C)CCC(C)C 34a_100011022521_100011261404 [0,2,0,0,0,0|1,0,0]=3 13664 B18R0.15771 COC(=O)CCCCCCCOC(C)CCC(C)C 34a_100011215350_100010004213 [0,2,0,0,0,0|1,0,0]=3 13665 B18R0.15771 COC(=O)CCCCCCCOC(C)CCC(C)C 7a_100011215350_100010004213 [0,2,0,0,0,0|1,0,0]=3 13666 B18R0.15771 COC(=O)CCCCCCCSC(C)CCC(C)C 62a_100010004213_100011261404 [0,2,0,0,0,0|1,0,0]=3 13667 B18R0.15771 COC(=O)CCCCCCCSC(C)CCC(C)C 62a_100011261404_100010004213 [0,2,0,0,0,0|1,0,0]=3 13668 B18R0.16003 CCC(=O)CC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000747405 [0,2,0,0,0,0|0,0,2]=4 13669 B18R0.16003 CCC(C)CC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000748023 [0,2,0,0,0,0|0,0,1]=3 13670 B18R0.16003 CCC(C)CC(=O)CCCCCCCCC(=O)OC 1458a_100000708755_100010282707 [0,2,0,0,0,0|0,0,1]=3 13671 B18R0.16003 CCC(C)CC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000708755 [0,2,0,0,0,0|1,0,1]=4 13672 B18R0.16003 CCC(C)CC(C)NCCCCCCCC(=O)OC 2230a_100000763565_100010004213 [0,2,0,0,0,0|1,0,0]=3 13673 B18R0.16003 CCC(C)CN(C)CCCCCCCCC(=O)OC 2230a_100000753921_100010282707 [0,2,0,0,0,0|1,0,0]=3 13674 B18R0.16003 CCC(C)CN(C)CCCCCCCCC(=O)OC 269982a_100000753921_100010282707 [0,2,0,0,0,0|1,0,0]=3 13675 B18R0.16003 CCC(C)NC(=O)CCCCCCCCC(=O)OC 11a_100000209981_100000036616 [0,2,0,0,0,0|1,0,1]=4 13676 B18R0.16003 CCC(C)NC(=O)CCCCCCCCC(=O)OC 1626a_100000209981_100000036616 [0,2,0,0,0,0|1,0,1]=4 13677 B18R0.16003 CCC(C)NC(=O)CCCCCCCCC(=O)OC 240690a_100000209981_100000036616 [0,2,0,0,0,0|1,0,1]=4 13678 B18R0.16003 CCC(O)CC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100011218378 [0,2,0,0,0,0|0,0,1]=3 13679 B18R0.16003 CCC(O)CC(=O)CCCCCCCCC(=O)OC 1458a_100011667805_100010282707 [0,2,0,0,0,0|0,0,1]=3 13680 B18R0.16003 CCC(O)CC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100011667805 [0,2,0,0,0,0|1,0,1]=4 13681 B18R0.16003 CCN(C)CC(=O)CCCCCCCCC(=O)OC 1458a_100116209913_100010282707 [0,2,0,0,0,0|1,0,1]=4 13682 B18R0.16003 CC[C@H](C)CC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100009816398 [0,2,0,0,0,0|0,0,1]=3 13683 B18R0.16003 COC(=O)CCCCCCCCC(=O)C[C@@H](C)CO 1458a_100000036616_100000059175 [0,2,0,0,0,0|1,0,1]=4 13684 B18R0.16003 COC(=O)CCCCCCCCN(C)CC(O)CO 2230a_100011216503_100010282707 [0,2,0,0,0,0|2,0,0]=4 13685 B18R0.16003 COC(=O)CCCCCCCCN(C)CC(O)CO 269982a_100011216503_100010282707 [0,2,0,0,0,0|2,0,0]=4 13686 B18R0.19862 CCCCC(C)CCCCOCCCC(=O)N(C)C 7a_200011021034_100000737642 [0,2,0,0,0,0|2,0,0]=4 13687 B18R0.26200 CCCCC(C)(C)COCCCCCCC(=O)OC 7a_200011995781_100009815986 [0,2,0,0,0,0|1,0,0]=3 13688 B18R0.26200 CCCCC(C)(C)OCCCCCCCC(=O)OC 7a_100011219641_100010004213 [0,2,0,0,0,0|1,0,0]=3 13689 B18R0.26200 CCCC[Si](C)(C)COCCCCCCC(=O)OC 7a_100009863599_200000073895 [0,2,0,0,0,0|1,1,0]=4 13690 B18R0.26200 CCCC[Si](C)(C)CSCCCCCCC(=O)OC 62a_100009815986_200000073895 [0,2,0,0,0,0|1,1,0]=4 13691 B18R0.26200 CCCC[Si](C)(C)CSCCCCCCC(=O)OC 62a_200000073895_100009815986 [0,2,0,0,0,0|1,1,0]=4 13692 B18R0.26200 COC(=O)CCCCCCCOC(C)(C)CCCBr 7a_100009888830_100010004213 [0,2,0,0,0,0|2,0,0]=4 13693 B18R0.11632 CCCCCCCCCC(=O)CCCC(=O)N(C)C 1458a_100000210558_100000737642 [0,2,0,0,0,0|1,0,1]=4 13694 B18R0.11632 CCCCCCCCCC(C)CNCC(=O)N(C)C 270004a_100015183351_200011218516 [0,2,0,0,0,0|2,0,0]=4 13695 B18R0.11632 CCCCCCCCCC(C)NCCC(=O)N(C)C 270004a_100000738053_100011215753 [0,2,0,0,0,0|2,0,0]=4 13696 B18R0.11632 CCCCCCCCCC(C)OCCC(=O)N(C)C 7a_100011218016_100000737620 [0,2,0,0,0,0|2,0,0]=4 13697 B18R0.11632 CCCCCCCCCN(C)CCCC(=O)N(C)C 2230a_100000232482_100000737642 [0,2,0,0,0,0|2,0,0]=4 13698 B18R0.11632 CCCCCCCCCN(C)CCCC(=O)N(C)C 269982a_100000232482_100000737642 [0,2,0,0,0,0|2,0,0]=4 13699 B18R0.13732 COC(=O)CCCC(=O)NCCCCCCC(C)C 11a_100000211014_100000239890 [0,2,0,0,0,0|1,0,1]=4 13700 B18R0.13732 COC(=O)CCCC(=O)NCCCCCCC(C)C 1626a_100000211014_100000239890 [0,2,0,0,0,0|1,0,1]=4 13701 B18R0.13732 COC(=O)CCCC(=O)NCCCCCCC(C)C 240690a_100000211014_100000239890 [0,2,0,0,0,0|1,0,1]=4 13702 B18R0.13732 COC(=O)CCCC(=O)NCCCCCCC(C)C 527a_100000211014_100000239890 [0,2,0,0,0,0|1,0,1]=4 13703 B18R0.19809 CCCCCCCCCC(=O)CC(C)CC(=O)OC 1458a_100000732146_100000210670 [0,2,0,0,0,0|0,0,1]=3 13704 B18R0.19809 CCCCCCCCCC(=O)N[C@H](C)CC(=O)OC 188690a_100016994721_100000210558 [0,2,0,0,0,0|1,0,1]=4 13705 B18R0.19809 CCCCCCCCCC(C)CN(C)CC(=O)NC 270004a_100000189611_200011218516 [0,2,0,0,0,0|2,0,0]=4 13706 B18R0.19809 CCCCCCCCCC(C)CN(C)CC(=O)OC 270004a_100000198492_200011218516 [0,2,0,0,0,0|1,0,0]=3 13707 B18R0.19809 CCCCCCCCCC(C)OC(C)CC(=O)OC 34a_100011218016_100009817358 [0,2,0,0,0,0|1,0,0]=3 13708 B18R0.19809 CCCCCCCCCC(C)OC(C)CC(=O)OC 7a_100011218016_100009817358 [0,2,0,0,0,0|1,0,0]=3 13709 B18R0.19809 CCCCCCCCNC(=O)CC(C)CC(=O)OC 11a_100000229939_100000732146 [0,2,0,0,0,0|1,0,1]=4 13710 B18R0.19809 CCCCCCCCNC(=O)CC(C)CC(=O)OC 1626a_100000229939_100000732146 [0,2,0,0,0,0|1,0,1]=4 13711 B18R0.19809 CCCCCCCCNC(=O)CC(C)CC(=O)OC 240690a_100000229939_100000732146 [0,2,0,0,0,0|1,0,1]=4 13712 B18R0.19809 CCCCCCCCNC(=O)CC(C)CC(=O)OC 527a_100000229939_100000732146 [0,2,0,0,0,0|1,0,1]=4 13713 B18R0.19809 COC(=O)CC(C)CC(=O)CCCCCCCCO 1458a_100000732146_100000033203 [0,2,0,0,0,0|1,0,1]=4 13714 B18R0.20144 CCCCCCCCCC(=O)N(C)CCC(=O)OC 11a_100025711912_100000210558 [0,2,0,0,0,0|1,0,1]=4 13715 B18R0.20144 CCCCCCCCCC(=O)N(C)CCC(=O)OC 1626a_100025711912_100000210558 [0,2,0,0,0,0|1,0,1]=4 13716 B18R0.20144 CCCCCCCCCC(=O)N(C)CCC(=O)OC 240690a_100025711912_100000210558 [0,2,0,0,0,0|1,0,1]=4 13717 B18R0.20144 CCCCCCCCCC(=O)N(C)CCC(=O)OC 527a_100025711912_100000210558 [0,2,0,0,0,0|1,0,1]=4 13718 B18R0.20144 CCCCCCCCCC(C)N(C)CCC(=O)NC 270004a_100000750875_100011215753 [0,2,0,0,0,0|2,0,0]=4 13719 B18R0.20144 CCCCCCCCCN(C)C(=O)CCC(=O)OC 11a_100000232482_100000187943 [0,2,0,0,0,0|1,0,1]=4 13720 B18R0.20144 CCCCCCCCCN(C)C(=O)CCC(=O)OC 1626a_100000232482_100000187943 [0,2,0,0,0,0|1,0,1]=4 13721 B18R0.20144 CCCCCCCCCN(C)C(=O)CCC(=O)OC 240690a_100000232482_100000187943 [0,2,0,0,0,0|1,0,1]=4 13722 B18R0.20144 CCCCCCCCCN(C)C(=O)CCC(=O)OC 527a_100000232482_100000187943 [0,2,0,0,0,0|1,0,1]=4 13723 B18R0.12002 CCC(C)(C)COCCCCCCCCC(=O)OC 7a_100000765029_100010282707 [0,2,0,0,0,0|1,0,0]=3 13724 B18R0.12002 CCC(C)(C)NCCCCCCCCCC(=O)OC 2230a_100000211385_100009813843 [0,2,0,0,0,0|1,0,0]=3 13725 B18R0.12002 CCC(C)(C)OCCCCCCCCCC(=O)OC 7a_100000210230_100009813843 [0,2,0,0,0,0|1,0,0]=3 13726 B18R0.12002 CCC(C)(C)SCCCCCCCCCC(=O)OC 62a_100000032637_100009813843 [0,2,0,0,0,0|1,0,0]=3 13727 B18R0.12002 CCS(=O)(=O)CCNCCCCCCCC(=O)OC 2230a_100000751051_100010004213 [0,2,0,0,0,0|2,0,0]=4 13728 B18R0.12002 CCS(=O)(=O)CCNCCCCCCCC(=O)OC 34a_100000751051_100010004213 [0,2,0,0,0,0|2,0,0]=4 13729 B18R0.12002 CCS(=O)(=O)CCOCCCCCCCC(=O)OC 34a_100011022521_100000756660 [0,2,0,0,0,0|2,0,0]=4 13730 B18R0.12002 CCS(=O)(=O)CCOCCCCCCCC(=O)OC 34a_200011216379_100010004213 [0,2,0,0,0,0|2,0,0]=4 13731 B18R0.12002 CCS(=O)(=O)CCOCCCCCCCC(=O)OC 7a_100011022521_100000756660 [0,2,0,0,0,0|2,0,0]=4 13732 B18R0.12002 CCS(=O)(=O)CCOCCCCCCCC(=O)OC 7a_200011216379_100010004213 [0,2,0,0,0,0|2,0,0]=4 13733 B18R0.12002 CCS(=O)(=O)CCSCCCCCCCC(=O)OC 62a_100000756660_100010004213 [0,2,0,0,0,0|2,0,0]=4 13734 B18R0.12002 CCS(=O)(=O)CCSCCCCCCCC(=O)OC 62a_100010004213_100000756660 [0,2,0,0,0,0|2,0,0]=4 13735 B18R0.12002 COC(=O)CCCCCCCCCNC(C)(C)CO 2230a_100000210608_100009813843 [0,2,0,0,0,0|2,0,0]=4 13736 B18R0.12002 COC(=O)CCCCCCCCCOC(C)(C)CCl 7a_100000764493_100009813843 [0,2,0,0,0,0|2,0,0]=4 13737 B18R0.12002 COC(=O)CCCCCCCCCSC(F)(F)CO 62a_100011217949_100009813843 [0,2,0,0,0,0|2,0,0]=4 13738 B18R0.12002 COC(=O)CCCCCCCCNCC(C)(C)CO 2230a_100020635058_100010282707 [0,2,0,0,0,0|2,0,0]=4 13739 B18R0.12002 COC(=O)CCCCCCCCNCC(C)(C)OC 2230a_100000763424_100010282707 [0,2,0,0,0,0|2,0,0]=4 13740 B18R0.12002 COC(=O)CCCCCCCCOCC(C)(C)CCl 7a_100011217199_100010282707 [0,2,0,0,0,0|2,0,0]=4 13741 B18R0.12002 COC(=O)CCCCCCCCOCC(C)(C)CO 34a_100000035544_100009813988 [0,2,0,0,0,0|2,0,0]=4 13742 B18R0.12002 COC(=O)CCCCCCCCOCC(C)(C)CO 7a_100000035544_100009813988 [0,2,0,0,0,0|2,0,0]=4 13743 B18R0.12002 COC(=O)CCCCCCCCOCC(C)(C)OC 34a_100000035544_100000701081 [0,2,0,0,0,0|2,0,0]=4 13744 B18R0.12002 COC(=O)CCCCCCCCOCC(F)(F)CN 34a_100000703232_100010282707 [0,2,0,0,0,0|2,0,0]=4 13745 B18R0.12002 COC(=O)CCCCCCCCSCC(C)(C)CO 62a_100009813988_100010282707 [0,2,0,0,0,0|2,0,0]=4 13746 B18R0.12002 COC(=O)CCCCCCCCSCC(C)(C)CO 62a_100010282707_100009813988 [0,2,0,0,0,0|2,0,0]=4 13747 B18R0.12002 COC(=O)CCCCCCCCSCC(C)(C)OC 62a_100000701081_100010282707 [0,2,0,0,0,0|2,0,0]=4 13748 B18R0.12002 COC(=O)CCCCCCCCSCC(C)(C)OC 62a_100010282707_100000701081 [0,2,0,0,0,0|2,0,0]=4 13749 B18R0.12002 COC(=O)CCCCCCCOCCC(C)(C)OC 7a_100000699976_100010004213 [0,2,0,0,0,0|2,0,0]=4 13750 B18R0.12002 COC(=O)CCCCCCNCCCC(C)(C)CO 2230a_100000039164_100009815986 [0,2,0,0,0,0|2,0,0]=4 13751 B18R0.15767 C=C(C)C(=O)CCCCCCCCCCC(=O)OC 1458a_100000185857_100009812566 [0,2,0,0,0,0|0,0,2]=4 13752 B18R0.15767 CCC(C)CCCCCOCCCCC(=O)N(C)C 7a_200000035636_100000752486 [0,2,0,0,0,0|2,0,0]=4 13753 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100009812566 [0,2,0,0,0,0|0,0,1]=3 13754 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)C(C)C 1458a_100016987261_100000210206 [0,2,0,0,0,0|0,0,1]=3 13755 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100009812566 [0,2,0,0,0,0|0,0,1]=3 13756 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100009812566 [0,2,0,0,0,0|1,0,1]=4 13757 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)N(C)C 11a_100102631434_100016987261 [0,2,0,0,0,0|1,0,1]=4 13758 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100016987261 [0,2,0,0,0,0|1,0,1]=4 13759 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100016987261 [0,2,0,0,0,0|1,0,1]=4 13760 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100009812566 [0,2,0,0,0,0|0,0,1]=3 13761 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100009812566 [0,2,0,0,0,0|0,0,1]=3 13762 B18R0.15767 COC(=O)CCCCCCCCCCN(C)C(C)C 269982a_200000211004_100009812566 [0,2,0,0,0,0|1,0,0]=3 13763 B18R0.15767 COC(=O)CCCCCCCCCNC(C)C(C)C 2230a_100000211541_100009813843 [0,2,0,0,0,0|1,0,0]=3 13764 B18R0.15767 COC(=O)CCCCCCCCCOC(C)C(=O)C 34a_100000212229_100009813843 [0,2,0,0,0,0|1,0,1]=4 13765 B18R0.15767 COC(=O)CCCCCCCCCOC(C)C(C)C 7a_100000748068_100009813843 [0,2,0,0,0,0|1,0,0]=3 13766 B18R0.15767 COC(=O)CCCCCCCCCSC(C)C(=O)C 62a_100009814033_100009813843 [0,2,0,0,0,0|1,0,1]=4 13767 B18R0.15767 COC(=O)CCCCCCCCNCC(O)C(C)C 2230a_100000759067_100010282707 [0,2,0,0,0,0|1,0,0]=3 13768 B18R0.15767 COC(=O)CCCCCCCCNCC(O)C(C)C 34a_100000759067_100010282707 [0,2,0,0,0,0|1,0,0]=3 13769 B18R0.15767 COC(=O)CCCCCCCCOCC(=O)C(C)C 34a_100000035544_100000753385 [0,2,0,0,0,0|1,0,1]=4 13770 B18R0.15767 COC(=O)CCCCCCCCOCC(=O)C(C)C 7a_100000035544_100000753385 [0,2,0,0,0,0|1,0,1]=4 13771 B18R0.15767 COC(=O)CCCCCCCCOCC(C)C(=O)C 34a_100000032740_100010282707 [0,2,0,0,0,0|1,0,1]=4 13772 B18R0.15767 COC(=O)CCCCCCCCOCC(C)C(=O)C 7a_100000032740_100010282707 [0,2,0,0,0,0|1,0,1]=4 13773 B18R0.15767 COC(=O)CCCCCCCCOC[C@H](N)C(C)C 34a_100011830312_100010282707 [0,2,0,0,0,0|1,0,0]=3 13774 B18R0.15767 COC(=O)CCCCCCCCSCC(=O)C(C)C 62a_100000753385_100010282707 [0,2,0,0,0,0|1,0,1]=4 13775 B18R0.15767 COC(=O)CCCCCCCCSCC(=O)C(C)C 62a_100010282707_100000753385 [0,2,0,0,0,0|1,0,1]=4 13776 B18R0.15767 COC(=O)CCCCCCCOCCC(N)C(C)C 34a_100161115045_100010004213 [0,2,0,0,0,0|1,0,0]=3 13777 B18R0.3204 COC(=O)CCC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000691467 [0,2,0,0,0,0|1,0,1]=4 13778 B18R0.3204 COC(=O)CCC(=O)CNCCCCCCC(C)C 34a_100000211014_100000691467 [0,2,0,0,0,0|1,0,1]=4 13779 B18R0.7561 CCCCCCCCCCN(CC)CCC(=O)OC 2230a_100000229097_100000210320 [0,2,0,0,0,0|1,0,0]=3 13780 B18R0.7561 CCCCCCCCCCN(CC)CCC(=O)OC 269982a_100000229097_100000210320 [0,2,0,0,0,0|1,0,0]=3 13781 B18R0.7561 CCN(CCCCCCCCCO)CCC(=O)OC 2230a_100000229097_100009813782 [0,2,0,0,0,0|2,0,0]=4 13782 B18R0.7561 CCN(CCCCCCCCCO)CCC(=O)OC 269982a_100000229097_100009813782 [0,2,0,0,0,0|2,0,0]=4 13783 B18R0.17280 CCCCCCCCCNS(=O)(=O)CCC(=O)OC 270084a_100000212291_100000205946 [0,2,0,0,0,0|2,0,0]=4 13784 B18R0.17280 CCCCCCCCCNS(=O)(=O)CCC(=O)OC 274078a_100000212291_100000205946 [0,2,0,0,0,0|2,0,0]=4 13785 B18R0.19180 CCCCCCCCCCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000210319 [0,2,0,0,0,0|0,0,1]=3 13786 B18R0.19180 CCCCCCCCCCC(=O)N(C)CC(=O)OC 11a_100000198492_100000210375 [0,2,0,0,0,0|1,0,1]=4 13787 B18R0.19180 CCCCCCCCCCC(=O)N(C)CC(=O)OC 1626a_100000198492_100000210375 [0,2,0,0,0,0|1,0,1]=4 13788 B18R0.19180 CCCCCCCCCCC(=O)N(C)CC(=O)OC 240690a_100000198492_100000210375 [0,2,0,0,0,0|1,0,1]=4 13789 B18R0.19180 CCCCCCCCCCC(C)N(C)CC(=O)NC 270004a_100000189611_200011219864 [0,2,0,0,0,0|2,0,0]=4 13790 B18R0.19180 CCCCCCCCCCC(C)N(C)CC(=O)OC 270004a_100000198492_200011219864 [0,2,0,0,0,0|1,0,0]=3 13791 B18R0.19180 CCCCCCCCCCN(C)C(=O)CC(=O)OC 240690a_100000207566_100000211351 [0,2,0,0,0,0|1,0,1]=4 13792 B18R0.19180 CCCCCCCCCCN(C)C(C)CC(=O)NC 2230a_100015186911_100000210320 [0,2,0,0,0,0|2,0,0]=4 13793 B18R0.19180 CCCCCCCCCCN(C)C(C)CC(=O)NC 269982a_100015186911_100000210320 [0,2,0,0,0,0|2,0,0]=4 13794 B18R0.19180 CCCCCCCCCCN(C)C(C)CC(=O)OC 2230a_100000207566_100009817358 [0,2,0,0,0,0|1,0,0]=3 13795 B18R0.19180 CCCCCCCCCCN(C)C(C)CC(=O)OC 269982a_100000207566_100009817358 [0,2,0,0,0,0|1,0,0]=3 13796 B18R0.19180 CCCCCCCCCNC(=O)C(C)CC(=O)OC 1626a_100000212291_100000037256 [0,2,0,0,0,0|1,0,1]=4 13797 B18R0.19180 CCCCCCCCCNC(=O)C(C)CC(=O)OC 240690a_100000212291_100000037256 [0,2,0,0,0,0|1,0,1]=4 13798 B18R0.19180 CCCCCCCCCNC(=O)C(C)CC(=O)OC 527a_100000212291_100000037256 [0,2,0,0,0,0|1,0,1]=4 13799 B18R0.19180 CCCCCCCCCSC(C)C(=O)CC(=O)OC 62a_100009997173_100000210670 [0,2,0,0,0,0|1,0,1]=4 13800 B18R0.19180 COC(=O)CC(C)C(=O)CCCCCCCCCO 1458a_100000037256_100009813782 [0,2,0,0,0,0|1,0,1]=4 13801 B18R0.19789 CCCCCCCCCCC(=O)CCC(=O)N(C)C 1458a_100011200748_100000210319 [0,2,0,0,0,0|1,0,1]=4 13802 B18R0.19789 CCCCCCCCCCC(C)NCC(=O)N(C)C 270004a_100015183351_200011219864 [0,2,0,0,0,0|2,0,0]=4 13803 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)C(=O)C 34a_100011215000_100011261029 [0,2,0,0,0,0|2,0,0]=4 13804 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)C(C)C 34a_100011215000_100000753385 [0,2,0,0,0,0|2,0,0]=4 13805 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)C(C)C 7a_100011215000_100000753385 [0,2,0,0,0,0|2,0,0]=4 13806 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)N(C)C 34a_100011215000_100000692301 [0,2,0,0,0,0|2,0,0]=4 13807 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)N(C)C 7a_100011215000_100000692301 [0,2,0,0,0,0|2,0,0]=4 13808 B18R0.19789 CCCCCCCCCCN(C)CCC(=O)N(C)C 2230a_100000207566_100000737620 [0,2,0,0,0,0|2,0,0]=4 13809 B18R0.19789 CCCCCCCCCCN(C)CCC(=O)N(C)C 269982a_100000207566_100000737620 [0,2,0,0,0,0|2,0,0]=4 13810 B18R0.186 CCCCCCCCCCCC(=O)CC(=O)C(=O)C 1458a_100000210736_100011261029 [0,2,0,0,0,0|1,0,1]=4 13811 B18R0.186 CCCCCCCCCCCC(=O)CC(=O)C(C)C 1458a_100000210736_100000753385 [0,2,0,0,0,0|1,0,1]=4 13812 B18R0.186 CCCCCCCCCCCC(=O)CC(=O)N(C)C 1458a_100000210736_100000185267 [0,2,0,0,0,0|1,0,1]=4 13813 B18R0.186 CCCCCCCCCCCC(O)CC(=O)N(C)C 1626a_100102631434_100000082106 [0,2,0,0,0,0|1,0,0]=3 13814 B18R0.186 CCCCCCCCCCCC(O)CC(=O)N(C)C 240690a_100102631434_100000082106 [0,2,0,0,0,0|1,0,0]=3 13815 B18R0.186 CCCCCCCCCCCN(C)CC(=O)N(C)C 2230a_100000185065_100011215454 [0,2,0,0,0,0|2,0,0]=4 13816 B18R0.190 CCCCCCCCCCO[C@@H](CC)CC(=O)OC 7a_200015357724_100000210320 [0,2,0,0,0,0|1,0,0]=3 13817 B18R0.190 CCCCCCCCCCO[C@@H](CCl)CC(=O)OC 7a_100000754131_100000210320 [0,2,0,0,0,0|1,0,0]=3 13818 B18R0.190 CC[C@@H](CC(=O)OC)OCCCCCCCCCO 7a_200015357724_100009813782 [0,2,0,0,0,0|2,0,0]=4 13819 B18R0.190 COC(=O)C[C@H](CCl)OCCCCCCCCCO 7a_100000754131_100009813782 [0,2,0,0,0,0|2,0,0]=4 13820 B18R0.19826 COC(=O)C[C@@H](O)COCCCCCCCC(C)C 34a_200000210741_100000754131 [0,2,0,0,0,0|1,0,0]=3 13821 B18R0.19826 COC(=O)C[C@@H](O)COCCCCCCCC(C)C 7a_200000210741_100000754131 [0,2,0,0,0,0|1,0,0]=3 13822 B18R0.72222 CCCCCCCCCCNS(=O)(=O)CC(=O)OC 270084a_100000684558_100000736875 [0,2,0,0,0,0|2,0,0]=4 13823 B18R0.72222 CCCCCCCCCCNS(=O)(=O)CC(=O)OC 274078a_100000684558_100000736875 [0,2,0,0,0,0|2,0,0]=4 13824 B18R0.72222 CCCCCCCCCCOC(C)(C)CC(=O)OC 7a_100015205050_100000210320 [0,2,0,0,0,0|1,0,0]=3 13825 B18R0.72222 COC(=O)CC(C)(C)OCCCCCCCCCO 7a_100015205050_100009813782 [0,2,0,0,0,0|2,0,0]=4 13826 B18R0.942 CC(C)CCCCCCCOCCCC(=O)N(C)C 7a_200000210741_100000737642 [0,2,0,0,0,0|2,0,0]=4 13827 B18R0.942 CC(C)CCCCCCNCCCCC(=O)N(C)C 34a_100000211014_100000752486 [0,2,0,0,0,0|2,0,0]=4 13828 B18R0.3048 CC(C)(C)C(=O)CCCCCCCCCCCCO 1458a_106744555173_100009813331 [0,2,0,0,0,0|2,0,0]=4 13829 B18R0.3048 CC(C)(F)C(=O)CCCCCCCCCCCCO 1458a_100000765255_100009813331 [0,2,0,0,0,0|2,0,0]=4 13830 B18R0.3048 CC(C)(O)C(=O)CCCCCCCCCCCCO 1458a_100000242741_100009813331 [0,2,0,0,0,0|2,0,0]=4 13831 B18R0.3048 CCCCCCCCCCCCCC(=O)C(C)(C)O 1458a_100000242741_100000210684 [0,2,0,0,0,0|1,0,0]=3 13832 B18R0.3048 CCCCCCCCCCCCCC(=O)C(F)(F)F 1458a_100000756256_200000243211 [0,2,0,0,0,0|2,0,0]=4 13833 B18R0.3048 CCCCCCCCCCCCCC(=O)C(F)(F)F 1458a_100015355933_100000210684 [0,2,0,0,0,0|2,0,0]=4 13834 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C 11a_100000210451_106744555173 [0,2,0,0,0,0|2,0,0]=4 13835 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C 1626a_100000210451_106744555173 [0,2,0,0,0,0|2,0,0]=4 13836 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C 240690a_100000210451_106744555173 [0,2,0,0,0,0|2,0,0]=4 13837 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C 527a_100000210451_106744555173 [0,2,0,0,0,0|2,0,0]=4 13838 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 11a_100000210451_100000765255 [0,2,0,0,0,0|2,0,0]=4 13839 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 1626a_100000210451_100000765255 [0,2,0,0,0,0|2,0,0]=4 13840 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 240690a_100000210451_100000765255 [0,2,0,0,0,0|2,0,0]=4 13841 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 527a_100000210451_100000765255 [0,2,0,0,0,0|2,0,0]=4 13842 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)O 240690a_100000210451_100000242741 [0,2,0,0,0,0|2,0,0]=4 13843 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 11a_100000210451_100000042251 [0,2,0,0,0,0|2,0,0]=4 13844 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 1626a_100000210451_100000042251 [0,2,0,0,0,0|2,0,0]=4 13845 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 240690a_100000210451_100000042251 [0,2,0,0,0,0|2,0,0]=4 13846 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 527a_100000210451_100000042251 [0,2,0,0,0,0|2,0,0]=4 13847 B18R0.3048 CCCCCCCCCCCNCC(=O)C(C)(C)C 34a_200011215754_100000229897 [0,2,0,0,0,0|2,0,0]=4 13848 B18R0.3048 CCCCCCCCCCCOCC(=O)C(C)(C)C 34a_100000210809_100000229897 [0,2,0,0,0,0|2,0,0]=4 13849 B18R0.3048 CCCCCCCCCCCOCC(=O)C(C)(C)C 34a_200011592769_100011215454 [0,2,0,0,0,0|2,0,0]=4 13850 B18R0.3048 CCCCCCCCCCCOCC(=O)C(C)(C)C 7a_100000210809_100000210923 [0,2,0,0,0,0|2,0,0]=4 13851 B18R0.3048 CCCCCCCCCCCOCC(=O)C(C)(C)C 7a_200011592769_100011215454 [0,2,0,0,0,0|2,0,0]=4 13852 B18R0.3048 CCCCCCCCCCCSCC(=O)C(C)(C)C 62a_100000210923_100011215454 [0,2,0,0,0,0|2,0,0]=4 13853 B18R0.16006 CCC(=O)CCCCCCCCCCCC(F)(F)F 1458a_100000210414_200044909058 [0,2,0,0,0,0|2,0,0]=4 13854 B18R0.16006 COC(=O)CCCCCCCCCCNC(C)(C)C 2230a_100000715429_100009812566 [0,2,0,0,0,0|1,0,0]=3 13855 B18R0.16006 COC(=O)CCCCCCCCCCOC(C)(C)C 34a_100011003013_100000210625 [0,2,0,0,0,0|1,0,0]=3 13856 B18R0.16006 COC(=O)CCCCCCCCCCOC(C)(C)C 34a_100015890283_100009812566 [0,2,0,0,0,0|1,0,0]=3 13857 B18R0.16006 COC(=O)CCCCCCCCCCOC(C)(C)C 7a_100015890283_100009812566 [0,2,0,0,0,0|1,0,0]=3 13858 B18R0.16006 COC(=O)CCCCCCCCCCOC(F)(F)F 34a_100011003013_200103152311 [0,2,0,0,0,0|2,0,0]=4 13859 B18R0.16006 COC(=O)CCCCCCCCCCOC(F)(F)F 7a_100011003013_200000243211 [0,2,0,0,0,0|2,0,0]=4 13860 B18R0.16006 COC(=O)CCCCCCCCCCSC(C)(C)C 62a_100000211941_100009812566 [0,2,0,0,0,0|1,0,0]=3 13861 B18R0.16006 COC(=O)CCCCCCCCCCSC(F)(F)F 62a_200000243211_100009812566 [0,2,0,0,0,0|2,0,0]=4 13862 B18R0.16006 COC(=O)CCCCCCCCCNCC(C)(C)C 2230a_100000743828_100009813843 [0,2,0,0,0,0|1,0,0]=3 13863 B18R0.16006 COC(=O)CCCCCCCCCNCC(C)(C)F 2230a_100020643315_100009813843 [0,2,0,0,0,0|1,0,0]=3 13864 B18R0.16006 COC(=O)CCCCCCCCCNCC(C)(C)O 2230a_100000751335_100009813843 [0,2,0,0,0,0|1,0,0]=3 13865 B18R0.16006 COC(=O)CCCCCCCCCNCC(F)(F)F 34a_100000717047_100009813843 [0,2,0,0,0,0|2,0,0]=4 13866 B18R0.16006 COC(=O)CCCCCCCCCOCC(C)(C)F 34a_100000716592_100009813843 [0,2,0,0,0,0|1,0,0]=3 13867 B18R0.16006 COC(=O)CCCCCCCCCOCC(C)(F)F 34a_100000068830_100009813843 [0,2,0,0,0,0|1,0,0]=3 13868 B18R0.16006 COC(=O)CCCCCCCCCOCC(F)(F)Br 34a_100011217949_100009813843 [0,2,0,0,0,0|2,0,0]=4 13869 B18R0.16006 COC(=O)CCCCCCCCCOCC(F)(F)Cl 34a_100000734434_100009813843 [0,2,0,0,0,0|2,0,0]=4 13870 B18R0.16006 COC(=O)CCCCCCCCCOCC(F)(F)F 34a_100000210435_100009813843 [0,2,0,0,0,0|2,0,0]=4 13871 B18R0.16006 COC(=O)CCCCCCCCCSCC(C)(C)C 62a_100011219605_100009813843 [0,2,0,0,0,0|1,0,0]=3 13872 B18R0.16006 COC(=O)CCCCCCCCCSCC(C)(C)F 62a_100011997219_100009813843 [0,2,0,0,0,0|1,0,0]=3 13873 B18R0.16006 COC(=O)CCCCCCCCCSCC(C)(C)O 62a_100000764493_100009813843 [0,2,0,0,0,0|1,0,0]=3 13874 B18R0.16006 COC(=O)CCCCCCCCCSCC(F)(F)F 62a_100000763148_100009813843 [0,2,0,0,0,0|2,0,0]=4 13875 B18R0.16006 COC(=O)CCCCCCCCCSC[N+](C)(C)C 62a_200000036245_100009813843 [0,2,0,0,0,0|2,0,0]=4 13876 B18R0.16006 COC(=O)CCCCCCCCCSC[Si](C)(C)C 62a_100000037933_100009813843 [0,2,0,0,0,0|1,1,0]=4 13877 B18R0.16006 COC(=O)CCCCCCCCNCCC(C)(C)C 2230a_100000738805_100010282707 [0,2,0,0,0,0|1,0,0]=3 13878 B18R0.16006 COC(=O)CCCCCCCCNCCC(C)(C)F 2230a_100016253952_100010282707 [0,2,0,0,0,0|1,0,0]=3 13879 B18R0.16006 COC(=O)CCCCCCCCNCCC(F)(F)F 2230a_100000740434_100010282707 [0,2,0,0,0,0|2,0,0]=4 13880 B18R0.16006 COC(=O)CCCCCCCCNCCC(F)(F)F 34a_100000740434_100010282707 [0,2,0,0,0,0|2,0,0]=4 13881 B18R0.16006 COC(=O)CCCCCCCCNCCS(=O)(=O)C 2230a_100000740961_100010282707 [0,2,0,0,0,0|2,0,0]=4 13882 B18R0.16006 COC(=O)CCCCCCCCNCCS(=O)(=O)C 34a_100000740961_100010282707 [0,2,0,0,0,0|2,0,0]=4 13883 B18R0.16006 COC(=O)CCCCCCCCOCCC(C)(C)C 34a_100000035544_100000755188 [0,2,0,0,0,0|1,0,0]=3 13884 B18R0.16006 COC(=O)CCCCCCCCOCCC(C)(C)C 7a_100000035544_100000755188 [0,2,0,0,0,0|1,0,0]=3 13885 B18R0.16006 COC(=O)CCCCCCCCOCCC(C)(C)C 7a_100000765024_100010282707 [0,2,0,0,0,0|1,0,0]=3 13886 B18R0.16006 COC(=O)CCCCCCCCOCCC(C)(C)O 34a_100000035544_100000702414 [0,2,0,0,0,0|1,0,0]=3 13887 B18R0.16006 COC(=O)CCCCCCCCOCCC(C)(C)O 7a_100000035544_100000702414 [0,2,0,0,0,0|1,0,0]=3 13888 B18R0.16006 COC(=O)CCCCCCCCOCCC(F)(F)F 34a_100000035544_100011219754 [0,2,0,0,0,0|2,0,0]=4 13889 B18R0.16006 COC(=O)CCCCCCCCOCCC(F)(F)F 34a_100000752437_100010282707 [0,2,0,0,0,0|2,0,0]=4 13890 B18R0.16006 COC(=O)CCCCCCCCOCCC(F)(F)F 7a_100000035544_100011219754 [0,2,0,0,0,0|2,0,0]=4 13891 B18R0.16006 COC(=O)CCCCCCCCOCCS(=O)(=O)C 34a_100000035544_100000731031 [0,2,0,0,0,0|2,0,0]=4 13892 B18R0.16006 COC(=O)CCCCCCCCOCCS(=O)(=O)C 34a_100000211924_100010282707 [0,2,0,0,0,0|2,0,0]=4 13893 B18R0.16006 COC(=O)CCCCCCCCOCCS(=O)(=O)C 7a_100000035544_100000230027 [0,2,0,0,0,0|2,0,0]=4 13894 B18R0.16006 COC(=O)CCCCCCCCOCCS(=O)(=O)C 7a_100000211924_100010282707 [0,2,0,0,0,0|2,0,0]=4 13895 B18R0.16006 COC(=O)CCCCCCCCOCC[N+](C)(C)C 34a_100000035544_100000085578 [0,2,0,0,0,0|2,0,0]=4 13896 B18R0.16006 COC(=O)CCCCCCCCOCC[N+](C)(C)C 7a_100000035544_100000085578 [0,2,0,0,0,0|2,0,0]=4 13897 B18R0.16006 COC(=O)CCCCCCCCOCC[N+](C)(C)C 7a_200020618287_100010282707 [0,2,0,0,0,0|2,0,0]=4 13898 B18R0.16006 COC(=O)CCCCCCCCOCC[Si](C)(C)C 34a_100000035544_200000733723 [0,2,0,0,0,0|1,1,0]=4 13899 B18R0.16006 COC(=O)CCCCCCCCOCC[Si](C)(C)C 7a_100000035544_200000733723 [0,2,0,0,0,0|1,1,0]=4 13900 B18R0.16006 COC(=O)CCCCCCCCOCC[Si](C)(C)C 7a_100000039746_100010282707 [0,2,0,0,0,0|1,1,0]=4 13901 B18R0.16006 COC(=O)CCCCCCCCSCCC(C)(C)C 62a_100000755188_100010282707 [0,2,0,0,0,0|1,0,0]=3 13902 B18R0.16006 COC(=O)CCCCCCCCSCCC(C)(C)C 62a_100010282707_100000755188 [0,2,0,0,0,0|1,0,0]=3 13903 B18R0.16006 COC(=O)CCCCCCCCSCCC(C)(C)O 62a_100000702414_100010282707 [0,2,0,0,0,0|1,0,0]=3 13904 B18R0.16006 COC(=O)CCCCCCCCSCCC(C)(C)O 62a_100010282707_100000702414 [0,2,0,0,0,0|1,0,0]=3 13905 B18R0.16006 COC(=O)CCCCCCCCSCCC(F)(F)F 62a_100010282707_100011219754 [0,2,0,0,0,0|2,0,0]=4 13906 B18R0.16006 COC(=O)CCCCCCCCSCCC(F)(F)F 62a_100011219754_100010282707 [0,2,0,0,0,0|2,0,0]=4 13907 B18R0.16006 COC(=O)CCCCCCCCSCCS(=O)(=O)C 62a_100000731031_100010282707 [0,2,0,0,0,0|2,0,0]=4 13908 B18R0.16006 COC(=O)CCCCCCCCSCCS(=O)(=O)C 62a_100010282707_100000230027 [0,2,0,0,0,0|2,0,0]=4 13909 B18R0.16006 COC(=O)CCCCCCCCSCC[N+](C)(C)C 62a_100000085578_100010282707 [0,2,0,0,0,0|2,0,0]=4 13910 B18R0.16006 COC(=O)CCCCCCCCSCC[N+](C)(C)C 62a_100010282707_100000085578 [0,2,0,0,0,0|2,0,0]=4 13911 B18R0.16006 COC(=O)CCCCCCCCSCC[Si](C)(C)C 62a_100010282707_200000733723 [0,2,0,0,0,0|1,1,0]=4 13912 B18R0.16006 COC(=O)CCCCCCCCSCC[Si](C)(C)C 62a_200000733723_100010282707 [0,2,0,0,0,0|1,1,0]=4 13913 B18R0.16006 COC(=O)CCCCCCCNCCCC(F)(F)F 2230a_100000727188_100010004213 [0,2,0,0,0,0|2,0,0]=4 13914 B18R0.16006 COC(=O)CCCCCCCNCCCC(F)(F)F 34a_100000727188_100010004213 [0,2,0,0,0,0|2,0,0]=4 13915 B18R0.16006 COC(=O)CCCCCCCNCCCS(=O)(=O)C 2230a_100000742409_100010004213 [0,2,0,0,0,0|2,0,0]=4 13916 B18R0.16006 COC(=O)CCCCCCCNCCCS(=O)(=O)C 34a_100000742409_100010004213 [0,2,0,0,0,0|2,0,0]=4 13917 B18R0.16006 COC(=O)CCCCCCCNCCOC(C)(C)C 2230a_100000747557_100010004213 [0,2,0,0,0,0|2,0,0]=4 13918 B18R0.16006 COC(=O)CCCCCCCNCCSC(C)(C)C 2230a_100000689375_100010004213 [0,2,0,0,0,0|2,0,0]=4 13919 B18R0.16006 COC(=O)CCCCCCCOCCCC(C)(C)O 34a_100011022521_100009888830 [0,2,0,0,0,0|1,0,0]=3 13920 B18R0.16006 COC(=O)CCCCCCCOCCCC(C)(C)O 7a_100011022521_100009888830 [0,2,0,0,0,0|1,0,0]=3 13921 B18R0.16006 COC(=O)CCCCCCCOCCCC(F)(F)F 34a_100000749235_100010004213 [0,2,0,0,0,0|2,0,0]=4 13922 B18R0.16006 COC(=O)CCCCCCCOCCCC(F)(F)F 34a_100011022521_100011215983 [0,2,0,0,0,0|2,0,0]=4 13923 B18R0.16006 COC(=O)CCCCCCCOCCCC(F)(F)F 7a_100011022521_100011216173 [0,2,0,0,0,0|2,0,0]=4 13924 B18R0.16006 COC(=O)CCCCCCCOCCCS(=O)(=O)C 34a_100000689940_100010004213 [0,2,0,0,0,0|2,0,0]=4 13925 B18R0.16006 COC(=O)CCCCCCCOCCCS(=O)(=O)C 34a_100011022521_100000754308 [0,2,0,0,0,0|2,0,0]=4 13926 B18R0.16006 COC(=O)CCCCCCCOCCCS(=O)(=O)C 7a_100000689940_100010004213 [0,2,0,0,0,0|2,0,0]=4 13927 B18R0.16006 COC(=O)CCCCCCCOCCCS(=O)(=O)C 7a_100011022521_100000754308 [0,2,0,0,0,0|2,0,0]=4 13928 B18R0.16006 COC(=O)CCCCCCCOCCC[N+](C)(C)C 34a_100011022521_100016990835 [0,2,0,0,0,0|2,0,0]=4 13929 B18R0.16006 COC(=O)CCCCCCCOCCC[N+](C)(C)C 7a_100011022521_100016990835 [0,2,0,0,0,0|2,0,0]=4 13930 B18R0.16006 COC(=O)CCCCCCCOCCC[Si](C)(C)C 34a_100011022521_100011219597 [0,2,0,0,0,0|1,1,0]=4 13931 B18R0.16006 COC(=O)CCCCCCCOCCC[Si](C)(C)C 7a_100011022521_100011219597 [0,2,0,0,0,0|1,1,0]=4 13932 B18R0.16006 COC(=O)CCCCCCCOCCC[Si](C)(C)C 7a_200011215415_100010004213 [0,2,0,0,0,0|1,1,0]=4 13933 B18R0.16006 COC(=O)CCCCCCCOCCOC(C)(C)C 34a_100000693234_100010004213 [0,2,0,0,0,0|2,0,0]=4 13934 B18R0.16006 COC(=O)CCCCCCCOCCOC(C)(C)C 7a_100000693234_100010004213 [0,2,0,0,0,0|2,0,0]=4 13935 B18R0.16006 COC(=O)CCCCCCCSCCCC(C)(C)O 62a_100009888830_100010004213 [0,2,0,0,0,0|1,0,0]=3 13936 B18R0.16006 COC(=O)CCCCCCCSCCCC(C)(C)O 62a_100010004213_100009888830 [0,2,0,0,0,0|1,0,0]=3 13937 B18R0.16006 COC(=O)CCCCCCCSCCCC(F)(F)F 62a_100010004213_100011216173 [0,2,0,0,0,0|2,0,0]=4 13938 B18R0.16006 COC(=O)CCCCCCCSCCCC(F)(F)F 62a_100011216173_100010004213 [0,2,0,0,0,0|2,0,0]=4 13939 B18R0.16006 COC(=O)CCCCCCCSCCCS(=O)(=O)C 62a_100000754308_100010004213 [0,2,0,0,0,0|2,0,0]=4 13940 B18R0.16006 COC(=O)CCCCCCCSCCCS(=O)(=O)C 62a_100010004213_100000754308 [0,2,0,0,0,0|2,0,0]=4 13941 B18R0.16006 COC(=O)CCCCCCCSCCC[N+](C)(C)C 62a_100010004213_100016990835 [0,2,0,0,0,0|2,0,0]=4 13942 B18R0.16006 COC(=O)CCCCCCCSCCC[N+](C)(C)C 62a_100016990835_100010004213 [0,2,0,0,0,0|2,0,0]=4 13943 B18R0.16006 COC(=O)CCCCCCCSCCC[Si](C)(C)C 62a_100010004213_100011219597 [0,2,0,0,0,0|1,1,0]=4 13944 B18R0.16006 COC(=O)CCCCCCCSCCC[Si](C)(C)C 62a_100011219597_100010004213 [0,2,0,0,0,0|1,1,0]=4 13945 B18R0.16006 COC(=O)CCCCCCNCCCOC(C)(C)C 2230a_100011250582_100009815986 [0,2,0,0,0,0|2,0,0]=4 13946 B18R0.16006 COC(=O)CCCCCCOCCCCC(F)(F)F 34a_100000749236_100009815986 [0,2,0,0,0,0|2,0,0]=4 13947 B18R0.16006 COC(=O)CCCCCCOCCCCC(F)(F)F 34a_100009863599_100000692467 [0,2,0,0,0,0|2,0,0]=4 13948 B18R0.16006 COC(=O)CCCCCCOCCCCC(F)(F)F 7a_100000749236_100009815986 [0,2,0,0,0,0|2,0,0]=4 13949 B18R0.16006 COC(=O)CCCCCCOCCCCC(F)(F)F 7a_100009863599_100000692467 [0,2,0,0,0,0|2,0,0]=4 13950 B18R0.16006 COC(=O)CCCCCCOCCCC[Si](C)(C)C 7a_200009881916_100009815986 [0,2,0,0,0,0|1,1,0]=4 13951 B18R0.16006 COC(=O)CCCCCCSCCCCC(F)(F)F 62a_100000692467_100009815986 [0,2,0,0,0,0|2,0,0]=4 13952 B18R0.16006 COC(=O)CCCCCCSCCCCC(F)(F)F 62a_100009815986_100000692467 [0,2,0,0,0,0|2,0,0]=4 13953 B18R0.16006 COC(=O)CCCCCOCCCCCC(C)(C)O 34a_100000074720_100010402123 [0,2,0,0,0,0|1,0,0]=3 13954 B18R0.16006 COC(=O)CCCCCOCCCCCC(C)(C)O 7a_100000074720_100010402123 [0,2,0,0,0,0|1,0,0]=3 13955 B18R0.16006 COC(=O)CCCCCOCCCCCC(F)(F)F 34a_100000074720_100010187589 [0,2,0,0,0,0|2,0,0]=4 13956 B18R0.16006 COC(=O)CCCCCOCCCCCC(F)(F)F 7a_100000074720_100010187589 [0,2,0,0,0,0|2,0,0]=4 13957 B18R0.16006 COC(=O)CCCCCOCCCCC[N+](C)(C)C 34a_100000074720_100009813293 [0,2,0,0,0,0|2,0,0]=4 13958 B18R0.16006 COC(=O)CCCCCOCCCCC[N+](C)(C)C 7a_100000074720_100009813293 [0,2,0,0,0,0|2,0,0]=4 13959 B18R0.16006 COC(=O)CCCCCSCCCCCC(C)(C)O 62a_100009816466_100010402123 [0,2,0,0,0,0|1,0,0]=3 13960 B18R0.16006 COC(=O)CCCCCSCCCCCC(C)(C)O 62a_100010402123_100009816466 [0,2,0,0,0,0|1,0,0]=3 13961 B18R0.16006 COC(=O)CCCCCSCCCCCC(F)(F)F 62a_100009816466_100010187589 [0,2,0,0,0,0|2,0,0]=4 13962 B18R0.16006 COC(=O)CCCCCSCCCCCC(F)(F)F 62a_100010187589_100009816466 [0,2,0,0,0,0|2,0,0]=4 13963 B18R0.16006 COC(=O)CCCCCSCCCCC[N+](C)(C)C 62a_100009813293_100009816466 [0,2,0,0,0,0|2,0,0]=4 13964 B18R0.16006 COC(=O)CCCCCSCCCCC[N+](C)(C)C 62a_100009816466_100009813293 [0,2,0,0,0,0|2,0,0]=4 13965 B18R0.16006 COC(=O)CCCCOCCCCCC[N+](C)(C)C 34a_100000059025_100009996864 [0,2,0,0,0,0|2,0,0]=4 13966 B18R0.16006 COC(=O)CCCCOCCCCCC[N+](C)(C)C 7a_100000059025_100009996864 [0,2,0,0,0,0|2,0,0]=4 13967 B18R0.16006 COC(=O)CCCCSCCCCCC[N+](C)(C)C 62a_100000204269_100009996864 [0,2,0,0,0,0|2,0,0]=4 13968 B18R0.16006 COC(=O)CCCCSCCCCCC[N+](C)(C)C 62a_100009996864_100000204269 [0,2,0,0,0,0|2,0,0]=4 13969 B18R0.16006 COC(=O)CSCCCCCCCCCC(F)(F)F 62a_100000747449_200041927475 [0,2,0,0,0,0|2,0,0]=4 13970 B18R0.16006 COC(=O)CSCCCCCCCCCC(F)(F)F 62a_200041927475_100000747449 [0,2,0,0,0,0|2,0,0]=4 13971 B16R1.271 CCCCCCN1CCCCC1CCOC 2230a_100015186528_100000210314 [1,0,0,1,0,0|1,0,1]=4 13972 B16R1.271 CCCCCCN1CCCCC1CCOC 269982a_100015186528_100000210757 [1,0,0,1,0,0|1,0,1]=4 13973 B16R1.271 CCCCCCN1CCCCC1CCOC 34a_100015186528_100000210314 [1,0,0,1,0,0|1,0,1]=4 13974 B16R1.284 CCCCCC1CCCC1NCCCOC 269862a_100150723488_200000198059 [1,0,0,1,0,0|1,0,1]=4 13975 B16R1.284 CCCCCC1CCCC1NCCCOC 270004a_100150723488_200000198059 [1,0,0,1,0,0|1,0,1]=4 13976 B16R1.284 CCCCCCC1CCCC1NCCOC 269862a_100000209980_100000189428 [1,0,0,1,0,0|1,0,1]=4 13977 B16R1.284 CCCCCCC1CCCC1NCCOC 270004a_100000209980_100000189428 [1,0,0,1,0,0|1,0,1]=4 13978 B16R1.643 CC=CCCCOCCCC1CCCCC1 34a_100020645299_100011713725 [1,0,0,1,0,0|2,0,0]=4 13979 B16R1.643 CCCCCCCCCCN1CC=CCC1 2230a_100000698166_100000210320 [1,0,0,1,0,0|2,0,0]=4 13980 B16R1.643 CCCCCCCCCCN1CC=CCC1 269982a_100000698166_100000210320 [1,0,0,1,0,0|2,0,0]=4 13981 B16R1.643 CCCCCCCCCCN1CC=CCC1 34a_100000698166_100000210320 [1,0,0,1,0,0|2,0,0]=4 13982 B16R1.643 CCCCCCCCCCN1CCCOC1 2230a_100000131196_100000210320 [1,0,0,1,0,0|1,0,1]=4 13983 B16R1.643 CCCCCCCCCCN1CCCOC1 269982a_100000131196_100000210320 [1,0,0,1,0,0|1,0,1]=4 13984 B16R1.643 CCCCCCCCCCN1CCCOC1 34a_100000131196_100000210320 [1,0,0,1,0,0|1,0,1]=4 13985 B16R1.643 CCCCCCCCCNC1CCCOC1 2230a_100000719290_100011214924 [1,0,0,1,0,0|1,0,1]=4 13986 B16R1.643 CCCCCCCCCNC1CCCOC1 270004a_100000212291_100000753404 [1,0,0,1,0,0|1,0,1]=4 13987 B16R1.643 CCCCCCCCCNC1CCCOC1 34a_100000212291_100000693364 [1,0,0,1,0,0|1,0,1]=4 13988 B16R1.643 CCCCCCCCCNC1CCCOC1 34a_100000719290_100011214924 [1,0,0,1,0,0|1,0,1]=4 13989 B16R1.643 CCCCCCCCCOC1CC=CCC1 34a_100000073881_100011214924 [1,0,0,1,0,0|2,0,0]=4 13990 B16R1.643 CCCCCCCCCOC1CCCOC1 34a_100000210712_100000693364 [1,0,0,1,0,0|1,0,1]=4 13991 B16R1.643 CCCCCCCCCOC1CCCOC1 34a_100000754041_100011214924 [1,0,0,1,0,0|1,0,1]=4 13992 B16R1.643 CCCCCCCCCOC1CCCOC1 7a_100000210712_100000693364 [1,0,0,1,0,0|1,0,1]=4 13993 B16R1.643 CCCCCCCCNCC1CC=CCC1 270004a_100000229939_100000189434 [1,0,0,1,0,0|2,0,0]=4 13994 B16R1.643 CCCCCCCCNCC1CCCOC1 2230a_100000229939_100000741521 [1,0,0,1,0,0|1,0,1]=4 13995 B16R1.643 CCCCCCCCNCC1CCCOC1 2230a_100000720124_100000210759 [1,0,0,1,0,0|1,0,1]=4 13996 B16R1.643 CCCCCCCCNCC1CCCOC1 34a_100000229939_100000741521 [1,0,0,1,0,0|1,0,1]=4 13997 B16R1.643 CCCCCCCCNCC1CCCOC1 34a_100000720124_100000210759 [1,0,0,1,0,0|1,0,1]=4 13998 B16R1.643 CCCCCCCCOCC1CC=CCC1 34a_100000210713_100000210759 [1,0,0,1,0,0|2,0,0]=4 13999 B16R1.643 CCCCCCCCOCC1CCCOC1 34a_100000210232_100000741521 [1,0,0,1,0,0|1,0,1]=4 14000 B16R1.643 CCCCCCCCOCC1CCCOC1 34a_100000741520_100000210759 [1,0,0,1,0,0|1,0,1]=4 14001 B16R1.643 CCCCCCCCOCC1CCCOC1 7a_100000210232_100000741521 [1,0,0,1,0,0|1,0,1]=4 14002 B16R1.643 CCCCCCCCSCC1CCCOC1 62a_100000210759_100000741521 [1,0,0,1,0,0|1,0,1]=4 14003 B16R1.643 CCCCCCCCSCC1CCCOC1 62a_100000741521_100000210317 [1,0,0,1,0,0|1,0,1]=4 14004 B16R1.643 COCCCCCCNCC1CCCCC1 2230a_100000210473_100011998445 [1,0,0,1,0,0|1,0,1]=4 14005 B16R1.643 COCCCCCCNCC1CCCCC1 34a_100000210473_100011998445 [1,0,0,1,0,0|1,0,1]=4 14006 B16R1.643 COCCCCCCOCC1CCCCC1 34a_100000212181_100011998445 [1,0,0,1,0,0|1,0,1]=4 14007 B16R1.643 COCCCCCCOCC1CCCCC1 34a_200012092642_100000211423 [1,0,0,1,0,0|1,0,1]=4 14008 B16R1.643 COCCCCCCOCC1CCCCC1 7a_100000212181_100011998445 [1,0,0,1,0,0|1,0,1]=4 14009 B16R1.643 COCCCCCCOCC1CCCCC1 7a_200012092642_100000211423 [1,0,0,1,0,0|1,0,1]=4 14010 B16R1.643 COCCCCCCSCC1CCCCC1 62a_100000211423_100011998445 [1,0,0,1,0,0|1,0,1]=4 14011 B16R1.643 COCCCCCCSCC1CCCCC1 62a_100011998445_100000211423 [1,0,0,1,0,0|1,0,1]=4 14012 B16R1.643 COCCCCCNCCC1CCCCC1 2230a_100000747528_100012355289 [1,0,0,1,0,0|1,0,1]=4 14013 B16R1.643 COCCCCCNCCC1CCCCC1 270004a_100000747528_100011713444 [1,0,0,1,0,0|1,0,1]=4 14014 B16R1.643 COCCCCCNCCC1CCCCC1 34a_100000747528_100011209188 [1,0,0,1,0,0|1,0,1]=4 14015 B16R1.643 COCCCCNCCCC1CCCCC1 2230a_100011211642_100000730899 [1,0,0,1,0,0|1,0,1]=4 14016 B16R1.643 COCCCCNCCCC1CCCCC1 34a_100011211642_100000755781 [1,0,0,1,0,0|1,0,1]=4 14017 B16R1.643 COCCCCOCCCC1CCCCC1 34a_100000198086_100000755781 [1,0,0,1,0,0|1,0,1]=4 14018 B16R1.643 COCCCCOCCCC1CCCCC1 34a_100000740925_100011713725 [1,0,0,1,0,0|1,0,1]=4 14019 B16R1.643 COCCCCOCCCC1CCCCC1 7a_100000198086_100000730899 [1,0,0,1,0,0|1,0,1]=4 14020 B16R1.643 COCCCCSCCCC1CCCCC1 62a_100000730899_100011713725 [1,0,0,1,0,0|1,0,1]=4 14021 B16R1.643 COCCCCSCCCC1CCCCC1 62a_100011713725_100000730899 [1,0,0,1,0,0|1,0,1]=4 14022 B16R1.643 COCCCOCCCCC1CCCCC1 34a_100011215267_100000740836 [1,0,0,1,0,0|1,0,1]=4 14023 B16R1.643 COCCCOCCCCC1CCCCC1 7a_100011215267_100000740836 [1,0,0,1,0,0|1,0,1]=4 14024 B16R1.1193 CCCCCCCCCCCN1CC=CC1 269982a_100015195280_100011215454 [1,0,0,1,0,0|2,0,0]=4 14025 B16R1.1193 CCCCCCCCCCNC1CC=CC1 2230a_100015188752_100000210320 [1,0,0,1,0,0|2,0,0]=4 14026 B16R1.1193 CCCCCCCCCCNC1CCOC1 2230a_100000684558_100000731011 [1,0,0,1,0,0|1,0,1]=4 14027 B16R1.1193 CCCCCCCCCCNC1CCOC1 270004a_100000684558_100000752484 [1,0,0,1,0,0|1,0,1]=4 14028 B16R1.1193 CCCCCCCCCCNC1CCOC1 34a_100000684558_100000690089 [1,0,0,1,0,0|1,0,1]=4 14029 B16R1.1193 CCCCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210320 [1,0,0,1,0,0|1,0,1]=4 14030 B16R1.1193 CCCCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210320 [1,0,0,1,0,0|1,0,1]=4 14031 B16R1.1193 CCCCCCCCCCN[C@H]1CCOC1 34a_100015188467_100000210320 [1,0,0,1,0,0|1,0,1]=4 14032 B16R1.1193 CCCCCCCCCCOC1CCOC1 34a_100000210711_100000690089 [1,0,0,1,0,0|1,0,1]=4 14033 B16R1.1193 CCCCCCCCCCOC1CCOC1 7a_100000210711_100000731011 [1,0,0,1,0,0|1,0,1]=4 14034 B16R1.1193 CCCCCCCCCCO[C@H]1CCOC1 34a_100000717292_100000210320 [1,0,0,1,0,0|1,0,1]=4 14035 B16R1.1193 CCCCCCCCCNCC1CCOC1 2230a_100000212291_100000702531 [1,0,0,1,0,0|1,0,1]=4 14036 B16R1.1193 CCCCCCCCCNCC1CCOC1 2230a_100000737293_100011214924 [1,0,0,1,0,0|1,0,1]=4 14037 B16R1.1193 CCCCCCCCCNCC1CCOC1 34a_100000212291_100011261433 [1,0,0,1,0,0|1,0,1]=4 14038 B16R1.1193 CCCCCCCCCNCC1CCOC1 34a_100000737293_100011214924 [1,0,0,1,0,0|1,0,1]=4 14039 B16R1.1193 CCCCCCCCCOCC1CC=CC1 34a_100000688395_100011214924 [1,0,0,1,0,0|2,0,0]=4 14040 B16R1.1193 CCCCCCCCCOCC1CCOC1 34a_100000210712_100011261433 [1,0,0,1,0,0|1,0,1]=4 14041 B16R1.1193 CCCCCCCCCOCC1CCOC1 34a_100000740260_100011214924 [1,0,0,1,0,0|1,0,1]=4 14042 B16R1.1193 CCCCCCCCCOCC1CCOC1 7a_100000210712_100000702531 [1,0,0,1,0,0|1,0,1]=4 14043 B16R1.1193 CCCCCCCCCSCC1CCOC1 62a_100000702531_100000210670 [1,0,0,1,0,0|1,0,1]=4 14044 B16R1.1193 CCCCCCCCOCCC1CCOC1 34a_100011879284_100000210759 [1,0,0,1,0,0|1,0,1]=4 14045 B16R1.1193 COCCCCCCNCCC1CCCC1 2230a_100000739158_100011998445 [1,0,0,1,0,0|1,0,1]=4 14046 B16R1.1193 COCCCCCCNCCC1CCCC1 34a_100000739158_100011998445 [1,0,0,1,0,0|1,0,1]=4 14047 B16R1.1193 COCCCCCCOCCC1CCCC1 34a_100000749090_100011998445 [1,0,0,1,0,0|1,0,1]=4 14048 B16R1.1193 COCCCCCCOCCC1CCCC1 34a_200012092642_100000760354 [1,0,0,1,0,0|1,0,1]=4 14049 B16R1.1193 COCCCCCCOCCC1CCCC1 7a_100000749090_100011998445 [1,0,0,1,0,0|1,0,1]=4 14050 B16R1.1193 COCCCCCCOCCC1CCCC1 7a_200012092642_100000760354 [1,0,0,1,0,0|1,0,1]=4 14051 B16R1.1193 COCCCCCCSCCC1CCCC1 62a_100000760354_100011998445 [1,0,0,1,0,0|1,0,1]=4 14052 B16R1.1193 COCCCCCCSCCC1CCCC1 62a_100011998445_100000760354 [1,0,0,1,0,0|1,0,1]=4 14053 B16R1.1193 COCCCCCNCCCC1CCCC1 2230a_100000747528_100011713738 [1,0,0,1,0,0|1,0,1]=4 14054 B16R1.1193 COCCCCCNCCCC1CCCC1 34a_100000747528_100011713738 [1,0,0,1,0,0|1,0,1]=4 14055 B16R1.1218 COCCCCCCNC1CCCCC1C 2230a_100000211402_100011998445 [1,0,0,1,0,0|1,0,1]=4 14056 B16R1.1218 COCCCCCCNC1CCCCC1C 34a_100000211402_100011998445 [1,0,0,1,0,0|1,0,1]=4 14057 B16R1.1218 COCCCCCCOC1CCCCC1C 34a_100000211207_100011998445 [1,0,0,1,0,0|1,0,1]=4 14058 B16R1.1218 COCCCCCCOC1CCCCC1C 7a_100000211207_100011998445 [1,0,0,1,0,0|1,0,1]=4 14059 B16R1.1418 CCC1CCCCC1NCCCCCOC 269862a_100000747528_100000757040 [1,0,0,1,0,0|1,0,1]=4 14060 B16R1.1418 CCC1CCCCC1NCCCCCOC 270004a_100000747528_100000757040 [1,0,0,1,0,0|1,0,1]=4 14061 B16R1.1418 CCC1CCCCN1CCCCCCOC 2230a_100000210034_100011998445 [1,0,0,1,0,0|1,0,1]=4 14062 B16R1.1418 CCC1CCCCN1CCCCCCOC 269982a_100000210034_100011998445 [1,0,0,1,0,0|1,0,1]=4 14063 B16R1.1418 CCC1CCCCN1CCCCCCOC 34a_100000210034_100011998445 [1,0,0,1,0,0|1,0,1]=4 14064 B16R1.1418 CCCCCCCNC1CCCCC1OC 270004a_100000229938_100000740605 [1,0,0,1,0,0|1,0,1]=4 14065 B16R1.1418 CCCCCCCNC1CCCCC1OC 34a_100011208099_100000210614 [1,0,0,1,0,0|1,0,1]=4 14066 B16R1.1418 CCCCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210614 [1,0,0,1,0,0|1,0,1]=4 14067 B16R1.1418 CCCCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210614 [1,0,0,1,0,0|1,0,1]=4 14068 B16R1.1425 CCCCCN1CCCCC1CCCOC 2230a_100011804088_100000210326 [1,0,0,1,0,0|1,0,1]=4 14069 B16R1.1425 CCCCCN1CCCCC1CCCOC 269982a_100011804088_100000210215 [1,0,0,1,0,0|1,0,1]=4 14070 B16R1.1425 CCCCCN1CCCCC1CCCOC 34a_100011804088_100000718602 [1,0,0,1,0,0|1,0,1]=4 14071 B16R1.3891 CCCCCCCCCCCNC1COC1 2230a_100016991112_100011215454 [1,0,0,1,0,0|1,0,1]=4 14072 B16R1.3891 CCCCCCCCCCCNC1COC1 34a_200011215754_100009818527 [1,0,0,1,0,0|1,0,1]=4 14073 B16R1.3891 CCCCCCCCCCCOC1COC1 34a_100000210809_100009818527 [1,0,0,1,0,0|1,0,1]=4 14074 B16R1.3891 CCCCCCCCCCCOC1COC1 7a_100000210809_100009818527 [1,0,0,1,0,0|1,0,1]=4 14075 B16R1.3891 CCCCCCCCCCNCC1COC1 2230a_100000684558_100010264016 [1,0,0,1,0,0|1,0,1]=4 14076 B16R1.3891 CCCCCCCCCCNCC1COC1 2230a_100015281925_100000210320 [1,0,0,1,0,0|1,0,1]=4 14077 B16R1.3891 CCCCCCCCCCNCC1COC1 34a_100000684558_100010264016 [1,0,0,1,0,0|1,0,1]=4 14078 B16R1.3891 CCCCCCCCCCNCC1COC1 34a_100015281925_100000210320 [1,0,0,1,0,0|1,0,1]=4 14079 B16R1.3891 CCCCCCCCCCOCC1COC1 34a_100000060846_100000210320 [1,0,0,1,0,0|1,0,1]=4 14080 B16R1.3891 CCCCCCCCCCOCC1COC1 34a_100000210711_100010264016 [1,0,0,1,0,0|1,0,1]=4 14081 B16R1.3891 CCCCCCCCCCOCC1COC1 7a_100000210711_100010264016 [1,0,0,1,0,0|1,0,1]=4 14082 B16R1.3891 CCCCCCCCCCSCC1COC1 62a_100010264016_100000210320 [1,0,0,1,0,0|1,0,1]=4 14083 B16R1.3891 CCCCCCCCCOCCC1COC1 34a_100009855314_100011214924 [1,0,0,1,0,0|1,0,1]=4 14084 B16R1.4697 CCCCCCCCCN1CCC1COC 2230a_100015195929_100011214924 [1,0,0,1,0,0|1,0,1]=4 14085 B16R1.4697 CCCCCCCCCN1CCC1COC 269982a_100015195929_100000210670 [1,0,0,1,0,0|1,0,1]=4 14086 B16R1.4697 CCCCCCCCCN1CCC1COC 34a_100015195929_100011214924 [1,0,0,1,0,0|1,0,1]=4 14087 B16R1.7352 COCNC1CCCCCCCCCCC1 2230a_100011194316_100000766300 [1,0,0,1,0,0|1,0,1]=4 14088 B16R1.8376 CCCC1CCCC1NCCCCCOC 269862a_100000747528_100000723119 [1,0,0,1,0,0|1,0,1]=4 14089 B16R1.8376 CCCC1CCCC1NCCCCCOC 270004a_100000747528_100000723119 [1,0,0,1,0,0|1,0,1]=4 14090 B16R1.8376 CCCCCCCCN1CCC[C@H]1COC 2230a_100020646714_100000210759 [1,0,0,1,0,0|1,0,1]=4 14091 B16R1.8376 CCCCCCCCN1CCC[C@H]1COC 269982a_100020646714_100000210759 [1,0,0,1,0,0|1,0,1]=4 14092 B16R1.8376 CCCCCCCCN1CCC[C@H]1COC 34a_100020646714_100000210759 [1,0,0,1,0,0|1,0,1]=4 14093 B16R1.8379 COCCCCCCN1CCCCCCC1 2230a_100000211400_100011998445 [1,0,0,1,0,0|1,0,1]=4 14094 B16R1.8379 COCCCCCCN1CCCCCCC1 269982a_100000211400_100011998445 [1,0,0,1,0,0|1,0,1]=4 14095 B16R1.8379 COCCCCCCN1CCCCCCC1 34a_100000211400_100011998445 [1,0,0,1,0,0|1,0,1]=4 14096 B16R1.8379 COCCCCCNC1CCCCCCC1 270004a_100000747528_100000210524 [1,0,0,1,0,0|1,0,1]=4 14097 B16R1.8379 COCCCCOCC1CCCCCCC1 34a_100011216312_100000755781 [1,0,0,1,0,0|1,0,1]=4 14098 B16R1.8379 COCCCCOCC1CCCCCCC1 7a_100011216312_100000730899 [1,0,0,1,0,0|1,0,1]=4 14099 B16R1.8379 COCCCNCCC1CCCCCCC1 2230a_100011532352_100000740836 [1,0,0,1,0,0|1,0,1]=4 14100 B16R1.8379 COCCCNCCC1CCCCCCC1 34a_100011532352_100000740836 [1,0,0,1,0,0|1,0,1]=4 14101 B16R1.17455 CCCCCCCCCCCNCC1CO1 2230a_200011215754_100011216344 [1,0,0,1,0,0|1,0,1]=4 14102 B16R1.17455 CCCCCCCCCCCNCC1CO1 34a_200011215754_102125554688 [1,0,0,1,0,0|1,0,1]=4 14103 B16R1.17455 CCCCCCCCCCCOCC1CO1 34a_100000210809_102125554688 [1,0,0,1,0,0|1,0,1]=4 14104 B16R1.17455 CCCCCCCCCCCOCC1CO1 7a_100000210809_102125554688 [1,0,0,1,0,0|1,0,1]=4 14105 B16R1.17455 CCCCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100011215454 [1,0,0,1,0,0|1,0,1]=4 14106 B16R1.17455 CCCCCCCCCCCOC[C@@H]1CO1 7a_100000210809_100000745022 [1,0,0,1,0,0|1,0,1]=4 14107 B16R1.17455 CCCCCCCCCCCSCC1CO1 62a_102125554688_100011215454 [1,0,0,1,0,0|1,0,1]=4 14108 B16R1.17455 CCCCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100011215454 [1,0,0,1,0,0|1,0,1]=4 14109 B16R1.17455 CCCCCCCCCCNCCC1CO1 2230a_100000684558_100000732470 [1,0,0,1,0,0|1,0,1]=4 14110 B16R1.17455 CCCCCCCCCCNCCC1CO1 34a_100000684558_100000732470 [1,0,0,1,0,0|1,0,1]=4 14111 B16R1.17455 CCCCCCCCCCOCCC1CO1 34a_100000210711_100000732470 [1,0,0,1,0,0|1,0,1]=4 14112 B16R1.17455 CCCCCCCCCCOCCC1CO1 7a_100000210711_100000732470 [1,0,0,1,0,0|1,0,1]=4 14113 B16R1.17455 CCCCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000210320 [1,0,0,1,0,0|1,0,1]=4 14114 B16R1.17455 CCCCCCCCCCSCCC1CO1 62a_100000732470_100000210320 [1,0,0,1,0,0|1,0,1]=4 14115 B16R1.17455 CCCCCCCCCNCCCC1CO1 2230a_100000212291_100000733510 [1,0,0,1,0,0|1,0,1]=4 14116 B16R1.17455 CCCCCCCCCNCCCC1CO1 34a_100000212291_100000733510 [1,0,0,1,0,0|1,0,1]=4 14117 B16R1.17455 CCCCCCCCCOCCCC1CO1 34a_100000210712_100000733510 [1,0,0,1,0,0|1,0,1]=4 14118 B16R1.17455 CCCCCCCCCOCCCC1CO1 7a_100000210712_100000733510 [1,0,0,1,0,0|1,0,1]=4 14119 B16R1.17455 CCCCCCCCCSCCCC1CO1 62a_100000733510_100000210670 [1,0,0,1,0,0|1,0,1]=4 14120 B16R1.17539 COCCCCCCNC1CCCCCC1 2230a_100000210984_100011998445 [1,0,0,1,0,0|1,0,1]=4 14121 B16R1.17539 COCCCCCCNC1CCCCCC1 34a_100000210984_100011998445 [1,0,0,1,0,0|1,0,1]=4 14122 B16R1.17539 COCCCCCCOC1CCCCCC1 34a_100000210887_100011998445 [1,0,0,1,0,0|1,0,1]=4 14123 B16R1.17539 COCCCCCCOC1CCCCCC1 34a_200012092642_100011217769 [1,0,0,1,0,0|1,0,1]=4 14124 B16R1.17539 COCCCCCCOC1CCCCCC1 7a_100000210887_100011998445 [1,0,0,1,0,0|1,0,1]=4 14125 B16R1.17539 COCCCCCCSC1CCCCCC1 62a_100011217769_100011998445 [1,0,0,1,0,0|1,0,1]=4 14126 B16R1.17539 COCCCCCCSC1CCCCCC1 62a_100011998445_100011217769 [1,0,0,1,0,0|1,0,1]=4 14127 B16R1.17539 COCCCCCNCC1CCCCCC1 2230a_100000747528_200000696569 [1,0,0,1,0,0|1,0,1]=4 14128 B16R1.17539 COCCCCCNCC1CCCCCC1 269862a_100000747528_200000763224 [1,0,0,1,0,0|1,0,1]=4 14129 B16R1.17539 COCCCCCNCC1CCCCCC1 34a_100000747528_200000696569 [1,0,0,1,0,0|1,0,1]=4 14130 B16R1.17539 COCCCCNCCC1CCCCCC1 2230a_100011532351_100000730899 [1,0,0,1,0,0|1,0,1]=4 14131 B16R1.17539 COCCCCNCCC1CCCCCC1 34a_100011532351_100000755781 [1,0,0,1,0,0|1,0,1]=4 14132 B16R1.20288 CCCC1CCCCC1OCCCCOC 34a_100011217265_100000755781 [1,0,0,1,0,0|1,0,1]=4 14133 B16R1.20288 CCCC1CCCCC1OCCCCOC 7a_100011217265_100000730899 [1,0,0,1,0,0|1,0,1]=4 14134 B16R1.20288 CCCCCCCN1CCCCC1COC 2230a_100015184032_100000210681 [1,0,0,1,0,0|1,0,1]=4 14135 B16R1.20288 CCCCCCCN1CCCCC1COC 269982a_100015184032_100000210681 [1,0,0,1,0,0|1,0,1]=4 14136 B16R1.20288 CCCCCCCN1CCCCC1COC 34a_100015184032_100000210614 [1,0,0,1,0,0|1,0,1]=4 14137 B16R1.6 CCCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210759 [1,0,0,1,0,0|2,0,0]=4 14138 B16R1.6 CCCCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210759 [1,0,0,1,0,0|2,0,0]=4 14139 B16R1.6 CCCCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210759 [1,0,0,1,0,0|2,0,0]=4 14140 B16R1.6 CCCCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210759 [1,0,0,1,0,0|2,0,0]=4 14141 B16R1.6 CCCCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210759 [1,0,0,1,0,0|2,0,0]=4 14142 B16R1.6 CCCCCCCOCC1CCC(=O)CC1 34a_100000062911_100000210614 [1,0,0,1,0,0|2,0,0]=4 14143 B16R1.75 CCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210314 [1,0,0,1,0,0|2,0,0]=4 14144 B16R1.75 CCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210314 [1,0,0,1,0,0|2,0,0]=4 14145 B16R1.273 CCCCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210314 [1,0,0,1,0,0|2,0,0]=4 14146 B16R1.273 CCCCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210757 [1,0,0,1,0,0|2,0,0]=4 14147 B16R1.273 CCCCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210314 [1,0,0,1,0,0|2,0,0]=4 14148 B16R1.273 CCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210314 [1,0,0,1,0,0|1,0,0]=3 14149 B16R1.273 CCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210757 [1,0,0,1,0,0|1,0,0]=3 14150 B16R1.273 CCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210314 [1,0,0,1,0,0|1,0,0]=3 14151 B16R1.273 CCCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210314 [1,0,0,1,0,0|2,0,0]=4 14152 B16R1.273 CCCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210314 [1,0,0,1,0,0|2,0,0]=4 14153 B16R1.273 CCCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000718602 [1,0,0,1,0,0|2,0,0]=4 14154 B16R1.273 CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000718602 [1,0,0,1,0,0|1,0,0]=3 14155 B16R1.273 CCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210326 [1,0,0,1,0,0|1,0,0]=3 14156 B16R1.273 CCCCOCN1CCCCC1C(=O)OC 2230a_100000734855_100011995733 [1,0,0,1,0,0|2,0,0]=4 14157 B16R1.273 CCCCOCN1CCCCC1C(=O)OC 269982a_100000734855_100011995733 [1,0,0,1,0,0|2,0,0]=4 14158 B16R1.273 CCCCOCN1CCCCC1C(=O)OC 34a_100000734855_100011995733 [1,0,0,1,0,0|2,0,0]=4 14159 B16R1.273 CCCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100011215938 [1,0,0,1,0,0|2,0,0]=4 14160 B16R1.273 CCCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100011215938 [1,0,0,1,0,0|2,0,0]=4 14161 B16R1.273 CCCOCCN1CCCCC1C(=O)OC 34a_100000734855_100011215938 [1,0,0,1,0,0|2,0,0]=4 14162 B16R1.273 CCOCCCN1CCCCC1C(=O)OC 2230a_100000734855_100012232248 [1,0,0,1,0,0|2,0,0]=4 14163 B16R1.273 CCOCCCN1CCCCC1C(=O)OC 269982a_100000734855_100012232248 [1,0,0,1,0,0|2,0,0]=4 14164 B16R1.273 CCOCCCN1CCCCC1C(=O)OC 34a_100000734855_100012232248 [1,0,0,1,0,0|2,0,0]=4 14165 B16R1.273 CCOCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210147 [1,0,0,1,0,0|2,0,0]=4 14166 B16R1.273 CCOCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011215890 [1,0,0,1,0,0|2,0,0]=4 14167 B16R1.273 CCSCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000757381 [1,0,0,1,0,0|2,0,0]=4 14168 B16R1.273 CCSCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000757381 [1,0,0,1,0,0|2,0,0]=4 14169 B16R1.273 COC(=O)C1CCCCN1CCCCCF 2230a_100000734855_100000729378 [1,0,0,1,0,0|2,0,0]=4 14170 B16R1.273 COC(=O)C1CCCCN1CCCCCF 269982a_100000734855_100000729378 [1,0,0,1,0,0|2,0,0]=4 14171 B16R1.273 COC(=O)C1CCCCN1CCCCCF 34a_100000734855_100000729378 [1,0,0,1,0,0|2,0,0]=4 14172 B16R1.273 COC(=O)C1CCCCN1CCCCCO 2230a_100000734855_100000746330 [1,0,0,1,0,0|2,0,0]=4 14173 B16R1.273 COC(=O)C1CCCCN1CCCCCO 269982a_100000734855_100000746330 [1,0,0,1,0,0|2,0,0]=4 14174 B16R1.273 COC(=O)C1CCCCN1CCCCCO 34a_100000734855_100000746330 [1,0,0,1,0,0|2,0,0]=4 14175 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCF 34a_100015709673_100000729493 [1,0,0,1,0,0|2,0,0]=4 14176 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCF 7a_100015709673_100000729493 [1,0,0,1,0,0|2,0,0]=4 14177 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCO 34a_100015709673_100011216708 [1,0,0,1,0,0|2,0,0]=4 14178 B16R1.273 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCO 7a_100015709673_100000210776 [1,0,0,1,0,0|2,0,0]=4 14179 B16R1.273 COCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000730899 [1,0,0,1,0,0|2,0,0]=4 14180 B16R1.273 COCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000730899 [1,0,0,1,0,0|2,0,0]=4 14181 B16R1.273 COCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000755781 [1,0,0,1,0,0|2,0,0]=4 14182 B16R1.273 COCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000740836 [1,0,0,1,0,0|2,0,0]=4 14183 B16R1.273 COCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000740836 [1,0,0,1,0,0|2,0,0]=4 14184 B16R1.285 CCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210314 [1,0,0,1,0,0|1,0,0]=3 14185 B16R1.285 CCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210757 [1,0,0,1,0,0|1,0,0]=3 14186 B16R1.285 CCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210314 [1,0,0,1,0,0|1,0,0]=3 14187 B16R1.285 CCCCOCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011995733 [1,0,0,1,0,0|2,0,0]=4 14188 B16R1.285 CCCCOCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011995733 [1,0,0,1,0,0|2,0,0]=4 14189 B16R1.285 CCCCOCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011995733 [1,0,0,1,0,0|2,0,0]=4 14190 B16R1.285 CCCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011215938 [1,0,0,1,0,0|2,0,0]=4 14191 B16R1.285 CCCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215938 [1,0,0,1,0,0|2,0,0]=4 14192 B16R1.285 CCCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011215938 [1,0,0,1,0,0|2,0,0]=4 14193 B16R1.285 CCOCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100012232248 [1,0,0,1,0,0|2,0,0]=4 14194 B16R1.285 CCOCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100012232248 [1,0,0,1,0,0|2,0,0]=4 14195 B16R1.285 CCOCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100012232248 [1,0,0,1,0,0|2,0,0]=4 14196 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCF 2230a_100025726698_100000729378 [1,0,0,1,0,0|2,0,0]=4 14197 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCF 269982a_100025726698_100000729378 [1,0,0,1,0,0|2,0,0]=4 14198 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCF 34a_100025726698_100000729378 [1,0,0,1,0,0|2,0,0]=4 14199 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCO 2230a_100025726698_100000746330 [1,0,0,1,0,0|2,0,0]=4 14200 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCO 269982a_100025726698_100000746330 [1,0,0,1,0,0|2,0,0]=4 14201 B16R1.285 COC(=O)C[C@H]1CCCN1CCCCCO 34a_100025726698_100000746330 [1,0,0,1,0,0|2,0,0]=4 14202 B16R1.285 COCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000730899 [1,0,0,1,0,0|2,0,0]=4 14203 B16R1.285 COCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000730899 [1,0,0,1,0,0|2,0,0]=4 14204 B16R1.285 COCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000755781 [1,0,0,1,0,0|2,0,0]=4 14205 B16R1.300 COCC1CCN1CCCCCC(=O)OC 2230a_100015195929_100009816466 [1,0,0,1,0,0|2,0,0]=4 14206 B16R1.300 COCC1CCN1CCCCCC(=O)OC 269982a_100015195929_100009816466 [1,0,0,1,0,0|2,0,0]=4 14207 B16R1.300 COCC1CCN1CCCCCC(=O)OC 34a_100015195929_100009816466 [1,0,0,1,0,0|2,0,0]=4 14208 B16R1.642 CCCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100000210320 [1,0,0,1,0,0|2,0,0]=4 14209 B16R1.642 CCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100011214924 [1,0,0,1,0,0|2,0,0]=4 14210 B16R1.642 CCCCCCCCCNC1COC(=O)O1 34a_100000212291_100000032252 [1,0,0,1,0,0|2,0,0]=4 14211 B16R1.642 CCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100011214924 [1,0,0,1,0,0|2,0,0]=4 14212 B16R1.642 CCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100011214924 [1,0,0,1,0,0|2,0,0]=4 14213 B16R1.642 CCCCCCCCCOC1COC(=O)O1 34a_100000210712_100000032252 [1,0,0,1,0,0|2,0,0]=4 14214 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210759 [1,0,0,1,0,0|2,0,0]=4 14215 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210759 [1,0,0,1,0,0|2,0,0]=4 14216 B16R1.642 CCCCCCCCNCC1COC(=O)O1 34a_100000229939_100000073702 [1,0,0,1,0,0|2,0,0]=4 14217 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000229939_100015307671 [1,0,0,1,0,0|2,0,0]=4 14218 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 34a_100000229939_100015307671 [1,0,0,1,0,0|2,0,0]=4 14219 B16R1.642 CCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210759 [1,0,0,1,0,0|2,0,0]=4 14220 B16R1.642 CCCCCCCCOCC1COC(=O)O1 34a_100000210232_100000073702 [1,0,0,1,0,0|2,0,0]=4 14221 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210232_100015307671 [1,0,0,1,0,0|2,0,0]=4 14222 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210232_100015307671 [1,0,0,1,0,0|2,0,0]=4 14223 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210317 [1,0,0,1,0,0|2,0,0]=4 14224 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000210759_100000073702 [1,0,0,1,0,0|2,0,0]=4 14225 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100000210759_100015307671 [1,0,0,1,0,0|2,0,0]=4 14226 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210317 [1,0,0,1,0,0|2,0,0]=4 14227 B16R1.696 CCCC1CCCCC1NCCC(=O)NC 269862a_100000738227_100011218038 [1,0,0,1,0,0|2,0,0]=4 14228 B16R1.696 CCCC1CCCCC1NCCC(=O)NC 270004a_100000738227_100011218038 [1,0,0,1,0,0|2,0,0]=4 14229 B16R1.696 CCCC1CCCCC1OCCC(=O)NC 34a_100011217265_100012179268 [1,0,0,1,0,0|2,0,0]=4 14230 B16R1.696 CCCC1CCCCC1OCCC(=O)NC 7a_100011217265_100000737683 [1,0,0,1,0,0|2,0,0]=4 14231 B16R1.696 CCCC1CCCCC1OCCC(=O)OC 34a_100011217265_100000742370 [1,0,0,1,0,0|1,0,0]=3 14232 B16R1.696 CCCC1CCCCC1OCCC(=O)OC 7a_100011217265_100000204255 [1,0,0,1,0,0|1,0,0]=3 14233 B16R1.696 CCCC1CCCCN1CCCC(=O)NC 2230a_100000701414_100000741757 [1,0,0,1,0,0|2,0,0]=4 14234 B16R1.696 CCCC1CCCCN1CCCC(=O)NC 269982a_100000701414_100000741757 [1,0,0,1,0,0|2,0,0]=4 14235 B16R1.696 CCCC1CCCCN1CCCC(=O)NC 34a_100000701414_100000741757 [1,0,0,1,0,0|2,0,0]=4 14236 B16R1.696 CCCC1CCCCN1CCCC(=O)OC 2230a_100000701414_100011218270 [1,0,0,1,0,0|1,0,0]=3 14237 B16R1.696 CCCC1CCCCN1CCCC(=O)OC 269982a_100000701414_100011218270 [1,0,0,1,0,0|1,0,0]=3 14238 B16R1.696 CCCC1CCCCN1CCCC(=O)OC 34a_100000701414_100000742333 [1,0,0,1,0,0|1,0,0]=3 14239 B16R1.696 CCCC1COCCN1CCCC(=O)OC 2230a_102495339903_100011218270 [1,0,0,1,0,0|2,0,0]=4 14240 B16R1.696 CCCC1COCCN1CCCC(=O)OC 269982a_102495339903_100011218270 [1,0,0,1,0,0|2,0,0]=4 14241 B16R1.696 CCCC1COCCN1CCCC(=O)OC 34a_102495339903_100000742333 [1,0,0,1,0,0|2,0,0]=4 14242 B16R1.696 COC(=O)CCCN1CCCCC1CCO 2230a_100000211664_100011218270 [1,0,0,1,0,0|2,0,0]=4 14243 B16R1.696 COC(=O)CCCN1CCCCC1CCO 269982a_100000211664_100011218270 [1,0,0,1,0,0|2,0,0]=4 14244 B16R1.696 COC(=O)CCCN1CCCCC1CCO 34a_100000211664_100000742333 [1,0,0,1,0,0|2,0,0]=4 14245 B16R1.696 COCC1CCCCN1CCCC(=O)OC 2230a_100015184032_100011218270 [1,0,0,1,0,0|2,0,0]=4 14246 B16R1.696 COCC1CCCCN1CCCC(=O)OC 269982a_100015184032_100011218270 [1,0,0,1,0,0|2,0,0]=4 14247 B16R1.696 COCC1CCCCN1CCCC(=O)OC 34a_100015184032_100000742333 [1,0,0,1,0,0|2,0,0]=4 14248 B16R1.994 COC(=O)CCN1CCCCC1CCCO 2230a_100011934581_100000204255 [1,0,0,1,0,0|2,0,0]=4 14249 B16R1.994 COC(=O)CCN1CCCCC1CCCO 269982a_100011934581_100000204255 [1,0,0,1,0,0|2,0,0]=4 14250 B16R1.994 COC(=O)CCN1CCCCC1CCCO 34a_100011934581_100000742370 [1,0,0,1,0,0|2,0,0]=4 14251 B16R1.994 COCCC1CCCCN1CCC(=O)OC 2230a_100015186528_100000204255 [1,0,0,1,0,0|2,0,0]=4 14252 B16R1.994 COCCC1CCCCN1CCC(=O)OC 269982a_100015186528_100000204255 [1,0,0,1,0,0|2,0,0]=4 14253 B16R1.994 COCCC1CCCCN1CCC(=O)OC 34a_100015186528_100000742370 [1,0,0,1,0,0|2,0,0]=4 14254 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 2230a_100000736752_100000741757 [1,0,0,1,0,0|2,0,0]=4 14255 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 2230a_100000740002_100011713738 [1,0,0,1,0,0|2,0,0]=4 14256 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 34a_100000736752_100000741757 [1,0,0,1,0,0|2,0,0]=4 14257 B16R1.1095 CNC(=O)CCCNCCCC1CCCC1 34a_100000740002_100011713738 [1,0,0,1,0,0|2,0,0]=4 14258 B16R1.1095 CNC(=O)CCCOCCCC1CCCC1 34a_100011215328_100000741757 [1,0,0,1,0,0|2,0,0]=4 14259 B16R1.1095 CNC(=O)CCCOCCCC1CCCC1 7a_100011215328_100000741757 [1,0,0,1,0,0|2,0,0]=4 14260 B16R1.1095 CNC(=O)CCCSCCCC1CCCC1 62a_100000741757_100011713738 [1,0,0,1,0,0|2,0,0]=4 14261 B16R1.1095 CNC(=O)CCCSCCCC1CCCC1 62a_100011713738_100000741757 [1,0,0,1,0,0|2,0,0]=4 14262 B16R1.1095 COC(=O)CCCCCCCN1CCCC1 2230a_100000188435_100010004213 [1,0,0,1,0,0|1,0,0]=3 14263 B16R1.1095 COC(=O)CCCCCCCN1CCCC1 269982a_100000188435_100010004213 [1,0,0,1,0,0|1,0,0]=3 14264 B16R1.1095 COC(=O)CCCCCCCN1CCSC1 2230a_100011215254_100010004213 [1,0,0,1,0,0|2,0,0]=4 14265 B16R1.1095 COC(=O)CCCCCCCN1CCSC1 269982a_100011215254_100010004213 [1,0,0,1,0,0|2,0,0]=4 14266 B16R1.1095 COC(=O)CCCCCCNC1CCCC1 2230a_100000211070_100009815986 [1,0,0,1,0,0|1,0,0]=3 14267 B16R1.1095 COC(=O)CCCCCCNC1CCCC1 34a_100000211070_100009815986 [1,0,0,1,0,0|1,0,0]=3 14268 B16R1.1095 COC(=O)CCCCCCN[C@@H]1CCOC1 2230a_200015188469_100009815986 [1,0,0,1,0,0|2,0,0]=4 14269 B16R1.1095 COC(=O)CCCCCCN[C@H]1CCOC1 2230a_100015188467_100009815986 [1,0,0,1,0,0|2,0,0]=4 14270 B16R1.1095 COC(=O)CCCCCCN[C@H]1CCOC1 34a_100015188467_100009815986 [1,0,0,1,0,0|2,0,0]=4 14271 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 34a_100000210269_100009815986 [1,0,0,1,0,0|1,0,0]=3 14272 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 34a_100009863599_100000179811 [1,0,0,1,0,0|1,0,0]=3 14273 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 7a_100000210269_100009815986 [1,0,0,1,0,0|1,0,0]=3 14274 B16R1.1095 COC(=O)CCCCCCOC1CCCC1 7a_100009863599_100000179811 [1,0,0,1,0,0|1,0,0]=3 14275 B16R1.1095 COC(=O)CCCCCCOC1CCCO1 34a_100000085407_100009815986 [1,0,0,1,0,0|2,0,0]=4 14276 B16R1.1095 COC(=O)CCCCCCOC1CCOC1 34a_100009863599_100000690089 [1,0,0,1,0,0|2,0,0]=4 14277 B16R1.1095 COC(=O)CCCCCCOC1CCOC1 7a_100009863599_100000731011 [1,0,0,1,0,0|2,0,0]=4 14278 B16R1.1095 COC(=O)CCCCCCOC1CCSC1 7a_100011232664_100009815986 [1,0,0,1,0,0|2,0,0]=4 14279 B16R1.1095 COC(=O)CCCCCCO[C@H]1CCOC1 34a_100000717292_100009815986 [1,0,0,1,0,0|2,0,0]=4 14280 B16R1.1095 COC(=O)CCCCCCSC1CCCC1 62a_100009815986_100000179811 [1,0,0,1,0,0|1,0,0]=3 14281 B16R1.1095 COC(=O)CCCCCCSC1CCCC1 62a_100011217020_100009815986 [1,0,0,1,0,0|1,0,0]=3 14282 B16R1.1095 COC(=O)CCCCCCSC1CCOC1 62a_100009815986_100000690089 [1,0,0,1,0,0|2,0,0]=4 14283 B16R1.1095 COC(=O)CCCCCNCC1CCCC1 2230a_100000737975_100009816466 [1,0,0,1,0,0|1,0,0]=3 14284 B16R1.1095 COC(=O)CCCCCNCC1CCCC1 34a_100000737975_100009816466 [1,0,0,1,0,0|1,0,0]=3 14285 B16R1.1095 COC(=O)CCCCCNCC1CCOC1 2230a_100000737293_100009816466 [1,0,0,1,0,0|2,0,0]=4 14286 B16R1.1095 COC(=O)CCCCCNCC1CCOC1 34a_100000737293_100009816466 [1,0,0,1,0,0|2,0,0]=4 14287 B16R1.1095 COC(=O)CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009816466 [1,0,0,1,0,0|2,0,0]=4 14288 B16R1.1095 COC(=O)CCCCCNC[C@@H]1CCCO1 34a_100020590478_100009816466 [1,0,0,1,0,0|2,0,0]=4 14289 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 34a_100000074720_100000740388 [1,0,0,1,0,0|1,0,0]=3 14290 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 34a_100000742336_100009816466 [1,0,0,1,0,0|1,0,0]=3 14291 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 7a_100000074720_100000740388 [1,0,0,1,0,0|1,0,0]=3 14292 B16R1.1095 COC(=O)CCCCCOCC1CCCC1 7a_100000742336_100009816466 [1,0,0,1,0,0|1,0,0]=3 14293 B16R1.1095 COC(=O)CCCCCOCC1CCCO1 34a_100000210270_100009816466 [1,0,0,1,0,0|2,0,0]=4 14294 B16R1.1095 COC(=O)CCCCCOCC1CCCO1 7a_100000074720_100000203698 [1,0,0,1,0,0|2,0,0]=4 14295 B16R1.1095 COC(=O)CCCCCOCC1CCCO1 7a_100000210270_100009816466 [1,0,0,1,0,0|2,0,0]=4 14296 B16R1.1095 COC(=O)CCCCCOCC1CCNC1 34a_100000748654_100009816466 [1,0,0,1,0,0|2,0,0]=4 14297 B16R1.1095 COC(=O)CCCCCOCC1CCOC1 34a_100000074720_100011261433 [1,0,0,1,0,0|2,0,0]=4 14298 B16R1.1095 COC(=O)CCCCCOCC1CCOC1 34a_100000740260_100009816466 [1,0,0,1,0,0|2,0,0]=4 14299 B16R1.1095 COC(=O)CCCCCOCC1CCOC1 7a_100000074720_100000702531 [1,0,0,1,0,0|2,0,0]=4 14300 B16R1.1095 COC(=O)CCCCCOC[C@H]1CCCN1 34a_100000745186_100009816466 [1,0,0,1,0,0|2,0,0]=4 14301 B16R1.1095 COC(=O)CCCCCSCC1CCCC1 62a_100000740388_100009816466 [1,0,0,1,0,0|1,0,0]=3 14302 B16R1.1095 COC(=O)CCCCCSCC1CCCC1 62a_100009816466_100000740388 [1,0,0,1,0,0|1,0,0]=3 14303 B16R1.1095 COC(=O)CCCCCSCC1CCCO1 62a_100000203698_100009816466 [1,0,0,1,0,0|2,0,0]=4 14304 B16R1.1095 COC(=O)CCCCCSCC1CCCO1 62a_100009816466_100000203698 [1,0,0,1,0,0|2,0,0]=4 14305 B16R1.1095 COC(=O)CCCCCSCC1CCOC1 62a_100000702531_100009816466 [1,0,0,1,0,0|2,0,0]=4 14306 B16R1.1095 COC(=O)CCCCCSCC1CCOC1 62a_100009816466_100000702531 [1,0,0,1,0,0|2,0,0]=4 14307 B16R1.1095 COC(=O)CCCCNCCC1CCCC1 2230a_100000739158_100000204269 [1,0,0,1,0,0|1,0,0]=3 14308 B16R1.1095 COC(=O)CCCCNCCC1CCCC1 34a_100000739158_100000204269 [1,0,0,1,0,0|1,0,0]=3 14309 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 34a_100000059025_100000760354 [1,0,0,1,0,0|1,0,0]=3 14310 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 34a_100000749090_100000204269 [1,0,0,1,0,0|1,0,0]=3 14311 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 7a_100000059025_100000760354 [1,0,0,1,0,0|1,0,0]=3 14312 B16R1.1095 COC(=O)CCCCOCCC1CCCC1 7a_100000749090_100000204269 [1,0,0,1,0,0|1,0,0]=3 14313 B16R1.1095 COC(=O)CCCCOCCC1CCNC1 34a_100016987287_100000204269 [1,0,0,1,0,0|2,0,0]=4 14314 B16R1.1095 COC(=O)CCCCOCCC1CCOC1 34a_100011879284_100000204269 [1,0,0,1,0,0|2,0,0]=4 14315 B16R1.1095 COC(=O)CCCCOCCN1CCCC1 7a_100000059025_100000004467 [1,0,0,1,0,0|2,0,0]=4 14316 B16R1.1095 COC(=O)CCCCSCCC1CCCC1 62a_100000204269_100000760354 [1,0,0,1,0,0|1,0,0]=3 14317 B16R1.1095 COC(=O)CCCCSCCC1CCCC1 62a_100000760354_100000204269 [1,0,0,1,0,0|1,0,0]=3 14318 B16R1.1095 COC(=O)CCCCSCCN1CCCC1 62a_100000204269_100000004467 [1,0,0,1,0,0|2,0,0]=4 14319 B16R1.1095 COC(=O)CCCCSCCN1CCCC1 62a_100000700749_100000204269 [1,0,0,1,0,0|2,0,0]=4 14320 B16R1.1095 COC(=O)CCCNCCCC1CCCC1 2230a_100000736752_100011218270 [1,0,0,1,0,0|1,0,0]=3 14321 B16R1.1095 COC(=O)CCCNCCCC1CCCC1 34a_100000736752_100000742333 [1,0,0,1,0,0|1,0,0]=3 14322 B16R1.1095 COC(=O)CCCNCCOC1CCCC1 34a_100000741755_100000742333 [1,0,0,1,0,0|2,0,0]=4 14323 B16R1.1095 COC(=O)CCCOCCCC1CCCC1 34a_100011215328_100000742333 [1,0,0,1,0,0|1,0,0]=3 14324 B16R1.1095 COC(=O)CCCOCCCC1CCCC1 7a_100011215328_100011218270 [1,0,0,1,0,0|1,0,0]=3 14325 B16R1.1095 COC(=O)CCCOCCNC1CCCC1 34a_200000200444_100000742333 [1,0,0,1,0,0|2,0,0]=4 14326 B16R1.1095 COC(=O)CCCOCCOC1CCCC1 34a_100000738311_100000742333 [1,0,0,1,0,0|2,0,0]=4 14327 B16R1.1095 COC(=O)CCCOCCOC1CCCC1 7a_100000738311_100011218270 [1,0,0,1,0,0|2,0,0]=4 14328 B16R1.1095 COC(=O)CCCSCCCC1CCCC1 62a_100011218270_100011713738 [1,0,0,1,0,0|1,0,0]=3 14329 B16R1.1095 COC(=O)CCCSCCCC1CCCC1 62a_100011713738_100011218270 [1,0,0,1,0,0|1,0,0]=3 14330 B16R1.1095 COC(=O)CCCSCCCN1CCCC1 62a_100011218270_100011445909 [1,0,0,1,0,0|2,0,0]=4 14331 B16R1.1095 COC(=O)CCCSCCCN1CCCC1 62a_100016991639_100011218270 [1,0,0,1,0,0|2,0,0]=4 14332 B16R1.1095 COC(=O)CCNCCCOC1CCCC1 34a_100000747560_100000742370 [1,0,0,1,0,0|2,0,0]=4 14333 B16R1.1095 COC(=O)COCCNCCC1CCCC1 2230a_100000739158_100000090808 [1,0,0,1,0,0|2,0,0]=4 14334 B16R1.1095 COC(=O)COCCNCCC1CCCC1 34a_100000739158_100000090808 [1,0,0,1,0,0|2,0,0]=4 14335 B16R1.1095 COC(=O)COCCOCCC1CCCC1 34a_100000749090_100000090808 [1,0,0,1,0,0|2,0,0]=4 14336 B16R1.1095 COC(=O)COCCOCCC1CCCC1 7a_100000749090_100000090808 [1,0,0,1,0,0|2,0,0]=4 14337 B16R1.1095 COC(=O)COCCSCCC1CCCC1 62a_100000090808_100000760354 [1,0,0,1,0,0|2,0,0]=4 14338 B16R1.1095 COC(=O)COCCSCCC1CCCC1 62a_100000760354_100000090808 [1,0,0,1,0,0|2,0,0]=4 14339 B16R1.1095 COC(=O)NCCOCCCC1CCCC1 34a_100000757965_100011713738 [1,0,0,1,0,0|2,0,0]=4 14340 B16R1.1095 COC(=O)OCCOCCCC1CCCC1 34a_100010262106_100011713738 [1,0,0,1,0,0|2,0,0]=4 14341 B16R1.1133 COC(=O)CCCCCN1CCCCC1C 2230a_100000211376_100009816466 [1,0,0,1,0,0|1,0,0]=3 14342 B16R1.1133 COC(=O)CCCCCN1CCCCC1C 269982a_100000211376_100009816466 [1,0,0,1,0,0|1,0,0]=3 14343 B16R1.1133 COC(=O)CCCCCN1CCCCC1C 34a_100000211376_100009816466 [1,0,0,1,0,0|1,0,0]=3 14344 B16R1.1133 COC(=O)CCCCCN1CCOC[C@@H]1C 2230a_100009815349_100009816466 [1,0,0,1,0,0|2,0,0]=4 14345 B16R1.1133 COC(=O)CCCCCN1CCOC[C@@H]1C 269982a_100009815349_100009816466 [1,0,0,1,0,0|2,0,0]=4 14346 B16R1.1133 COC(=O)CCCCCN1CCOC[C@@H]1C 34a_100009815349_100009816466 [1,0,0,1,0,0|2,0,0]=4 14347 B16R1.1133 COC(=O)CCCCNC1CCCCC1C 2230a_100000211402_100000204269 [1,0,0,1,0,0|1,0,0]=3 14348 B16R1.1133 COC(=O)CCCCNC1CCCCC1C 34a_100000211402_100000204269 [1,0,0,1,0,0|1,0,0]=3 14349 B16R1.1133 COC(=O)CCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000204269 [1,0,0,1,0,0|2,0,0]=4 14350 B16R1.1133 COC(=O)CCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000204269 [1,0,0,1,0,0|2,0,0]=4 14351 B16R1.1133 COC(=O)CCCCOC1CCCCC1C 34a_100000211207_100000204269 [1,0,0,1,0,0|1,0,0]=3 14352 B16R1.1133 COC(=O)CCCCOC1CCCCC1C 7a_100000211207_100000204269 [1,0,0,1,0,0|1,0,0]=3 14353 B16R1.1133 COC(=O)CCCCOC1CCCCC1Cl 34a_100000038908_100000204269 [1,0,0,1,0,0|2,0,0]=4 14354 B16R1.1133 COC(=O)CCCCOC1CCCCC1Cl 7a_100000038908_100000204269 [1,0,0,1,0,0|2,0,0]=4 14355 B16R1.1133 COC(=O)CCCCOC1CCCCC1F 34a_100000059025_100015423560 [1,0,0,1,0,0|2,0,0]=4 14356 B16R1.1133 COC(=O)CCCCOC1CCCCC1O 34a_100000059025_100000038908 [1,0,0,1,0,0|2,0,0]=4 14357 B16R1.1133 COC(=O)CCCCOC1CCNCC1C 34a_100011998114_100000204269 [1,0,0,1,0,0|2,0,0]=4 14358 B16R1.1133 COC(=O)CCCCOC1CNCCC1C 34a_100000696640_100000204269 [1,0,0,1,0,0|2,0,0]=4 14359 B16R1.1133 COC(=O)CCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000204269 [1,0,0,1,0,0|2,0,0]=4 14360 B16R1.1133 COC(=O)CCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000204269 [1,0,0,1,0,0|2,0,0]=4 14361 B16R1.1133 COC(=O)CCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000204269 [1,0,0,1,0,0|2,0,0]=4 14362 B16R1.1133 COC(=O)CCCCSC1CCCCC1F 62a_100000204269_100015423560 [1,0,0,1,0,0|2,0,0]=4 14363 B16R1.1133 COC(=O)CCCCSC1CCCCC1F 62a_100015423560_100000204269 [1,0,0,1,0,0|2,0,0]=4 14364 B16R1.1133 COC(=O)CCCCSC1CCCCC1O 62a_100000038908_100000204269 [1,0,0,1,0,0|2,0,0]=4 14365 B16R1.1133 COC(=O)CCCCSC1CCCCC1O 62a_100000204269_100000038908 [1,0,0,1,0,0|2,0,0]=4 14366 B16R1.1133 COC(=O)CCCNCC1CCCCC1O 34a_100011216029_100000742333 [1,0,0,1,0,0|2,0,0]=4 14367 B16R1.1133 COC(=O)CCCNCC1CCCCN1C 34a_100011228421_100000742333 [1,0,0,1,0,0|2,0,0]=4 14368 B16R1.1133 COC(=O)CCCOCC1CCCCN1C 34a_100000225079_100000742333 [1,0,0,1,0,0|2,0,0]=4 14369 B16R1.1133 COC(=O)CCCSCC1CCCCN1C 62a_100011218270_100015185383 [1,0,0,1,0,0|2,0,0]=4 14370 B16R1.1133 COC(=O)CCCSCC1CCCCN1C 62a_100015185383_100011218270 [1,0,0,1,0,0|2,0,0]=4 14371 B16R1.1133 COC(=O)CCNCCN1CCCCC1C 2230a_100000739827_100000204255 [1,0,0,1,0,0|2,0,0]=4 14372 B16R1.1133 COC(=O)CCNCCN1CCCCC1C 34a_100000739827_100000742370 [1,0,0,1,0,0|2,0,0]=4 14373 B16R1.1133 COC(=O)CCOCCN1CCCCC1C 34a_100011305533_100000742370 [1,0,0,1,0,0|2,0,0]=4 14374 B16R1.1133 COC(=O)CCSCCC1CCCCN1C 62a_100000204255_100000211948 [1,0,0,1,0,0|2,0,0]=4 14375 B16R1.1133 COC(=O)CCSCCC1CCCCN1C 62a_100000211948_100000204255 [1,0,0,1,0,0|2,0,0]=4 14376 B16R1.1133 COC(=O)CNCCCN1CCCCC1C 34a_100000212276_100000747449 [1,0,0,1,0,0|2,0,0]=4 14377 B16R1.1133 COC(=O)COCCCN1CCCCC1C 34a_100000213889_100000747449 [1,0,0,1,0,0|2,0,0]=4 14378 B16R1.1133 COC(=O)COCCCN1CCCCC1C 7a_100000213889_100000747449 [1,0,0,1,0,0|2,0,0]=4 14379 B16R1.1133 COC(=O)COCCNC1CCCCC1C 2230a_100000211402_100000090808 [1,0,0,1,0,0|2,0,0]=4 14380 B16R1.1133 COC(=O)COCCNC1CCCCC1C 34a_100000211402_100000090808 [1,0,0,1,0,0|2,0,0]=4 14381 B16R1.1133 COC(=O)COCCOC1CCCCC1C 34a_100000211207_100000090808 [1,0,0,1,0,0|2,0,0]=4 14382 B16R1.1133 COC(=O)COCCOC1CCCCC1C 7a_100000211207_100000090808 [1,0,0,1,0,0|2,0,0]=4 14383 B16R1.1166 CCC(=O)COCCCCC1CCCCC1 7a_100011215267_100000747405 [1,0,0,1,0,0|2,0,0]=4 14384 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 2230a_100000738074_100000741757 [1,0,0,1,0,0|2,0,0]=4 14385 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 2230a_100000740002_100012355289 [1,0,0,1,0,0|2,0,0]=4 14386 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 270004a_100000740002_100011713444 [1,0,0,1,0,0|2,0,0]=4 14387 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 34a_100000738074_100000741757 [1,0,0,1,0,0|2,0,0]=4 14388 B16R1.1166 CNC(=O)CCCNCCC1CCCCC1 34a_100000740002_100011209188 [1,0,0,1,0,0|2,0,0]=4 14389 B16R1.1166 CNC(=O)CCCOCCC1CCCCC1 34a_100011217863_100000741757 [1,0,0,1,0,0|2,0,0]=4 14390 B16R1.1166 CNC(=O)CCCOCCC1CCCCC1 7a_100011217863_100000741757 [1,0,0,1,0,0|2,0,0]=4 14391 B16R1.1166 CNC(=O)CCCSCCC1CCCCC1 62a_100000741757_100012355289 [1,0,0,1,0,0|2,0,0]=4 14392 B16R1.1166 CNC(=O)CCCSCCC1CCCCC1 62a_100012355289_100000741757 [1,0,0,1,0,0|2,0,0]=4 14393 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 2230a_100000738227_100011713725 [1,0,0,1,0,0|2,0,0]=4 14394 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000737683 [1,0,0,1,0,0|2,0,0]=4 14395 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 34a_100000738227_100011713725 [1,0,0,1,0,0|2,0,0]=4 14396 B16R1.1166 CNC(=O)CCNCCCC1CCCCC1 34a_100011211642_100012179268 [1,0,0,1,0,0|2,0,0]=4 14397 B16R1.1166 CNC(=O)CCOCCCC1CCCCC1 34a_100000198086_100012179268 [1,0,0,1,0,0|2,0,0]=4 14398 B16R1.1166 CNC(=O)CCOCCCC1CCCCC1 34a_100000754576_100011713725 [1,0,0,1,0,0|2,0,0]=4 14399 B16R1.1166 CNC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000737683 [1,0,0,1,0,0|2,0,0]=4 14400 B16R1.1166 CNC(=O)CCSCCCC1CCCCC1 62a_100000737683_100011713725 [1,0,0,1,0,0|2,0,0]=4 14401 B16R1.1166 CNC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000737683 [1,0,0,1,0,0|2,0,0]=4 14402 B16R1.1166 CNC(=O)COCCCCC1CCCCC1 34a_100011215267_100000183359 [1,0,0,1,0,0|2,0,0]=4 14403 B16R1.1166 CNC(=O)COCCCCC1CCCCC1 7a_100011215267_100000183359 [1,0,0,1,0,0|2,0,0]=4 14404 B16R1.1166 COC(=O)CCCCCCN1CCCOC1 2230a_100000131196_100009815986 [1,0,0,1,0,0|2,0,0]=4 14405 B16R1.1166 COC(=O)CCCCCCN1CCCOC1 269982a_100000131196_100009815986 [1,0,0,1,0,0|2,0,0]=4 14406 B16R1.1166 COC(=O)CCCCCCN1CCCOC1 34a_100000131196_100009815986 [1,0,0,1,0,0|2,0,0]=4 14407 B16R1.1166 COC(=O)CCCCCCN1CCOCC1 2230a_100015191051_100009815986 [1,0,0,1,0,0|2,0,0]=4 14408 B16R1.1166 COC(=O)CCCCCCN1CCOCC1 269982a_100015191051_100009815986 [1,0,0,1,0,0|2,0,0]=4 14409 B16R1.1166 COC(=O)CCCCCCN1CCOCC1 34a_100015191051_100009815986 [1,0,0,1,0,0|2,0,0]=4 14410 B16R1.1166 COC(=O)CCCCCCN1CCSCC1 2230a_100000737611_100009815986 [1,0,0,1,0,0|2,0,0]=4 14411 B16R1.1166 COC(=O)CCCCCCN1CCSCC1 269982a_100000737611_100009815986 [1,0,0,1,0,0|2,0,0]=4 14412 B16R1.1166 COC(=O)CCCCCNC1CCCCC1 2230a_100000182618_100009816466 [1,0,0,1,0,0|1,0,0]=3 14413 B16R1.1166 COC(=O)CCCCCNC1CCCCC1 34a_100000182618_100009816466 [1,0,0,1,0,0|1,0,0]=3 14414 B16R1.1166 COC(=O)CCCCCNC1CCCOC1 2230a_100000719290_100009816466 [1,0,0,1,0,0|2,0,0]=4 14415 B16R1.1166 COC(=O)CCCCCNC1CCCOC1 34a_100000719290_100009816466 [1,0,0,1,0,0|2,0,0]=4 14416 B16R1.1166 COC(=O)CCCCCNC1CCOCC1 2230a_100000741149_100009816466 [1,0,0,1,0,0|2,0,0]=4 14417 B16R1.1166 COC(=O)CCCCCNC1CCOCC1 34a_100000741149_100009816466 [1,0,0,1,0,0|2,0,0]=4 14418 B16R1.1166 COC(=O)CCCCCNC1CCSCC1 2230a_100000748639_100009816466 [1,0,0,1,0,0|2,0,0]=4 14419 B16R1.1166 COC(=O)CCCCCNC1CCSCC1 34a_100000748639_100009816466 [1,0,0,1,0,0|2,0,0]=4 14420 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 34a_100000074720_100000210327 [1,0,0,1,0,0|1,0,0]=3 14421 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 34a_100000210231_100009816466 [1,0,0,1,0,0|1,0,0]=3 14422 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 7a_100000074720_100000210327 [1,0,0,1,0,0|1,0,0]=3 14423 B16R1.1166 COC(=O)CCCCCOC1CCCCC1 7a_100000210231_100009816466 [1,0,0,1,0,0|1,0,0]=3 14424 B16R1.1166 COC(=O)CCCCCOC1CCCCO1 34a_100000033831_100009816466 [1,0,0,1,0,0|2,0,0]=4 14425 B16R1.1166 COC(=O)CCCCCOC1CCCOC1 34a_100000074720_100000693364 [1,0,0,1,0,0|2,0,0]=4 14426 B16R1.1166 COC(=O)CCCCCOC1CCCOC1 34a_100000754041_100009816466 [1,0,0,1,0,0|2,0,0]=4 14427 B16R1.1166 COC(=O)CCCCCOC1CCCOC1 7a_100000074720_100000693364 [1,0,0,1,0,0|2,0,0]=4 14428 B16R1.1166 COC(=O)CCCCCOC1CCCSC1 7a_100015962668_100009816466 [1,0,0,1,0,0|2,0,0]=4 14429 B16R1.1166 COC(=O)CCCCCOC1CCOCC1 34a_100000744328_100009816466 [1,0,0,1,0,0|2,0,0]=4 14430 B16R1.1166 COC(=O)CCCCCOC1CCOCC1 7a_100000074720_100000686592 [1,0,0,1,0,0|2,0,0]=4 14431 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 34a_100000074720_100000069128 [1,0,0,1,0,0|2,0,0]=4 14432 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 34a_100000731022_100009816466 [1,0,0,1,0,0|2,0,0]=4 14433 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 7a_100000074720_100011500858 [1,0,0,1,0,0|2,0,0]=4 14434 B16R1.1166 COC(=O)CCCCCOC1CCSCC1 7a_100000731022_100009816466 [1,0,0,1,0,0|2,0,0]=4 14435 B16R1.1166 COC(=O)CCCCCSC1CCCCC1 62a_100000210327_100009816466 [1,0,0,1,0,0|1,0,0]=3 14436 B16R1.1166 COC(=O)CCCCCSC1CCCCC1 62a_100009816466_100000210327 [1,0,0,1,0,0|1,0,0]=3 14437 B16R1.1166 COC(=O)CCCCCSC1CCCOC1 62a_100009816466_100000693364 [1,0,0,1,0,0|2,0,0]=4 14438 B16R1.1166 COC(=O)CCCCCSC1CCOCC1 62a_100009816466_100011324220 [1,0,0,1,0,0|2,0,0]=4 14439 B16R1.1166 COC(=O)CCCCCSC1CCSCC1 62a_100009816466_100000069128 [1,0,0,1,0,0|2,0,0]=4 14440 B16R1.1166 COC(=O)CCCCNCC1CCCCC1 2230a_100000210473_100000204269 [1,0,0,1,0,0|1,0,0]=3 14441 B16R1.1166 COC(=O)CCCCNCC1CCCCC1 34a_100000210473_100000204269 [1,0,0,1,0,0|1,0,0]=3 14442 B16R1.1166 COC(=O)CCCCNCC1CCCCO1 2230a_100000174945_100000204269 [1,0,0,1,0,0|2,0,0]=4 14443 B16R1.1166 COC(=O)CCCCNCC1CCCCO1 34a_100000174945_100000204269 [1,0,0,1,0,0|2,0,0]=4 14444 B16R1.1166 COC(=O)CCCCNCC1CCCOC1 2230a_100000720124_100000204269 [1,0,0,1,0,0|2,0,0]=4 14445 B16R1.1166 COC(=O)CCCCNCC1CCCOC1 34a_100000720124_100000204269 [1,0,0,1,0,0|2,0,0]=4 14446 B16R1.1166 COC(=O)CCCCNCC1CCOCC1 2230a_100000746373_100000204269 [1,0,0,1,0,0|2,0,0]=4 14447 B16R1.1166 COC(=O)CCCCNCC1CCOCC1 34a_100000746373_100000204269 [1,0,0,1,0,0|2,0,0]=4 14448 B16R1.1166 COC(=O)CCCCNCC1CCSCC1 2230a_100015188806_100000204269 [1,0,0,1,0,0|2,0,0]=4 14449 B16R1.1166 COC(=O)CCCCNCC1CCSCC1 34a_100015188806_100000204269 [1,0,0,1,0,0|2,0,0]=4 14450 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 34a_100000059025_100000211423 [1,0,0,1,0,0|1,0,0]=3 14451 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 34a_100000212181_100000204269 [1,0,0,1,0,0|1,0,0]=3 14452 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 7a_100000059025_100000211423 [1,0,0,1,0,0|1,0,0]=3 14453 B16R1.1166 COC(=O)CCCCOCC1CCCCC1 7a_100000212181_100000204269 [1,0,0,1,0,0|1,0,0]=3 14454 B16R1.1166 COC(=O)CCCCOCC1CCCCN1 34a_100000210821_100000204269 [1,0,0,1,0,0|2,0,0]=4 14455 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 34a_100000059025_100000211543 [1,0,0,1,0,0|2,0,0]=4 14456 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 34a_100000211370_100000204269 [1,0,0,1,0,0|2,0,0]=4 14457 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 7a_100000059025_100000211543 [1,0,0,1,0,0|2,0,0]=4 14458 B16R1.1166 COC(=O)CCCCOCC1CCCCO1 7a_100000211370_100000204269 [1,0,0,1,0,0|2,0,0]=4 14459 B16R1.1166 COC(=O)CCCCOCC1CCCNC1 34a_100000211344_100000204269 [1,0,0,1,0,0|2,0,0]=4 14460 B16R1.1166 COC(=O)CCCCOCC1CCCOC1 34a_100000059025_100000741521 [1,0,0,1,0,0|2,0,0]=4 14461 B16R1.1166 COC(=O)CCCCOCC1CCCOC1 34a_100000741520_100000204269 [1,0,0,1,0,0|2,0,0]=4 14462 B16R1.1166 COC(=O)CCCCOCC1CCCOC1 7a_100000059025_100000741521 [1,0,0,1,0,0|2,0,0]=4 14463 B16R1.1166 COC(=O)CCCCOCC1CCNCC1 34a_100000738675_100000204269 [1,0,0,1,0,0|2,0,0]=4 14464 B16R1.1166 COC(=O)CCCCOCC1CCOCC1 34a_100000059025_100000754603 [1,0,0,1,0,0|2,0,0]=4 14465 B16R1.1166 COC(=O)CCCCOCC1CCOCC1 34a_100000749013_100000204269 [1,0,0,1,0,0|2,0,0]=4 14466 B16R1.1166 COC(=O)CCCCOCC1CCOCC1 7a_100000059025_100000754603 [1,0,0,1,0,0|2,0,0]=4 14467 B16R1.1166 COC(=O)CCCCOCC1CCSCC1 34a_100000070558_100000204269 [1,0,0,1,0,0|2,0,0]=4 14468 B16R1.1166 COC(=O)CCCCOCC1CCSCC1 7a_100000070558_100000204269 [1,0,0,1,0,0|2,0,0]=4 14469 B16R1.1166 COC(=O)CCCCSCC1CCCCC1 62a_100000204269_100000211423 [1,0,0,1,0,0|1,0,0]=3 14470 B16R1.1166 COC(=O)CCCCSCC1CCCCC1 62a_100000211423_100000204269 [1,0,0,1,0,0|1,0,0]=3 14471 B16R1.1166 COC(=O)CCCCSCC1CCCCO1 62a_100000204269_100000211543 [1,0,0,1,0,0|2,0,0]=4 14472 B16R1.1166 COC(=O)CCCCSCC1CCCCO1 62a_100000211543_100000204269 [1,0,0,1,0,0|2,0,0]=4 14473 B16R1.1166 COC(=O)CCCCSCC1CCCOC1 62a_100000204269_100000741521 [1,0,0,1,0,0|2,0,0]=4 14474 B16R1.1166 COC(=O)CCCCSCC1CCCOC1 62a_100000741521_100000204269 [1,0,0,1,0,0|2,0,0]=4 14475 B16R1.1166 COC(=O)CCCCSCC1CCOCC1 62a_100000204269_100000749018 [1,0,0,1,0,0|2,0,0]=4 14476 B16R1.1166 COC(=O)CCCCSCC1CCOCC1 62a_100000754603_100000204269 [1,0,0,1,0,0|2,0,0]=4 14477 B16R1.1166 COC(=O)CCCNCCC1CCCCC1 2230a_100000738074_100011218270 [1,0,0,1,0,0|1,0,0]=3 14478 B16R1.1166 COC(=O)CCCNCCC1CCCCC1 34a_100000738074_100000742333 [1,0,0,1,0,0|1,0,0]=3 14479 B16R1.1166 COC(=O)CCCNCCC1CCCCO1 2230a_100015183643_100011218270 [1,0,0,1,0,0|2,0,0]=4 14480 B16R1.1166 COC(=O)CCCNCCC1CCCCO1 34a_100015183643_100000742333 [1,0,0,1,0,0|2,0,0]=4 14481 B16R1.1166 COC(=O)CCCNCCC1CCOCC1 2230a_100000755988_100011218270 [1,0,0,1,0,0|2,0,0]=4 14482 B16R1.1166 COC(=O)CCCNCCC1CCOCC1 34a_100000755988_100000742333 [1,0,0,1,0,0|2,0,0]=4 14483 B16R1.1166 COC(=O)CCCOCCC1CCCCC1 34a_100011217863_100000742333 [1,0,0,1,0,0|1,0,0]=3 14484 B16R1.1166 COC(=O)CCCOCCC1CCCCC1 7a_100011217863_100011218270 [1,0,0,1,0,0|1,0,0]=3 14485 B16R1.1166 COC(=O)CCCOCCC1CCCCN1 34a_100000211664_100000742333 [1,0,0,1,0,0|2,0,0]=4 14486 B16R1.1166 COC(=O)CCCOCCC1CCCNC1 34a_100000752241_100000742333 [1,0,0,1,0,0|2,0,0]=4 14487 B16R1.1166 COC(=O)CCCOCCC1CCNCC1 34a_100015190746_100000742333 [1,0,0,1,0,0|2,0,0]=4 14488 B16R1.1166 COC(=O)CCCOCCC1CCOCC1 34a_100011933979_100000742333 [1,0,0,1,0,0|2,0,0]=4 14489 B16R1.1166 COC(=O)CCCOCCC1CCOCC1 7a_100011933979_100011218270 [1,0,0,1,0,0|2,0,0]=4 14490 B16R1.1166 COC(=O)CCCSCCC1CCCCC1 62a_100011218270_100012355289 [1,0,0,1,0,0|1,0,0]=3 14491 B16R1.1166 COC(=O)CCCSCCC1CCCCC1 62a_100012355289_100011218270 [1,0,0,1,0,0|1,0,0]=3 14492 B16R1.1166 COC(=O)CCCSCCC1CCOCC1 62a_100011218270_100011934994 [1,0,0,1,0,0|2,0,0]=4 14493 B16R1.1166 COC(=O)CCCSCCC1CCOCC1 62a_100011934994_100011218270 [1,0,0,1,0,0|2,0,0]=4 14494 B16R1.1166 COC(=O)CCCSCCN1CCCCC1 62a_100000739454_100011218270 [1,0,0,1,0,0|2,0,0]=4 14495 B16R1.1166 COC(=O)CCCSCCN1CCCCC1 62a_100011218270_100000739454 [1,0,0,1,0,0|2,0,0]=4 14496 B16R1.1166 COC(=O)CCCSCOC1CCCCC1 62a_100011218270_100011935260 [1,0,0,1,0,0|2,0,0]=4 14497 B16R1.1166 COC(=O)CCCSCOC1CCCCC1 62a_100011935260_100011218270 [1,0,0,1,0,0|2,0,0]=4 14498 B16R1.1166 COC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000204255 [1,0,0,1,0,0|1,0,0]=3 14499 B16R1.1166 COC(=O)CCNCCCC1CCCCC1 34a_100011211642_100000742370 [1,0,0,1,0,0|1,0,0]=3 14500 B16R1.1166 COC(=O)CCNCCOC1CCCCC1 34a_100015206981_100000742370 [1,0,0,1,0,0|2,0,0]=4 14501 B16R1.1166 COC(=O)CCOCCCC1CCCCC1 34a_100000198086_100000742370 [1,0,0,1,0,0|1,0,0]=3 14502 B16R1.1166 COC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000204255 [1,0,0,1,0,0|1,0,0]=3 14503 B16R1.1166 COC(=O)CCOCCCC1CCCCN1 34a_100011934581_100000742370 [1,0,0,1,0,0|2,0,0]=4 14504 B16R1.1166 COC(=O)CCOCCCC1CCCNC1 34a_100150707839_100000742370 [1,0,0,1,0,0|2,0,0]=4 14505 B16R1.1166 COC(=O)CCOCCCC1CCNCC1 34a_100016988962_100000742370 [1,0,0,1,0,0|2,0,0]=4 14506 B16R1.1166 COC(=O)CCOCCCN1CCCCC1 34a_100000212458_100000742370 [1,0,0,1,0,0|2,0,0]=4 14507 B16R1.1166 COC(=O)CCOCCNC1CCCCC1 34a_100000200466_100000742370 [1,0,0,1,0,0|2,0,0]=4 14508 B16R1.1166 COC(=O)CCOCCOC1CCCCC1 34a_100011249652_100000742370 [1,0,0,1,0,0|2,0,0]=4 14509 B16R1.1166 COC(=O)CCOCCOC1CCCCC1 7a_100011249652_100000204255 [1,0,0,1,0,0|2,0,0]=4 14510 B16R1.1166 COC(=O)CCSCCCC1CCCCC1 62a_100000204255_100011713725 [1,0,0,1,0,0|1,0,0]=3 14511 B16R1.1166 COC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000204255 [1,0,0,1,0,0|1,0,0]=3 14512 B16R1.1166 COC(=O)CCSCCCN1CCCCC1 62a_100000204255_100000007876 [1,0,0,1,0,0|2,0,0]=4 14513 B16R1.1166 COC(=O)CCSCCCN1CCCCC1 62a_100132302099_100000204255 [1,0,0,1,0,0|2,0,0]=4 14514 B16R1.1166 COC(=O)CCSCCOC1CCCCC1 62a_100000204255_100011211530 [1,0,0,1,0,0|2,0,0]=4 14515 B16R1.1166 COC(=O)CCSCCOC1CCCCC1 62a_100011211530_100000204255 [1,0,0,1,0,0|2,0,0]=4 14516 B16R1.1166 COC(=O)CNCCCOC1CCCCC1 34a_100000205933_100000747449 [1,0,0,1,0,0|2,0,0]=4 14517 B16R1.1166 COC(=O)COCCCCC1CCCCC1 34a_100011215267_100000747449 [1,0,0,1,0,0|1,0,0]=3 14518 B16R1.1166 COC(=O)COCCCCC1CCCCC1 7a_100011215267_100000747449 [1,0,0,1,0,0|1,0,0]=3 14519 B16R1.1166 COC(=O)COCCCCC1CCNCC1 34a_100016989291_100000747449 [1,0,0,1,0,0|2,0,0]=4 14520 B16R1.1166 COC(=O)COCCNCC1CCCCC1 2230a_100000210473_100000090808 [1,0,0,1,0,0|2,0,0]=4 14521 B16R1.1166 COC(=O)COCCNCC1CCCCC1 34a_100000210473_100000090808 [1,0,0,1,0,0|2,0,0]=4 14522 B16R1.1166 COC(=O)COCCOCC1CCCCC1 34a_100000212181_100000090808 [1,0,0,1,0,0|2,0,0]=4 14523 B16R1.1166 COC(=O)COCCOCC1CCCCC1 7a_100000212181_100000090808 [1,0,0,1,0,0|2,0,0]=4 14524 B16R1.1166 COC(=O)COCCSCC1CCCCC1 62a_100000090808_100000211423 [1,0,0,1,0,0|2,0,0]=4 14525 B16R1.1166 COC(=O)COCCSCC1CCCCC1 62a_100000211423_100000090808 [1,0,0,1,0,0|2,0,0]=4 14526 B16R1.1166 COC(=O)NCCOCCC1CCCCC1 34a_100000757965_100011209188 [1,0,0,1,0,0|2,0,0]=4 14527 B16R1.1166 COC(=O)OCCOCCC1CCCCC1 34a_100010262106_100011209188 [1,0,0,1,0,0|2,0,0]=4 14528 B16R1.1166 COC(=O)OCSCCCC1CCCCC1 62a_100011713725_100000139417 [1,0,0,1,0,0|2,0,0]=4 14529 B16R1.1271 CCCCC1CCCC1NCCC(=O)NC 269862a_100000738227_100000750825 [1,0,0,1,0,0|2,0,0]=4 14530 B16R1.1271 CCCCC1CCCC1NCCC(=O)NC 270004a_100000738227_100000750825 [1,0,0,1,0,0|2,0,0]=4 14531 B16R1.1353 CCC1CCCN1CCCCCC(=O)OC 2230a_100000754278_100009816466 [1,0,0,1,0,0|1,0,0]=3 14532 B16R1.1353 CCC1CCCN1CCCCCC(=O)OC 269982a_100000754278_100009816466 [1,0,0,1,0,0|1,0,0]=3 14533 B16R1.1353 CCC1CCCN1CCCCCC(=O)OC 34a_100000754278_100009816466 [1,0,0,1,0,0|1,0,0]=3 14534 B16R1.1353 CCN1CCCC1CNCCCC(=O)OC 2230a_100000211693_100011218270 [1,0,0,1,0,0|2,0,0]=4 14535 B16R1.1353 CCN1CCC[C@@H]1COCCCC(=O)OC 34a_100011739246_100000742333 [1,0,0,1,0,0|2,0,0]=4 14536 B16R1.1353 CCN1CCC[C@@H]1COCCCC(=O)OC 7a_100011739246_100011218270 [1,0,0,1,0,0|2,0,0]=4 14537 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009816466 [1,0,0,1,0,0|2,0,0]=4 14538 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009816466 [1,0,0,1,0,0|2,0,0]=4 14539 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO 34a_100000745186_100009816466 [1,0,0,1,0,0|2,0,0]=4 14540 B16R1.1426 CCCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210326 [1,0,0,1,0,0|2,0,0]=4 14541 B16R1.1426 CCCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000718602 [1,0,0,1,0,0|2,0,0]=4 14542 B16R1.1426 COCCCC1CCCCN1CC(=O)OC 2230a_100011804088_100000747449 [1,0,0,1,0,0|2,0,0]=4 14543 B16R1.1426 COCCCC1CCCCN1CC(=O)OC 269982a_100011804088_100000747449 [1,0,0,1,0,0|2,0,0]=4 14544 B16R1.1426 COCCCC1CCCCN1CC(=O)OC 34a_100011804088_100000747449 [1,0,0,1,0,0|2,0,0]=4 14545 B16R1.3257 COC(=O)CCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100010004213 [1,0,0,1,0,0|2,0,0]=4 14546 B16R1.3257 COC(=O)CCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100010004213 [1,0,0,1,0,0|2,0,0]=4 14547 B16R1.3257 COC(=O)CCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100010004213 [1,0,0,1,0,0|2,0,0]=4 14548 B16R1.3257 COC(=O)CCCCCCOCC1CC1C 34a_100000744939_100009815986 [1,0,0,1,0,0|1,0,0]=3 14549 B16R1.3257 COC(=O)CCCCCCOCC1CC1C 7a_100000744939_100009815986 [1,0,0,1,0,0|1,0,0]=3 14550 B16R1.3258 COC(=O)CCCCCCCCN1CCC1 269982a_100000754969_100010282707 [1,0,0,1,0,0|1,0,0]=3 14551 B16R1.3258 COC(=O)CCCCCCCNC1CCC1 2230a_100000749019_100010004213 [1,0,0,1,0,0|1,0,0]=3 14552 B16R1.3258 COC(=O)CCCCCCCNC1CCC1 34a_100000749019_100010004213 [1,0,0,1,0,0|1,0,0]=3 14553 B16R1.3258 COC(=O)CCCCCCCNC1COC1 2230a_100016991112_100010004213 [1,0,0,1,0,0|2,0,0]=4 14554 B16R1.3258 COC(=O)CCCCCCCOC1CCC1 34a_100000748187_100010004213 [1,0,0,1,0,0|1,0,0]=3 14555 B16R1.3258 COC(=O)CCCCCCCOC1CCC1 34a_100011022521_100000749161 [1,0,0,1,0,0|1,0,0]=3 14556 B16R1.3258 COC(=O)CCCCCCCOC1COC1 34a_100011022521_100009818527 [1,0,0,1,0,0|2,0,0]=4 14557 B16R1.3258 COC(=O)CCCCCCCOC1COC1 7a_100011022521_100009818527 [1,0,0,1,0,0|2,0,0]=4 14558 B16R1.3258 COC(=O)CCCCCCCOC1CSC1 7a_100000072292_100010004213 [1,0,0,1,0,0|2,0,0]=4 14559 B16R1.3258 COC(=O)CCCCCCCSC1CCC1 62a_100010004213_100000749161 [1,0,0,1,0,0|1,0,0]=3 14560 B16R1.3258 COC(=O)CCCCCCCSC1COC1 62a_100010004213_100009818527 [1,0,0,1,0,0|2,0,0]=4 14561 B16R1.3258 COC(=O)CCCCCCNCC1CCC1 2230a_100000738700_100009815986 [1,0,0,1,0,0|1,0,0]=3 14562 B16R1.3258 COC(=O)CCCCCCNCC1CCC1 34a_100000738700_100009815986 [1,0,0,1,0,0|1,0,0]=3 14563 B16R1.3258 COC(=O)CCCCCCNCC1COC1 2230a_100015281925_100009815986 [1,0,0,1,0,0|2,0,0]=4 14564 B16R1.3258 COC(=O)CCCCCCNCC1COC1 34a_100015281925_100009815986 [1,0,0,1,0,0|2,0,0]=4 14565 B16R1.3258 COC(=O)CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009815986 [1,0,0,1,0,0|2,0,0]=4 14566 B16R1.3258 COC(=O)CCCCCCNC[C@@H]1CCO1 34a_100020831831_100009815986 [1,0,0,1,0,0|2,0,0]=4 14567 B16R1.3258 COC(=O)CCCCCCOCC1CCC1 34a_100000760304_100009815986 [1,0,0,1,0,0|1,0,0]=3 14568 B16R1.3258 COC(=O)CCCCCCOCC1CCC1 34a_100009863599_100000763275 [1,0,0,1,0,0|1,0,0]=3 14569 B16R1.3258 COC(=O)CCCCCCOCC1CCC1 7a_100009863599_100000763275 [1,0,0,1,0,0|1,0,0]=3 14570 B16R1.3258 COC(=O)CCCCCCOCC1CCO1 34a_100000039022_100009815986 [1,0,0,1,0,0|2,0,0]=4 14571 B16R1.3258 COC(=O)CCCCCCOCC1CCO1 34a_100009863599_100000103362 [1,0,0,1,0,0|2,0,0]=4 14572 B16R1.3258 COC(=O)CCCCCCOCC1CCO1 7a_100009863599_100000103362 [1,0,0,1,0,0|2,0,0]=4 14573 B16R1.3258 COC(=O)CCCCCCOCC1CNC1 34a_100016987283_100009815986 [1,0,0,1,0,0|2,0,0]=4 14574 B16R1.3258 COC(=O)CCCCCCOCC1COC1 34a_100000060846_100009815986 [1,0,0,1,0,0|2,0,0]=4 14575 B16R1.3258 COC(=O)CCCCCCOCC1COC1 34a_100009863599_100010264016 [1,0,0,1,0,0|2,0,0]=4 14576 B16R1.3258 COC(=O)CCCCCCOCC1COC1 7a_100009863599_100010264016 [1,0,0,1,0,0|2,0,0]=4 14577 B16R1.3258 COC(=O)CCCCCCSCC1CCC1 62a_100000763275_100009815986 [1,0,0,1,0,0|1,0,0]=3 14578 B16R1.3258 COC(=O)CCCCCCSCC1CCC1 62a_100009815986_100000763275 [1,0,0,1,0,0|1,0,0]=3 14579 B16R1.3258 COC(=O)CCCCCCSCC1CCO1 62a_100000103362_100009815986 [1,0,0,1,0,0|2,0,0]=4 14580 B16R1.3258 COC(=O)CCCCCCSCC1CCO1 62a_100009815986_100000103362 [1,0,0,1,0,0|2,0,0]=4 14581 B16R1.3258 COC(=O)CCCCCCSCC1COC1 62a_100009815986_100010264016 [1,0,0,1,0,0|2,0,0]=4 14582 B16R1.3258 COC(=O)CCCCCCSCC1COC1 62a_100010264016_100009815986 [1,0,0,1,0,0|2,0,0]=4 14583 B16R1.3258 COC(=O)CCCCCOCCC1COC1 34a_100009855314_100009816466 [1,0,0,1,0,0|2,0,0]=4 14584 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210681 [1,0,0,1,0,0|2,0,0]=4 14585 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210681 [1,0,0,1,0,0|2,0,0]=4 14586 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000210614 [1,0,0,1,0,0|2,0,0]=4 14587 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210681 [1,0,0,1,0,0|1,0,0]=3 14588 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210681 [1,0,0,1,0,0|1,0,0]=3 14589 B16R1.3907 CCCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210681 [1,0,0,1,0,0|2,0,0]=4 14590 B16R1.3907 CCCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210681 [1,0,0,1,0,0|2,0,0]=4 14591 B16R1.3907 CCCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210681 [1,0,0,1,0,0|2,0,0]=4 14592 B16R1.3907 CCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210314 [1,0,0,1,0,0|1,0,0]=3 14593 B16R1.3907 CCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210314 [1,0,0,1,0,0|1,0,0]=3 14594 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000743108 [1,0,0,1,0,0|2,0,0]=4 14595 B16R1.3907 CCCCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000743108 [1,0,0,1,0,0|2,0,0]=4 14596 B16R1.3907 CCCCOCOC1CCCC1C(=O)OC 34a_200000081814_100011995733 [1,0,0,1,0,0|2,0,0]=4 14597 B16R1.3907 CCCOCCOC1CCCC1C(=O)OC 34a_200000081814_100011215938 [1,0,0,1,0,0|2,0,0]=4 14598 B16R1.3907 CCCOCCOC1CCCC1C(=O)OC 7a_200000081814_100011215938 [1,0,0,1,0,0|2,0,0]=4 14599 B16R1.3907 CCOCCCOC1CCCC1C(=O)OC 34a_200000081814_100012232248 [1,0,0,1,0,0|2,0,0]=4 14600 B16R1.3907 CCOCCCOC1CCCC1C(=O)OC 7a_200000081814_100012232248 [1,0,0,1,0,0|2,0,0]=4 14601 B16R1.3907 COC(=O)C1CCCC1OCCCCCF 34a_200000081814_100000729378 [1,0,0,1,0,0|2,0,0]=4 14602 B16R1.3907 COC(=O)C1CCCC1OCCCCCF 7a_200000081814_100000729378 [1,0,0,1,0,0|2,0,0]=4 14603 B16R1.3907 COC(=O)C1CCCC1OCCCCCO 34a_200000081814_100000746330 [1,0,0,1,0,0|2,0,0]=4 14604 B16R1.3907 COC(=O)C1CCCC1OCCCCCO 7a_200000081814_100000746330 [1,0,0,1,0,0|2,0,0]=4 14605 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCF 2230a_100000752040_100015922095 [1,0,0,1,0,0|2,0,0]=4 14606 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCF 269982a_100000752040_100015922095 [1,0,0,1,0,0|2,0,0]=4 14607 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCO 2230a_100000752040_100000766143 [1,0,0,1,0,0|2,0,0]=4 14608 B16R1.3907 COC(=O)[C@@H]1CCCN1CCCCCCO 269982a_100000752040_100000766143 [1,0,0,1,0,0|2,0,0]=4 14609 B16R1.3907 COCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000755781 [1,0,0,1,0,0|2,0,0]=4 14610 B16R1.3907 COCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000730899 [1,0,0,1,0,0|2,0,0]=4 14611 B16R1.3910 CCC1CCCCC1NCCCC(=O)NC 269862a_100000740002_100000757040 [1,0,0,1,0,0|2,0,0]=4 14612 B16R1.3910 CCC1CCCCC1NCCCC(=O)NC 270004a_100000740002_100000757040 [1,0,0,1,0,0|2,0,0]=4 14613 B16R1.3910 CCC1CCCCC1OCCCC(=O)NC 34a_100000210738_100000741757 [1,0,0,1,0,0|2,0,0]=4 14614 B16R1.3910 CCC1CCCCC1OCCCC(=O)NC 7a_100000210738_100000741757 [1,0,0,1,0,0|2,0,0]=4 14615 B16R1.3910 CCC1CCCCC1OCCCC(=O)OC 34a_100000210738_100000742333 [1,0,0,1,0,0|1,0,0]=3 14616 B16R1.3910 CCC1CCCCC1OCCCC(=O)OC 7a_100000210738_100011218270 [1,0,0,1,0,0|1,0,0]=3 14617 B16R1.3910 CCC1CCCCN1CCCCC(=O)OC 2230a_100000210034_100000204269 [1,0,0,1,0,0|1,0,0]=3 14618 B16R1.3910 CCC1CCCCN1CCCCC(=O)OC 269982a_100000210034_100000204269 [1,0,0,1,0,0|1,0,0]=3 14619 B16R1.3910 CCC1CCCCN1CCCCC(=O)OC 34a_100000210034_100000204269 [1,0,0,1,0,0|1,0,0]=3 14620 B16R1.3910 CCC1CCCCN1CCNCC(=O)OC 2230a_100000755458_100000747449 [1,0,0,1,0,0|2,0,0]=4 14621 B16R1.3910 CCC1CCCCN1CCNCC(=O)OC 34a_100000755458_100000747449 [1,0,0,1,0,0|2,0,0]=4 14622 B16R1.3910 CCC1CCCCN1CCOCC(=O)OC 2230a_100000210034_100000090808 [1,0,0,1,0,0|2,0,0]=4 14623 B16R1.3910 CCC1CCCCN1CCOCC(=O)OC 34a_100000210034_100000090808 [1,0,0,1,0,0|2,0,0]=4 14624 B16R1.3910 CCN1CCCCC1CNCCC(=O)OC 2230a_100000754393_100000204255 [1,0,0,1,0,0|2,0,0]=4 14625 B16R1.3910 CCN1CCCCC1CNCCC(=O)OC 34a_100000754393_100000742370 [1,0,0,1,0,0|2,0,0]=4 14626 B16R1.3910 CCN1CCCCC1COCCC(=O)OC 34a_100000225091_100000742370 [1,0,0,1,0,0|2,0,0]=4 14627 B16R1.3910 CCN1CCCCC1COCCC(=O)OC 7a_100000225091_100000204255 [1,0,0,1,0,0|2,0,0]=4 14628 B16R1.3910 CC[C@H]1COCCN1CCCCC(=O)OC 2230a_100016988097_100000204269 [1,0,0,1,0,0|2,0,0]=4 14629 B16R1.3910 CC[C@H]1COCCN1CCCCC(=O)OC 269982a_100016988097_100000204269 [1,0,0,1,0,0|2,0,0]=4 14630 B16R1.3910 CC[C@H]1COCCN1CCCCC(=O)OC 34a_100016988097_100000204269 [1,0,0,1,0,0|2,0,0]=4 14631 B16R1.3910 CN[C@@H]1CCCC[C@H]1OCCCC(=O)OC 34a_100000708425_100000742333 [1,0,0,1,0,0|2,0,0]=4 14632 B16R1.3910 COC(=O)CCCCN1CCCCC1CO 2230a_100000210821_100000204269 [1,0,0,1,0,0|2,0,0]=4 14633 B16R1.3910 COC(=O)CCCCN1CCCCC1CO 269982a_100000210821_100000204269 [1,0,0,1,0,0|2,0,0]=4 14634 B16R1.3910 COC(=O)CCCCN1CCCCC1CO 34a_100000210821_100000204269 [1,0,0,1,0,0|2,0,0]=4 14635 B16R1.3910 COC(=O)CCCNC1CCCCC1OC 34a_100011208099_100000742333 [1,0,0,1,0,0|2,0,0]=4 14636 B16R1.3910 COC(=O)CCCOC1CCCCC1CN 34a_100011216029_100000742333 [1,0,0,1,0,0|2,0,0]=4 14637 B16R1.3910 COC(=O)CCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000742333 [1,0,0,1,0,0|2,0,0]=4 14638 B16R1.3910 COC(=O)CCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011218270 [1,0,0,1,0,0|2,0,0]=4 14639 B16R1.6695 CCCC1CCCC1NCCCC(=O)NC 269862a_100000740002_100000723119 [1,0,0,1,0,0|2,0,0]=4 14640 B16R1.6695 CCCC1CCCC1NCCCC(=O)NC 270004a_100000740002_100000723119 [1,0,0,1,0,0|2,0,0]=4 14641 B16R1.6695 CCCN1CCCC1COCCC(=O)OC 34a_200000694710_100000742370 [1,0,0,1,0,0|2,0,0]=4 14642 B16R1.6695 CCCN1CCCC1COCCC(=O)OC 7a_200000694710_100000204255 [1,0,0,1,0,0|2,0,0]=4 14643 B16R1.6695 COC[C@@H]1CCCN1CCCCC(=O)OC 2230a_100020646714_100000204269 [1,0,0,1,0,0|2,0,0]=4 14644 B16R1.6695 COC[C@@H]1CCCN1CCCCC(=O)OC 269982a_100020646714_100000204269 [1,0,0,1,0,0|2,0,0]=4 14645 B16R1.6695 COC[C@@H]1CCCN1CCCCC(=O)OC 34a_100020646714_100000204269 [1,0,0,1,0,0|2,0,0]=4 14646 B16R1.12713 CCCCCC1CCCC1NCC(=O)NC 269862a_100000693194_200000198059 [1,0,0,1,0,0|2,0,0]=4 14647 B16R1.12713 CCCCCC1CCCC1NCC(=O)NC 270004a_100000693194_200000198059 [1,0,0,1,0,0|2,0,0]=4 14648 B16R1.12872 CCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210759 [1,0,0,1,0,0|1,0,0]=3 14649 B16R1.12872 CCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210759 [1,0,0,1,0,0|1,0,0]=3 14650 B16R1.12872 COC(=O)[C@@H]1CCN1CCCCCCCO 2230a_102516456887_100000760002 [1,0,0,1,0,0|2,0,0]=4 14651 B16R1.12872 COC(=O)[C@@H]1CCN1CCCCCCCO 269982a_102516456887_100000760002 [1,0,0,1,0,0|2,0,0]=4 14652 B16R1.12872 COCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011998445 [1,0,0,1,0,0|2,0,0]=4 14653 B16R1.12872 COCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011998445 [1,0,0,1,0,0|2,0,0]=4 14654 B16R1.16747 COC(=O)CCCCCCCCNC1CC1 34a_100000212008_100010282707 [1,0,0,1,0,0|1,0,0]=3 14655 B16R1.16747 COC(=O)CCCCCCCCOC1CC1 34a_100000035544_100000211595 [1,0,0,1,0,0|1,0,0]=3 14656 B16R1.16747 COC(=O)CCCCCCCCSC1CC1 62a_100010282707_100000211595 [1,0,0,1,0,0|1,0,0]=3 14657 B16R1.16747 COC(=O)CCCCCCCNCC1CC1 2230a_100000735609_100010004213 [1,0,0,1,0,0|1,0,0]=3 14658 B16R1.16747 COC(=O)CCCCCCCNCC1CC1 34a_100000735609_100010004213 [1,0,0,1,0,0|1,0,0]=3 14659 B16R1.16747 COC(=O)CCCCCCCOCC1CC1 34a_100000211283_100010004213 [1,0,0,1,0,0|1,0,0]=3 14660 B16R1.16747 COC(=O)CCCCCCCOCC1CC1 34a_100011022521_100000742324 [1,0,0,1,0,0|1,0,0]=3 14661 B16R1.16747 COC(=O)CCCCCCCOCC1CC1 7a_100011022521_100000742324 [1,0,0,1,0,0|1,0,0]=3 14662 B16R1.16747 COC(=O)CCCCCCCOCC1CO1 34a_100011022521_102125554688 [1,0,0,1,0,0|2,0,0]=4 14663 B16R1.16747 COC(=O)CCCCCCCOCC1CO1 7a_100011022521_102125554688 [1,0,0,1,0,0|2,0,0]=4 14664 B16R1.16747 COC(=O)CCCCCCCOCC1CS1 7a_100011022521_100000031435 [1,0,0,1,0,0|2,0,0]=4 14665 B16R1.16747 COC(=O)CCCCCCCOC[C@@H]1CO1 34a_100000757423_100010004213 [1,0,0,1,0,0|2,0,0]=4 14666 B16R1.16747 COC(=O)CCCCCCCOC[C@@H]1CO1 7a_100011022521_100000745022 [1,0,0,1,0,0|2,0,0]=4 14667 B16R1.16747 COC(=O)CCCCCCCSCC1CC1 62a_100000756562_100010004213 [1,0,0,1,0,0|1,0,0]=3 14668 B16R1.16747 COC(=O)CCCCCCCSCC1CC1 62a_100010004213_100000742324 [1,0,0,1,0,0|1,0,0]=3 14669 B16R1.16747 COC(=O)CCCCCCCSCC1CO1 62a_100010004213_102125554688 [1,0,0,1,0,0|2,0,0]=4 14670 B16R1.16747 COC(=O)CCCCCCCSCC1CO1 62a_102125554688_100010004213 [1,0,0,1,0,0|2,0,0]=4 14671 B16R1.16747 COC(=O)CCCCCCCSCC1CS1 62a_100000031435_100010004213 [1,0,0,1,0,0|2,0,0]=4 14672 B16R1.16747 COC(=O)CCCCCCCSCC1CS1 62a_100010004213_100000031435 [1,0,0,1,0,0|2,0,0]=4 14673 B16R1.16747 COC(=O)CCCCCCCSC[C@@H]1CO1 62a_100000745022_100010004213 [1,0,0,1,0,0|2,0,0]=4 14674 B16R1.16747 COC(=O)CCCCCCCSC[C@@H]1CO1 62a_100010004213_100000745022 [1,0,0,1,0,0|2,0,0]=4 14675 B16R1.16747 COC(=O)CCCCCCNCCC1CC1 34a_100000764129_100009815986 [1,0,0,1,0,0|1,0,0]=3 14676 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 34a_100000754188_100009815986 [1,0,0,1,0,0|1,0,0]=3 14677 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 34a_100009863599_100000694398 [1,0,0,1,0,0|1,0,0]=3 14678 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 7a_100000754188_100009815986 [1,0,0,1,0,0|1,0,0]=3 14679 B16R1.16747 COC(=O)CCCCCCOCCC1CC1 7a_100009863599_100000764125 [1,0,0,1,0,0|1,0,0]=3 14680 B16R1.16747 COC(=O)CCCCCCOCCC1CO1 34a_100009863599_100000732470 [1,0,0,1,0,0|2,0,0]=4 14681 B16R1.16747 COC(=O)CCCCCCOCCC1CO1 7a_100009863599_100000732470 [1,0,0,1,0,0|2,0,0]=4 14682 B16R1.16747 COC(=O)CCCCCCOCC[C@@H]1CO1 34a_100009820653_100009815986 [1,0,0,1,0,0|2,0,0]=4 14683 B16R1.16747 COC(=O)CCCCCCSCCC1CC1 62a_100000764125_100009815986 [1,0,0,1,0,0|1,0,0]=3 14684 B16R1.16747 COC(=O)CCCCCCSCCC1CC1 62a_100009815986_100000764125 [1,0,0,1,0,0|1,0,0]=3 14685 B16R1.16747 COC(=O)CCCCCCSCCC1CO1 62a_100000732470_100009815986 [1,0,0,1,0,0|2,0,0]=4 14686 B16R1.16747 COC(=O)CCCCCCSCCC1CO1 62a_100009815986_100000732470 [1,0,0,1,0,0|2,0,0]=4 14687 B16R1.16747 COC(=O)CCCCCOCCCC1CO1 34a_100000074720_100000733510 [1,0,0,1,0,0|2,0,0]=4 14688 B16R1.16747 COC(=O)CCCCCOCCCC1CO1 7a_100000074720_100000733510 [1,0,0,1,0,0|2,0,0]=4 14689 B16R1.16747 COC(=O)CCCCCOCCNC1CC1 34a_100000738766_100009816466 [1,0,0,1,0,0|2,0,0]=4 14690 B16R1.16747 COC(=O)CCCCCSCCCC1CO1 62a_100000733510_100009816466 [1,0,0,1,0,0|2,0,0]=4 14691 B16R1.16747 COC(=O)CCCCCSCCCC1CO1 62a_100009816466_100000733510 [1,0,0,1,0,0|2,0,0]=4 14692 B16R1.16885 COC(=O)CCCCCCN1CCC[C@@H]1C 2230a_100020605311_100009815986 [1,0,0,1,0,0|1,0,0]=3 14693 B16R1.16885 COC(=O)CCCCCCN1CCC[C@@H]1C 269982a_100020605311_100009815986 [1,0,0,1,0,0|1,0,0]=3 14694 B16R1.16885 COC(=O)CCCCCCN1CCC[C@H]1C 2230a_100015189458_100009815986 [1,0,0,1,0,0|1,0,0]=3 14695 B16R1.16885 COC(=O)CCCCCCN1CCC[C@H]1C 269982a_100015189458_100009815986 [1,0,0,1,0,0|1,0,0]=3 14696 B16R1.16885 COC(=O)CCCCCCN1CCC[C@H]1C 34a_100015189458_100009815986 [1,0,0,1,0,0|1,0,0]=3 14697 B16R1.16885 COC(=O)CCCCCCN1CCSC1C 2230a_200011216479_100009815986 [1,0,0,1,0,0|2,0,0]=4 14698 B16R1.16885 COC(=O)CCCCCCN1CCSC1C 269982a_200011216479_100009815986 [1,0,0,1,0,0|2,0,0]=4 14699 B16R1.16885 COC(=O)CCCCCCN1CCSC1C 34a_200011216479_100009815986 [1,0,0,1,0,0|2,0,0]=4 14700 B16R1.16885 COC(=O)CCCCCOC1CCCC1C 34a_100011216460_100009816466 [1,0,0,1,0,0|1,0,0]=3 14701 B16R1.16885 COC(=O)CCCCCOC1CCCC1C 7a_100011216460_100009816466 [1,0,0,1,0,0|1,0,0]=3 14702 B16R1.16885 COC(=O)CCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009816466 [1,0,0,1,0,0|2,0,0]=4 14703 B16R1.16885 COC(=O)CCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009816466 [1,0,0,1,0,0|2,0,0]=4 14704 B16R1.16885 COC(=O)CCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009816466 [1,0,0,1,0,0|2,0,0]=4 14705 B16R1.16885 COC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_100009816466_200016002552 [1,0,0,1,0,0|2,0,0]=4 14706 B16R1.16885 COC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009816466 [1,0,0,1,0,0|2,0,0]=4 14707 B16R1.16885 COC(=O)CCCCOCC1CCCN1C 34a_100000743107_100000204269 [1,0,0,1,0,0|2,0,0]=4 14708 B16R1.16885 COC(=O)CCCOCCC1CCCN1C 34a_100011215177_100000742333 [1,0,0,1,0,0|2,0,0]=4 14709 B16R1.16885 COC(=O)CCCOCCC1CCCN1C 7a_100011215177_100011218270 [1,0,0,1,0,0|2,0,0]=4 14710 B16R1.16885 COC(=O)CCCSCCC1CCCN1C 62a_100000005710_100011218270 [1,0,0,1,0,0|2,0,0]=4 14711 B16R1.16885 COC(=O)CCCSCCC1CCCN1C 62a_100011218270_100000005710 [1,0,0,1,0,0|2,0,0]=4 14712 B16R1.16890 COC(=O)CCCCCCCN1CCC1C 269982a_100000755817_100010004213 [1,0,0,1,0,0|1,0,0]=3 14713 B16R1.16890 COC(=O)CCCCCCCN1CCC1C 34a_100000755817_100010004213 [1,0,0,1,0,0|1,0,0]=3 14714 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 2230a_100000740002_200000696569 [1,0,0,1,0,0|2,0,0]=4 14715 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 2230a_100015204231_100000741757 [1,0,0,1,0,0|2,0,0]=4 14716 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 269862a_100000740002_200000763224 [1,0,0,1,0,0|2,0,0]=4 14717 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 34a_100000740002_200000696569 [1,0,0,1,0,0|2,0,0]=4 14718 B16R1.16924 CNC(=O)CCCNCC1CCCCCC1 34a_100015204231_100000741757 [1,0,0,1,0,0|2,0,0]=4 14719 B16R1.16924 CNC(=O)CCCOCC1CCCCCC1 34a_100000699130_100000741757 [1,0,0,1,0,0|2,0,0]=4 14720 B16R1.16924 CNC(=O)CCCOCC1CCCCCC1 7a_100000699130_100000741757 [1,0,0,1,0,0|2,0,0]=4 14721 B16R1.16924 CNC(=O)CCCSCC1CCCCCC1 62a_100000741757_200000696569 [1,0,0,1,0,0|2,0,0]=4 14722 B16R1.16924 CNC(=O)CCCSCC1CCCCCC1 62a_200000696569_100000741757 [1,0,0,1,0,0|2,0,0]=4 14723 B16R1.16924 CNC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000737683 [1,0,0,1,0,0|2,0,0]=4 14724 B16R1.16924 CNC(=O)CCNCCC1CCCCCC1 34a_100011532351_100012179268 [1,0,0,1,0,0|2,0,0]=4 14725 B16R1.16924 COC(=O)CCCCCN1CCCCCC1 2230a_100000185865_100009816466 [1,0,0,1,0,0|1,0,0]=3 14726 B16R1.16924 COC(=O)CCCCCN1CCCCCC1 269982a_100000185865_100009816466 [1,0,0,1,0,0|1,0,0]=3 14727 B16R1.16924 COC(=O)CCCCCN1CCCCCC1 34a_100000185865_100009816466 [1,0,0,1,0,0|1,0,0]=3 14728 B16R1.16924 COC(=O)CCCCCN1CCCOCC1 2230a_100000685342_100009816466 [1,0,0,1,0,0|2,0,0]=4 14729 B16R1.16924 COC(=O)CCCCCN1CCCOCC1 269982a_100000685342_100009816466 [1,0,0,1,0,0|2,0,0]=4 14730 B16R1.16924 COC(=O)CCCCCN1CCCOCC1 34a_100000685342_100009816466 [1,0,0,1,0,0|2,0,0]=4 14731 B16R1.16924 COC(=O)CCCCNC1CCCCCC1 2230a_100000210984_100000204269 [1,0,0,1,0,0|1,0,0]=3 14732 B16R1.16924 COC(=O)CCCCNC1CCCCCC1 34a_100000210984_100000204269 [1,0,0,1,0,0|1,0,0]=3 14733 B16R1.16924 COC(=O)CCCCOC1CCCCCC1 34a_100000059025_100011217769 [1,0,0,1,0,0|1,0,0]=3 14734 B16R1.16924 COC(=O)CCCCOC1CCCCCC1 34a_100000210887_100000204269 [1,0,0,1,0,0|1,0,0]=3 14735 B16R1.16924 COC(=O)CCCCOC1CCCCCC1 7a_100000210887_100000204269 [1,0,0,1,0,0|1,0,0]=3 14736 B16R1.16924 COC(=O)CCCCSC1CCCCCC1 62a_100000204269_100011217769 [1,0,0,1,0,0|1,0,0]=3 14737 B16R1.16924 COC(=O)CCCCSC1CCCCCC1 62a_100011217769_100000204269 [1,0,0,1,0,0|1,0,0]=3 14738 B16R1.16924 COC(=O)CCCNCC1CCCCCC1 2230a_100015204231_100011218270 [1,0,0,1,0,0|1,0,0]=3 14739 B16R1.16924 COC(=O)CCCNCC1CCCCCC1 34a_100015204231_100000742333 [1,0,0,1,0,0|1,0,0]=3 14740 B16R1.16924 COC(=O)CCCOCC1CCCCCC1 34a_100000699130_100000742333 [1,0,0,1,0,0|1,0,0]=3 14741 B16R1.16924 COC(=O)CCCOCC1CCCCCC1 7a_100000699130_100011218270 [1,0,0,1,0,0|1,0,0]=3 14742 B16R1.16924 COC(=O)CCCSCC1CCCCCC1 62a_100011218270_200000696569 [1,0,0,1,0,0|1,0,0]=3 14743 B16R1.16924 COC(=O)CCCSCC1CCCCCC1 62a_200000696569_100011218270 [1,0,0,1,0,0|1,0,0]=3 14744 B16R1.16924 COC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000204255 [1,0,0,1,0,0|1,0,0]=3 14745 B16R1.16924 COC(=O)CCNCCC1CCCCCC1 34a_100011532351_100000742370 [1,0,0,1,0,0|1,0,0]=3 14746 B16R1.16924 COC(=O)CCOCCN1CCCCCC1 34a_100000238007_100000742370 [1,0,0,1,0,0|2,0,0]=4 14747 B16R1.16924 COC(=O)CCSCCN1CCCCCC1 62a_100000204255_100000722644 [1,0,0,1,0,0|2,0,0]=4 14748 B16R1.16924 COC(=O)CCSCCN1CCCCCC1 62a_100000722644_100000204255 [1,0,0,1,0,0|2,0,0]=4 14749 B16R1.16924 COC(=O)COCCCN1CCCCCC1 34a_100102886287_100000747449 [1,0,0,1,0,0|2,0,0]=4 14750 B16R1.16924 COC(=O)COCCCN1CCCCCC1 7a_100102886287_100000747449 [1,0,0,1,0,0|2,0,0]=4 14751 B16R1.16924 COC(=O)COCCNC1CCCCCC1 2230a_100000210984_100000090808 [1,0,0,1,0,0|2,0,0]=4 14752 B16R1.16924 COC(=O)COCCNC1CCCCCC1 34a_100000210984_100000090808 [1,0,0,1,0,0|2,0,0]=4 14753 B16R1.16924 COC(=O)COCCOC1CCCCCC1 34a_100000210887_100000090808 [1,0,0,1,0,0|2,0,0]=4 14754 B16R1.16924 COC(=O)COCCOC1CCCCCC1 7a_100000210887_100000090808 [1,0,0,1,0,0|2,0,0]=4 14755 B16R1.16924 COC(=O)COCCSC1CCCCCC1 62a_100000090808_100011217769 [1,0,0,1,0,0|2,0,0]=4 14756 B16R1.16924 COC(=O)COCCSC1CCCCCC1 62a_100011217769_100000090808 [1,0,0,1,0,0|2,0,0]=4 14757 B16R1.16924 COC(=O)NCCOCC1CCCCCC1 34a_100000757965_200000696569 [1,0,0,1,0,0|2,0,0]=4 14758 B16R1.16924 COC(=O)OCCOCC1CCCCCC1 34a_100010262106_200000696569 [1,0,0,1,0,0|2,0,0]=4 14759 B16R1.17553 CCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100011214924 [1,0,0,1,0,0|1,0,0]=3 14760 B16R1.17553 COC(=O)C1CN1CCCCCCCCO 2230a_200009830135_100000033203 [1,0,0,1,0,0|2,0,0]=4 14761 B16R1.18261 CNC(=O)CCCNC1CCCCCCC1 2230a_100000211152_100000741757 [1,0,0,1,0,0|2,0,0]=4 14762 B16R1.18261 CNC(=O)CCCNC1CCCCCCC1 270004a_100000740002_100000210524 [1,0,0,1,0,0|2,0,0]=4 14763 B16R1.18261 CNC(=O)CCCNC1CCCCCCC1 34a_100000211152_100000741757 [1,0,0,1,0,0|2,0,0]=4 14764 B16R1.18261 CNC(=O)CCCOC1CCCCCCC1 34a_100000210054_100000741757 [1,0,0,1,0,0|2,0,0]=4 14765 B16R1.18261 CNC(=O)CCCOC1CCCCCCC1 7a_100000210054_100000741757 [1,0,0,1,0,0|2,0,0]=4 14766 B16R1.18261 CNC(=O)CCOCC1CCCCCCC1 34a_100011216312_100012179268 [1,0,0,1,0,0|2,0,0]=4 14767 B16R1.18261 CNC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000737683 [1,0,0,1,0,0|2,0,0]=4 14768 B16R1.18261 CNC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000183359 [1,0,0,1,0,0|2,0,0]=4 14769 B16R1.18261 CNC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000183359 [1,0,0,1,0,0|2,0,0]=4 14770 B16R1.18261 COC(=O)CCCCN1CCCCCCC1 2230a_100000211400_100000204269 [1,0,0,1,0,0|1,0,0]=3 14771 B16R1.18261 COC(=O)CCCCN1CCCCCCC1 269982a_100000211400_100000204269 [1,0,0,1,0,0|1,0,0]=3 14772 B16R1.18261 COC(=O)CCCCN1CCCCCCC1 34a_100000211400_100000204269 [1,0,0,1,0,0|1,0,0]=3 14773 B16R1.18261 COC(=O)CCCNC1CCCCCCC1 2230a_100000211152_100011218270 [1,0,0,1,0,0|1,0,0]=3 14774 B16R1.18261 COC(=O)CCCNC1CCCCCCC1 34a_100000211152_100000742333 [1,0,0,1,0,0|1,0,0]=3 14775 B16R1.18261 COC(=O)CCCOC1CCCCCCC1 34a_100000210054_100000742333 [1,0,0,1,0,0|1,0,0]=3 14776 B16R1.18261 COC(=O)CCCOC1CCCCCCC1 7a_100000210054_100011218270 [1,0,0,1,0,0|1,0,0]=3 14777 B16R1.18261 COC(=O)CCOCC1CCCCCCC1 34a_100011216312_100000742370 [1,0,0,1,0,0|1,0,0]=3 14778 B16R1.18261 COC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000204255 [1,0,0,1,0,0|1,0,0]=3 14779 B16R1.18261 COC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000747449 [1,0,0,1,0,0|1,0,0]=3 14780 B16R1.18261 COC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000747449 [1,0,0,1,0,0|1,0,0]=3 14781 B16R1.18261 COC(=O)COCCN1CCCCCCC1 2230a_100000211400_100000090808 [1,0,0,1,0,0|2,0,0]=4 14782 B16R1.18261 COC(=O)COCCN1CCCCCCC1 34a_100000211400_100000090808 [1,0,0,1,0,0|2,0,0]=4 14783 B16R1.18469 CNC(=O)CCCN1CCCCCCCC1 2230a_100000039187_100000741757 [1,0,0,1,0,0|2,0,0]=4 14784 B16R1.18469 CNC(=O)CCCN1CCCCCCCC1 269982a_100000039187_100000741757 [1,0,0,1,0,0|2,0,0]=4 14785 B16R1.18469 CNC(=O)CCCN1CCCCCCCC1 34a_100000039187_100000741757 [1,0,0,1,0,0|2,0,0]=4 14786 B16R1.18469 CNC(=O)CCNC1CCCCCCCC1 270004a_100000738227_100000038600 [1,0,0,1,0,0|2,0,0]=4 14787 B16R1.18469 COC(=O)CCCN1CCCCCCCC1 2230a_100000039187_100011218270 [1,0,0,1,0,0|1,0,0]=3 14788 B16R1.18469 COC(=O)CCCN1CCCCCCCC1 269982a_100000039187_100011218270 [1,0,0,1,0,0|1,0,0]=3 14789 B16R1.18469 COC(=O)CCCN1CCCCCCCC1 34a_100000039187_100000742333 [1,0,0,1,0,0|1,0,0]=3 14790 B16R1.27 CCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100011214924 [1,0,0,1,0,0|2,0,0]=4 14791 B16R1.27 CCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011214924 [1,0,0,1,0,0|2,0,0]=4 14792 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210759 [1,0,0,1,0,0|2,0,0]=4 14793 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210759 [1,0,0,1,0,0|2,0,0]=4 14794 B16R1.27 CCCCCCCCOC1C=C(CCC1)C 34a_100011218613_100000210759 [1,0,0,1,0,0|2,0,0]=4 14795 B16R1.27 CCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210759 [1,0,0,1,0,0|1,0,0]=3 14796 B16R1.27 CCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210759 [1,0,0,1,0,0|2,0,0]=4 14797 B16R1.27 CCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210614 [1,0,0,1,0,0|2,0,0]=4 14798 B16R1.27 CCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210614 [1,0,0,1,0,0|2,0,0]=4 14799 B16R1.27 COCCCCCCOC1CCCC(=O)C1 34a_100012613340_100011998445 [1,0,0,1,0,0|2,0,0]=4 14800 B16R1.27 O=C1CCCC(C1)OCCCCCCCO 34a_100012613340_100000760002 [1,0,0,1,0,0|2,0,0]=4 14801 B16R1.57 CC(=O)CCCCOC1CCCCC1CN 34a_100011216029_100009817362 [1,0,0,1,0,0|2,0,0]=4 14802 B16R1.57 CCC1CCCCC1NCCCCC(=O)N 269862a_100000696515_100000757040 [1,0,0,1,0,0|2,0,0]=4 14803 B16R1.57 CCC1CCCCC1NCCCCC(=O)N 270004a_100000696515_100000757040 [1,0,0,1,0,0|2,0,0]=4 14804 B16R1.57 CCC1CCCCC1NCCCNC(=O)C 269862a_100000736810_100000757040 [1,0,0,1,0,0|2,0,0]=4 14805 B16R1.57 CCC1CCCCC1NCCCNC(=O)C 270004a_100000736810_100000757040 [1,0,0,1,0,0|2,0,0]=4 14806 B16R1.57 CCC1CCCCC1OCCCCC(=O)C 34a_100000210738_100009817362 [1,0,0,1,0,0|1,0,0]=3 14807 B16R1.57 CCC1CCCCC1OCCCCC(=O)C 7a_100000210738_100000735457 [1,0,0,1,0,0|1,0,0]=3 14808 B16R1.57 CCC1CCCCC1OCCCOC(=O)C 34a_100000210738_100000042594 [1,0,0,1,0,0|2,0,0]=4 14809 B16R1.57 CCC1CCCCC1OCCCOC(=O)C 7a_100000210738_100000042594 [1,0,0,1,0,0|2,0,0]=4 14810 B16R1.57 CCC1CCCCC1OCCCSC(=O)C 34a_100000210738_100000038929 [1,0,0,1,0,0|2,0,0]=4 14811 B16R1.57 CCC1CCCCC1OCCCSC(=O)C 7a_100000210738_100000038929 [1,0,0,1,0,0|2,0,0]=4 14812 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 2230a_100000210034_100009817443 [1,0,0,1,0,0|2,0,0]=4 14813 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 269982a_100000210034_100009817443 [1,0,0,1,0,0|2,0,0]=4 14814 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 34a_100000210034_100009817443 [1,0,0,1,0,0|2,0,0]=4 14815 B16R1.57 CCC1CCCCN1CCCCOC(=O)C 269982a_100000210034_100000033659 [1,0,0,1,0,0|2,0,0]=4 14816 B16R1.57 CCC1CCCCN1CCCCOC(=O)C 34a_100000210034_100000033659 [1,0,0,1,0,0|2,0,0]=4 14817 B16R1.57 CCC1CCCCN1CCCCSC(=O)C 2230a_100000210034_200010402107 [1,0,0,1,0,0|2,0,0]=4 14818 B16R1.57 CCC1CCCCN1CCCCSC(=O)C 269982a_100000210034_200010402107 [1,0,0,1,0,0|2,0,0]=4 14819 B16R1.57 CCC1CCCCN1CCCCSC(=O)C 34a_100000210034_200010402107 [1,0,0,1,0,0|2,0,0]=4 14820 B16R1.57 CCN1CCCCC1CNCCCC(=O)C 34a_100000754393_100000685027 [1,0,0,1,0,0|2,0,0]=4 14821 B16R1.57 CCN1CCCCC1COCCCC(=O)C 34a_100000225091_100000685027 [1,0,0,1,0,0|2,0,0]=4 14822 B16R1.57 CCN1CCCCC1COCCCC(=O)C 7a_100000225091_100011215641 [1,0,0,1,0,0|2,0,0]=4 14823 B16R1.57 CN[C@@H]1CCCC[C@H]1OCCCCC(=O)C 34a_100000708425_100009817362 [1,0,0,1,0,0|2,0,0]=4 14824 B16R1.57 COC1CCCCC1NCCCCC(=O)C 34a_100011208099_100009817362 [1,0,0,1,0,0|2,0,0]=4 14825 B16R1.57 CO[C@H]1CCCC[C@@H]1OCCCCC(=O)C 34a_200009815850_100009817362 [1,0,0,1,0,0|2,0,0]=4 14826 B16R1.57 CO[C@H]1CCCC[C@@H]1OCCCCC(=O)C 7a_200009815850_100000735457 [1,0,0,1,0,0|2,0,0]=4 14827 B16R1.250 C=C1CC(C1)CNCCCCCCCCC 2230a_100102567296_100011214924 [1,0,0,1,0,0|2,0,0]=4 14828 B16R1.250 C=C1CC(C1)CNCCCCCCCCC 34a_100102567296_100011214924 [1,0,0,1,0,0|2,0,0]=4 14829 B16R1.250 C=C1CC(C1)COCCCCCCCCC 34a_100011011225_100011214924 [1,0,0,1,0,0|2,0,0]=4 14830 B16R1.250 C=C1CC(C1)NCCCCCCCCCC 2230a_100132301982_100000210320 [1,0,0,1,0,0|2,0,0]=4 14831 B16R1.250 CCCCCCCCCCSC1CC(=O)C1 62a_100009894365_100000210320 [1,0,0,1,0,0|1,0,0]=3 14832 B16R1.250 CCCCCCCCCNCC1CC(=O)C1 2230a_100000212291_100009874392 [1,0,0,1,0,0|1,0,0]=3 14833 B16R1.250 CCCCCCCCCOCC1CC(=O)C1 34a_100000101936_100011214924 [1,0,0,1,0,0|1,0,0]=3 14834 B16R1.250 CCCCCCCCCOCC1CC(=O)C1 7a_100000210712_100009874392 [1,0,0,1,0,0|1,0,0]=3 14835 B16R1.250 CCCCCCCCCSCC1CC(=O)C1 62a_100009874392_100000210670 [1,0,0,1,0,0|1,0,0]=3 14836 B16R1.250 CCCCCCOCCOCC1CC(=O)C1 7a_100000691444_100009874392 [1,0,0,1,0,0|2,0,0]=4 14837 B16R1.250 CCCCOCCCCOCC1CC(=O)C1 7a_200000760531_100009874392 [1,0,0,1,0,0|2,0,0]=4 14838 B16R1.250 O=C1CC(C1)CNCCCCCCCCO 2230a_102515433106_100009874392 [1,0,0,1,0,0|2,0,0]=4 14839 B16R1.250 O=C1CC(C1)COCCCCCCCCBr 7a_100009813846_100009874392 [1,0,0,1,0,0|2,0,0]=4 14840 B16R1.250 O=C1CC(C1)COCCCCCCCCCl 7a_100000033203_100009874392 [1,0,0,1,0,0|2,0,0]=4 14841 B16R1.250 O=C1CC(C1)COCCCCCCCCO 34a_100000101936_100000033203 [1,0,0,1,0,0|2,0,0]=4 14842 B16R1.250 O=C1CC(C1)CSCCCCCCCCO 62a_100000033203_100009874392 [1,0,0,1,0,0|2,0,0]=4 14843 B16R1.250 O=C1CC(C1)CSCCCCCCCCO 62a_100009874392_100000033203 [1,0,0,1,0,0|2,0,0]=4 14844 B16R1.250 O=C1CC(C1)SCCCCCCCCCO 62a_100009894365_100009813782 [1,0,0,1,0,0|2,0,0]=4 14845 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 2230a_100015184752_100000210314 [1,0,0,1,0,0|2,0,0]=4 14846 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 269982a_100015184752_100000210757 [1,0,0,1,0,0|2,0,0]=4 14847 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 34a_100015184752_100000210314 [1,0,0,1,0,0|2,0,0]=4 14848 B16R1.290 CC(=O)CCCCNCC1CCCCC1O 34a_100011216029_100009817362 [1,0,0,1,0,0|2,0,0]=4 14849 B16R1.290 CC(=O)CCCCNCC1CCCCN1C 34a_100011228421_100009817362 [1,0,0,1,0,0|2,0,0]=4 14850 B16R1.290 CC(=O)CCCCOCC1CCCCN1C 34a_100000225079_100009817362 [1,0,0,1,0,0|2,0,0]=4 14851 B16R1.290 CC(=O)CCCCSCC1CCCCN1C 62a_100000735457_100015185383 [1,0,0,1,0,0|2,0,0]=4 14852 B16R1.290 CC(=O)CCCCSCC1CCCCN1C 62a_100015185383_100000735457 [1,0,0,1,0,0|2,0,0]=4 14853 B16R1.290 CC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100000685027 [1,0,0,1,0,0|2,0,0]=4 14854 B16R1.290 CC(=O)CCCOCCC1CCCCN1C 34a_100000759063_100000211948 [1,0,0,1,0,0|2,0,0]=4 14855 B16R1.290 CC(=O)CCCOCCC1CCCCN1C 7a_100000759063_100000211948 [1,0,0,1,0,0|2,0,0]=4 14856 B16R1.290 CC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100000685027 [1,0,0,1,0,0|2,0,0]=4 14857 B16R1.290 CC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100011215641 [1,0,0,1,0,0|2,0,0]=4 14858 B16R1.290 CC(=O)CCCSCCC1CCCCN1C 62a_100011215641_100000211948 [1,0,0,1,0,0|2,0,0]=4 14859 B16R1.290 CC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000053229 [1,0,0,1,0,0|2,0,0]=4 14860 B16R1.290 CC(=O)NCCCCNC1CCCCC1C 269862a_200011368371_100000210921 [1,0,0,1,0,0|2,0,0]=4 14861 B16R1.290 CC(=O)NCCCCNC1CCCCC1C 270004a_200011368371_100000210921 [1,0,0,1,0,0|2,0,0]=4 14862 B16R1.290 CC(=O)OCCCCCN1CCCCC1C 2230a_100000211376_100009813381 [1,0,0,1,0,0|2,0,0]=4 14863 B16R1.290 CC(=O)OCCCCCN1CCCCC1C 269982a_100000211376_100000033007 [1,0,0,1,0,0|2,0,0]=4 14864 B16R1.290 CC(=O)OCCCCCN1CCCCC1C 34a_100000211376_100000033007 [1,0,0,1,0,0|2,0,0]=4 14865 B16R1.290 CC(=O)OCCCCNC1CCCCC1C 34a_100000211402_100000033659 [1,0,0,1,0,0|2,0,0]=4 14866 B16R1.290 CC(=O)OCCCCOC1CCCCC1C 34a_100000211207_100000033659 [1,0,0,1,0,0|2,0,0]=4 14867 B16R1.290 CC(=O)OCCCCOC1CCCCC1C 7a_100000211207_100000033659 [1,0,0,1,0,0|2,0,0]=4 14868 B16R1.290 CC(=O)SCCCCNC1CCCCC1C 2230a_100000211402_200010402107 [1,0,0,1,0,0|2,0,0]=4 14869 B16R1.290 CC(=O)SCCCCNC1CCCCC1C 34a_100000211402_200010402107 [1,0,0,1,0,0|2,0,0]=4 14870 B16R1.290 CC(=O)SCCCCOC1CCCCC1C 34a_100000211207_200010402107 [1,0,0,1,0,0|2,0,0]=4 14871 B16R1.290 CC(=O)SCCCCOC1CCCCC1C 7a_100000211207_200010402107 [1,0,0,1,0,0|2,0,0]=4 14872 B16R1.290 CC1CCCCC1NCCCCCC(=O)N 2230a_100000211402_100009817443 [1,0,0,1,0,0|2,0,0]=4 14873 B16R1.290 CC1CCCCC1NCCCCCC(=O)N 34a_100000211402_100009817443 [1,0,0,1,0,0|2,0,0]=4 14874 B16R1.290 CC1CCCCC1OCCCCCC(=O)N 34a_100000211207_100009817443 [1,0,0,1,0,0|2,0,0]=4 14875 B16R1.290 CC1CCCCC1OCCCCCC(=O)N 7a_100000211207_100009817443 [1,0,0,1,0,0|2,0,0]=4 14876 B16R1.394 CC(=O)CCCCOCCC1CCCN1C 34a_100011215177_100009817362 [1,0,0,1,0,0|2,0,0]=4 14877 B16R1.394 CC(=O)CCCCOCCC1CCCN1C 7a_100011215177_100000735457 [1,0,0,1,0,0|2,0,0]=4 14878 B16R1.394 CC(=O)CCCCSCCC1CCCN1C 62a_100000005710_100000735457 [1,0,0,1,0,0|2,0,0]=4 14879 B16R1.394 CC(=O)CCCCSCCC1CCCN1C 62a_100000735457_100000005710 [1,0,0,1,0,0|2,0,0]=4 14880 B16R1.394 CC(=O)NCCCCCNC1CCCC1C 269862a_200012022750_100000752053 [1,0,0,1,0,0|2,0,0]=4 14881 B16R1.394 CC(=O)OCCCCCOC1CCCC1C 34a_100011216460_100000033007 [1,0,0,1,0,0|2,0,0]=4 14882 B16R1.394 CC(=O)OCCCCCOC1CCCC1C 7a_100011216460_100000033007 [1,0,0,1,0,0|2,0,0]=4 14883 B16R1.596 C=C(C)CCOCCCCC1CCCCC1 34a_100011215267_100000730704 [1,0,0,1,0,0|2,0,0]=4 14884 B16R1.596 C=C(C)CCOCCCCC1CCCCC1 7a_100011215267_100000730704 [1,0,0,1,0,0|2,0,0]=4 14885 B16R1.596 CC(=O)CCCCCCOC1CCCCO1 1458a_100000070787_100000033462 [1,0,0,1,0,0|2,0,0]=4 14886 B16R1.596 CC(=O)CCCCNCCC1CCCCC1 34a_100000738074_100009817362 [1,0,0,1,0,0|1,0,0]=3 14887 B16R1.596 CC(=O)CCCCNCCC1CCCCO1 34a_100015183643_100009817362 [1,0,0,1,0,0|2,0,0]=4 14888 B16R1.596 CC(=O)CCCCNCCC1CCOCC1 34a_100000755988_100009817362 [1,0,0,1,0,0|2,0,0]=4 14889 B16R1.596 CC(=O)CCCCOCCC1CCCCC1 34a_100011217863_100009817362 [1,0,0,1,0,0|1,0,0]=3 14890 B16R1.596 CC(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000735457 [1,0,0,1,0,0|1,0,0]=3 14891 B16R1.596 CC(=O)CCCCOCCC1CCCCN1 34a_100000211664_100009817362 [1,0,0,1,0,0|2,0,0]=4 14892 B16R1.596 CC(=O)CCCCOCCC1CCCNC1 34a_100000752241_100009817362 [1,0,0,1,0,0|2,0,0]=4 14893 B16R1.596 CC(=O)CCCCOCCC1CCNCC1 34a_100015190746_100009817362 [1,0,0,1,0,0|2,0,0]=4 14894 B16R1.596 CC(=O)CCCCOCCC1CCOCC1 34a_100011933979_100009817362 [1,0,0,1,0,0|2,0,0]=4 14895 B16R1.596 CC(=O)CCCCOCCC1CCOCC1 7a_100011933979_100000735457 [1,0,0,1,0,0|2,0,0]=4 14896 B16R1.596 CC(=O)CCCCSCCC1CCCCC1 62a_100000735457_100012355289 [1,0,0,1,0,0|1,0,0]=3 14897 B16R1.596 CC(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000735457 [1,0,0,1,0,0|1,0,0]=3 14898 B16R1.596 CC(=O)CCCCSCCC1CCOCC1 62a_100000735457_100011934994 [1,0,0,1,0,0|2,0,0]=4 14899 B16R1.596 CC(=O)CCCCSCCC1CCOCC1 62a_100011934994_100000735457 [1,0,0,1,0,0|2,0,0]=4 14900 B16R1.596 CC(=O)CCCCSCCN1CCCCC1 62a_100000735457_100000739454 [1,0,0,1,0,0|2,0,0]=4 14901 B16R1.596 CC(=O)CCCCSCCN1CCCCC1 62a_100000739454_100000735457 [1,0,0,1,0,0|2,0,0]=4 14902 B16R1.596 CC(=O)CCCCSCOC1CCCCC1 62a_100000735457_100011935260 [1,0,0,1,0,0|2,0,0]=4 14903 B16R1.596 CC(=O)CCCCSCOC1CCCCC1 62a_100011935260_100000735457 [1,0,0,1,0,0|2,0,0]=4 14904 B16R1.596 CC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100000685027 [1,0,0,1,0,0|1,0,0]=3 14905 B16R1.596 CC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100000685027 [1,0,0,1,0,0|2,0,0]=4 14906 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100000685027 [1,0,0,1,0,0|1,0,0]=3 14907 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 34a_100000759063_100011713725 [1,0,0,1,0,0|1,0,0]=3 14908 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100011215641 [1,0,0,1,0,0|1,0,0]=3 14909 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 7a_100000759063_100011713725 [1,0,0,1,0,0|1,0,0]=3 14910 B16R1.596 CC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100000685027 [1,0,0,1,0,0|2,0,0]=4 14911 B16R1.596 CC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100000685027 [1,0,0,1,0,0|2,0,0]=4 14912 B16R1.596 CC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100000685027 [1,0,0,1,0,0|2,0,0]=4 14913 B16R1.596 CC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100000685027 [1,0,0,1,0,0|2,0,0]=4 14914 B16R1.596 CC(=O)CCCOCCCN1CCCCC1 34a_100000759063_100000690320 [1,0,0,1,0,0|2,0,0]=4 14915 B16R1.596 CC(=O)CCCOCCCN1CCCCC1 7a_100000759063_100000007876 [1,0,0,1,0,0|2,0,0]=4 14916 B16R1.596 CC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100000685027 [1,0,0,1,0,0|2,0,0]=4 14917 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 34a_100000759063_100011211530 [1,0,0,1,0,0|2,0,0]=4 14918 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100000685027 [1,0,0,1,0,0|2,0,0]=4 14919 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 7a_100000759063_100011211530 [1,0,0,1,0,0|2,0,0]=4 14920 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100011215641 [1,0,0,1,0,0|2,0,0]=4 14921 B16R1.596 CC(=O)CCCSCCCC1CCCCC1 62a_100011215641_100011713725 [1,0,0,1,0,0|1,0,0]=3 14922 B16R1.596 CC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100011215641 [1,0,0,1,0,0|1,0,0]=3 14923 B16R1.596 CC(=O)CCCSCCCN1CCCCC1 62a_100011215641_100000007876 [1,0,0,1,0,0|2,0,0]=4 14924 B16R1.596 CC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100011215641 [1,0,0,1,0,0|2,0,0]=4 14925 B16R1.596 CC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100011215641 [1,0,0,1,0,0|2,0,0]=4 14926 B16R1.596 CC(=O)CCCSCCOC1CCCCC1 62a_100011215641_100011211530 [1,0,0,1,0,0|2,0,0]=4 14927 B16R1.596 CC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000053229 [1,0,0,1,0,0|1,0,0]=3 14928 B16R1.596 CC(=O)NCCCCCNC1CCCCC1 270004a_200012022750_100000210434 [1,0,0,1,0,0|2,0,0]=4 14929 B16R1.596 CC(=O)NCCCCCNC1CCCCC1 34a_200012022750_100000210327 [1,0,0,1,0,0|2,0,0]=4 14930 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 2230a_200011368371_100000211423 [1,0,0,1,0,0|2,0,0]=4 14931 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 269862a_200011368371_100000211278 [1,0,0,1,0,0|2,0,0]=4 14932 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 34a_200011368371_100000211423 [1,0,0,1,0,0|2,0,0]=4 14933 B16R1.596 CC(=O)NCCCNCCC1CCCCC1 270004a_100000736810_100011713444 [1,0,0,1,0,0|2,0,0]=4 14934 B16R1.596 CC(=O)NCCCNCCC1CCCCC1 34a_100000736810_100011209188 [1,0,0,1,0,0|2,0,0]=4 14935 B16R1.596 CC(=O)NCCCOCCC1CCCCC1 34a_100000752032_100011209188 [1,0,0,1,0,0|2,0,0]=4 14936 B16R1.596 CC(=O)NCCNCCCC1CCCCC1 2230a_100000209853_100011713725 [1,0,0,1,0,0|2,0,0]=4 14937 B16R1.596 CC(=O)NCCNCCCC1CCCCC1 2230a_100011211642_100000189650 [1,0,0,1,0,0|2,0,0]=4 14938 B16R1.596 CC(=O)NCCOCCCC1CCCCC1 34a_100000158858_100011713725 [1,0,0,1,0,0|2,0,0]=4 14939 B16R1.596 CC(=O)NCCOCCCC1CCCCC1 7a_100000198086_100000189650 [1,0,0,1,0,0|2,0,0]=4 14940 B16R1.596 CC(=O)NCCSCCCC1CCCCC1 62a_100000189650_100011713725 [1,0,0,1,0,0|2,0,0]=4 14941 B16R1.596 CC(=O)NCCSCCCC1CCCCC1 62a_100011713725_100000189650 [1,0,0,1,0,0|2,0,0]=4 14942 B16R1.596 CC(=O)OCCCCCNC1CCCCC1 2230a_100000182618_100009813381 [1,0,0,1,0,0|2,0,0]=4 14943 B16R1.596 CC(=O)OCCCCCNC1CCCCC1 34a_100000182618_100000033007 [1,0,0,1,0,0|2,0,0]=4 14944 B16R1.596 CC(=O)OCCCCCOC1CCCCC1 34a_100000210231_100000033007 [1,0,0,1,0,0|2,0,0]=4 14945 B16R1.596 CC(=O)OCCCCCOC1CCCCC1 7a_100000210231_100000033007 [1,0,0,1,0,0|2,0,0]=4 14946 B16R1.596 CC(=O)OCCCCCSC1CCCCC1 62a_100000033007_100000210327 [1,0,0,1,0,0|2,0,0]=4 14947 B16R1.596 CC(=O)OCCCCCSC1CCCCC1 62a_100000210327_100000033007 [1,0,0,1,0,0|2,0,0]=4 14948 B16R1.596 CC(=O)OCCCCNCC1CCCCC1 34a_100000210473_100000033659 [1,0,0,1,0,0|2,0,0]=4 14949 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 34a_100000073216_100000211423 [1,0,0,1,0,0|2,0,0]=4 14950 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 34a_100000212181_100000033659 [1,0,0,1,0,0|2,0,0]=4 14951 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 7a_100000073216_100000211423 [1,0,0,1,0,0|2,0,0]=4 14952 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 7a_100000212181_100000033659 [1,0,0,1,0,0|2,0,0]=4 14953 B16R1.596 CC(=O)OCCCCSCC1CCCCC1 62a_100000033659_100000211423 [1,0,0,1,0,0|2,0,0]=4 14954 B16R1.596 CC(=O)OCCCCSCC1CCCCC1 62a_100000211423_100000033659 [1,0,0,1,0,0|2,0,0]=4 14955 B16R1.596 CC(=O)OCCCNCCC1CCCCC1 34a_100000738074_100000042594 [1,0,0,1,0,0|2,0,0]=4 14956 B16R1.596 CC(=O)OCCCOCCC1CCCCC1 34a_100011217863_100000042594 [1,0,0,1,0,0|2,0,0]=4 14957 B16R1.596 CC(=O)OCCCOCCC1CCCCC1 7a_100011217863_100000042594 [1,0,0,1,0,0|2,0,0]=4 14958 B16R1.596 CC(=O)OCCCSCCC1CCCCC1 62a_100000042594_100012355289 [1,0,0,1,0,0|2,0,0]=4 14959 B16R1.596 CC(=O)OCCCSCCC1CCCCC1 62a_100012355289_100000042594 [1,0,0,1,0,0|2,0,0]=4 14960 B16R1.596 CC(=O)OCCNCCCC1CCCCC1 34a_100011211642_100009814007 [1,0,0,1,0,0|2,0,0]=4 14961 B16R1.596 CC(=O)OCCOCCCC1CCCCC1 34a_100000198086_100009814007 [1,0,0,1,0,0|2,0,0]=4 14962 B16R1.596 CC(=O)OCCOCCCC1CCCCC1 7a_100000198086_100009814007 [1,0,0,1,0,0|2,0,0]=4 14963 B16R1.596 CC(=O)OCCSCCCC1CCCCC1 62a_100009814007_100011713725 [1,0,0,1,0,0|2,0,0]=4 14964 B16R1.596 CC(=O)OCCSCCCC1CCCCC1 62a_100011713725_100009814007 [1,0,0,1,0,0|2,0,0]=4 14965 B16R1.596 CC(=O)OCOCCCCC1CCCCC1 34a_100011215267_100009813279 [1,0,0,1,0,0|2,0,0]=4 14966 B16R1.596 CC(=O)SCCCCNCC1CCCCC1 2230a_100000210473_200010402107 [1,0,0,1,0,0|2,0,0]=4 14967 B16R1.596 CC(=O)SCCCCNCC1CCCCC1 34a_100000210473_200010402107 [1,0,0,1,0,0|2,0,0]=4 14968 B16R1.596 CC(=O)SCCCCOCC1CCCCC1 34a_100000212181_200010402107 [1,0,0,1,0,0|2,0,0]=4 14969 B16R1.596 CC(=O)SCCCCOCC1CCCCC1 7a_100000212181_200010402107 [1,0,0,1,0,0|2,0,0]=4 14970 B16R1.596 CC(=O)SCCCCSCC1CCCCC1 62a_100000211423_200010402107 [1,0,0,1,0,0|2,0,0]=4 14971 B16R1.596 CC(=O)SCCCCSCC1CCCCC1 62a_200010402107_100000211423 [1,0,0,1,0,0|2,0,0]=4 14972 B16R1.596 CC(=O)SCCCNCCC1CCCCC1 2230a_100000738074_100000038929 [1,0,0,1,0,0|2,0,0]=4 14973 B16R1.596 CC(=O)SCCCNCCC1CCCCC1 34a_100000738074_100000038929 [1,0,0,1,0,0|2,0,0]=4 14974 B16R1.596 CC(=O)SCCCOCCC1CCCCC1 34a_100011217863_100000038929 [1,0,0,1,0,0|2,0,0]=4 14975 B16R1.596 CC(=O)SCCCOCCC1CCCCC1 7a_100011217863_100000038929 [1,0,0,1,0,0|2,0,0]=4 14976 B16R1.596 CC(=O)SCCCSCCC1CCCCC1 62a_100000038929_100012355289 [1,0,0,1,0,0|2,0,0]=4 14977 B16R1.596 CC(=O)SCCCSCCC1CCCCC1 62a_100012355289_100000038929 [1,0,0,1,0,0|2,0,0]=4 14978 B16R1.596 CS(=O)CCCNCCCC1CCCCC1 2230a_200000753449_100011713725 [1,0,0,1,0,0|2,0,0]=4 14979 B16R1.596 NC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_100009817443 [1,0,0,1,0,0|2,0,0]=4 14980 B16R1.596 NC(=O)CCCCCNCC1CCCCC1 34a_100000210473_100009817443 [1,0,0,1,0,0|2,0,0]=4 14981 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 34a_100000123541_100000211423 [1,0,0,1,0,0|2,0,0]=4 14982 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 34a_100000212181_100009817443 [1,0,0,1,0,0|2,0,0]=4 14983 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 7a_100000123541_100000211423 [1,0,0,1,0,0|2,0,0]=4 14984 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 7a_100000212181_100009817443 [1,0,0,1,0,0|2,0,0]=4 14985 B16R1.596 NC(=O)CCCCCSCC1CCCCC1 62a_100000211423_100009817443 [1,0,0,1,0,0|2,0,0]=4 14986 B16R1.596 NC(=O)CCCCCSCC1CCCCC1 62a_100009817443_100000211423 [1,0,0,1,0,0|2,0,0]=4 14987 B16R1.596 NC(=O)CCCCNCCC1CCCCC1 270004a_100000696515_100011713444 [1,0,0,1,0,0|2,0,0]=4 14988 B16R1.596 NC(=O)CCCCNCCC1CCCCC1 34a_100000696515_100011209188 [1,0,0,1,0,0|2,0,0]=4 14989 B16R1.596 NC(=O)CCCCOCCC1CCCCC1 34a_100012022536_100011209188 [1,0,0,1,0,0|2,0,0]=4 14990 B16R1.596 NC(=O)CCCCOCCC1CCCCC1 7a_100012022536_100011273959 [1,0,0,1,0,0|2,0,0]=4 14991 B16R1.596 NC(=O)CCCNCCCC1CCCCC1 34a_100000739312_100011713725 [1,0,0,1,0,0|2,0,0]=4 14992 B16R1.596 NC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100102525003 [1,0,0,1,0,0|2,0,0]=4 14993 B16R1.596 NC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100102525003 [1,0,0,1,0,0|2,0,0]=4 14994 B16R1.596 NC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100102525003 [1,0,0,1,0,0|2,0,0]=4 14995 B16R1.596 NC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100102525003 [1,0,0,1,0,0|2,0,0]=4 14996 B16R1.596 NC(=O)CCCSCCCC1CCCCC1 62a_100102525003_100011713725 [1,0,0,1,0,0|2,0,0]=4 14997 B16R1.596 NC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100000731001 [1,0,0,1,0,0|2,0,0]=4 14998 B16R1.596 NC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000744528 [1,0,0,1,0,0|2,0,0]=4 14999 B16R1.596 O=C(O)COCCNCCC1CCCCC1 269956a_100000700818_100011273959 [1,0,0,1,0,0|2,0,0]=4 15000 B16R1.596 O=C([O-])CCCCCOCC1CCCCC1 7a_100102619762_100000211423 [1,0,0,1,0,0|1,0,1]=4 15001 B16R1.695 CC(=O)CCCCN1CCCCC1CCO 269982a_100000211664_100000735457 [1,0,0,1,0,0|2,0,0]=4 15002 B16R1.695 CC(=O)CCCCN1CCCCC1CCO 34a_100000211664_100009817362 [1,0,0,1,0,0|2,0,0]=4 15003 B16R1.695 CCCC1CCCCC1NCCCC(=O)N 269862a_100000739312_100011218038 [1,0,0,1,0,0|2,0,0]=4 15004 B16R1.695 CCCC1CCCCC1NCCCS(=O)C 270004a_200000753449_100011218038 [1,0,0,1,0,0|2,0,0]=4 15005 B16R1.695 CCCC1CCCCC1NCCNC(=O)C 269862a_100000209853_100011218038 [1,0,0,1,0,0|2,0,0]=4 15006 B16R1.695 CCCC1CCCCC1NCCSC(=O)C 269862a_100020647217_100011218038 [1,0,0,1,0,0|2,0,0]=4 15007 B16R1.695 CCCC1CCCCC1OCCCC(=O)C 34a_100011217265_100000685027 [1,0,0,1,0,0|1,0,0]=3 15008 B16R1.695 CCCC1CCCCC1OCCCC(=O)C 7a_100011217265_100011215641 [1,0,0,1,0,0|1,0,0]=3 15009 B16R1.695 CCCC1CCCCC1OCCCC(=O)N 34a_100011217265_100102525003 [1,0,0,1,0,0|2,0,0]=4 15010 B16R1.695 CCCC1CCCCC1OCCCC(=O)N 7a_100011217265_100102525003 [1,0,0,1,0,0|2,0,0]=4 15011 B16R1.695 CCCC1CCCCC1OCCNC(=O)C 7a_100011217265_100000189650 [1,0,0,1,0,0|2,0,0]=4 15012 B16R1.695 CCCC1CCCCC1OCCOC(=O)C 34a_100011217265_100009814007 [1,0,0,1,0,0|2,0,0]=4 15013 B16R1.695 CCCC1CCCCC1OCCOC(=O)C 7a_100011217265_100009814007 [1,0,0,1,0,0|2,0,0]=4 15014 B16R1.695 CCCC1CCCCN1CCCCC(=O)C 269982a_100000701414_100000735457 [1,0,0,1,0,0|1,0,0]=3 15015 B16R1.695 CCCC1CCCCN1CCCCC(=O)C 34a_100000701414_100009817362 [1,0,0,1,0,0|1,0,0]=3 15016 B16R1.695 CCCC1CCCCN1CCCOC(=O)C 269982a_100000701414_100000042594 [1,0,0,1,0,0|2,0,0]=4 15017 B16R1.695 CCCC1CCCCN1CCCOC(=O)C 34a_100000701414_100000042594 [1,0,0,1,0,0|2,0,0]=4 15018 B16R1.695 CCCC1CCCCN1CCCSC(=O)C 2230a_100000701414_100000038929 [1,0,0,1,0,0|2,0,0]=4 15019 B16R1.695 CCCC1CCCCN1CCCSC(=O)C 269982a_100000701414_100000038929 [1,0,0,1,0,0|2,0,0]=4 15020 B16R1.695 CCCC1CCCCN1CCCSC(=O)C 34a_100000701414_100000038929 [1,0,0,1,0,0|2,0,0]=4 15021 B16R1.695 CCCC1COCCN1CCCCC(=O)C 269982a_102495339903_100000735457 [1,0,0,1,0,0|2,0,0]=4 15022 B16R1.695 CCCC1COCCN1CCCCC(=O)C 34a_102495339903_100009817362 [1,0,0,1,0,0|2,0,0]=4 15023 B16R1.695 COCC1CCCCN1CCCCC(=O)C 269982a_100015184032_100000735457 [1,0,0,1,0,0|2,0,0]=4 15024 B16R1.695 COCC1CCCCN1CCCCC(=O)C 34a_100015184032_100009817362 [1,0,0,1,0,0|2,0,0]=4 15025 B16R1.708 CCCC1CCCC1NCCCCC(=O)N 269862a_100000696515_100000723119 [1,0,0,1,0,0|2,0,0]=4 15026 B16R1.708 CCCC1CCCC1NCCCCC(=O)N 270004a_100000696515_100000723119 [1,0,0,1,0,0|2,0,0]=4 15027 B16R1.708 CCCC1CCCC1NCCCNC(=O)C 269862a_100000736810_100000723119 [1,0,0,1,0,0|2,0,0]=4 15028 B16R1.708 CCCC1CCCC1NCCCNC(=O)C 270004a_100000736810_100000723119 [1,0,0,1,0,0|2,0,0]=4 15029 B16R1.708 CCCN1CCCC1COCCCC(=O)C 34a_200000694710_100000685027 [1,0,0,1,0,0|2,0,0]=4 15030 B16R1.708 CCCN1CCCC1COCCCC(=O)C 7a_200000694710_100011215641 [1,0,0,1,0,0|2,0,0]=4 15031 B16R1.1255 CC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100011215641 [1,0,0,1,0,0|2,0,0]=4 15032 B16R1.1255 CC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100000685027 [1,0,0,1,0,0|2,0,0]=4 15033 B16R1.1255 CCCCN1CCCCC1CCNC(=O)C 2230a_200011221479_100000210211 [1,0,0,1,0,0|2,0,0]=4 15034 B16R1.1255 CCCCN1CCCCC1CCNC(=O)C 269982a_200011221479_100000210211 [1,0,0,1,0,0|2,0,0]=4 15035 B16R1.1255 CCCCN1CCCCC1CCNC(=O)C 34a_200011221479_100000210210 [1,0,0,1,0,0|2,0,0]=4 15036 B16R1.1255 COCCC1CCCCN1CCCC(=O)C 269982a_100015186528_100011215641 [1,0,0,1,0,0|2,0,0]=4 15037 B16R1.1255 COCCC1CCCCN1CCCC(=O)C 34a_100015186528_100000685027 [1,0,0,1,0,0|2,0,0]=4 15038 B16R1.1270 CCCCC1CCCC1NCCCC(=O)N 269862a_100000739312_100000750825 [1,0,0,1,0,0|2,0,0]=4 15039 B16R1.1270 CCCCC1CCCC1NCCCS(=O)C 270004a_200000753449_100000750825 [1,0,0,1,0,0|2,0,0]=4 15040 B16R1.1270 CCCCC1CCCC1NCCNC(=O)C 269862a_100000209853_100000750825 [1,0,0,1,0,0|2,0,0]=4 15041 B16R1.1270 CCCCC1CCCC1NCCSC(=O)C 269862a_100020647217_100000750825 [1,0,0,1,0,0|2,0,0]=4 15042 B16R1.1275 CC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100009817362 [1,0,0,1,0,0|1,0,0]=3 15043 B16R1.1275 CC(=O)CCCCNCCOC1CCCC1 34a_100000741755_100009817362 [1,0,0,1,0,0|2,0,0]=4 15044 B16R1.1275 CC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100009817362 [1,0,0,1,0,0|1,0,0]=3 15045 B16R1.1275 CC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000735457 [1,0,0,1,0,0|1,0,0]=3 15046 B16R1.1275 CC(=O)CCCCOCCNC1CCCC1 34a_200000200444_100009817362 [1,0,0,1,0,0|2,0,0]=4 15047 B16R1.1275 CC(=O)CCCCOCCOC1CCCC1 34a_100000738311_100009817362 [1,0,0,1,0,0|2,0,0]=4 15048 B16R1.1275 CC(=O)CCCCOCCOC1CCCC1 7a_100000738311_100000735457 [1,0,0,1,0,0|2,0,0]=4 15049 B16R1.1275 CC(=O)CCCCSCCCC1CCCC1 62a_100000735457_100011713738 [1,0,0,1,0,0|1,0,0]=3 15050 B16R1.1275 CC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000735457 [1,0,0,1,0,0|1,0,0]=3 15051 B16R1.1275 CC(=O)CCCCSCCCN1CCCC1 62a_100000735457_100011445909 [1,0,0,1,0,0|2,0,0]=4 15052 B16R1.1275 CC(=O)CCCCSCCCN1CCCC1 62a_100016991639_100000735457 [1,0,0,1,0,0|2,0,0]=4 15053 B16R1.1275 CC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100000685027 [1,0,0,1,0,0|2,0,0]=4 15054 B16R1.1275 CC(=O)NCCCCCCNC1CCCC1 2230a_200011996284_100000179811 [1,0,0,1,0,0|2,0,0]=4 15055 B16R1.1275 CC(=O)NCCCCCCNC1CCCC1 270004a_200011996284_100000210133 [1,0,0,1,0,0|2,0,0]=4 15056 B16R1.1275 CC(=O)NCCCCCCNC1CCCC1 34a_200011996284_100000179811 [1,0,0,1,0,0|2,0,0]=4 15057 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 2230a_200012022750_100000740388 [1,0,0,1,0,0|2,0,0]=4 15058 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 269862a_200012022750_100000746403 [1,0,0,1,0,0|2,0,0]=4 15059 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 34a_200012022750_100000740388 [1,0,0,1,0,0|2,0,0]=4 15060 B16R1.1275 CC(=O)NCCCCNCCC1CCCC1 2230a_200011368371_100000760354 [1,0,0,1,0,0|2,0,0]=4 15061 B16R1.1275 CC(=O)NCCCCNCCC1CCCC1 34a_200011368371_100000760354 [1,0,0,1,0,0|2,0,0]=4 15062 B16R1.1275 CC(=O)NCCCNCCCC1CCCC1 34a_100000736810_100011713738 [1,0,0,1,0,0|2,0,0]=4 15063 B16R1.1275 CC(=O)NCCCOCCCC1CCCC1 34a_100000752032_100011713738 [1,0,0,1,0,0|2,0,0]=4 15064 B16R1.1275 CC(=O)OCCCCCNCC1CCCC1 2230a_100000737975_100009813381 [1,0,0,1,0,0|2,0,0]=4 15065 B16R1.1275 CC(=O)OCCCCCNCC1CCCC1 34a_100000737975_100000033007 [1,0,0,1,0,0|2,0,0]=4 15066 B16R1.1275 CC(=O)OCCCCCOCC1CCCC1 34a_100000742336_100000033007 [1,0,0,1,0,0|2,0,0]=4 15067 B16R1.1275 CC(=O)OCCCCCOCC1CCCC1 7a_100000742336_100000033007 [1,0,0,1,0,0|2,0,0]=4 15068 B16R1.1275 CC(=O)OCCCCCSCC1CCCC1 62a_100000033007_100000740388 [1,0,0,1,0,0|2,0,0]=4 15069 B16R1.1275 CC(=O)OCCCCCSCC1CCCC1 62a_100000740388_100000033007 [1,0,0,1,0,0|2,0,0]=4 15070 B16R1.1275 CC(=O)OCCCCNCCC1CCCC1 34a_100000739158_100000033659 [1,0,0,1,0,0|2,0,0]=4 15071 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 34a_100000073216_100000760354 [1,0,0,1,0,0|2,0,0]=4 15072 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 34a_100000749090_100000033659 [1,0,0,1,0,0|2,0,0]=4 15073 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 7a_100000073216_100000760354 [1,0,0,1,0,0|2,0,0]=4 15074 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 7a_100000749090_100000033659 [1,0,0,1,0,0|2,0,0]=4 15075 B16R1.1275 CC(=O)OCCCCSCCC1CCCC1 62a_100000033659_100000760354 [1,0,0,1,0,0|2,0,0]=4 15076 B16R1.1275 CC(=O)OCCCCSCCC1CCCC1 62a_100000760354_100000033659 [1,0,0,1,0,0|2,0,0]=4 15077 B16R1.1275 CC(=O)OCCCNCCCC1CCCC1 34a_100000736752_100000042594 [1,0,0,1,0,0|2,0,0]=4 15078 B16R1.1275 CC(=O)OCCCOCCCC1CCCC1 34a_100011215328_100000042594 [1,0,0,1,0,0|2,0,0]=4 15079 B16R1.1275 CC(=O)OCCCOCCCC1CCCC1 7a_100011215328_100000042594 [1,0,0,1,0,0|2,0,0]=4 15080 B16R1.1275 CC(=O)OCCCSCCCC1CCCC1 62a_100000042594_100011713738 [1,0,0,1,0,0|2,0,0]=4 15081 B16R1.1275 CC(=O)OCCCSCCCC1CCCC1 62a_100011713738_100000042594 [1,0,0,1,0,0|2,0,0]=4 15082 B16R1.1275 CC(=O)SCCCCCCNC1CCCC1 270004a_100000704104_100000210133 [1,0,0,1,0,0|2,0,0]=4 15083 B16R1.1275 CC(=O)SCCCCNCCC1CCCC1 2230a_100000739158_200010402107 [1,0,0,1,0,0|2,0,0]=4 15084 B16R1.1275 CC(=O)SCCCCNCCC1CCCC1 34a_100000739158_200010402107 [1,0,0,1,0,0|2,0,0]=4 15085 B16R1.1275 CC(=O)SCCCCOCCC1CCCC1 34a_100000749090_200010402107 [1,0,0,1,0,0|2,0,0]=4 15086 B16R1.1275 CC(=O)SCCCCOCCC1CCCC1 7a_100000749090_200010402107 [1,0,0,1,0,0|2,0,0]=4 15087 B16R1.1275 CC(=O)SCCCCSCCC1CCCC1 62a_100000760354_200010402107 [1,0,0,1,0,0|2,0,0]=4 15088 B16R1.1275 CC(=O)SCCCCSCCC1CCCC1 62a_200010402107_100000760354 [1,0,0,1,0,0|2,0,0]=4 15089 B16R1.1275 CC(=O)SCCCNCCCC1CCCC1 2230a_100000736752_100000038929 [1,0,0,1,0,0|2,0,0]=4 15090 B16R1.1275 CC(=O)SCCCNCCCC1CCCC1 34a_100000736752_100000038929 [1,0,0,1,0,0|2,0,0]=4 15091 B16R1.1275 CC(=O)SCCCOCCCC1CCCC1 34a_100011215328_100000038929 [1,0,0,1,0,0|2,0,0]=4 15092 B16R1.1275 CC(=O)SCCCOCCCC1CCCC1 7a_100011215328_100000038929 [1,0,0,1,0,0|2,0,0]=4 15093 B16R1.1275 CC(=O)SCCCSCCCC1CCCC1 62a_100000038929_100011713738 [1,0,0,1,0,0|2,0,0]=4 15094 B16R1.1275 CC(=O)SCCCSCCCC1CCCC1 62a_100011713738_100000038929 [1,0,0,1,0,0|2,0,0]=4 15095 B16R1.1275 NC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100009817443 [1,0,0,1,0,0|2,0,0]=4 15096 B16R1.1275 NC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100009817443 [1,0,0,1,0,0|2,0,0]=4 15097 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 34a_100000123541_100000760354 [1,0,0,1,0,0|2,0,0]=4 15098 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100009817443 [1,0,0,1,0,0|2,0,0]=4 15099 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 7a_100000123541_100000760354 [1,0,0,1,0,0|2,0,0]=4 15100 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100009817443 [1,0,0,1,0,0|2,0,0]=4 15101 B16R1.1275 NC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100009817443 [1,0,0,1,0,0|2,0,0]=4 15102 B16R1.1275 NC(=O)CCCCCSCCC1CCCC1 62a_100009817443_100000760354 [1,0,0,1,0,0|2,0,0]=4 15103 B16R1.1275 NC(=O)CCCCNCCCC1CCCC1 34a_100000696515_100011713738 [1,0,0,1,0,0|2,0,0]=4 15104 B16R1.1275 NC(=O)CCCCOCCCC1CCCC1 34a_100012022536_100011713738 [1,0,0,1,0,0|2,0,0]=4 15105 B16R1.1275 NC(=O)CCCCOCCCC1CCCC1 7a_100012022536_100011713738 [1,0,0,1,0,0|2,0,0]=4 15106 B16R1.1275 O=C(O)COCCNCCCC1CCCC1 269956a_100000700818_100011713738 [1,0,0,1,0,0|2,0,0]=4 15107 B16R1.1275 O=C([O-])CCCCCOCCC1CCCC1 7a_100102619762_100000760354 [1,0,0,1,0,0|1,0,1]=4 15108 B16R1.1352 CCC1CCCC1NCCCCNC(=O)C 269862a_200011368371_100000749056 [1,0,0,1,0,0|2,0,0]=4 15109 B16R1.1352 CCC1CCCC1NCCCCNC(=O)C 270004a_200011368371_100000749056 [1,0,0,1,0,0|2,0,0]=4 15110 B16R1.1352 CCC1CCCN1CCCCCOC(=O)C 2230a_100000754278_100009813381 [1,0,0,1,0,0|2,0,0]=4 15111 B16R1.1352 CCC1CCCN1CCCCCOC(=O)C 269982a_100000754278_100000033007 [1,0,0,1,0,0|2,0,0]=4 15112 B16R1.1352 CCC1CCCN1CCCCCOC(=O)C 34a_100000754278_100000033007 [1,0,0,1,0,0|2,0,0]=4 15113 B16R1.1352 CCN1CCC[C@@H]1COCCCCC(=O)C 34a_100011739246_100009817362 [1,0,0,1,0,0|2,0,0]=4 15114 B16R1.1352 CCN1CCC[C@@H]1COCCCCC(=O)C 7a_100011739246_100000735457 [1,0,0,1,0,0|2,0,0]=4 15115 B16R1.1424 CCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210326 [1,0,0,1,0,0|1,0,0]=3 15116 B16R1.1424 CCOCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210147 [1,0,0,1,0,0|2,0,0]=4 15117 B16R1.1424 CCSCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000757381 [1,0,0,1,0,0|2,0,0]=4 15118 B16R1.1424 COCCCC1CCCCN1CCC(=O)C 269982a_100011804088_100000053229 [1,0,0,1,0,0|2,0,0]=4 15119 B16R1.1424 COCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000740836 [1,0,0,1,0,0|2,0,0]=4 15120 B16R1.1424 O=C(O)CCC1CCCCN1CCCCF 269956a_100000694054_100000729493 [1,0,0,1,0,0|2,0,0]=4 15121 B16R1.1424 O=C(O)CCC1CCCCN1CCCCO 269956a_100000694054_100000210776 [1,0,0,1,0,0|2,0,0]=4 15122 B16R1.1442 CCCCCC1CCCC1NCCC(=O)N 269862a_100000740010_200000198059 [1,0,0,1,0,0|2,0,0]=4 15123 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 2230a_100000181395_100000210681 [1,0,0,1,0,0|2,0,0]=4 15124 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 269982a_100000181395_100000210681 [1,0,0,1,0,0|2,0,0]=4 15125 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 34a_100000181395_100000210614 [1,0,0,1,0,0|2,0,0]=4 15126 B16R1.3900 CCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210614 [1,0,0,1,0,0|1,0,0]=3 15127 B16R1.3900 CCCCCCCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210614 [1,0,0,1,0,0|2,0,0]=4 15128 B16R1.3900 CCCCCCCN1CCSCC1C(=O)O 269956a_100011346106_100000210614 [1,0,0,1,0,0|2,0,0]=4 15129 B16R1.3900 CCCCCCCN1CSCCC1C(=O)O 269956a_100015185162_100000210614 [1,0,0,1,0,0|2,0,0]=4 15130 B16R1.3900 CCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210757 [1,0,0,1,0,0|1,0,0]=3 15131 B16R1.3900 CCCCOCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000743108 [1,0,0,1,0,0|2,0,0]=4 15132 B16R1.3900 CCCCOCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011995733 [1,0,0,1,0,0|2,0,0]=4 15133 B16R1.3900 CCCOCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011215938 [1,0,0,1,0,0|2,0,0]=4 15134 B16R1.3900 CCOCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100012232248 [1,0,0,1,0,0|2,0,0]=4 15135 B16R1.3900 COCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000730899 [1,0,0,1,0,0|2,0,0]=4 15136 B16R1.3900 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCF 269956a_100009816435_100000729378 [1,0,0,1,0,0|2,0,0]=4 15137 B16R1.3900 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCO 269956a_100009816435_100000746330 [1,0,0,1,0,0|2,0,0]=4 15138 B16R1.3900 O=C(O)[C@H]1CCCCN1CCCCCCF 269956a_100000763471_100015922095 [1,0,0,1,0,0|2,0,0]=4 15139 B16R1.3900 O=C(O)[C@H]1CCCCN1CCCCCCO 269956a_100000763471_100000766143 [1,0,0,1,0,0|2,0,0]=4 15140 B16R1.5450 CCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210211 [1,0,0,1,0,0|1,0,0]=3 15141 B16R1.5450 CCOCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000739092 [1,0,0,1,0,0|2,0,0]=4 15142 B16R1.5450 COCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000233755 [1,0,0,1,0,0|2,0,0]=4 15143 B16R1.5450 CSCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000212216 [1,0,0,1,0,0|2,0,0]=4 15144 B16R1.5450 O=C(O)[C@H]1CCCCCC[C@H]1NCCCF 269956a_200049070474_100011934791 [1,0,0,1,0,0|2,0,0]=4 15145 B16R1.5450 O=C(O)[C@H]1CCCCCC[C@H]1NCCCO 269956a_200049070474_100011215043 [1,0,0,1,0,0|2,0,0]=4 15146 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210759 [1,0,0,1,0,0|2,0,0]=4 15147 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210759 [1,0,0,1,0,0|1,0,0]=3 15148 B16R1.6690 CCCCCCCCN1CCSC1C(=O)O 269956a_100000035718_100000210759 [1,0,0,1,0,0|2,0,0]=4 15149 B16R1.6690 CCCCCCCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210759 [1,0,0,1,0,0|2,0,0]=4 15150 B16R1.6690 CCCCCCOC[C@H]1CCCN1C(=O)C 34a_100012242843_100000210314 [1,0,0,1,0,0|2,0,0]=4 15151 B16R1.6690 CCCCCCOC[C@H]1CCCN1C(=O)C 7a_100012242843_100000210314 [1,0,0,1,0,0|2,0,0]=4 15152 B16R1.6690 COCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011998445 [1,0,0,1,0,0|2,0,0]=4 15153 B16R1.6690 O=C(O)[C@@H]1CCCN1CCCCCCCO 269956a_100000743916_100000760002 [1,0,0,1,0,0|2,0,0]=4 15154 B16R1.7037 CCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210757 [1,0,0,1,0,0|1,0,0]=3 15155 B16R1.7037 CCCCOCN1CCCCCC1C(=O)O 269956a_100000758484_100011995733 [1,0,0,1,0,0|2,0,0]=4 15156 B16R1.7037 CCCOCCN1CCCCCC1C(=O)O 269956a_100000758484_100011215938 [1,0,0,1,0,0|2,0,0]=4 15157 B16R1.7037 CCOCCCN1CCCCCC1C(=O)O 269956a_100000758484_100012232248 [1,0,0,1,0,0|2,0,0]=4 15158 B16R1.7037 COCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000730899 [1,0,0,1,0,0|2,0,0]=4 15159 B16R1.7037 O=C(O)C1CCCCCN1CCCCCF 269956a_100000758484_100000729378 [1,0,0,1,0,0|2,0,0]=4 15160 B16R1.7037 O=C(O)C1CCCCCN1CCCCCO 269956a_100000758484_100000746330 [1,0,0,1,0,0|2,0,0]=4 15161 B16R1.8377 CCCCCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210759 [1,0,0,1,0,0|2,0,0]=4 15162 B16R1.10873 CC(=O)C1CCCCCCCCCCC1=O 1458a_100000070787_200009990614 [1,0,0,1,0,0|1,0,1]=4 15163 B16R1.12272 CC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000735457 [1,0,0,1,0,0|1,0,0]=3 15164 B16R1.12272 CC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100009817362 [1,0,0,1,0,0|1,0,0]=3 15165 B16R1.12272 CC(=O)OCCCN1CCCCCCCC1 269982a_100000039187_100000042594 [1,0,0,1,0,0|2,0,0]=4 15166 B16R1.12272 CC(=O)OCCCN1CCCCCCCC1 34a_100000039187_100000042594 [1,0,0,1,0,0|2,0,0]=4 15167 B16R1.12272 CC(=O)SCCCN1CCCCCCCC1 2230a_100000039187_100000038929 [1,0,0,1,0,0|2,0,0]=4 15168 B16R1.12272 CC(=O)SCCCN1CCCCCCCC1 269982a_100000039187_100000038929 [1,0,0,1,0,0|2,0,0]=4 15169 B16R1.12272 CC(=O)SCCCN1CCCCCCCC1 34a_100000039187_100000038929 [1,0,0,1,0,0|2,0,0]=4 15170 B16R1.12272 CS(=O)CCCNC1CCCCCCCC1 270004a_200000753449_100000038600 [1,0,0,1,0,0|2,0,0]=4 15171 B16R1.12321 CC(=O)NCCCCCCNCC1CCC1 2230a_200011996284_100000763275 [1,0,0,1,0,0|2,0,0]=4 15172 B16R1.12321 CC(=O)NCCCCCCNCC1CCC1 269862a_200011996284_100000753134 [1,0,0,1,0,0|2,0,0]=4 15173 B16R1.12321 CC(=O)NCCCCCCNCC1CCC1 34a_200011996284_100000763275 [1,0,0,1,0,0|2,0,0]=4 15174 B16R1.12321 CC(=O)SCCCCCCNCC1CCC1 269862a_100000704104_100000753134 [1,0,0,1,0,0|2,0,0]=4 15175 B16R1.12354 C=C(C)CCNCCC1CCCCCCC1 2230a_100011532352_100000730704 [1,0,0,1,0,0|2,0,0]=4 15176 B16R1.12354 C=C(C)CCNCCC1CCCCCCC1 34a_100011532352_100000730704 [1,0,0,1,0,0|2,0,0]=4 15177 B16R1.12354 CC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100009817362 [1,0,0,1,0,0|1,0,0]=3 15178 B16R1.12354 CC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100009817362 [1,0,0,1,0,0|1,0,0]=3 15179 B16R1.12354 CC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000735457 [1,0,0,1,0,0|1,0,0]=3 15180 B16R1.12354 CC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000685027 [1,0,0,1,0,0|1,0,0]=3 15181 B16R1.12354 CC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011215641 [1,0,0,1,0,0|1,0,0]=3 15182 B16R1.12354 CC(=O)NCCCNC1CCCCCCC1 270004a_100000736810_100000210524 [1,0,0,1,0,0|2,0,0]=4 15183 B16R1.12354 CC(=O)NCCOCC1CCCCCCC1 7a_100011216312_100000189650 [1,0,0,1,0,0|2,0,0]=4 15184 B16R1.12354 CC(=O)OCCCCN1CCCCCCC1 269982a_100000211400_100000033659 [1,0,0,1,0,0|2,0,0]=4 15185 B16R1.12354 CC(=O)OCCCCN1CCCCCCC1 34a_100000211400_100000033659 [1,0,0,1,0,0|2,0,0]=4 15186 B16R1.12354 CC(=O)OCCCNC1CCCCCCC1 34a_100000211152_100000042594 [1,0,0,1,0,0|2,0,0]=4 15187 B16R1.12354 CC(=O)OCCCOC1CCCCCCC1 34a_100000210054_100000042594 [1,0,0,1,0,0|2,0,0]=4 15188 B16R1.12354 CC(=O)OCCCOC1CCCCCCC1 7a_100000210054_100000042594 [1,0,0,1,0,0|2,0,0]=4 15189 B16R1.12354 CC(=O)OCCOCC1CCCCCCC1 34a_100011216312_100009814007 [1,0,0,1,0,0|2,0,0]=4 15190 B16R1.12354 CC(=O)OCCOCC1CCCCCCC1 7a_100011216312_100009814007 [1,0,0,1,0,0|2,0,0]=4 15191 B16R1.12354 CC(=O)OCNCCC1CCCCCCC1 34a_100011532352_100009813279 [1,0,0,1,0,0|2,0,0]=4 15192 B16R1.12354 CC(=O)SCCCCN1CCCCCCC1 2230a_100000211400_200010402107 [1,0,0,1,0,0|2,0,0]=4 15193 B16R1.12354 CC(=O)SCCCCN1CCCCCCC1 269982a_100000211400_200010402107 [1,0,0,1,0,0|2,0,0]=4 15194 B16R1.12354 CC(=O)SCCCCN1CCCCCCC1 34a_100000211400_200010402107 [1,0,0,1,0,0|2,0,0]=4 15195 B16R1.12354 CC(=O)SCCCNC1CCCCCCC1 2230a_100000211152_100000038929 [1,0,0,1,0,0|2,0,0]=4 15196 B16R1.12354 CC(=O)SCCCNC1CCCCCCC1 34a_100000211152_100000038929 [1,0,0,1,0,0|2,0,0]=4 15197 B16R1.12354 CC(=O)SCCCOC1CCCCCCC1 34a_100000210054_100000038929 [1,0,0,1,0,0|2,0,0]=4 15198 B16R1.12354 CC(=O)SCCCOC1CCCCCCC1 7a_100000210054_100000038929 [1,0,0,1,0,0|2,0,0]=4 15199 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100009817443 [1,0,0,1,0,0|2,0,0]=4 15200 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100009817443 [1,0,0,1,0,0|2,0,0]=4 15201 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100009817443 [1,0,0,1,0,0|2,0,0]=4 15202 B16R1.12354 NC(=O)CCCCNC1CCCCCCC1 270004a_100000696515_100000210524 [1,0,0,1,0,0|2,0,0]=4 15203 B16R1.12354 NC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100102525003 [1,0,0,1,0,0|2,0,0]=4 15204 B16R1.12354 NC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100102525003 [1,0,0,1,0,0|2,0,0]=4 15205 B16R1.12354 NC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000744528 [1,0,0,1,0,0|2,0,0]=4 15206 B16R1.12354 NC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000731001 [1,0,0,1,0,0|2,0,0]=4 15207 B16R1.17540 CCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210670 [1,0,0,1,0,0|1,0,0]=3 15208 B16R1.17540 O=C(O)C1CCN1CCCCCCCCO 269956a_100000021838_100000033203 [1,0,0,1,0,0|2,0,0]=4 15209 B16R1.18063 CC(=O)NCCCCCCNCCC1CC1 2230a_200011996284_100000694398 [1,0,0,1,0,0|2,0,0]=4 15210 B16R1.18063 CC(=O)NCCCCCCNCCC1CC1 34a_200011996284_100000694398 [1,0,0,1,0,0|2,0,0]=4 15211 B16R1.18095 CC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100009817362 [1,0,0,1,0,0|1,0,0]=3 15212 B16R1.18095 CC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100009817362 [1,0,0,1,0,0|1,0,0]=3 15213 B16R1.18095 CC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000735457 [1,0,0,1,0,0|1,0,0]=3 15214 B16R1.18095 CC(=O)CCCCSCC1CCCCCC1 62a_100000735457_200000696569 [1,0,0,1,0,0|1,0,0]=3 15215 B16R1.18095 CC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000735457 [1,0,0,1,0,0|1,0,0]=3 15216 B16R1.18095 CC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000685027 [1,0,0,1,0,0|1,0,0]=3 15217 B16R1.18095 CC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100000685027 [1,0,0,1,0,0|2,0,0]=4 15218 B16R1.18095 CC(=O)CCCOCCN1CCCCCC1 7a_100000759063_100000722644 [1,0,0,1,0,0|2,0,0]=4 15219 B16R1.18095 CC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100011215641 [1,0,0,1,0,0|2,0,0]=4 15220 B16R1.18095 CC(=O)CCCSCCN1CCCCCC1 62a_100011215641_100000722644 [1,0,0,1,0,0|2,0,0]=4 15221 B16R1.18095 CC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000053229 [1,0,0,1,0,0|2,0,0]=4 15222 B16R1.18095 CC(=O)NCCCCNC1CCCCCC1 270004a_200011368371_100000210131 [1,0,0,1,0,0|2,0,0]=4 15223 B16R1.18095 CC(=O)NCCCCNC1CCCCCC1 34a_200011368371_100011217769 [1,0,0,1,0,0|2,0,0]=4 15224 B16R1.18095 CC(=O)NCCCNCC1CCCCCC1 269862a_100000736810_200000763224 [1,0,0,1,0,0|2,0,0]=4 15225 B16R1.18095 CC(=O)NCCCNCC1CCCCCC1 34a_100000736810_200000696569 [1,0,0,1,0,0|2,0,0]=4 15226 B16R1.18095 CC(=O)NCCCOCC1CCCCCC1 34a_100000752032_200000696569 [1,0,0,1,0,0|2,0,0]=4 15227 B16R1.18095 CC(=O)NCCNCCC1CCCCCC1 2230a_100011532351_100000189650 [1,0,0,1,0,0|2,0,0]=4 15228 B16R1.18095 CC(=O)OCCCCCN1CCCCCC1 2230a_100000185865_100009813381 [1,0,0,1,0,0|2,0,0]=4 15229 B16R1.18095 CC(=O)OCCCCCN1CCCCCC1 269982a_100000185865_100000033007 [1,0,0,1,0,0|2,0,0]=4 15230 B16R1.18095 CC(=O)OCCCCCN1CCCCCC1 34a_100000185865_100000033007 [1,0,0,1,0,0|2,0,0]=4 15231 B16R1.18095 CC(=O)OCCCCNC1CCCCCC1 34a_100000210984_100000033659 [1,0,0,1,0,0|2,0,0]=4 15232 B16R1.18095 CC(=O)OCCCCOC1CCCCCC1 34a_100000073216_100011217769 [1,0,0,1,0,0|2,0,0]=4 15233 B16R1.18095 CC(=O)OCCCCOC1CCCCCC1 34a_100000210887_100000033659 [1,0,0,1,0,0|2,0,0]=4 15234 B16R1.18095 CC(=O)OCCCCOC1CCCCCC1 7a_100000210887_100000033659 [1,0,0,1,0,0|2,0,0]=4 15235 B16R1.18095 CC(=O)OCCCCSC1CCCCCC1 62a_100000033659_100011217769 [1,0,0,1,0,0|2,0,0]=4 15236 B16R1.18095 CC(=O)OCCCCSC1CCCCCC1 62a_100011217769_100000033659 [1,0,0,1,0,0|2,0,0]=4 15237 B16R1.18095 CC(=O)OCCCNCC1CCCCCC1 34a_100015204231_100000042594 [1,0,0,1,0,0|2,0,0]=4 15238 B16R1.18095 CC(=O)OCCCOCC1CCCCCC1 34a_100000699130_100000042594 [1,0,0,1,0,0|2,0,0]=4 15239 B16R1.18095 CC(=O)OCCCOCC1CCCCCC1 7a_100000699130_100000042594 [1,0,0,1,0,0|2,0,0]=4 15240 B16R1.18095 CC(=O)OCCCSCC1CCCCCC1 62a_100000042594_200000696569 [1,0,0,1,0,0|2,0,0]=4 15241 B16R1.18095 CC(=O)OCCCSCC1CCCCCC1 62a_200000696569_100000042594 [1,0,0,1,0,0|2,0,0]=4 15242 B16R1.18095 CC(=O)OCCNCCC1CCCCCC1 34a_100011532351_100009814007 [1,0,0,1,0,0|2,0,0]=4 15243 B16R1.18095 CC(=O)SCCCCNC1CCCCCC1 2230a_100000210984_200010402107 [1,0,0,1,0,0|2,0,0]=4 15244 B16R1.18095 CC(=O)SCCCCNC1CCCCCC1 34a_100000210984_200010402107 [1,0,0,1,0,0|2,0,0]=4 15245 B16R1.18095 CC(=O)SCCCCOC1CCCCCC1 34a_100000210887_200010402107 [1,0,0,1,0,0|2,0,0]=4 15246 B16R1.18095 CC(=O)SCCCCOC1CCCCCC1 7a_100000210887_200010402107 [1,0,0,1,0,0|2,0,0]=4 15247 B16R1.18095 CC(=O)SCCCCSC1CCCCCC1 62a_100011217769_200010402107 [1,0,0,1,0,0|2,0,0]=4 15248 B16R1.18095 CC(=O)SCCCCSC1CCCCCC1 62a_200010402107_100011217769 [1,0,0,1,0,0|2,0,0]=4 15249 B16R1.18095 CC(=O)SCCCNCC1CCCCCC1 2230a_100015204231_100000038929 [1,0,0,1,0,0|2,0,0]=4 15250 B16R1.18095 CC(=O)SCCCNCC1CCCCCC1 34a_100015204231_100000038929 [1,0,0,1,0,0|2,0,0]=4 15251 B16R1.18095 CC(=O)SCCCOCC1CCCCCC1 34a_100000699130_100000038929 [1,0,0,1,0,0|2,0,0]=4 15252 B16R1.18095 CC(=O)SCCCOCC1CCCCCC1 7a_100000699130_100000038929 [1,0,0,1,0,0|2,0,0]=4 15253 B16R1.18095 CC(=O)SCCCSCC1CCCCCC1 62a_100000038929_200000696569 [1,0,0,1,0,0|2,0,0]=4 15254 B16R1.18095 CC(=O)SCCCSCC1CCCCCC1 62a_200000696569_100000038929 [1,0,0,1,0,0|2,0,0]=4 15255 B16R1.18095 NC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100009817443 [1,0,0,1,0,0|2,0,0]=4 15256 B16R1.18095 NC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100009817443 [1,0,0,1,0,0|2,0,0]=4 15257 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 34a_100000123541_100011217769 [1,0,0,1,0,0|2,0,0]=4 15258 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100009817443 [1,0,0,1,0,0|2,0,0]=4 15259 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100009817443 [1,0,0,1,0,0|2,0,0]=4 15260 B16R1.18095 NC(=O)CCCCCSC1CCCCCC1 62a_100009817443_100011217769 [1,0,0,1,0,0|2,0,0]=4 15261 B16R1.18095 NC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100009817443 [1,0,0,1,0,0|2,0,0]=4 15262 B16R1.18095 NC(=O)CCCCNCC1CCCCCC1 269862a_100000696515_200000763224 [1,0,0,1,0,0|2,0,0]=4 15263 B16R1.18095 NC(=O)CCCCNCC1CCCCCC1 34a_100000696515_200000696569 [1,0,0,1,0,0|2,0,0]=4 15264 B16R1.18095 NC(=O)CCCCOCC1CCCCCC1 34a_100012022536_200000696569 [1,0,0,1,0,0|2,0,0]=4 15265 B16R1.18095 NC(=O)CCCCOCC1CCCCCC1 7a_100012022536_200000696569 [1,0,0,1,0,0|2,0,0]=4 15266 B16R1.18095 NC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100102525003 [1,0,0,1,0,0|2,0,0]=4 15267 B16R1.18095 O=C(O)COCCNCC1CCCCCC1 269956a_100000700818_200000696569 [1,0,0,1,0,0|2,0,0]=4 15268 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100015343762 [1,0,0,1,0,0|1,0,0]=3 15269 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100015343762 [1,0,0,1,0,0|1,0,0]=3 15270 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100015343762 [1,0,0,1,0,0|1,0,0]=3 15271 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100103153847 [1,0,0,1,0,0|1,0,0]=3 15272 B18R1.1133 CCCCCCCC(C)OCC1CCC(=O)CC1 34a_100000062911_200011218727 [0,1,0,1,0,0|2,0,0]=4 15273 B18R1.1221 COC(=O)CCCCCC(=O)CCC1CCCC1 1458a_100000211120_100009816466 [0,1,0,1,0,0|0,0,1]=3 15274 B18R1.1221 COC(=O)CCCCCC(=O)CCC1CCCC1 1458a_100009848860_100000760354 [0,1,0,1,0,0|0,0,1]=3 15275 B18R1.1221 COC(=O)CCCCCC(=O)CCC1CCCO1 1458a_100011247709_100009816466 [0,1,0,1,0,0|1,0,1]=4 15276 B18R1.1221 COC(=O)CCCCCC(=O)CCN1CCCC1 1458a_100000738983_100009816466 [0,1,0,1,0,0|1,0,1]=4 15277 B18R1.1221 COC(=O)CCCCCC(=O)CCN1CCCC1 1458a_100009848860_100000004467 [0,1,0,1,0,0|1,0,1]=4 15278 B18R1.1221 COC(=O)CCCCCC(=O)COC1CCCC1 1458a_100000741352_100009816466 [0,1,0,1,0,0|1,0,1]=4 15279 B18R1.1221 COC(=O)CCCCCC(=O)NCC1CCCC1 11a_100000737975_100009848860 [0,1,0,1,0,0|1,0,1]=4 15280 B18R1.1221 COC(=O)CCCCCC(=O)NCC1CCCC1 1626a_100000737975_100009848860 [0,1,0,1,0,0|1,0,1]=4 15281 B18R1.1221 COC(=O)CCCCCC(=O)NCC1CCCC1 240690a_100000737975_100009848860 [0,1,0,1,0,0|1,0,1]=4 15282 B18R1.1221 COC(=O)CCCCCN(C)CCN1CCCC1 2230a_100000225677_100009816466 [0,1,0,1,0,0|2,0,0]=4 15283 B18R1.1221 COC(=O)CCCCCN(C)CCN1CCCC1 269982a_100000225677_100009816466 [0,1,0,1,0,0|2,0,0]=4 15284 B18R1.1221 COC(=O)CCCCNC(=O)CCC1CCCC1 188690a_100000746077_100000211120 [0,1,0,1,0,0|1,0,1]=4 15285 B18R1.4089 CCCCCCCN1CC[C@H](C1)OCC(=O)OC 2230a_100102564761_100000210681 [0,1,0,1,0,0|2,0,0]=4 15286 B18R1.4089 CCCCCCCN1CC[C@H](C1)OCC(=O)OC 269982a_100102564761_100000210681 [0,1,0,1,0,0|2,0,0]=4 15287 B18R1.4108 CCCCCCCN1CCCC(C1)CC(=O)OC 2230a_100016989293_100000210681 [0,1,0,1,0,0|1,0,0]=3 15288 B18R1.4108 CCCCCCCN1CCCC(C1)CC(=O)OC 269982a_100016989293_100000210681 [0,1,0,1,0,0|1,0,0]=3 15289 B18R1.4108 CCCCCCCN1CCOC(C1)CC(=O)OC 2230a_100000684468_100000210681 [0,1,0,1,0,0|2,0,0]=4 15290 B18R1.4108 CCCCCCCN1CCOC(C1)CC(=O)OC 269982a_100000684468_100000210681 [0,1,0,1,0,0|2,0,0]=4 15291 B18R1.4108 CCCCCCOC1CCCC(C1)CC(=O)OC 7a_200010992784_100000210314 [0,1,0,1,0,0|1,0,0]=3 15292 B18R1.4108 CCCCOCCN1CCCC(C1)CC(=O)OC 2230a_100016989293_100000743108 [0,1,0,1,0,0|2,0,0]=4 15293 B18R1.4108 CCCCOCCN1CCCC(C1)CC(=O)OC 269982a_100016989293_100000743108 [0,1,0,1,0,0|2,0,0]=4 15294 B18R1.4108 CCCOCCOC1CCCC(C1)CC(=O)OC 7a_200010992784_100011215938 [0,1,0,1,0,0|2,0,0]=4 15295 B18R1.4108 CCOCCCOC1CCCC(C1)CC(=O)OC 7a_200010992784_100012232248 [0,1,0,1,0,0|2,0,0]=4 15296 B18R1.4108 COC(=O)CC1CCCC(C1)OCCCCCF 7a_200010992784_100000729378 [0,1,0,1,0,0|2,0,0]=4 15297 B18R1.4108 COC(=O)CC1CCCC(C1)OCCCCCO 7a_200010992784_100000746330 [0,1,0,1,0,0|2,0,0]=4 15298 B18R1.4108 COC(=O)CC1CCCN(C1)CCCCCCF 2230a_100016989293_100015922095 [0,1,0,1,0,0|2,0,0]=4 15299 B18R1.4108 COC(=O)CC1CCCN(C1)CCCCCCF 269982a_100016989293_100015922095 [0,1,0,1,0,0|2,0,0]=4 15300 B18R1.4108 COC(=O)CC1CCCN(C1)CCCCCCO 2230a_100016989293_100000766143 [0,1,0,1,0,0|2,0,0]=4 15301 B18R1.4108 COC(=O)CC1CCCN(C1)CCCCCCO 269982a_100016989293_100000766143 [0,1,0,1,0,0|2,0,0]=4 15302 B18R1.4108 COCCCCOC1CCCC(C1)CC(=O)OC 7a_200010992784_100000730899 [0,1,0,1,0,0|2,0,0]=4 15303 B18R1.4856 CNC(=O)CCCOC[C@@H](N)CC1CCCCC1 34a_100015184289_100000741757 [0,1,0,1,0,0|2,0,0]=4 15304 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCCCC1 1458a_100000211666_100009816466 [0,1,0,1,0,0|0,0,1]=3 15305 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCCCC1 1458a_100009848860_100000211423 [0,1,0,1,0,0|0,0,1]=3 15306 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCCCO1 1458a_100000238585_100009816466 [0,1,0,1,0,0|1,0,1]=4 15307 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCCCO1 1458a_100009848860_100000211543 [0,1,0,1,0,0|1,0,1]=4 15308 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCCOC1 1458a_100000741523_100009816466 [0,1,0,1,0,0|1,0,1]=4 15309 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCCOC1 1458a_100009848860_100000741521 [0,1,0,1,0,0|1,0,1]=4 15310 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCOCC1 1458a_100000757261_100009816466 [0,1,0,1,0,0|1,0,1]=4 15311 B18R1.4856 COC(=O)CCCCCC(=O)CC1CCOCC1 1458a_100009848860_100000754603 [0,1,0,1,0,0|1,0,1]=4 15312 B18R1.4856 COC(=O)CCCCCC(=O)CN1CCCCC1 1458a_100000740322_100009816466 [0,1,0,1,0,0|1,0,1]=4 15313 B18R1.4856 COC(=O)CCCCCC(=O)NC1CCCCC1 11a_100000182618_100009848860 [0,1,0,1,0,0|1,0,1]=4 15314 B18R1.4856 COC(=O)CCCCCC(=O)NC1CCCCC1 1626a_100000182618_100009848860 [0,1,0,1,0,0|1,0,1]=4 15315 B18R1.4856 COC(=O)CCCCCC(=O)NC1CCCCC1 240690a_100000182618_100009848860 [0,1,0,1,0,0|1,0,1]=4 15316 B18R1.4856 COC(=O)CCCCCN(C)CC1CCCCC1 2230a_100000736448_100009816466 [0,1,0,1,0,0|1,0,0]=3 15317 B18R1.4856 COC(=O)CCCCCN(C)CC1CCCCC1 269982a_100000736448_100009816466 [0,1,0,1,0,0|1,0,0]=3 15318 B18R1.4856 COC(=O)CCCCCN(C)CC1CCCCC1 34a_100000736448_100009816466 [0,1,0,1,0,0|1,0,0]=3 15319 B18R1.4856 COC(=O)CCCCCN(C)CC1CCCCO1 2230a_100000225654_100009816466 [0,1,0,1,0,0|2,0,0]=4 15320 B18R1.4856 COC(=O)CCCCCN(C)CC1CCCCO1 269982a_100000225654_100009816466 [0,1,0,1,0,0|2,0,0]=4 15321 B18R1.4856 COC(=O)CCCCCN(C)CC1CCCCO1 34a_100000225654_100009816466 [0,1,0,1,0,0|2,0,0]=4 15322 B18R1.4856 COC(=O)CCCCCN(C)CC1CCOCC1 2230a_100025706683_100009816466 [0,1,0,1,0,0|2,0,0]=4 15323 B18R1.4856 COC(=O)CCCCCN(C)CC1CCOCC1 269982a_100025706683_100009816466 [0,1,0,1,0,0|2,0,0]=4 15324 B18R1.4856 COC(=O)CCCCCN(C)CC1CCOCC1 34a_100025706683_100009816466 [0,1,0,1,0,0|2,0,0]=4 15325 B18R1.4856 COC(=O)CCCCCN(C)CC1CCSCC1 2230a_100011935259_100009816466 [0,1,0,1,0,0|2,0,0]=4 15326 B18R1.4856 COC(=O)CCCCCN(C)CC1CCSCC1 269982a_100011935259_100009816466 [0,1,0,1,0,0|2,0,0]=4 15327 B18R1.4856 COC(=O)CCCCCN(C)CC1CCSCC1 34a_100011935259_100009816466 [0,1,0,1,0,0|2,0,0]=4 15328 B18R1.4856 COC(=O)CCCCNC(=O)CC1CCCCC1 188690a_100000746077_100000211666 [0,1,0,1,0,0|1,0,1]=4 15329 B18R1.4856 COC(=O)CCCCNC(C)CN1CCCCC1 2230a_100000738326_100000204269 [0,1,0,1,0,0|2,0,0]=4 15330 B18R1.4856 COC(=O)CCCCSC(C)CN1CCCCC1 62a_100000204269_100009831500 [0,1,0,1,0,0|2,0,0]=4 15331 B18R1.4856 COC(=O)CCCCSC(C)CN1CCCCC1 62a_100009831500_100000204269 [0,1,0,1,0,0|2,0,0]=4 15332 B18R1.4856 COC(=O)CCCNC[C@H](O)CN1CCCCC1 2230a_100015205997_100011218270 [0,1,0,1,0,0|2,0,0]=4 15333 B18R1.4856 COC(=O)CCCOCC(C)CN1CCCCC1 34a_200011934647_100000742333 [0,1,0,1,0,0|2,0,0]=4 15334 B18R1.4856 COC(=O)CCCOC[C@@H](N)CC1CCCCC1 34a_100015184289_100000742333 [0,1,0,1,0,0|1,0,0]=3 15335 B18R1.7761 CCC1CCCN1C(=O)CCCCCC(=O)OC 11a_100000754278_100009848860 [0,1,0,1,0,0|1,0,1]=4 15336 B18R1.7761 CCC1CCCN1C(=O)CCCCCC(=O)OC 1626a_100000754278_100009848860 [0,1,0,1,0,0|1,0,1]=4 15337 B18R1.7761 CCC1CCCN1C(=O)CCCCCC(=O)OC 240690a_100000754278_100009848860 [0,1,0,1,0,0|1,0,1]=4 15338 B18R1.7761 CCN1CCCC1C(=O)CCCCCC(=O)OC 1458a_106256033941_100009816466 [0,1,0,1,0,0|1,0,1]=4 15339 B18R1.10583 CCCCCCCC(=O)N1CCC[C@H]1C(=O)OC 11a_100000752040_100000211969 [0,1,0,1,0,0|1,0,1]=4 15340 B18R1.10583 CCCCCCCC(=O)N1CCC[C@H]1C(=O)OC 1626a_100000752040_100000211969 [0,1,0,1,0,0|1,0,1]=4 15341 B18R1.10583 CCCCCCCC(=O)N1CCC[C@H]1C(=O)OC 240690a_100000752040_100000211969 [0,1,0,1,0,0|1,0,1]=4 15342 B18R1.10583 CCCCCCCC(=O)N1CCC[C@H]1C(=O)OC 527a_100000752040_100000211969 [0,1,0,1,0,0|1,0,1]=4 15343 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)NC 2230a_100015185040_200011218727 [0,1,0,1,0,0|2,0,0]=4 15344 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)NC 269982a_100015185040_200011218727 [0,1,0,1,0,0|2,0,0]=4 15345 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)NC 270004a_100015185040_100000210596 [0,1,0,1,0,0|2,0,0]=4 15346 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)NC 34a_100015185040_200011218727 [0,1,0,1,0,0|2,0,0]=4 15347 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)OC 2230a_100000752040_200011218727 [0,1,0,1,0,0|1,0,0]=3 15348 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)OC 269982a_100000752040_200011218727 [0,1,0,1,0,0|1,0,0]=3 15349 B18R1.10583 CCCCCCCC(C)N1CCC[C@H]1C(=O)OC 270004a_100000752040_100000210596 [0,1,0,1,0,0|1,0,0]=3 15350 B18R1.10583 CCCCCCCC(C)N1CCSC1C(=O)OC 2230a_100015296106_200011218727 [0,1,0,1,0,0|2,0,0]=4 15351 B18R1.10583 CCCCCCCC(C)N1CCSC1C(=O)OC 269982a_100015296106_200011218727 [0,1,0,1,0,0|2,0,0]=4 15352 B18R1.10583 CCCCCCCC(C)N1CCSC1C(=O)OC 270004a_100015296106_100000210596 [0,1,0,1,0,0|2,0,0]=4 15353 B18R1.10583 CCCCCCCC(C)N1CSCC1C(=O)OC 269982a_200000724679_200011218727 [0,1,0,1,0,0|2,0,0]=4 15354 B18R1.10583 CCCCCCCC(C)N1CSCC1C(=O)OC 270004a_200000724679_100000210596 [0,1,0,1,0,0|2,0,0]=4 15355 B18R1.23136 CCCN1CCCC(C1)NCCCCC(=O)OC 2230a_100011435248_100000204269 [0,1,0,1,0,0|2,0,0]=4 15356 B18R1.23136 CCOC1CCCN(C1)CCCCCC(=O)OC 2230a_100000745229_100009816466 [0,1,0,1,0,0|2,0,0]=4 15357 B18R1.23136 CCOC1CCCN(C1)CCCCCC(=O)OC 269982a_100000745229_100009816466 [0,1,0,1,0,0|2,0,0]=4 15358 B18R1.23136 CCOC1CCCN(C1)CCCCCC(=O)OC 34a_100000745229_100009816466 [0,1,0,1,0,0|2,0,0]=4 15359 B18R1.23136 COC(=O)CCCCCN1CCCC(C1)CCO 2230a_100000752241_100009816466 [0,1,0,1,0,0|2,0,0]=4 15360 B18R1.23136 COC(=O)CCCCCN1CCCC(C1)CCO 269982a_100000752241_100009816466 [0,1,0,1,0,0|2,0,0]=4 15361 B18R1.23136 COC(=O)CCCCCN1CCCC(C1)CCO 34a_100000752241_100009816466 [0,1,0,1,0,0|2,0,0]=4 15362 B18R1.23136 COCC1CCCN(C1)CCCCCC(=O)OC 2230a_100000755410_100009816466 [0,1,0,1,0,0|2,0,0]=4 15363 B18R1.23136 COCC1CCCN(C1)CCCCCC(=O)OC 269982a_100000755410_100009816466 [0,1,0,1,0,0|2,0,0]=4 15364 B18R1.23136 COCC1CCCN(C1)CCCCCC(=O)OC 34a_100000755410_100009816466 [0,1,0,1,0,0|2,0,0]=4 15365 B18R1.33712 COC(=O)CCCCCN1CCCCCCCC1 2230a_100000039187_100009816466 [0,1,0,1,0,0|0,0,0]=2 15366 B18R1.33712 COC(=O)CCCCCN1CCCCCCCC1 269982a_100000039187_100009816466 [0,1,0,1,0,0|0,0,0]=2 15367 B18R1.33712 COC(=O)CCCCCN1CCCCCCCC1 34a_100000039187_100009816466 [0,1,0,1,0,0|0,0,0]=2 15368 B18R1.34439 COC(=O)CCCCCC(=O)C1CCCCC1C 1458a_100011215568_100009816466 [0,1,0,1,0,0|0,0,1]=3 15369 B18R1.34439 COC(=O)CCCCCC(=O)C1CCCCC1O 1458a_100011803323_100009816466 [0,1,0,1,0,0|1,0,1]=4 15370 B18R1.34439 COC(=O)CCCCCC(=O)N1CCCCC1C 11a_100000211376_100009848860 [0,1,0,1,0,0|1,0,1]=4 15371 B18R1.34439 COC(=O)CCCCCC(=O)N1CCCCC1C 1626a_100000211376_100009848860 [0,1,0,1,0,0|1,0,1]=4 15372 B18R1.34439 COC(=O)CCCCCC(=O)N1CCCCC1C 240690a_100000211376_100009848860 [0,1,0,1,0,0|1,0,1]=4 15373 B18R1.34439 COC(=O)CCCCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100009816466 [0,1,0,1,0,0|1,0,1]=4 15374 B18R1.34439 COC(=O)CCCCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100009816466 [0,1,0,1,0,0|2,0,0]=4 15375 B18R1.34439 COC(=O)CCCCNC(=O)C1CCCCC1C 188690a_100000746077_100011215568 [0,1,0,1,0,0|1,0,1]=4 15376 B18R1.34439 COC(=O)CCCOCC(C)N1CCCCC1C 34a_200011934825_100000742333 [0,1,0,1,0,0|2,0,0]=4 15377 B18R1.34439 COC(=O)CCCOCC(C)N1CCCCC1C 7a_200011934825_100011218270 [0,1,0,1,0,0|2,0,0]=4 15378 B18R1.247546 COC(=O)CCCCCC(=O)C1CCCCCC1 1458a_100000749507_100009816466 [0,1,0,1,0,0|0,0,1]=3 15379 B18R1.247546 COC(=O)CCCCCC(=O)C1CCCCCC1 1458a_100009848860_100011217769 [0,1,0,1,0,0|0,0,1]=3 15380 B18R1.247546 COC(=O)CCCCCC(=O)N1CCCCCC1 11a_100000185865_100009848860 [0,1,0,1,0,0|1,0,1]=4 15381 B18R1.247546 COC(=O)CCCCCC(=O)N1CCCCCC1 1626a_100000185865_100009848860 [0,1,0,1,0,0|1,0,1]=4 15382 B18R1.247546 COC(=O)CCCCCC(=O)N1CCCCCC1 240690a_100000185865_100009848860 [0,1,0,1,0,0|1,0,1]=4 15383 B18R1.247546 COC(=O)CCCCCN(C)C1CCCCCC1 2230a_100015185097_100009816466 [0,1,0,1,0,0|1,0,0]=3 15384 B18R1.247546 COC(=O)CCCCCN(C)C1CCCCCC1 269982a_100015185097_100009816466 [0,1,0,1,0,0|1,0,0]=3 15385 B18R1.247546 COC(=O)CCCCCN(C)C1CCCCCC1 34a_100015185097_100009816466 [0,1,0,1,0,0|1,0,0]=3 15386 B18R1.247546 COC(=O)CCCCNC(=O)C1CCCCCC1 188690a_100000746077_100000749507 [0,1,0,1,0,0|1,0,1]=4 15387 B18R1.1122 CCCOC1CCCN(C1)CCCCC(=O)OC 2230a_100000743837_100000204269 [0,1,0,1,0,0|2,0,0]=4 15388 B18R1.1122 CCCOC1CCCN(C1)CCCCC(=O)OC 269982a_100000743837_100000204269 [0,1,0,1,0,0|2,0,0]=4 15389 B18R1.1122 CCCOC1CCCN(C1)CCCCC(=O)OC 34a_100000743837_100000204269 [0,1,0,1,0,0|2,0,0]=4 15390 B18R1.1122 COC(=O)CCCCN1CCCC(C1)CCCO 2230a_100150707839_100000204269 [0,1,0,1,0,0|2,0,0]=4 15391 B18R1.1122 COC(=O)CCCCN1CCCC(C1)CCCO 269982a_100150707839_100000204269 [0,1,0,1,0,0|2,0,0]=4 15392 B18R1.1122 COC(=O)CCCCN1CCCC(C1)CCCO 34a_100150707839_100000204269 [0,1,0,1,0,0|2,0,0]=4 15393 B18R1.1122 COCCC1CCCN(C1)CCCCC(=O)OC 2230a_100011653411_100000204269 [0,1,0,1,0,0|2,0,0]=4 15394 B18R1.1122 COCCC1CCCN(C1)CCCCC(=O)OC 269982a_100011653411_100000204269 [0,1,0,1,0,0|2,0,0]=4 15395 B18R1.1122 COCCC1CCCN(C1)CCCCC(=O)OC 34a_100011653411_100000204269 [0,1,0,1,0,0|2,0,0]=4 15396 B18R1.1136 CCCCCCCCC(C)NC1CCC(=O)NC1 270004a_100000748762_100011216694 [0,1,0,1,0,0|2,0,0]=4 15397 B18R1.1271 CCCOCC1CCN(C1)CCCCC(=O)OC 2230a_200011652792_100000204269 [0,1,0,1,0,0|2,0,0]=4 15398 B18R1.1271 CCCOCC1CCN(C1)CCCCC(=O)OC 269982a_200011652792_100000204269 [0,1,0,1,0,0|2,0,0]=4 15399 B18R1.1271 CCCOCC1CCN(C1)CCCCC(=O)OC 34a_200011652792_100000204269 [0,1,0,1,0,0|2,0,0]=4 15400 B18R1.1305 CCCCCCCCC(C)COC1COC(=O)O1 34a_200012125181_100000032252 [0,1,0,1,0,0|2,0,0]=4 15401 B18R1.1305 CCCCCCCCC(C)OCC1COC(=O)O1 34a_100000210740_100000073702 [0,1,0,1,0,0|2,0,0]=4 15402 B18R1.1305 CCCCCCCCC(C)OC[C@H]1COC(=O)N1 34a_100000210740_100015307671 [0,1,0,1,0,0|2,0,0]=4 15403 B18R1.1305 CCCCCCCCC(C)OC[C@H]1COC(=O)N1 7a_100000210740_100015307671 [0,1,0,1,0,0|2,0,0]=4 15404 B18R1.4851 COC(=O)CCCCC(=O)CCC1CCCCC1 1458a_100000211375_100000204269 [0,1,0,1,0,0|0,0,1]=3 15405 B18R1.4851 COC(=O)CCCCC(=O)CCC1CCCCC1 1458a_100000695723_100011273959 [0,1,0,1,0,0|0,0,1]=3 15406 B18R1.4851 COC(=O)CCCCC(=O)CCC1CCOCC1 1458a_100000695723_100011934994 [0,1,0,1,0,0|1,0,1]=4 15407 B18R1.4851 COC(=O)CCCCC(=O)CCN1CCCCC1 1458a_100000695723_100000739454 [0,1,0,1,0,0|1,0,1]=4 15408 B18R1.4851 COC(=O)CCCCC(=O)CCN1CCCCC1 1458a_100000743487_100000204269 [0,1,0,1,0,0|1,0,1]=4 15409 B18R1.4851 COC(=O)CCCCC(=O)COC1CCCCC1 1458a_100000695723_100011935260 [0,1,0,1,0,0|1,0,1]=4 15410 B18R1.4851 COC(=O)CCCCC(=O)COC1CCCCC1 1458a_100011223303_100000204269 [0,1,0,1,0,0|1,0,1]=4 15411 B18R1.4851 COC(=O)CCCCC(=O)NCC1CCCCC1 11a_100000210473_100000695723 [0,1,0,1,0,0|1,0,1]=4 15412 B18R1.4851 COC(=O)CCCCC(=O)NCC1CCCCC1 1626a_100000210473_100000695723 [0,1,0,1,0,0|1,0,1]=4 15413 B18R1.4851 COC(=O)CCCCC(=O)NCC1CCCCC1 240690a_100000210473_100000695723 [0,1,0,1,0,0|1,0,1]=4 15414 B18R1.4851 COC(=O)CCCCC(=O)NCC1CCCCC1 527a_100000210473_100000695723 [0,1,0,1,0,0|1,0,1]=4 15415 B18R1.4851 COC(=O)CCCCN(C)CCC1CCCCO1 2230a_100015183322_100000204269 [0,1,0,1,0,0|2,0,0]=4 15416 B18R1.4851 COC(=O)CCCCN(C)CCC1CCCCO1 269982a_100015183322_100000204269 [0,1,0,1,0,0|2,0,0]=4 15417 B18R1.4851 COC(=O)CCCCN(C)CCC1CCCCO1 34a_100015183322_100000204269 [0,1,0,1,0,0|2,0,0]=4 15418 B18R1.4851 COC(=O)CCCNC(=O)CCC1CCCCC1 188690a_100000184769_100000211375 [0,1,0,1,0,0|1,0,1]=4 15419 B18R1.4851 COC(=O)CCCOC(C)CNC1CCCCC1 34a_100000202029_100000742333 [0,1,0,1,0,0|2,0,0]=4 15420 B18R1.4851 COC(=O)COCCC(=O)CCC1CCCCC1 1458a_100000211375_100000090808 [0,1,0,1,0,0|1,0,1]=4 15421 B18R1.4851 COC(=O)NCCCC(=O)CCC1CCCCC1 1458a_100000753017_100011273959 [0,1,0,1,0,0|1,0,1]=4 15422 B18R1.7248 CCC1CCCCN1C(=O)CCCCC(=O)OC 11a_100000210034_100000695723 [0,1,0,1,0,0|1,0,1]=4 15423 B18R1.7248 CCC1CCCCN1C(=O)CCCCC(=O)OC 1626a_100000210034_100000695723 [0,1,0,1,0,0|1,0,1]=4 15424 B18R1.7248 CCC1CCCCN1C(=O)CCCCC(=O)OC 240690a_100000210034_100000695723 [0,1,0,1,0,0|1,0,1]=4 15425 B18R1.7248 CCC1CCCCN1C(=O)CCCCC(=O)OC 527a_100000210034_100000695723 [0,1,0,1,0,0|1,0,1]=4 15426 B18R1.7248 CCN1CCCCC1C(=O)CCCCC(=O)OC 1458a_100000743832_100000204269 [0,1,0,1,0,0|1,0,1]=4 15427 B18R1.7832 CCCCCCCCC(C)OCCC1CCC1=O 7a_100000210740_200016118888 [0,1,0,1,0,0|2,0,0]=4 15428 B18R1.8741 CCCCCCCCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100000210759 [0,1,0,1,0,0|1,0,0]=3 15429 B18R1.8741 CCCCCCCCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100000210759 [0,1,0,1,0,0|1,0,0]=3 15430 B18R1.8741 COC(=O)C[C@H]1CCN(C1)CCCCCCCO 2230a_100020634416_100000760002 [0,1,0,1,0,0|2,0,0]=4 15431 B18R1.8741 COC(=O)C[C@H]1CCN(C1)CCCCCCCO 269982a_100020634416_100000760002 [0,1,0,1,0,0|2,0,0]=4 15432 B18R1.8741 COCCCCCCN1CC[C@@H](C1)CC(=O)OC 2230a_100020634416_100011998445 [0,1,0,1,0,0|2,0,0]=4 15433 B18R1.8741 COCCCCCCN1CC[C@@H](C1)CC(=O)OC 269982a_100020634416_100011998445 [0,1,0,1,0,0|2,0,0]=4 15434 B18R1.33576 COC(=O)CCCCC(=O)CCCC1CCCC1 1458a_100000695723_100011713738 [0,1,0,1,0,0|0,0,1]=3 15435 B18R1.33576 COC(=O)CCCCC(=O)CCCN1CCCC1 1458a_100000695723_100011445909 [0,1,0,1,0,0|1,0,1]=4 15436 B18R1.33576 COC(=O)CCCCC(=O)CCCN1CCCC1 1458a_100000743284_100000204269 [0,1,0,1,0,0|1,0,1]=4 15437 B18R1.33576 COC(=O)CCCCC(=O)NCCC1CCCC1 11a_100000739158_100000695723 [0,1,0,1,0,0|1,0,1]=4 15438 B18R1.33576 COC(=O)CCCCC(=O)NCCC1CCCC1 1626a_100000739158_100000695723 [0,1,0,1,0,0|1,0,1]=4 15439 B18R1.33576 COC(=O)CCCCC(=O)NCCC1CCCC1 240690a_100000739158_100000695723 [0,1,0,1,0,0|1,0,1]=4 15440 B18R1.33576 COC(=O)CCCCC(=O)NCCC1CCCC1 527a_100000739158_100000695723 [0,1,0,1,0,0|1,0,1]=4 15441 B18R1.33576 COC(=O)CCCCN(C)CCCC1CCCC1 2230a_100015186261_100000204269 [0,1,0,1,0,0|1,0,0]=3 15442 B18R1.33576 COC(=O)CCCCN(C)CCCC1CCCC1 269982a_100015186261_100000204269 [0,1,0,1,0,0|1,0,0]=3 15443 B18R1.33576 COC(=O)CCCCN(C)CCCC1CCCC1 34a_100015186261_100000204269 [0,1,0,1,0,0|1,0,0]=3 15444 B18R1.33576 COC(=O)CCCCN(C)CCCC1CCCO1 2230a_100011698863_100000204269 [0,1,0,1,0,0|2,0,0]=4 15445 B18R1.33576 COC(=O)CCCCN(C)CCCC1CCCO1 269982a_100011698863_100000204269 [0,1,0,1,0,0|2,0,0]=4 15446 B18R1.33576 COC(=O)CCCCN(C)CCCC1CCCO1 34a_100011698863_100000204269 [0,1,0,1,0,0|2,0,0]=4 15447 B18R1.33576 COC(=O)CCCCN(C)CCCN1CCCC1 269982a_100000233079_100000204269 [0,1,0,1,0,0|2,0,0]=4 15448 B18R1.33576 COC(=O)COCCN(C)CCCC1CCCC1 2230a_100015186261_100000090808 [0,1,0,1,0,0|2,0,0]=4 15449 B18R1.33576 COC(=O)COCCN(C)CCCC1CCCC1 34a_100015186261_100000090808 [0,1,0,1,0,0|2,0,0]=4 15450 B18R1.33576 COC(=O)NCCCC(=O)CCCC1CCCC1 1458a_100000753017_100011713738 [0,1,0,1,0,0|1,0,1]=4 15451 B18R1.33676 COC(=O)CCCCC(=O)CCC1CCCN1C 1458a_100000695723_100000005710 [0,1,0,1,0,0|1,0,1]=4 15452 B18R1.33689 COC(=O)CCCCC(=O)C1CCCCCN1C 1458a_100015187800_100000204269 [0,1,0,1,0,0|1,0,1]=4 15453 B18R1.33695 COC(=O)CCCCC(=O)CC1CCCCN1C 1458a_100000695723_100015185383 [0,1,0,1,0,0|1,0,1]=4 15454 B18R1.33695 COC(=O)CCCCC(=O)NC1CCCCC1C 11a_100000211402_100000695723 [0,1,0,1,0,0|1,0,1]=4 15455 B18R1.33695 COC(=O)CCCCC(=O)NC1CCCCC1C 1626a_100000211402_100000695723 [0,1,0,1,0,0|1,0,1]=4 15456 B18R1.33695 COC(=O)CCCCC(=O)NC1CCCCC1C 240690a_100000211402_100000695723 [0,1,0,1,0,0|1,0,1]=4 15457 B18R1.33695 COC(=O)CCCCC(=O)NC1CCCCC1C 527a_100000211402_100000695723 [0,1,0,1,0,0|1,0,1]=4 15458 B18R1.33695 COC(=O)CCCCN(C)CC1CCCCN1C 2230a_100015185953_100000204269 [0,1,0,1,0,0|2,0,0]=4 15459 B18R1.33695 COC(=O)CCCCN(C)CC1CCCCN1C 269982a_100015185953_100000204269 [0,1,0,1,0,0|2,0,0]=4 15460 B18R1.41028 CCCCCCCCN1CCCC(C1)C(=O)NC 2230a_100000754358_100000210759 [0,1,0,1,0,0|2,0,0]=4 15461 B18R1.41028 CCCCCCCCN1CCCC(C1)C(=O)NC 269982a_100000754358_100000210759 [0,1,0,1,0,0|2,0,0]=4 15462 B18R1.41028 CCCCCCCCN1CCCC(C1)C(=O)NC 34a_100000754358_100000210759 [0,1,0,1,0,0|2,0,0]=4 15463 B18R1.41028 CCCCCCCCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100000210759 [0,1,0,1,0,0|1,0,0]=3 15464 B18R1.41028 CCCCCCCCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100000210759 [0,1,0,1,0,0|1,0,0]=3 15465 B18R1.41028 CCCCCCCCN1CCOC(C1)C(=O)OC 2230a_100000751517_100000210759 [0,1,0,1,0,0|2,0,0]=4 15466 B18R1.41028 CCCCCCCCN1CCOC(C1)C(=O)OC 269982a_100000751517_100000210759 [0,1,0,1,0,0|2,0,0]=4 15467 B18R1.41028 CCCCCCCCN1CCOC(C1)C(=O)OC 34a_100000751517_100000210759 [0,1,0,1,0,0|2,0,0]=4 15468 B18R1.41028 CCCCCCCOC1CCCC(C1)C(=O)OC 34a_100012184231_100000210614 [0,1,0,1,0,0|1,0,0]=3 15469 B18R1.41028 CCCCCCCOC1CCCC(C1)C(=O)OC 7a_100012184231_100000210614 [0,1,0,1,0,0|1,0,0]=3 15470 B18R1.41028 CCCCOCCOC1CCCC(C1)C(=O)OC 34a_100012184231_100000743108 [0,1,0,1,0,0|2,0,0]=4 15471 B18R1.41028 CCCCOCCOC1CCCC(C1)C(=O)OC 7a_100012184231_100000743108 [0,1,0,1,0,0|2,0,0]=4 15472 B18R1.41028 COC(=O)C1CCCC(C1)OCCCCCCF 34a_100012184231_100015922095 [0,1,0,1,0,0|2,0,0]=4 15473 B18R1.41028 COC(=O)C1CCCC(C1)OCCCCCCF 7a_100012184231_100015922095 [0,1,0,1,0,0|2,0,0]=4 15474 B18R1.41028 COC(=O)C1CCCC(C1)OCCCCCCO 34a_100012184231_100000766143 [0,1,0,1,0,0|2,0,0]=4 15475 B18R1.41028 COC(=O)C1CCCC(C1)OCCCCCCO 7a_100012184231_100000766143 [0,1,0,1,0,0|2,0,0]=4 15476 B18R1.41028 COC(=O)[C@H]1CCCN(C1)CCCCCCCO 2230a_100016988859_100000760002 [0,1,0,1,0,0|2,0,0]=4 15477 B18R1.41028 COC(=O)[C@H]1CCCN(C1)CCCCCCCO 269982a_100016988859_100000760002 [0,1,0,1,0,0|2,0,0]=4 15478 B18R1.41028 COCCCCCCN1CCC[C@@H](C1)C(=O)OC 2230a_100016988859_100011998445 [0,1,0,1,0,0|2,0,0]=4 15479 B18R1.41028 COCCCCCCN1CCC[C@@H](C1)C(=O)OC 269982a_100016988859_100011998445 [0,1,0,1,0,0|2,0,0]=4 15480 B18R1.78085 CCCCCCCCC(=O)N1CC[C@H]1C(=O)OC 11a_102516456887_100000210188 [0,1,0,1,0,0|1,0,1]=4 15481 B18R1.78085 CCCCCCCCC(=O)N1CC[C@H]1C(=O)OC 1626a_102516456887_100000210188 [0,1,0,1,0,0|1,0,1]=4 15482 B18R1.78085 CCCCCCCCC(=O)N1CC[C@H]1C(=O)OC 240690a_102516456887_100000210188 [0,1,0,1,0,0|1,0,1]=4 15483 B18R1.78085 CCCCCCCCC(=O)N1CC[C@H]1C(=O)OC 527a_102516456887_100000210188 [0,1,0,1,0,0|1,0,1]=4 15484 B18R1.78085 CCCCCCCCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100000210759 [0,1,0,1,0,0|0,0,1]=3 15485 B18R1.78085 CCCCCCCCC(C)N1CC[C@H]1C(=O)OC 270004a_102516456887_100011216694 [0,1,0,1,0,0|1,0,0]=3 15486 B18R1.78085 CCCCCCCNC(=O)[C@H]1CC[C@H]1C(=O)OC 11a_100000229938_100009908320 [0,1,0,1,0,0|1,0,1]=4 15487 B18R1.78085 CCCCCCCNC(=O)[C@H]1CC[C@H]1C(=O)OC 240690a_100000229938_100009908320 [0,1,0,1,0,0|1,0,1]=4 15488 B18R1.78085 COC(=O)[C@@H]1CC[C@@H]1C(=O)CCCCCCCO 1458a_100009908320_100000760002 [0,1,0,1,0,0|1,0,1]=4 15489 B18R1.78085 COCCCCCCC(=O)[C@H]1CC[C@H]1C(=O)OC 1458a_100009908320_100011998445 [0,1,0,1,0,0|1,0,1]=4 15490 B18R1.78147 CCCCCCCCC(C)CN1CC1C(=O)OC 270004a_200009830135_100011995885 [0,1,0,1,0,0|1,0,0]=3 15491 B18R1.242865 COC(=O)CCCCC(=O)N1CCCCCCC1 11a_100000211400_100000695723 [0,1,0,1,0,0|1,0,1]=4 15492 B18R1.242865 COC(=O)CCCCC(=O)N1CCCCCCC1 1626a_100000211400_100000695723 [0,1,0,1,0,0|1,0,1]=4 15493 B18R1.242865 COC(=O)CCCCC(=O)N1CCCCCCC1 240690a_100000211400_100000695723 [0,1,0,1,0,0|1,0,1]=4 15494 B18R1.242865 COC(=O)CCCCC(=O)N1CCCCCCC1 527a_100000211400_100000695723 [0,1,0,1,0,0|1,0,1]=4 15495 B18R1.242952 COC(=O)CCCCC(=O)CC1CCCCCC1 1458a_100000685095_100000204269 [0,1,0,1,0,0|0,0,1]=3 15496 B18R1.242952 COC(=O)CCCCC(=O)CC1CCCCCC1 1458a_100000695723_200000696569 [0,1,0,1,0,0|0,0,1]=3 15497 B18R1.242952 COC(=O)CCCCC(=O)CN1CCCCCC1 1458a_100000740298_100000204269 [0,1,0,1,0,0|1,0,1]=4 15498 B18R1.242952 COC(=O)CCCCC(=O)NC1CCCCCC1 11a_100000210984_100000695723 [0,1,0,1,0,0|1,0,1]=4 15499 B18R1.242952 COC(=O)CCCCC(=O)NC1CCCCCC1 1626a_100000210984_100000695723 [0,1,0,1,0,0|1,0,1]=4 15500 B18R1.242952 COC(=O)CCCCC(=O)NC1CCCCCC1 240690a_100000210984_100000695723 [0,1,0,1,0,0|1,0,1]=4 15501 B18R1.242952 COC(=O)CCCCC(=O)NC1CCCCCC1 527a_100000210984_100000695723 [0,1,0,1,0,0|1,0,1]=4 15502 B18R1.242952 COC(=O)CCCNC(=O)CC1CCCCCC1 188690a_100000184769_100000685095 [0,1,0,1,0,0|1,0,1]=4 15503 B18R1.242952 COC(=O)COCCC(=O)CC1CCCCCC1 1458a_100000685095_100000090808 [0,1,0,1,0,0|1,0,1]=4 15504 B18R1.242952 COC(=O)NCCCC(=O)CC1CCCCCC1 1458a_100000753017_200000696569 [0,1,0,1,0,0|1,0,1]=4 15505 B18R1.335 CCCCCCN1CCCC(C1)CCC(=O)NC 2230a_100015187509_100000210314 [0,1,0,1,0,0|2,0,0]=4 15506 B18R1.335 CCCCCCN1CCCC(C1)CCC(=O)NC 269982a_100015187509_100000210757 [0,1,0,1,0,0|2,0,0]=4 15507 B18R1.335 CCCCCCN1CCCC(C1)CCC(=O)NC 34a_100015187509_100000210314 [0,1,0,1,0,0|2,0,0]=4 15508 B18R1.335 CCCCCCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100000210314 [0,1,0,1,0,0|1,0,0]=3 15509 B18R1.335 CCCCCCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100000210757 [0,1,0,1,0,0|1,0,0]=3 15510 B18R1.335 CCCCCCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100000210314 [0,1,0,1,0,0|1,0,0]=3 15511 B18R1.335 CCCCOCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100011995733 [0,1,0,1,0,0|2,0,0]=4 15512 B18R1.335 CCCCOCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100011995733 [0,1,0,1,0,0|2,0,0]=4 15513 B18R1.335 CCCCOCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100011995733 [0,1,0,1,0,0|2,0,0]=4 15514 B18R1.335 CCCOCCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100011215938 [0,1,0,1,0,0|2,0,0]=4 15515 B18R1.335 CCCOCCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100011215938 [0,1,0,1,0,0|2,0,0]=4 15516 B18R1.335 CCCOCCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100011215938 [0,1,0,1,0,0|2,0,0]=4 15517 B18R1.335 CCOCCCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100012232248 [0,1,0,1,0,0|2,0,0]=4 15518 B18R1.335 CCOCCCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100012232248 [0,1,0,1,0,0|2,0,0]=4 15519 B18R1.335 CCOCCCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100012232248 [0,1,0,1,0,0|2,0,0]=4 15520 B18R1.335 COC(=O)CCC1CCCN(C1)CCCCCF 2230a_100015184279_100000729378 [0,1,0,1,0,0|2,0,0]=4 15521 B18R1.335 COC(=O)CCC1CCCN(C1)CCCCCF 269982a_100015184279_100000729378 [0,1,0,1,0,0|2,0,0]=4 15522 B18R1.335 COC(=O)CCC1CCCN(C1)CCCCCF 34a_100015184279_100000729378 [0,1,0,1,0,0|2,0,0]=4 15523 B18R1.335 COC(=O)CCC1CCCN(C1)CCCCCO 2230a_100015184279_100000746330 [0,1,0,1,0,0|2,0,0]=4 15524 B18R1.335 COC(=O)CCC1CCCN(C1)CCCCCO 269982a_100015184279_100000746330 [0,1,0,1,0,0|2,0,0]=4 15525 B18R1.335 COC(=O)CCC1CCCN(C1)CCCCCO 34a_100015184279_100000746330 [0,1,0,1,0,0|2,0,0]=4 15526 B18R1.335 COCCCCN1CCCC(C1)CCC(=O)OC 2230a_100015184279_100000730899 [0,1,0,1,0,0|2,0,0]=4 15527 B18R1.335 COCCCCN1CCCC(C1)CCC(=O)OC 269982a_100015184279_100000730899 [0,1,0,1,0,0|2,0,0]=4 15528 B18R1.335 COCCCCN1CCCC(C1)CCC(=O)OC 34a_100015184279_100000755781 [0,1,0,1,0,0|2,0,0]=4 15529 B18R1.693 CCCCCCC(C)NCC1CCCC(=O)N1C 2230a_200010383782_100011215978 [0,1,0,1,0,0|2,0,0]=4 15530 B18R1.693 CCCCCCC(C)NCC1CCCC(=O)N1C 270004a_200010383782_100000210826 [0,1,0,1,0,0|2,0,0]=4 15531 B18R1.693 CCCCCCC(C)NCC1CCCC(=O)N1C 34a_200010383782_100011215978 [0,1,0,1,0,0|2,0,0]=4 15532 B18R1.1100 CNC(=O)CCCOCCC(N)C1CCCCC1 34a_200020622111_100000741757 [0,1,0,1,0,0|2,0,0]=4 15533 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCCCC1 1458a_100000036694_100000210327 [0,1,0,1,0,0|0,0,1]=3 15534 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCCCC1 1458a_100000210647_100009815986 [0,1,0,1,0,0|0,0,1]=3 15535 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCCCO1 1458a_100000748299_100009815986 [0,1,0,1,0,0|1,0,1]=4 15536 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCCOC1 1458a_100000036694_100000693364 [0,1,0,1,0,0|1,0,1]=4 15537 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCCOC1 1458a_100000741522_100009815986 [0,1,0,1,0,0|1,0,1]=4 15538 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCOCC1 1458a_100000036694_100011324220 [0,1,0,1,0,0|1,0,1]=4 15539 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCOCC1 1458a_100000195482_100009815986 [0,1,0,1,0,0|1,0,1]=4 15540 B18R1.1100 COC(=O)CCCCCCC(=O)C1CCSCC1 1458a_100000755232_100009815986 [0,1,0,1,0,0|1,0,1]=4 15541 B18R1.1100 COC(=O)CCCCCCN(C)C1CCCCC1 2230a_100000207522_100009815986 [0,1,0,1,0,0|1,0,0]=3 15542 B18R1.1100 COC(=O)CCCCCCN(C)C1CCCCC1 269982a_100000207522_100009815986 [0,1,0,1,0,0|1,0,0]=3 15543 B18R1.1100 COC(=O)CCCCCCN(C)C1CCCCC1 34a_100000207522_100009815986 [0,1,0,1,0,0|1,0,0]=3 15544 B18R1.1100 COC(=O)CCCCCCN(C)C1CCOCC1 2230a_100020587155_100009815986 [0,1,0,1,0,0|2,0,0]=4 15545 B18R1.1100 COC(=O)CCCCCCN(C)C1CCOCC1 269982a_100020587155_100009815986 [0,1,0,1,0,0|2,0,0]=4 15546 B18R1.1100 COC(=O)CCCCCCN(C)C1CCOCC1 34a_100020587155_100009815986 [0,1,0,1,0,0|2,0,0]=4 15547 B18R1.1100 COC(=O)CCCCCCN(C)C1CCSCC1 2230a_100015184757_100009815986 [0,1,0,1,0,0|2,0,0]=4 15548 B18R1.1100 COC(=O)CCCCCCN(C)C1CCSCC1 269982a_100015184757_100009815986 [0,1,0,1,0,0|2,0,0]=4 15549 B18R1.1100 COC(=O)CCCCCCN(C)C1CCSCC1 34a_100015184757_100009815986 [0,1,0,1,0,0|2,0,0]=4 15550 B18R1.1100 COC(=O)CCCCCNC(=O)C1CCCCC1 188690a_100000184999_100000210647 [0,1,0,1,0,0|1,0,1]=4 15551 B18R1.1100 COC(=O)CCCCCN[C@H](C)C1CCCCC1 2230a_100025707633_100009816466 [0,1,0,1,0,0|1,0,0]=3 15552 B18R1.1100 COC(=O)CCCCCN[C@H](C)C1CCCCC1 34a_100025707633_100009816466 [0,1,0,1,0,0|1,0,0]=3 15553 B18R1.1100 COC(=O)CCCCCOC(C)C1CCCCC1 34a_100011216961_100009816466 [0,1,0,1,0,0|1,0,0]=3 15554 B18R1.1100 COC(=O)CCCCCOC(C)C1CCCCC1 7a_100011216961_100009816466 [0,1,0,1,0,0|1,0,0]=3 15555 B18R1.1100 COC(=O)CCCCCOC(C)C1CCCNC1 34a_100000740858_100009816466 [0,1,0,1,0,0|2,0,0]=4 15556 B18R1.1100 COC(=O)CCCCCOC(C)C1CCNCC1 34a_100011728446_100009816466 [0,1,0,1,0,0|2,0,0]=4 15557 B18R1.1100 COC(=O)CCCCCO[C@H](C)C1CCOCC1 34a_100000703848_100009816466 [0,1,0,1,0,0|2,0,0]=4 15558 B18R1.1100 COC(=O)CCCCCO[C@H](C)C1CCOCC1 7a_100000703848_100009816466 [0,1,0,1,0,0|2,0,0]=4 15559 B18R1.1100 COC(=O)CCCCOCC(=O)C1CCCCC1 34a_100000059025_100000241979 [0,1,0,1,0,0|1,0,1]=4 15560 B18R1.1100 COC(=O)CCCCOCC(=O)C1CCCCC1 7a_100000059025_100000241979 [0,1,0,1,0,0|1,0,1]=4 15561 B18R1.1100 COC(=O)CCCCOC[C@H](N)C1CCCCC1 34a_100009817630_100000204269 [0,1,0,1,0,0|1,0,0]=3 15562 B18R1.1100 COC(=O)CCCCSCC(=O)C1CCCCC1 62a_100000204269_100000241979 [0,1,0,1,0,0|1,0,1]=4 15563 B18R1.1100 COC(=O)CCCCSCC(=O)C1CCCCC1 62a_100000241979_100000204269 [0,1,0,1,0,0|1,0,1]=4 15564 B18R1.1100 COC(=O)CCCOCCC(N)C1CCCCC1 34a_200020622111_100000742333 [0,1,0,1,0,0|1,0,0]=3 15565 B18R1.1100 COC(=O)COCCOC[C@H](N)C1CCCCC1 34a_100009817630_100000090808 [0,1,0,1,0,0|2,0,0]=4 15566 B18R1.1231 COC(=O)CCCCCCC(=O)CC1CCCC1 1458a_100000036694_100000740388 [0,1,0,1,0,0|0,0,1]=3 15567 B18R1.1231 COC(=O)CCCCCCC(=O)CC1CCCC1 1458a_100000210891_100009815986 [0,1,0,1,0,0|0,0,1]=3 15568 B18R1.1231 COC(=O)CCCCCCC(=O)CC1CCCO1 1458a_100000036694_100000203698 [0,1,0,1,0,0|1,0,1]=4 15569 B18R1.1231 COC(=O)CCCCCCC(=O)CC1CCOC1 1458a_100000036694_100000702531 [0,1,0,1,0,0|1,0,1]=4 15570 B18R1.1231 COC(=O)CCCCCCC(=O)CC1CCOC1 1458a_100011218419_100009815986 [0,1,0,1,0,0|1,0,1]=4 15571 B18R1.1231 COC(=O)CCCCCCC(=O)CN1CCCC1 1458a_100000740243_100009815986 [0,1,0,1,0,0|1,0,1]=4 15572 B18R1.1231 COC(=O)CCCCCCC(=O)NC1CCCC1 11a_100000211070_100000036694 [0,1,0,1,0,0|1,0,1]=4 15573 B18R1.1231 COC(=O)CCCCCCC(=O)NC1CCCC1 1626a_100000211070_100000036694 [0,1,0,1,0,0|1,0,1]=4 15574 B18R1.1231 COC(=O)CCCCCCC(=O)NC1CCCC1 240690a_100000211070_100000036694 [0,1,0,1,0,0|1,0,1]=4 15575 B18R1.1231 COC(=O)CCCCCCN(C)CC1CCCO1 2230a_100102946541_100009815986 [0,1,0,1,0,0|2,0,0]=4 15576 B18R1.1231 COC(=O)CCCCCCN(C)CC1CCCO1 269982a_100102946541_100009815986 [0,1,0,1,0,0|2,0,0]=4 15577 B18R1.1231 COC(=O)CCCCCCN(C)CC1CCCO1 34a_100102946541_100009815986 [0,1,0,1,0,0|2,0,0]=4 15578 B18R1.1231 COC(=O)CCCCCCN(C)CC1CCOC1 2230a_100000684583_100009815986 [0,1,0,1,0,0|2,0,0]=4 15579 B18R1.1231 COC(=O)CCCCCCN(C)CC1CCOC1 269982a_100000684583_100009815986 [0,1,0,1,0,0|2,0,0]=4 15580 B18R1.1231 COC(=O)CCCCCCN(C)CC1CCOC1 34a_100000684583_100009815986 [0,1,0,1,0,0|2,0,0]=4 15581 B18R1.1231 COC(=O)CCCCCNC(=O)CC1CCCC1 188690a_100000184999_100000210891 [0,1,0,1,0,0|1,0,1]=4 15582 B18R1.1231 COC(=O)CCCCOCC(C)CN1CCCC1 7a_200011934648_100000204269 [0,1,0,1,0,0|2,0,0]=4 15583 B18R1.5197 CCCCCCC(C)CCOCC1COC(=O)O1 34a_200011024964_100000073702 [0,1,0,1,0,0|2,0,0]=4 15584 B18R1.5197 CCCCCCC(C)CCOC[C@H]1COC(=O)N1 34a_200011024964_100015307671 [0,1,0,1,0,0|2,0,0]=4 15585 B18R1.5197 CCCCCCC(C)CCOC[C@H]1COC(=O)N1 7a_200011024964_100015307671 [0,1,0,1,0,0|2,0,0]=4 15586 B18R1.5236 CCCCCCC(=O)C1CCCCN1C(=O)OC 1458a_100000236124_100000210757 [0,1,0,1,0,0|1,0,1]=4 15587 B18R1.5236 CCCCCCC(=O)N1CCCCC1C(=O)OC 11a_100000734855_100102632555 [0,1,0,1,0,0|1,0,1]=4 15588 B18R1.5236 CCCCCCC(=O)N1CCCCC1C(=O)OC 1626a_100000734855_100102632555 [0,1,0,1,0,0|1,0,1]=4 15589 B18R1.5236 CCCCCCC(=O)N1CCCCC1C(=O)OC 240690a_100000734855_100102632555 [0,1,0,1,0,0|1,0,1]=4 15590 B18R1.5236 CCCCCCC(=O)N1CCCCC1C(=O)OC 527a_100000734855_100102632555 [0,1,0,1,0,0|1,0,1]=4 15591 B18R1.5236 CCCCCCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100000210757 [0,1,0,1,0,0|0,0,1]=3 15592 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)NC 2230a_100011209383_100011215978 [0,1,0,1,0,0|2,0,0]=4 15593 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)NC 269982a_100011209383_100011215978 [0,1,0,1,0,0|2,0,0]=4 15594 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)NC 270004a_100011209383_100000210826 [0,1,0,1,0,0|2,0,0]=4 15595 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)NC 34a_100011209383_100011215978 [0,1,0,1,0,0|2,0,0]=4 15596 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)OC 2230a_100000734855_100011215978 [0,1,0,1,0,0|1,0,0]=3 15597 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)OC 269982a_100000734855_100011215978 [0,1,0,1,0,0|1,0,0]=3 15598 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)OC 270004a_100000734855_100000210826 [0,1,0,1,0,0|1,0,0]=3 15599 B18R1.5236 CCCCCCC(C)N1CCCCC1C(=O)OC 34a_100000734855_100011215978 [0,1,0,1,0,0|1,0,0]=3 15600 B18R1.5236 CCCCCCC(C)N1CCOCC1C(=O)OC 2230a_100000765174_100011215978 [0,1,0,1,0,0|2,0,0]=4 15601 B18R1.5236 CCCCCCC(C)N1CCOCC1C(=O)OC 270004a_100000765174_100000210826 [0,1,0,1,0,0|2,0,0]=4 15602 B18R1.5236 CCCCCCC(C)N1CCOCC1C(=O)OC 34a_100000765174_100011215978 [0,1,0,1,0,0|2,0,0]=4 15603 B18R1.5236 CCCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 11a_100000209983_100009817520 [0,1,0,1,0,0|1,0,1]=4 15604 B18R1.5236 CCCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 240690a_100000209983_100009817520 [0,1,0,1,0,0|1,0,1]=4 15605 B18R1.5236 CCCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 527a_100000209983_100009817520 [0,1,0,1,0,0|1,0,1]=4 15606 B18R1.5236 CCCCOCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100011995733 [0,1,0,1,0,0|1,0,1]=4 15607 B18R1.5236 CCCOCCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100011215938 [0,1,0,1,0,0|1,0,1]=4 15608 B18R1.5236 CCOCCCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100012232248 [0,1,0,1,0,0|1,0,1]=4 15609 B18R1.5236 COC(=O)[C@H]1CCCC[C@H]1C(=O)CCCCCF 1458a_100009817520_100000729378 [0,1,0,1,0,0|1,0,1]=4 15610 B18R1.5236 COC(=O)[C@H]1CCCC[C@H]1C(=O)CCCCCO 1458a_100009817520_100000746330 [0,1,0,1,0,0|1,0,1]=4 15611 B18R1.5236 COCCCCC(=O)[C@@H]1CCCC[C@@H]1C(=O)OC 1458a_100009817520_100000755781 [0,1,0,1,0,0|1,0,1]=4 15612 B18R1.5248 CCCCCCC(=O)N1CCC[C@@H]1CC(=O)OC 11a_100025726698_100102632555 [0,1,0,1,0,0|1,0,1]=4 15613 B18R1.5248 CCCCCCC(=O)N1CCC[C@@H]1CC(=O)OC 1626a_100025726698_100102632555 [0,1,0,1,0,0|1,0,1]=4 15614 B18R1.5248 CCCCCCC(=O)N1CCC[C@@H]1CC(=O)OC 240690a_100025726698_100102632555 [0,1,0,1,0,0|1,0,1]=4 15615 B18R1.5248 CCCCCCC(=O)N1CCC[C@@H]1CC(=O)OC 527a_100025726698_100102632555 [0,1,0,1,0,0|1,0,1]=4 15616 B18R1.5248 CCCCCCC(C)N1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011215978 [0,1,0,1,0,0|1,0,0]=3 15617 B18R1.5248 CCCCCCC(C)N1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215978 [0,1,0,1,0,0|1,0,0]=3 15618 B18R1.5248 CCCCCCC(C)N1CCC[C@@H]1CC(=O)OC 270004a_100025726698_100000210826 [0,1,0,1,0,0|1,0,0]=3 15619 B18R1.5248 CCCCCCC(C)N1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011215978 [0,1,0,1,0,0|1,0,0]=3 15620 B18R1.7245 CCCCCCC(C)OC1CCCC1C(=O)OC 34a_200000081814_100011215978 [0,1,0,1,0,0|1,0,0]=3 15621 B18R1.7245 CCCCCCC(C)OC1CCCC1C(=O)OC 7a_200000081814_100011215978 [0,1,0,1,0,0|1,0,0]=3 15622 B18R1.15578 CCO[C@H]1CCN(C1)CCCCCCC(=O)OC 2230a_100011787710_100009815986 [0,1,0,1,0,0|2,0,0]=4 15623 B18R1.15578 CCO[C@H]1CCN(C1)CCCCCCC(=O)OC 269982a_100011787710_100009815986 [0,1,0,1,0,0|2,0,0]=4 15624 B18R1.15578 CCO[C@H]1CCN(C1)CCCCCCC(=O)OC 34a_100011787710_100009815986 [0,1,0,1,0,0|2,0,0]=4 15625 B18R1.15578 COC(=O)CCCCCCN1CCC(C1)CCO 2230a_100016987287_100009815986 [0,1,0,1,0,0|2,0,0]=4 15626 B18R1.15578 COC(=O)CCCCCCN1CCC(C1)CCO 269982a_100016987287_100009815986 [0,1,0,1,0,0|2,0,0]=4 15627 B18R1.15578 COC(=O)CCCCCCN1CCC(C1)CCO 34a_100016987287_100009815986 [0,1,0,1,0,0|2,0,0]=4 15628 B18R1.15578 COCC1CCN(C1)CCCCCCC(=O)OC 2230a_100025706693_100009815986 [0,1,0,1,0,0|2,0,0]=4 15629 B18R1.15578 COCC1CCN(C1)CCCCCCC(=O)OC 269982a_100025706693_100009815986 [0,1,0,1,0,0|2,0,0]=4 15630 B18R1.15578 COCC1CCN(C1)CCCCCCC(=O)OC 34a_100025706693_100009815986 [0,1,0,1,0,0|2,0,0]=4 15631 B18R1.23362 CCCCCCC(C)CCOCCC1CCC1=O 7a_200011024964_200016118888 [0,1,0,1,0,0|2,0,0]=4 15632 B18R1.31572 CCCOC1CN(C1)CCCCCCC(=O)OC 269982a_200020626125_100009815986 [0,1,0,1,0,0|2,0,0]=4 15633 B18R1.31572 CCCOC1CN(C1)CCCCCCC(=O)OC 34a_200020626125_100009815986 [0,1,0,1,0,0|2,0,0]=4 15634 B18R1.34854 COC(=O)CCCCCCC(=O)C1CCCC1C 1458a_100000690547_100009815986 [0,1,0,1,0,0|0,0,1]=3 15635 B18R1.34854 COC(=O)CCCCCCC(=O)N1CCC[C@@H]1C 240690a_100020605311_100000036694 [0,1,0,1,0,0|1,0,1]=4 15636 B18R1.34854 COC(=O)CCCCCCC(=O)N1CCC[C@H]1C 11a_100015189458_100000036694 [0,1,0,1,0,0|1,0,1]=4 15637 B18R1.34854 COC(=O)CCCCCCC(=O)N1CCC[C@H]1C 240690a_100015189458_100000036694 [0,1,0,1,0,0|1,0,1]=4 15638 B18R1.34854 COC(=O)CCCCCCC(=O)[C@@H]1CCCN1C 1458a_100009816429_100009815986 [0,1,0,1,0,0|1,0,1]=4 15639 B18R1.34854 COC(=O)CCCCCNC(=O)C1CCCC1C 188690a_100000184999_100000690547 [0,1,0,1,0,0|1,0,1]=4 15640 B18R1.34854 COC(=O)CCCCCO[C@@H](C)[C@@H]1CCCN1C 34a_100160487421_100009816466 [0,1,0,1,0,0|2,0,0]=4 15641 B18R1.37276 COC(=O)CCCCCCN1CCCCC(C1)O 2230a_100025706797_100009815986 [0,1,0,1,0,0|1,0,0]=3 15642 B18R1.37276 COC(=O)CCCCCCN1CCCCC(C1)O 269982a_100025706797_100009815986 [0,1,0,1,0,0|1,0,0]=3 15643 B18R1.37276 COC(=O)CCCCCCN1CCOC[C@@H](C1)O 2230a_100016073750_100009815986 [0,1,0,1,0,0|2,0,0]=4 15644 B18R1.37276 COC(=O)CCCCCCN1CCOC[C@@H](C1)O 269982a_100016073750_100009815986 [0,1,0,1,0,0|2,0,0]=4 15645 B18R1.37281 CNC(=O)CCCNCCC1CCCCCCC1 2230a_100011532352_100000741757 [0,1,0,1,0,0|1,0,0]=3 15646 B18R1.37281 CNC(=O)CCCNCCC1CCCCCCC1 34a_100011532352_100000741757 [0,1,0,1,0,0|1,0,0]=3 15647 B18R1.37281 CNC(=O)OCCNCCC1CCCCCCC1 34a_100011532352_200011997002 [0,1,0,1,0,0|2,0,0]=4 15648 B18R1.37281 COC(=O)/C=C/CNCCC1CCCCCCC1 2230a_100011532352_100000742655 [0,1,0,1,0,0|0,0,2]=4 15649 B18R1.37281 COC(=O)/C=C/CNCCC1CCCCCCC1 34a_100011532352_100000742655 [0,1,0,1,0,0|0,0,2]=4 15650 B18R1.37281 COC(=O)CCCCCCN1CCCCCCC1 2230a_100000211400_100009815986 [0,1,0,1,0,0|0,0,0]=2 15651 B18R1.37281 COC(=O)CCCCCCN1CCCCCCC1 269982a_100000211400_100009815986 [0,1,0,1,0,0|0,0,0]=2 15652 B18R1.37281 COC(=O)CCCCCCN1CCCCCCC1 34a_100000211400_100009815986 [0,1,0,1,0,0|0,0,0]=2 15653 B18R1.37281 COC(=O)CCCCCNC1CCCCCCC1 2230a_100000211152_100009816466 [0,1,0,1,0,0|0,0,0]=2 15654 B18R1.37281 COC(=O)CCCCCNC1CCCCCCC1 34a_100000211152_100009816466 [0,1,0,1,0,0|0,0,0]=2 15655 B18R1.37281 COC(=O)CCCCCOC1C=CCCCCC1 34a_100000688657_100009816466 [0,1,0,1,0,0|0,0,2]=4 15656 B18R1.37281 COC(=O)CCCCCOC1CC/C=C\CCC1 34a_100000074720_100021000466 [0,1,0,1,0,0|0,0,2]=4 15657 B18R1.37281 COC(=O)CCCCCOC1CC/C=C\CCC1 34a_100016989180_100009816466 [0,1,0,1,0,0|0,0,2]=4 15658 B18R1.37281 COC(=O)CCCCCOC1CC/C=C\CCC1 7a_100000074720_100021000466 [0,1,0,1,0,0|0,0,2]=4 15659 B18R1.37281 COC(=O)CCCCCOC1CCCCCCC1 34a_100000210054_100009816466 [0,1,0,1,0,0|0,0,0]=2 15660 B18R1.37281 COC(=O)CCCCCOC1CCCCCCC1 7a_100000210054_100009816466 [0,1,0,1,0,0|0,0,0]=2 15661 B18R1.37281 COC(=O)CCCCCSC1CC/C=C\CCC1 62a_100009816466_100021000466 [0,1,0,1,0,0|0,0,2]=4 15662 B18R1.37281 COC(=O)CCCCCSC1CC/C=C\CCC1 62a_100021000466_100009816466 [0,1,0,1,0,0|0,0,2]=4 15663 B18R1.37281 COC(=O)CCCCNCC1CC/C=C\CCC1 2230a_100102730862_100000204269 [0,1,0,1,0,0|0,0,2]=4 15664 B18R1.37281 COC(=O)CCCCNCC1CC/C=C\CCC1 34a_100102730862_100000204269 [0,1,0,1,0,0|0,0,2]=4 15665 B18R1.37281 COC(=O)CCCCOCC1CCCCCCC1 34a_100011216312_100000204269 [0,1,0,1,0,0|0,0,0]=2 15666 B18R1.37281 COC(=O)CCCCOCC1CCCCCCC1 7a_100011216312_100000204269 [0,1,0,1,0,0|0,0,0]=2 15667 B18R1.37281 COC(=O)CCCNCCC1CCCCCCC1 2230a_100011532352_100011218270 [0,1,0,1,0,0|0,0,0]=2 15668 B18R1.37281 COC(=O)CCCNCCC1CCCCCCC1 34a_100011532352_100000742333 [0,1,0,1,0,0|0,0,0]=2 15669 B18R1.37281 COC(=O)COCCOCC1CCCCCCC1 34a_100011216312_100000090808 [0,1,0,1,0,0|1,0,0]=3 15670 B18R1.37281 COC(=O)COCCOCC1CCCCCCC1 7a_100011216312_100000090808 [0,1,0,1,0,0|1,0,0]=3 15671 B18R1.37694 COC(=O)CCCCCCC(=O)NCC1CCC1 11a_100000738700_100000036694 [0,1,0,1,0,0|1,0,1]=4 15672 B18R1.37694 COC(=O)CCCCCCC(=O)NCC1CCC1 1626a_100000738700_100000036694 [0,1,0,1,0,0|1,0,1]=4 15673 B18R1.37694 COC(=O)CCCCCCC(=O)NCC1CCC1 240690a_100000738700_100000036694 [0,1,0,1,0,0|1,0,1]=4 15674 B18R1.37695 COC(=O)CCCCCCC(=O)CCCC1CO1 1458a_100000036694_100000733510 [0,1,0,1,0,0|1,0,1]=4 15675 B18R1.37695 COC(=O)CCCCCCC(=O)CSCC1CC1 1458a_200011316215_100009815986 [0,1,0,1,0,0|1,0,1]=4 15676 B18R1.37695 COC(=O)CCCCCCC(=O)NCCC1CC1 1626a_100000764129_100000036694 [0,1,0,1,0,0|1,0,1]=4 15677 B18R1.37695 COC(=O)CCCCCCC(=O)NCCC1CC1 240690a_100000764129_100000036694 [0,1,0,1,0,0|1,0,1]=4 15678 B18R1.39727 CCC1CCCC(C1)OCCCCCC(=O)OC 7a_100011985506_100009816466 [0,1,0,1,0,0|1,0,0]=3 15679 B18R1.39727 CCC1CN(CCO1)CCCCCCC(=O)OC 2230a_100000736320_100009815986 [0,1,0,1,0,0|2,0,0]=4 15680 B18R1.39727 CCC1CN(CCO1)CCCCCCC(=O)OC 269982a_100000736320_100009815986 [0,1,0,1,0,0|2,0,0]=4 15681 B18R1.39727 CCC1CN(CCO1)CCCCCCC(=O)OC 34a_100000736320_100009815986 [0,1,0,1,0,0|2,0,0]=4 15682 B18R1.39727 CCN1CCCC(C1)CNCCCCC(=O)OC 2230a_100000747413_100000204269 [0,1,0,1,0,0|2,0,0]=4 15683 B18R1.39727 CCN1CCCC(C1)COCCCCC(=O)OC 7a_200000227639_100000204269 [0,1,0,1,0,0|2,0,0]=4 15684 B18R1.39727 CCN1CCC[C@H](C1)NCCCCCC(=O)OC 2230a_100025775482_100009816466 [0,1,0,1,0,0|2,0,0]=4 15685 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)CF 2230a_100016992999_100009815986 [0,1,0,1,0,0|2,0,0]=4 15686 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)CF 269982a_100016992999_100009815986 [0,1,0,1,0,0|2,0,0]=4 15687 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)CF 34a_100016992999_100009815986 [0,1,0,1,0,0|2,0,0]=4 15688 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)CO 2230a_100000211344_100009815986 [0,1,0,1,0,0|2,0,0]=4 15689 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)CO 269982a_100000211344_100009815986 [0,1,0,1,0,0|2,0,0]=4 15690 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)CO 34a_100000211344_100009815986 [0,1,0,1,0,0|2,0,0]=4 15691 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)OC 2230a_100000695604_100009815986 [0,1,0,1,0,0|2,0,0]=4 15692 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)OC 269982a_100000695604_100009815986 [0,1,0,1,0,0|2,0,0]=4 15693 B18R1.39727 COC(=O)CCCCCCN1CCCC(C1)OC 34a_100000695604_100009815986 [0,1,0,1,0,0|2,0,0]=4 15694 B18R1.39727 COC(=O)CCCCCOC1CCCC(C1)CN 34a_100011254705_100009816466 [0,1,0,1,0,0|2,0,0]=4 15695 B18R1.245589 COC(=O)CCCCCNC1(CCCCCC1)C 2230a_100000704638_100009816466 [0,1,0,1,0,0|1,0,0]=3 15696 B18R1.245589 COC(=O)CCCCCNC1(CCCCCC1)C 34a_100000704638_100009816466 [0,1,0,1,0,0|1,0,0]=3 15697 B18R1.245589 COC(=O)CCCCCOC1(CCCCCC1)C 34a_100000708895_100009816466 [0,1,0,1,0,0|1,0,0]=3 15698 B18R1.245589 COC(=O)CCCCCOC1(CCCCCC1)C 7a_100000708895_100009816466 [0,1,0,1,0,0|1,0,0]=3 15699 B18R1.245589 COC(=O)CCCCCOC1(CCCNCC1)C 34a_100000723723_100009816466 [0,1,0,1,0,0|2,0,0]=4 15700 B18R1.27 C=C1CCC(CC1)COCCCCCCCCC 34a_100000074039_100011214924 [0,1,0,1,0,0|2,0,0]=4 15701 B18R1.27 C=C1CCC(CC1)NCCCCCCCCCC 270004a_100000684558_100010272673 [0,1,0,1,0,0|2,0,0]=4 15702 B18R1.27 C=C1CCN(CC1)CCCCCCCCCCC 2230a_100000752442_100011215454 [0,1,0,1,0,0|2,0,0]=4 15703 B18R1.27 C=C1CCN(CC1)CCCCCCCCCCC 269982a_100000752442_100011215454 [0,1,0,1,0,0|2,0,0]=4 15704 B18R1.27 C=C1CCN(CC1)CCCCCCCCCCC 34a_100000752442_100011215454 [0,1,0,1,0,0|2,0,0]=4 15705 B18R1.27 CCCCCCCCCCCN1CC=C(CC1)C 2230a_100000693516_100011215454 [0,1,0,1,0,0|2,0,0]=4 15706 B18R1.27 CCCCCCCCCCCN1CC=C(CC1)C 269982a_100000693516_100011215454 [0,1,0,1,0,0|2,0,0]=4 15707 B18R1.27 CCCCCCCCCCCN1CC=C(CC1)C 34a_100000693516_100011215454 [0,1,0,1,0,0|2,0,0]=4 15708 B18R1.27 CCCCCCCCCCCN1CCS(=O)CC1 2230a_100000752083_100011215454 [0,1,0,1,0,0|2,0,0]=4 15709 B18R1.27 CCCCCCCCCCCN1CCS(=O)CC1 269982a_100000752083_100011215454 [0,1,0,1,0,0|2,0,0]=4 15710 B18R1.27 CCCCCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210320 [0,1,0,1,0,0|1,0,0]=3 15711 B18R1.27 CCCCCCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210320 [0,1,0,1,0,0|1,0,0]=3 15712 B18R1.27 CCCCCCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210320 [0,1,0,1,0,0|1,0,0]=3 15713 B18R1.27 CCCCCCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210320 [0,1,0,1,0,0|1,0,0]=3 15714 B18R1.27 CCCCCCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210320 [0,1,0,1,0,0|1,0,0]=3 15715 B18R1.27 CCCCCCCCCCOC1CNC(=O)NC1 34a_100000080929_100000210320 [0,1,0,1,0,0|2,0,0]=4 15716 B18R1.27 CCCCCCCCCOCC1CCC(=O)CC1 34a_100000062911_100011214924 [0,1,0,1,0,0|1,0,0]=3 15717 B18R1.27 O=C1CCC(CC1)COCCCCCCCCO 34a_100000062911_100000033203 [0,1,0,1,0,0|2,0,0]=4 15718 B18R1.27 O=C1CCC(CC1)OCCCCCCCCCO 34a_100000764474_100009813782 [0,1,0,1,0,0|2,0,0]=4 15719 B18R1.27 O=C1CCC(CC1)OCCCCCCCCCO 7a_100000764474_100009813782 [0,1,0,1,0,0|2,0,0]=4 15720 B18R1.27 O=C1CCC(CN1)NCCCCCCCCCO 2230a_100000748762_100009813782 [0,1,0,1,0,0|2,0,0]=4 15721 B18R1.27 O=C1CCC(CN1)NCCCCCCCCCO 34a_100000748762_100009813782 [0,1,0,1,0,0|2,0,0]=4 15722 B18R1.27 O=C1CCC(CN1)OCCCCCCCCCO 34a_100000079199_100009813782 [0,1,0,1,0,0|2,0,0]=4 15723 B18R1.373 CCCCCCC1CCCC1NCCC(=O)NC 269862a_100000738227_100000189428 [0,1,0,1,0,0|1,0,0]=3 15724 B18R1.373 CCCCCCC1CCCC1NCCC(=O)NC 270004a_100000738227_100000189428 [0,1,0,1,0,0|1,0,0]=3 15725 B18R1.681 CCCCCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100000210320 [0,1,0,1,0,0|2,0,0]=4 15726 B18R1.681 CCCCCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210320 [0,1,0,1,0,0|2,0,0]=4 15727 B18R1.681 CCCCCCCCCCN1CCNC(=O)C1C 34a_100000750721_100000210320 [0,1,0,1,0,0|2,0,0]=4 15728 B18R1.681 CCCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210759 [0,1,0,1,0,0|1,0,0]=3 15729 B18R1.681 CCCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210759 [0,1,0,1,0,0|1,0,0]=3 15730 B18R1.681 CN1C(=O)CCCC1CNCCCCCCCO 2230a_200010383782_100000760002 [0,1,0,1,0,0|2,0,0]=4 15731 B18R1.681 CN1C(=O)CCCC1CNCCCCCCCO 34a_200010383782_100000760002 [0,1,0,1,0,0|2,0,0]=4 15732 B18R1.681 COCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100011998445 [0,1,0,1,0,0|2,0,0]=4 15733 B18R1.681 COCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100011998445 [0,1,0,1,0,0|2,0,0]=4 15734 B18R1.939 COC(=O)CCCCN1CCCCC1CCCO 2230a_100011934581_100000204269 [0,1,0,1,0,0|1,0,0]=3 15735 B18R1.939 COC(=O)CCCCN1CCCCC1CCCO 269982a_100011934581_100000204269 [0,1,0,1,0,0|1,0,0]=3 15736 B18R1.939 COC(=O)CCCCN1CCCCC1CCCO 34a_100011934581_100000204269 [0,1,0,1,0,0|1,0,0]=3 15737 B18R1.939 COC(=O)CCOCC1CCCCN1CCCN 34a_200011473794_100000742370 [0,1,0,1,0,0|2,0,0]=4 15738 B18R1.939 COC(=O)COCCN1CCCCC1CCCO 2230a_100011934581_100000090808 [0,1,0,1,0,0|2,0,0]=4 15739 B18R1.939 COC(=O)COCCN1CCCCC1CCCO 34a_100011934581_100000090808 [0,1,0,1,0,0|2,0,0]=4 15740 B18R1.939 COCCC1CCCCN1CCCCC(=O)OC 2230a_100015186528_100000204269 [0,1,0,1,0,0|1,0,0]=3 15741 B18R1.939 COCCC1CCCCN1CCCCC(=O)OC 269982a_100015186528_100000204269 [0,1,0,1,0,0|1,0,0]=3 15742 B18R1.939 COCCC1CCCCN1CCCCC(=O)OC 34a_100015186528_100000204269 [0,1,0,1,0,0|1,0,0]=3 15743 B18R1.939 COCCC1CCCCN1CCOCC(=O)OC 2230a_100015186528_100000090808 [0,1,0,1,0,0|2,0,0]=4 15744 B18R1.939 COCCC1CCCCN1CCOCC(=O)OC 34a_100015186528_100000090808 [0,1,0,1,0,0|2,0,0]=4 15745 B18R1.953 CCCCC1C=CCN1CCCCCC(=O)OC 2230a_100015184376_100009816466 [0,1,0,1,0,0|0,0,2]=4 15746 B18R1.953 CCCCC1C=CCN1CCCCCC(=O)OC 269982a_100015184376_100009816466 [0,1,0,1,0,0|0,0,2]=4 15747 B18R1.953 CCCCC1C=CCN1CCCCCC(=O)OC 34a_100015184376_100009816466 [0,1,0,1,0,0|0,0,2]=4 15748 B18R1.1160 CCC(=O)CCCCCCCCCC1OCCO1 1458a_100000210414_103619048131 [0,1,0,1,0,0|2,0,0]=4 15749 B18R1.1160 COC(=O)CCCCCCCCCN1CC=CC1 269982a_100015195280_100009813843 [0,1,0,1,0,0|0,0,2]=4 15750 B18R1.1160 COC(=O)CCCCCCCCCN1CCCC1 2230a_100000188435_100009813843 [0,1,0,1,0,0|0,0,0]=2 15751 B18R1.1160 COC(=O)CCCCCCCCCN1CCCC1 269982a_100000188435_100009813843 [0,1,0,1,0,0|0,0,0]=2 15752 B18R1.1160 COC(=O)CCCCCCCCCN1CCSC1 2230a_100011215254_100009813843 [0,1,0,1,0,0|1,0,0]=3 15753 B18R1.1160 COC(=O)CCCCCCCCCN1CCSC1 269982a_100011215254_100009813843 [0,1,0,1,0,0|1,0,0]=3 15754 B18R1.1160 COC(=O)CCCCCCCCNC1CC=CC1 2230a_100015188752_100010282707 [0,1,0,1,0,0|0,0,2]=4 15755 B18R1.1160 COC(=O)CCCCCCCCNC1CCCC1 2230a_100000211070_100010282707 [0,1,0,1,0,0|0,0,0]=2 15756 B18R1.1160 COC(=O)CCCCCCCCNC1CCCC1 34a_100000211070_100010282707 [0,1,0,1,0,0|0,0,0]=2 15757 B18R1.1160 COC(=O)CCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100010282707 [0,1,0,1,0,0|1,0,0]=3 15758 B18R1.1160 COC(=O)CCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100010282707 [0,1,0,1,0,0|1,0,0]=3 15759 B18R1.1160 COC(=O)CCCCCCCCN[C@H]1CCOC1 34a_100015188467_100010282707 [0,1,0,1,0,0|1,0,0]=3 15760 B18R1.1160 COC(=O)CCCCCCCCOC1CCCC1 34a_100000035544_100000179811 [0,1,0,1,0,0|0,0,0]=2 15761 B18R1.1160 COC(=O)CCCCCCCCOC1CCCC1 34a_100000210269_100010282707 [0,1,0,1,0,0|0,0,0]=2 15762 B18R1.1160 COC(=O)CCCCCCCCOC1CCCC1 7a_100000035544_100000179811 [0,1,0,1,0,0|0,0,0]=2 15763 B18R1.1160 COC(=O)CCCCCCCCOC1CCCC1 7a_100000210269_100010282707 [0,1,0,1,0,0|0,0,0]=2 15764 B18R1.1160 COC(=O)CCCCCCCCOC1CCCO1 34a_100000085407_100010282707 [0,1,0,1,0,0|1,0,0]=3 15765 B18R1.1160 COC(=O)CCCCCCCCOC1CCOC1 34a_100000035544_100000690089 [0,1,0,1,0,0|1,0,0]=3 15766 B18R1.1160 COC(=O)CCCCCCCCOC1CCOC1 7a_100000035544_100000731011 [0,1,0,1,0,0|1,0,0]=3 15767 B18R1.1160 COC(=O)CCCCCCCCOC1CCSC1 7a_100011232664_100010282707 [0,1,0,1,0,0|1,0,0]=3 15768 B18R1.1160 COC(=O)CCCCCCCCO[C@H]1CCOC1 34a_100000717292_100010282707 [0,1,0,1,0,0|1,0,0]=3 15769 B18R1.1160 COC(=O)CCCCCCCCSC1CCCC1 62a_100010282707_100000179811 [0,1,0,1,0,0|0,0,0]=2 15770 B18R1.1160 COC(=O)CCCCCCCCSC1CCCC1 62a_100011217020_100010282707 [0,1,0,1,0,0|0,0,0]=2 15771 B18R1.1160 COC(=O)CCCCCCCCSC1CCOC1 62a_100010282707_100000690089 [0,1,0,1,0,0|1,0,0]=3 15772 B18R1.1160 COC(=O)CCCCCCCNCC1CCCC1 2230a_100000737975_100010004213 [0,1,0,1,0,0|0,0,0]=2 15773 B18R1.1160 COC(=O)CCCCCCCNCC1CCCC1 34a_100000737975_100010004213 [0,1,0,1,0,0|0,0,0]=2 15774 B18R1.1160 COC(=O)CCCCCCCNCC1CCOC1 2230a_100000737293_100010004213 [0,1,0,1,0,0|1,0,0]=3 15775 B18R1.1160 COC(=O)CCCCCCCNCC1CCOC1 34a_100000737293_100010004213 [0,1,0,1,0,0|1,0,0]=3 15776 B18R1.1160 COC(=O)CCCCCCCNCC1OCCO1 2230a_100000036311_100010004213 [0,1,0,1,0,0|2,0,0]=4 15777 B18R1.1160 COC(=O)CCCCCCCNCC1OCCO1 34a_100000036311_100010004213 [0,1,0,1,0,0|2,0,0]=4 15778 B18R1.1160 COC(=O)CCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100010004213 [0,1,0,1,0,0|1,0,0]=3 15779 B18R1.1160 COC(=O)CCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100010004213 [0,1,0,1,0,0|1,0,0]=3 15780 B18R1.1160 COC(=O)CCCCCCCOCC1CC=CC1 34a_100000688395_100010004213 [0,1,0,1,0,0|0,0,2]=4 15781 B18R1.1160 COC(=O)CCCCCCCOCC1CCCC1 34a_100000742336_100010004213 [0,1,0,1,0,0|0,0,0]=2 15782 B18R1.1160 COC(=O)CCCCCCCOCC1CCCC1 34a_100011022521_100000740388 [0,1,0,1,0,0|0,0,0]=2 15783 B18R1.1160 COC(=O)CCCCCCCOCC1CCCC1 7a_100000742336_100010004213 [0,1,0,1,0,0|0,0,0]=2 15784 B18R1.1160 COC(=O)CCCCCCCOCC1CCCC1 7a_100011022521_100000740388 [0,1,0,1,0,0|0,0,0]=2 15785 B18R1.1160 COC(=O)CCCCCCCOCC1CCCO1 34a_100000210270_100010004213 [0,1,0,1,0,0|1,0,0]=3 15786 B18R1.1160 COC(=O)CCCCCCCOCC1CCCO1 7a_100000210270_100010004213 [0,1,0,1,0,0|1,0,0]=3 15787 B18R1.1160 COC(=O)CCCCCCCOCC1CCCO1 7a_100011022521_100000203698 [0,1,0,1,0,0|1,0,0]=3 15788 B18R1.1160 COC(=O)CCCCCCCOCC1CCNC1 34a_100000748654_100010004213 [0,1,0,1,0,0|1,0,0]=3 15789 B18R1.1160 COC(=O)CCCCCCCOCC1CCOC1 34a_100000740260_100010004213 [0,1,0,1,0,0|1,0,0]=3 15790 B18R1.1160 COC(=O)CCCCCCCOCC1CCOC1 34a_100011022521_100011261433 [0,1,0,1,0,0|1,0,0]=3 15791 B18R1.1160 COC(=O)CCCCCCCOCC1CCOC1 7a_100011022521_100000702531 [0,1,0,1,0,0|1,0,0]=3 15792 B18R1.1160 COC(=O)CCCCCCCOCC1COCO1 34a_100011216627_100010004213 [0,1,0,1,0,0|2,0,0]=4 15793 B18R1.1160 COC(=O)CCCCCCCOCC1OCCO1 34a_100000087154_100010004213 [0,1,0,1,0,0|2,0,0]=4 15794 B18R1.1160 COC(=O)CCCCCCCOCC1OCCO1 34a_100011022521_100000755774 [0,1,0,1,0,0|2,0,0]=4 15795 B18R1.1160 COC(=O)CCCCCCCOCC1OCCO1 7a_100011022521_100000755774 [0,1,0,1,0,0|2,0,0]=4 15796 B18R1.1160 COC(=O)CCCCCCCOC[C@H]1CCCN1 34a_100000745186_100010004213 [0,1,0,1,0,0|1,0,0]=3 15797 B18R1.1160 COC(=O)CCCCCCCSCC1CCCC1 62a_100000740388_100010004213 [0,1,0,1,0,0|0,0,0]=2 15798 B18R1.1160 COC(=O)CCCCCCCSCC1CCCC1 62a_100010004213_100000740388 [0,1,0,1,0,0|0,0,0]=2 15799 B18R1.1160 COC(=O)CCCCCCCSCC1CCCO1 62a_100000203698_100010004213 [0,1,0,1,0,0|1,0,0]=3 15800 B18R1.1160 COC(=O)CCCCCCCSCC1CCCO1 62a_100010004213_100000203698 [0,1,0,1,0,0|1,0,0]=3 15801 B18R1.1160 COC(=O)CCCCCCCSCC1CCOC1 62a_100000702531_100010004213 [0,1,0,1,0,0|1,0,0]=3 15802 B18R1.1160 COC(=O)CCCCCCCSCC1CCOC1 62a_100010004213_100000702531 [0,1,0,1,0,0|1,0,0]=3 15803 B18R1.1160 COC(=O)CCCCCCCSCC1OCCO1 62a_100000755774_100010004213 [0,1,0,1,0,0|2,0,0]=4 15804 B18R1.1160 COC(=O)CCCCCCCSCC1OCCO1 62a_100010004213_100000755774 [0,1,0,1,0,0|2,0,0]=4 15805 B18R1.1160 COC(=O)CCCCCCNCCC1CCCC1 2230a_100000739158_100009815986 [0,1,0,1,0,0|0,0,0]=2 15806 B18R1.1160 COC(=O)CCCCCCNCCC1CCCC1 34a_100000739158_100009815986 [0,1,0,1,0,0|0,0,0]=2 15807 B18R1.1160 COC(=O)CCCCCCNCCC1OCCO1 2230a_100000034215_100009815986 [0,1,0,1,0,0|2,0,0]=4 15808 B18R1.1160 COC(=O)CCCCCCNCCC1OCCO1 34a_100000034215_100009815986 [0,1,0,1,0,0|2,0,0]=4 15809 B18R1.1160 COC(=O)CCCCCCOCCC1CCCC1 34a_100000749090_100009815986 [0,1,0,1,0,0|0,0,0]=2 15810 B18R1.1160 COC(=O)CCCCCCOCCC1CCCC1 34a_100009863599_100000760354 [0,1,0,1,0,0|0,0,0]=2 15811 B18R1.1160 COC(=O)CCCCCCOCCC1CCCC1 7a_100000749090_100009815986 [0,1,0,1,0,0|0,0,0]=2 15812 B18R1.1160 COC(=O)CCCCCCOCCC1CCCC1 7a_100009863599_100000760354 [0,1,0,1,0,0|0,0,0]=2 15813 B18R1.1160 COC(=O)CCCCCCOCCC1CCNC1 34a_100016987287_100009815986 [0,1,0,1,0,0|1,0,0]=3 15814 B18R1.1160 COC(=O)CCCCCCOCCC1CCOC1 34a_100011879284_100009815986 [0,1,0,1,0,0|1,0,0]=3 15815 B18R1.1160 COC(=O)CCCCCCOCCC1OCCO1 34a_100009863599_100000740749 [0,1,0,1,0,0|2,0,0]=4 15816 B18R1.1160 COC(=O)CCCCCCOCCC1OCCO1 7a_100009863599_100000740749 [0,1,0,1,0,0|2,0,0]=4 15817 B18R1.1160 COC(=O)CCCCCCOCCN1CCCC1 7a_100009863599_100000004467 [0,1,0,1,0,0|1,0,0]=3 15818 B18R1.1160 COC(=O)CCCCCCSCCC1CCCC1 62a_100000760354_100009815986 [0,1,0,1,0,0|0,0,0]=2 15819 B18R1.1160 COC(=O)CCCCCCSCCC1CCCC1 62a_100009815986_100000760354 [0,1,0,1,0,0|0,0,0]=2 15820 B18R1.1160 COC(=O)CCCCCCSCCC1OCCO1 62a_100009815986_100000740749 [0,1,0,1,0,0|2,0,0]=4 15821 B18R1.1160 COC(=O)CCCCCCSCCN1CCCC1 62a_100000700749_100009815986 [0,1,0,1,0,0|1,0,0]=3 15822 B18R1.1160 COC(=O)CCCCCCSCCN1CCCC1 62a_100009815986_100000004467 [0,1,0,1,0,0|1,0,0]=3 15823 B18R1.1160 COC(=O)CCCCCNCCCC1CCCC1 2230a_100000736752_100009816466 [0,1,0,1,0,0|0,0,0]=2 15824 B18R1.1160 COC(=O)CCCCCNCCCC1CCCC1 34a_100000736752_100009816466 [0,1,0,1,0,0|0,0,0]=2 15825 B18R1.1160 COC(=O)CCCCCNCCOC1CCCC1 34a_100000741755_100009816466 [0,1,0,1,0,0|1,0,0]=3 15826 B18R1.1160 COC(=O)CCCCCOCCCC1CCCC1 34a_100000074720_100011713738 [0,1,0,1,0,0|0,0,0]=2 15827 B18R1.1160 COC(=O)CCCCCOCCCC1CCCC1 34a_100011215328_100009816466 [0,1,0,1,0,0|0,0,0]=2 15828 B18R1.1160 COC(=O)CCCCCOCCCC1CCCC1 7a_100000074720_100011713738 [0,1,0,1,0,0|0,0,0]=2 15829 B18R1.1160 COC(=O)CCCCCOCCCC1CCCC1 7a_100011215328_100009816466 [0,1,0,1,0,0|0,0,0]=2 15830 B18R1.1160 COC(=O)CCCCCOCCCC1OCCO1 34a_100000074720_100009861162 [0,1,0,1,0,0|2,0,0]=4 15831 B18R1.1160 COC(=O)CCCCCOCCCC1OCCO1 34a_100009871617_100009816466 [0,1,0,1,0,0|2,0,0]=4 15832 B18R1.1160 COC(=O)CCCCCOCCCC1OCCO1 7a_100000074720_100000042513 [0,1,0,1,0,0|2,0,0]=4 15833 B18R1.1160 COC(=O)CCCCCOCCCC1OCCO1 7a_100009871617_100009816466 [0,1,0,1,0,0|2,0,0]=4 15834 B18R1.1160 COC(=O)CCCCCOCCCN1CCCC1 34a_100000074720_100016991639 [0,1,0,1,0,0|1,0,0]=3 15835 B18R1.1160 COC(=O)CCCCCOCCCN1CCCC1 7a_100000074720_100011445909 [0,1,0,1,0,0|1,0,0]=3 15836 B18R1.1160 COC(=O)CCCCCOCCNC1CCCC1 34a_200000200444_100009816466 [0,1,0,1,0,0|1,0,0]=3 15837 B18R1.1160 COC(=O)CCCCCOCCOC1CCCC1 34a_100000738311_100009816466 [0,1,0,1,0,0|1,0,0]=3 15838 B18R1.1160 COC(=O)CCCCCOCCOC1CCCC1 7a_100000738311_100009816466 [0,1,0,1,0,0|1,0,0]=3 15839 B18R1.1160 COC(=O)CCCCCSCCCC1CCCC1 62a_100009816466_100011713738 [0,1,0,1,0,0|0,0,0]=2 15840 B18R1.1160 COC(=O)CCCCCSCCCC1CCCC1 62a_100011713738_100009816466 [0,1,0,1,0,0|0,0,0]=2 15841 B18R1.1160 COC(=O)CCCCCSCCCC1OCCO1 62a_100009816466_100000042513 [0,1,0,1,0,0|2,0,0]=4 15842 B18R1.1160 COC(=O)CCCCCSCCCN1CCCC1 62a_100009816466_100011445909 [0,1,0,1,0,0|1,0,0]=3 15843 B18R1.1160 COC(=O)CCCCCSCCCN1CCCC1 62a_100016991639_100009816466 [0,1,0,1,0,0|1,0,0]=3 15844 B18R1.1160 COC(=O)CCCCNCCCOC1CCCC1 34a_100000747560_100000204269 [0,1,0,1,0,0|1,0,0]=3 15845 B18R1.1160 COC(=O)CCCCOCCCCC1OCCO1 34a_100000059025_200009813554 [0,1,0,1,0,0|2,0,0]=4 15846 B18R1.1160 COC(=O)CCCCOCCCCC1OCCO1 7a_100000059025_100000034956 [0,1,0,1,0,0|2,0,0]=4 15847 B18R1.1160 COC(=O)CCCCSCCCCC1OCCO1 62a_100000204269_100000034956 [0,1,0,1,0,0|2,0,0]=4 15848 B18R1.1160 COC(=O)CCCOCCCCOC1CCCO1 34a_100011018183_100000742333 [0,1,0,1,0,0|2,0,0]=4 15849 B18R1.1160 COC(=O)CCCOCCCCOC1CCCO1 7a_100011018183_100011218270 [0,1,0,1,0,0|2,0,0]=4 15850 B18R1.1160 COC(=O)CCOCCOCCOC1CCCC1 34a_100010982084_100000179811 [0,1,0,1,0,0|2,0,0]=4 15851 B18R1.1160 COC(=O)CCOCCOCCOC1CCCC1 7a_100010982084_100000179811 [0,1,0,1,0,0|2,0,0]=4 15852 B18R1.1160 COC(=O)COCCNCCCOC1CCCC1 34a_100000747560_100000090808 [0,1,0,1,0,0|2,0,0]=4 15853 B18R1.1160 COC(=O)COCCOCCOCC1CCCC1 34a_100011023656_100000740388 [0,1,0,1,0,0|2,0,0]=4 15854 B18R1.1160 COC(=O)COCCOCCOCC1CCCC1 7a_100011023656_100000740388 [0,1,0,1,0,0|2,0,0]=4 15855 B18R1.1165 COC(=O)CCCCCOC1CCCCCC1=O 7a_100000074720_100000243696 [0,1,0,1,0,0|1,0,1]=4 15856 B18R1.1165 COC(=O)CCCCCSC1CCCCCC1=O 62a_100000243696_100009816466 [0,1,0,1,0,0|1,0,1]=4 15857 B18R1.1165 COC(=O)CCCCCSC1CCCCCC1=O 62a_100009816466_100000243696 [0,1,0,1,0,0|1,0,1]=4 15858 B18R1.1194 CNC(=O)CCCNCCCN1CCCCC1C 34a_100000212276_100000741757 [0,1,0,1,0,0|2,0,0]=4 15859 B18R1.1194 CNC(=O)CCCOCCCN1CCCCC1C 34a_100000213889_100000741757 [0,1,0,1,0,0|2,0,0]=4 15860 B18R1.1194 CNC(=O)CCCOCCCN1CCCCC1C 7a_100000213889_100000741757 [0,1,0,1,0,0|2,0,0]=4 15861 B18R1.1194 COC(=O)CCCCCCCN1CCCCC1C 2230a_100000211376_100010004213 [0,1,0,1,0,0|0,0,0]=2 15862 B18R1.1194 COC(=O)CCCCCCCN1CCCCC1C 269982a_100000211376_100010004213 [0,1,0,1,0,0|0,0,0]=2 15863 B18R1.1194 COC(=O)CCCCCCCN1CCCCC1C 34a_100000211376_100010004213 [0,1,0,1,0,0|0,0,0]=2 15864 B18R1.1194 COC(=O)CCCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100010004213 [0,1,0,1,0,0|1,0,0]=3 15865 B18R1.1194 COC(=O)CCCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100010004213 [0,1,0,1,0,0|1,0,0]=3 15866 B18R1.1194 COC(=O)CCCCCCCN1CCOC[C@@H]1C 34a_100009815349_100010004213 [0,1,0,1,0,0|1,0,0]=3 15867 B18R1.1194 COC(=O)CCCCCCNC1CCCCC1C 2230a_100000211402_100009815986 [0,1,0,1,0,0|0,0,0]=2 15868 B18R1.1194 COC(=O)CCCCCCNC1CCCCC1C 34a_100000211402_100009815986 [0,1,0,1,0,0|0,0,0]=2 15869 B18R1.1194 COC(=O)CCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009815986 [0,1,0,1,0,0|1,0,0]=3 15870 B18R1.1194 COC(=O)CCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009815986 [0,1,0,1,0,0|1,0,0]=3 15871 B18R1.1194 COC(=O)CCCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100009815986 [0,1,0,1,0,0|2,0,0]=4 15872 B18R1.1194 COC(=O)CCCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100009815986 [0,1,0,1,0,0|2,0,0]=4 15873 B18R1.1194 COC(=O)CCCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100009815986 [0,1,0,1,0,0|2,0,0]=4 15874 B18R1.1194 COC(=O)CCCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100009815986 [0,1,0,1,0,0|2,0,0]=4 15875 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1=O 34a_100009863599_100000754470 [0,1,0,1,0,0|1,0,1]=4 15876 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1=O 34a_100011214950_100009815986 [0,1,0,1,0,0|1,0,1]=4 15877 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1=O 7a_100009863599_100000204591 [0,1,0,1,0,0|1,0,1]=4 15878 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1C 34a_100000211207_100009815986 [0,1,0,1,0,0|0,0,0]=2 15879 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1C 7a_100000211207_100009815986 [0,1,0,1,0,0|0,0,0]=2 15880 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1Cl 34a_100000038908_100009815986 [0,1,0,1,0,0|1,0,0]=3 15881 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1Cl 7a_100000038908_100009815986 [0,1,0,1,0,0|1,0,0]=3 15882 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1F 34a_100009863599_100015423560 [0,1,0,1,0,0|1,0,0]=3 15883 B18R1.1194 COC(=O)CCCCCCOC1CCCCC1O 34a_100009863599_100000038908 [0,1,0,1,0,0|1,0,0]=3 15884 B18R1.1194 COC(=O)CCCCCCOC1CCNCC1C 34a_100011998114_100009815986 [0,1,0,1,0,0|1,0,0]=3 15885 B18R1.1194 COC(=O)CCCCCCOC1CNCCC1C 34a_100000696640_100009815986 [0,1,0,1,0,0|1,0,0]=3 15886 B18R1.1194 COC(=O)CCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009815986 [0,1,0,1,0,0|1,0,0]=3 15887 B18R1.1194 COC(=O)CCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100009815986 [0,1,0,1,0,0|1,0,0]=3 15888 B18R1.1194 COC(=O)CCCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100009815986 [0,1,0,1,0,0|2,0,0]=4 15889 B18R1.1194 COC(=O)CCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100009815986 [0,1,0,1,0,0|1,0,0]=3 15890 B18R1.1194 COC(=O)CCCCCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100009815986 [0,1,0,1,0,0|2,0,0]=4 15891 B18R1.1194 COC(=O)CCCCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100009815986 [0,1,0,1,0,0|2,0,0]=4 15892 B18R1.1194 COC(=O)CCCCCCSC1CCCCC1=O 62a_100000204591_100009815986 [0,1,0,1,0,0|1,0,1]=4 15893 B18R1.1194 COC(=O)CCCCCCSC1CCCCC1=O 62a_100009815986_100000204591 [0,1,0,1,0,0|1,0,1]=4 15894 B18R1.1194 COC(=O)CCCCCCSC1CCCCC1F 62a_100009815986_100015423560 [0,1,0,1,0,0|1,0,0]=3 15895 B18R1.1194 COC(=O)CCCCCCSC1CCCCC1F 62a_100015423560_100009815986 [0,1,0,1,0,0|1,0,0]=3 15896 B18R1.1194 COC(=O)CCCCCCSC1CCCCC1O 62a_100000038908_100009815986 [0,1,0,1,0,0|1,0,0]=3 15897 B18R1.1194 COC(=O)CCCCCCSC1CCCCC1O 62a_100009815986_100000038908 [0,1,0,1,0,0|1,0,0]=3 15898 B18R1.1194 COC(=O)CCCCCNCC1CCCCC1O 34a_100011216029_100009816466 [0,1,0,1,0,0|1,0,0]=3 15899 B18R1.1194 COC(=O)CCCCCNCC1CCCCN1C 34a_100011228421_100009816466 [0,1,0,1,0,0|1,0,0]=3 15900 B18R1.1194 COC(=O)CCCCCOCC1CC=CCC1C 34a_100000211322_100009816466 [0,1,0,1,0,0|0,0,2]=4 15901 B18R1.1194 COC(=O)CCCCCOCC1CCCCC1=O 34a_100009861125_100009816466 [0,1,0,1,0,0|1,0,1]=4 15902 B18R1.1194 COC(=O)CCCCCOCC1CCCCC1=O 7a_100009861125_100009816466 [0,1,0,1,0,0|1,0,1]=4 15903 B18R1.1194 COC(=O)CCCCCOCC1CCCCN1C 34a_100000074720_100015186950 [0,1,0,1,0,0|1,0,0]=3 15904 B18R1.1194 COC(=O)CCCCCOCC1CCCCN1C 34a_100000225079_100009816466 [0,1,0,1,0,0|1,0,0]=3 15905 B18R1.1194 COC(=O)CCCCCOCC1CCCCN1C 7a_100000074720_100015185383 [0,1,0,1,0,0|1,0,0]=3 15906 B18R1.1194 COC(=O)CCCCCOCC1COCCC1N 34a_214813039666_100009816466 [0,1,0,1,0,0|2,0,0]=4 15907 B18R1.1194 COC(=O)CCCCCOCC1COCCN1C 34a_100013547906_100009816466 [0,1,0,1,0,0|2,0,0]=4 15908 B18R1.1194 COC(=O)CCCCCSCC1CCCCN1C 62a_100009816466_100015185383 [0,1,0,1,0,0|1,0,0]=3 15909 B18R1.1194 COC(=O)CCCCCSCC1CCCCN1C 62a_100015185383_100009816466 [0,1,0,1,0,0|1,0,0]=3 15910 B18R1.1194 COC(=O)CCCCNCCN1CCCCC1C 2230a_100000739827_100000204269 [0,1,0,1,0,0|1,0,0]=3 15911 B18R1.1194 COC(=O)CCCCNCCN1CCCCC1C 34a_100000739827_100000204269 [0,1,0,1,0,0|1,0,0]=3 15912 B18R1.1194 COC(=O)CCCCOCCC1CCCCN1C 34a_100000059025_100000211948 [0,1,0,1,0,0|1,0,0]=3 15913 B18R1.1194 COC(=O)CCCCOCCC1CCCCN1C 7a_100000059025_100000211948 [0,1,0,1,0,0|1,0,0]=3 15914 B18R1.1194 COC(=O)CCCCOCCN1CCCCC1C 34a_100011305533_100000204269 [0,1,0,1,0,0|1,0,0]=3 15915 B18R1.1194 COC(=O)CCCCSCCC1CCCCN1C 62a_100000204269_100000211948 [0,1,0,1,0,0|1,0,0]=3 15916 B18R1.1194 COC(=O)CCCCSCCC1CCCCN1C 62a_100000211948_100000204269 [0,1,0,1,0,0|1,0,0]=3 15917 B18R1.1194 COC(=O)CCCNCCCN1CCCCC1C 34a_100000212276_100000742333 [0,1,0,1,0,0|1,0,0]=3 15918 B18R1.1194 COC(=O)CCCOCCCN1CCCCC1C 34a_100000213889_100000742333 [0,1,0,1,0,0|1,0,0]=3 15919 B18R1.1194 COC(=O)CCCOCCCN1CCCCC1C 7a_100000213889_100011218270 [0,1,0,1,0,0|1,0,0]=3 15920 B18R1.1194 COC(=O)COCCNCCN1CCCCC1C 2230a_100000739827_100000090808 [0,1,0,1,0,0|2,0,0]=4 15921 B18R1.1194 COC(=O)COCCNCCN1CCCCC1C 34a_100000739827_100000090808 [0,1,0,1,0,0|2,0,0]=4 15922 B18R1.1194 COC(=O)COCCOCCN1CCCCC1C 34a_100011305533_100000090808 [0,1,0,1,0,0|2,0,0]=4 15923 B18R1.1194 COC(=O)COCCSCCC1CCCCN1C 62a_100000090808_100000211948 [0,1,0,1,0,0|2,0,0]=4 15924 B18R1.1194 COC(=O)COCCSCCC1CCCCN1C 62a_100000211948_100000090808 [0,1,0,1,0,0|2,0,0]=4 15925 B18R1.1224 CNC(=O)CCCNCCCOC1CCCCC1 34a_100000205933_100000741757 [0,1,0,1,0,0|2,0,0]=4 15926 B18R1.1224 CNC(=O)CCCOCCCCC1CCCCC1 34a_100011215267_100000741757 [0,1,0,1,0,0|1,0,0]=3 15927 B18R1.1224 CNC(=O)CCCOCCCCC1CCCCC1 7a_100011215267_100000741757 [0,1,0,1,0,0|1,0,0]=3 15928 B18R1.1224 CNC(=O)CCCOCCCCC1CCNCC1 34a_100016989291_100000741757 [0,1,0,1,0,0|2,0,0]=4 15929 B18R1.1224 CNC(=O)CCOCCCCCN1CCCCC1 34a_100011216611_100012179268 [0,1,0,1,0,0|2,0,0]=4 15930 B18R1.1224 CNC(=O)CCOCCCCCN1CCCCC1 7a_100011216611_100000737683 [0,1,0,1,0,0|2,0,0]=4 15931 B18R1.1224 CNC(=O)OCCOCCCCC1CCCCC1 34a_100011215267_200011997002 [0,1,0,1,0,0|2,0,0]=4 15932 B18R1.1224 CNC(=O)OCCOCCCCC1CCCCC1 7a_100011215267_200011997002 [0,1,0,1,0,0|2,0,0]=4 15933 B18R1.1224 COC(=O)/C=C/COCCCCC1CCCCC1 34a_100011215267_100000742655 [0,1,0,1,0,0|0,0,2]=4 15934 B18R1.1224 COC(=O)/C=C/COCCCCC1CCCCC1 7a_100011215267_100000742655 [0,1,0,1,0,0|0,0,2]=4 15935 B18R1.1224 COC(=O)CCCCC=NNCC1CCCCC1 4a_100000740227_100000052768 [0,1,0,1,0,0|1,0,1]=4 15936 B18R1.1224 COC(=O)CCCCCCCCN1CC=CCC1 2230a_100000698166_100010282707 [0,1,0,1,0,0|0,0,2]=4 15937 B18R1.1224 COC(=O)CCCCCCCCN1CC=CCC1 269982a_100000698166_100010282707 [0,1,0,1,0,0|0,0,2]=4 15938 B18R1.1224 COC(=O)CCCCCCCCN1CC=CCC1 34a_100000698166_100010282707 [0,1,0,1,0,0|0,0,2]=4 15939 B18R1.1224 COC(=O)CCCCCCCCN1CCCOC1 2230a_100000131196_100010282707 [0,1,0,1,0,0|1,0,0]=3 15940 B18R1.1224 COC(=O)CCCCCCCCN1CCCOC1 269982a_100000131196_100010282707 [0,1,0,1,0,0|1,0,0]=3 15941 B18R1.1224 COC(=O)CCCCCCCCN1CCCOC1 34a_100000131196_100010282707 [0,1,0,1,0,0|1,0,0]=3 15942 B18R1.1224 COC(=O)CCCCCCCCN1CCOCC1 2230a_100015191051_100010282707 [0,1,0,1,0,0|1,0,0]=3 15943 B18R1.1224 COC(=O)CCCCCCCCN1CCOCC1 269982a_100015191051_100010282707 [0,1,0,1,0,0|1,0,0]=3 15944 B18R1.1224 COC(=O)CCCCCCCCN1CCOCC1 34a_100015191051_100010282707 [0,1,0,1,0,0|1,0,0]=3 15945 B18R1.1224 COC(=O)CCCCCCCCN1CCSCC1 2230a_100000737611_100010282707 [0,1,0,1,0,0|1,0,0]=3 15946 B18R1.1224 COC(=O)CCCCCCCCN1CCSCC1 269982a_100000737611_100010282707 [0,1,0,1,0,0|1,0,0]=3 15947 B18R1.1224 COC(=O)CCCCCCCNC1CCCCC1 2230a_100000182618_100010004213 [0,1,0,1,0,0|0,0,0]=2 15948 B18R1.1224 COC(=O)CCCCCCCNC1CCCCC1 34a_100000182618_100010004213 [0,1,0,1,0,0|0,0,0]=2 15949 B18R1.1224 COC(=O)CCCCCCCNC1CCCOC1 2230a_100000719290_100010004213 [0,1,0,1,0,0|1,0,0]=3 15950 B18R1.1224 COC(=O)CCCCCCCNC1CCCOC1 34a_100000719290_100010004213 [0,1,0,1,0,0|1,0,0]=3 15951 B18R1.1224 COC(=O)CCCCCCCNC1CCOCC1 2230a_100000741149_100010004213 [0,1,0,1,0,0|1,0,0]=3 15952 B18R1.1224 COC(=O)CCCCCCCNC1CCOCC1 34a_100000741149_100010004213 [0,1,0,1,0,0|1,0,0]=3 15953 B18R1.1224 COC(=O)CCCCCCCNC1CCSCC1 2230a_100000748639_100010004213 [0,1,0,1,0,0|1,0,0]=3 15954 B18R1.1224 COC(=O)CCCCCCCNC1CCSCC1 34a_100000748639_100010004213 [0,1,0,1,0,0|1,0,0]=3 15955 B18R1.1224 COC(=O)CCCCCCCOC1C=CCCC1 34a_100011215024_100010004213 [0,1,0,1,0,0|0,0,2]=4 15956 B18R1.1224 COC(=O)CCCCCCCOC1C=CCCC1 7a_100011022521_100000751183 [0,1,0,1,0,0|0,0,2]=4 15957 B18R1.1224 COC(=O)CCCCCCCOC1CC=CCC1 34a_100000073881_100010004213 [0,1,0,1,0,0|0,0,2]=4 15958 B18R1.1224 COC(=O)CCCCCCCOC1CCCCC1 34a_100000210231_100010004213 [0,1,0,1,0,0|0,0,0]=2 15959 B18R1.1224 COC(=O)CCCCCCCOC1CCCCC1 34a_100011022521_100000210327 [0,1,0,1,0,0|0,0,0]=2 15960 B18R1.1224 COC(=O)CCCCCCCOC1CCCCC1 7a_100000210231_100010004213 [0,1,0,1,0,0|0,0,0]=2 15961 B18R1.1224 COC(=O)CCCCCCCOC1CCCCC1 7a_100011022521_100000210327 [0,1,0,1,0,0|0,0,0]=2 15962 B18R1.1224 COC(=O)CCCCCCCOC1CCCCO1 34a_100000033831_100010004213 [0,1,0,1,0,0|1,0,0]=3 15963 B18R1.1224 COC(=O)CCCCCCCOC1CCCOC1 34a_100000754041_100010004213 [0,1,0,1,0,0|1,0,0]=3 15964 B18R1.1224 COC(=O)CCCCCCCOC1CCCOC1 34a_100011022521_100000693364 [0,1,0,1,0,0|1,0,0]=3 15965 B18R1.1224 COC(=O)CCCCCCCOC1CCCOC1 7a_100011022521_100000693364 [0,1,0,1,0,0|1,0,0]=3 15966 B18R1.1224 COC(=O)CCCCCCCOC1CCCSC1 7a_100015962668_100010004213 [0,1,0,1,0,0|1,0,0]=3 15967 B18R1.1224 COC(=O)CCCCCCCOC1CCOCC1 34a_100000744328_100010004213 [0,1,0,1,0,0|1,0,0]=3 15968 B18R1.1224 COC(=O)CCCCCCCOC1CCOCC1 7a_100011022521_100000686592 [0,1,0,1,0,0|1,0,0]=3 15969 B18R1.1224 COC(=O)CCCCCCCOC1CCSCC1 34a_100000731022_100010004213 [0,1,0,1,0,0|1,0,0]=3 15970 B18R1.1224 COC(=O)CCCCCCCOC1CCSCC1 34a_100011022521_100000069128 [0,1,0,1,0,0|1,0,0]=3 15971 B18R1.1224 COC(=O)CCCCCCCOC1CCSCC1 7a_100000731022_100010004213 [0,1,0,1,0,0|1,0,0]=3 15972 B18R1.1224 COC(=O)CCCCCCCOC1CCSCC1 7a_100011022521_100011500858 [0,1,0,1,0,0|1,0,0]=3 15973 B18R1.1224 COC(=O)CCCCCCCSC1C=CCCC1 62a_100000751183_100010004213 [0,1,0,1,0,0|0,0,2]=4 15974 B18R1.1224 COC(=O)CCCCCCCSC1C=CCCC1 62a_100010004213_100000751183 [0,1,0,1,0,0|0,0,2]=4 15975 B18R1.1224 COC(=O)CCCCCCCSC1CCCCC1 62a_100000210327_100010004213 [0,1,0,1,0,0|0,0,0]=2 15976 B18R1.1224 COC(=O)CCCCCCCSC1CCCCC1 62a_100010004213_100000210327 [0,1,0,1,0,0|0,0,0]=2 15977 B18R1.1224 COC(=O)CCCCCCCSC1CCCOC1 62a_100010004213_100000693364 [0,1,0,1,0,0|1,0,0]=3 15978 B18R1.1224 COC(=O)CCCCCCCSC1CCOCC1 62a_100010004213_100011324220 [0,1,0,1,0,0|1,0,0]=3 15979 B18R1.1224 COC(=O)CCCCCCCSC1CCSCC1 62a_100010004213_100000069128 [0,1,0,1,0,0|1,0,0]=3 15980 B18R1.1224 COC(=O)CCCCCCNCC1CCCCC1 2230a_100000210473_100009815986 [0,1,0,1,0,0|0,0,0]=2 15981 B18R1.1224 COC(=O)CCCCCCNCC1CCCCC1 34a_100000210473_100009815986 [0,1,0,1,0,0|0,0,0]=2 15982 B18R1.1224 COC(=O)CCCCCCNCC1CCCCO1 2230a_100000174945_100009815986 [0,1,0,1,0,0|1,0,0]=3 15983 B18R1.1224 COC(=O)CCCCCCNCC1CCCCO1 34a_100000174945_100009815986 [0,1,0,1,0,0|1,0,0]=3 15984 B18R1.1224 COC(=O)CCCCCCNCC1CCCOC1 2230a_100000720124_100009815986 [0,1,0,1,0,0|1,0,0]=3 15985 B18R1.1224 COC(=O)CCCCCCNCC1CCCOC1 34a_100000720124_100009815986 [0,1,0,1,0,0|1,0,0]=3 15986 B18R1.1224 COC(=O)CCCCCCNCC1CCOCC1 2230a_100000746373_100009815986 [0,1,0,1,0,0|1,0,0]=3 15987 B18R1.1224 COC(=O)CCCCCCNCC1CCOCC1 34a_100000746373_100009815986 [0,1,0,1,0,0|1,0,0]=3 15988 B18R1.1224 COC(=O)CCCCCCNCC1CCSCC1 2230a_100015188806_100009815986 [0,1,0,1,0,0|1,0,0]=3 15989 B18R1.1224 COC(=O)CCCCCCNCC1CCSCC1 34a_100015188806_100009815986 [0,1,0,1,0,0|1,0,0]=3 15990 B18R1.1224 COC(=O)CCCCCCNC[C@H]1COCCO1 2230a_100010981119_100009815986 [0,1,0,1,0,0|2,0,0]=4 15991 B18R1.1224 COC(=O)CCCCCCNC[C@H]1COCCO1 34a_100010981119_100009815986 [0,1,0,1,0,0|2,0,0]=4 15992 B18R1.1224 COC(=O)CCCCCCOCC1CC=CCC1 34a_100000210713_100009815986 [0,1,0,1,0,0|0,0,2]=4 15993 B18R1.1224 COC(=O)CCCCCCOCC1CCCCC1 34a_100000212181_100009815986 [0,1,0,1,0,0|0,0,0]=2 15994 B18R1.1224 COC(=O)CCCCCCOCC1CCCCC1 34a_100009863599_100000211423 [0,1,0,1,0,0|0,0,0]=2 15995 B18R1.1224 COC(=O)CCCCCCOCC1CCCCC1 7a_100000212181_100009815986 [0,1,0,1,0,0|0,0,0]=2 15996 B18R1.1224 COC(=O)CCCCCCOCC1CCCCC1 7a_100009863599_100000211423 [0,1,0,1,0,0|0,0,0]=2 15997 B18R1.1224 COC(=O)CCCCCCOCC1CCCCN1 34a_100000210821_100009815986 [0,1,0,1,0,0|1,0,0]=3 15998 B18R1.1224 COC(=O)CCCCCCOCC1CCCCO1 34a_100000211370_100009815986 [0,1,0,1,0,0|1,0,0]=3 15999 B18R1.1224 COC(=O)CCCCCCOCC1CCCCO1 34a_100009863599_100000211543 [0,1,0,1,0,0|1,0,0]=3 16000 B18R1.1224 COC(=O)CCCCCCOCC1CCCCO1 7a_100000211370_100009815986 [0,1,0,1,0,0|1,0,0]=3 16001 B18R1.1224 COC(=O)CCCCCCOCC1CCCCO1 7a_100009863599_100000211543 [0,1,0,1,0,0|1,0,0]=3 16002 B18R1.1224 COC(=O)CCCCCCOCC1CCCNC1 34a_100000211344_100009815986 [0,1,0,1,0,0|1,0,0]=3 16003 B18R1.1224 COC(=O)CCCCCCOCC1CCCOC1 34a_100000741520_100009815986 [0,1,0,1,0,0|1,0,0]=3 16004 B18R1.1224 COC(=O)CCCCCCOCC1CCCOC1 34a_100009863599_100000741521 [0,1,0,1,0,0|1,0,0]=3 16005 B18R1.1224 COC(=O)CCCCCCOCC1CCCOC1 7a_100009863599_100000741521 [0,1,0,1,0,0|1,0,0]=3 16006 B18R1.1224 COC(=O)CCCCCCOCC1CCNCC1 34a_100000738675_100009815986 [0,1,0,1,0,0|1,0,0]=3 16007 B18R1.1224 COC(=O)CCCCCCOCC1CCOCC1 34a_100000749013_100009815986 [0,1,0,1,0,0|1,0,0]=3 16008 B18R1.1224 COC(=O)CCCCCCOCC1CCOCC1 34a_100009863599_100000754603 [0,1,0,1,0,0|1,0,0]=3 16009 B18R1.1224 COC(=O)CCCCCCOCC1CCOCC1 7a_100009863599_100000754603 [0,1,0,1,0,0|1,0,0]=3 16010 B18R1.1224 COC(=O)CCCCCCOCC1CCSCC1 34a_100000070558_100009815986 [0,1,0,1,0,0|1,0,0]=3 16011 B18R1.1224 COC(=O)CCCCCCOCC1CCSCC1 7a_100000070558_100009815986 [0,1,0,1,0,0|1,0,0]=3 16012 B18R1.1224 COC(=O)CCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100009815986 [0,1,0,1,0,0|2,0,0]=4 16013 B18R1.1224 COC(=O)CCCCCCOC[C@@H]1COCCN1 34a_100000717676_100009815986 [0,1,0,1,0,0|2,0,0]=4 16014 B18R1.1224 COC(=O)CCCCCCOC[C@H]1COCCO1 34a_100009875890_100009815986 [0,1,0,1,0,0|2,0,0]=4 16015 B18R1.1224 COC(=O)CCCCCCSCC1CCCCC1 62a_100000211423_100009815986 [0,1,0,1,0,0|0,0,0]=2 16016 B18R1.1224 COC(=O)CCCCCCSCC1CCCCC1 62a_100009815986_100000211423 [0,1,0,1,0,0|0,0,0]=2 16017 B18R1.1224 COC(=O)CCCCCCSCC1CCCCO1 62a_100000211543_100009815986 [0,1,0,1,0,0|1,0,0]=3 16018 B18R1.1224 COC(=O)CCCCCCSCC1CCCCO1 62a_100009815986_100000211543 [0,1,0,1,0,0|1,0,0]=3 16019 B18R1.1224 COC(=O)CCCCCCSCC1CCCOC1 62a_100000741521_100009815986 [0,1,0,1,0,0|1,0,0]=3 16020 B18R1.1224 COC(=O)CCCCCCSCC1CCCOC1 62a_100009815986_100000741521 [0,1,0,1,0,0|1,0,0]=3 16021 B18R1.1224 COC(=O)CCCCCCSCC1CCOCC1 62a_100000754603_100009815986 [0,1,0,1,0,0|1,0,0]=3 16022 B18R1.1224 COC(=O)CCCCCCSCC1CCOCC1 62a_100009815986_100000749018 [0,1,0,1,0,0|1,0,0]=3 16023 B18R1.1224 COC(=O)CCCCCNCCC1=CCCCC1 2230a_100000212019_100009816466 [0,1,0,1,0,0|0,0,2]=4 16024 B18R1.1224 COC(=O)CCCCCNCCC1=CCCCC1 34a_100000212019_100009816466 [0,1,0,1,0,0|0,0,2]=4 16025 B18R1.1224 COC(=O)CCCCCNCCC1CCCCC1 2230a_100000738074_100009816466 [0,1,0,1,0,0|0,0,0]=2 16026 B18R1.1224 COC(=O)CCCCCNCCC1CCCCC1 34a_100000738074_100009816466 [0,1,0,1,0,0|0,0,0]=2 16027 B18R1.1224 COC(=O)CCCCCNCCC1CCCCO1 2230a_100015183643_100009816466 [0,1,0,1,0,0|1,0,0]=3 16028 B18R1.1224 COC(=O)CCCCCNCCC1CCCCO1 34a_100015183643_100009816466 [0,1,0,1,0,0|1,0,0]=3 16029 B18R1.1224 COC(=O)CCCCCNCCC1CCOCC1 2230a_100000755988_100009816466 [0,1,0,1,0,0|1,0,0]=3 16030 B18R1.1224 COC(=O)CCCCCNCCC1CCOCC1 34a_100000755988_100009816466 [0,1,0,1,0,0|1,0,0]=3 16031 B18R1.1224 COC(=O)CCCCCNCCN1CCSCC1 2230a_100000755026_100009816466 [0,1,0,1,0,0|2,0,0]=4 16032 B18R1.1224 COC(=O)CCCCCOCCC1CCCCC1 34a_100000074720_100011209188 [0,1,0,1,0,0|0,0,0]=2 16033 B18R1.1224 COC(=O)CCCCCOCCC1CCCCC1 34a_100011217863_100009816466 [0,1,0,1,0,0|0,0,0]=2 16034 B18R1.1224 COC(=O)CCCCCOCCC1CCCCC1 7a_100000074720_100011273959 [0,1,0,1,0,0|0,0,0]=2 16035 B18R1.1224 COC(=O)CCCCCOCCC1CCCCC1 7a_100011217863_100009816466 [0,1,0,1,0,0|0,0,0]=2 16036 B18R1.1224 COC(=O)CCCCCOCCC1CCCCN1 34a_100000211664_100009816466 [0,1,0,1,0,0|1,0,0]=3 16037 B18R1.1224 COC(=O)CCCCCOCCC1CCCNC1 34a_100000752241_100009816466 [0,1,0,1,0,0|1,0,0]=3 16038 B18R1.1224 COC(=O)CCCCCOCCC1CCNCC1 34a_100015190746_100009816466 [0,1,0,1,0,0|1,0,0]=3 16039 B18R1.1224 COC(=O)CCCCCOCCC1CCOCC1 34a_100000074720_100011934994 [0,1,0,1,0,0|1,0,0]=3 16040 B18R1.1224 COC(=O)CCCCCOCCC1CCOCC1 34a_100011933979_100009816466 [0,1,0,1,0,0|1,0,0]=3 16041 B18R1.1224 COC(=O)CCCCCOCCC1CCOCC1 7a_100000074720_100011934994 [0,1,0,1,0,0|1,0,0]=3 16042 B18R1.1224 COC(=O)CCCCCOCCC1CCOCC1 7a_100011933979_100009816466 [0,1,0,1,0,0|1,0,0]=3 16043 B18R1.1224 COC(=O)CCCCCOCCC1OCCCO1 34a_100000074720_100000764188 [0,1,0,1,0,0|2,0,0]=4 16044 B18R1.1224 COC(=O)CCCCCOCCC1OCCCO1 7a_100000074720_100000764188 [0,1,0,1,0,0|2,0,0]=4 16045 B18R1.1224 COC(=O)CCCCCOCCC1SCCCS1 34a_200011025297_100009816466 [0,1,0,1,0,0|2,0,0]=4 16046 B18R1.1224 COC(=O)CCCCCOCCC1SCCCS1 7a_200011025297_100009816466 [0,1,0,1,0,0|2,0,0]=4 16047 B18R1.1224 COC(=O)CCCCCOCCN1CCCCC1 34a_100000074720_100000739454 [0,1,0,1,0,0|1,0,0]=3 16048 B18R1.1224 COC(=O)CCCCCOCCN1CCCCC1 7a_100000074720_100000739454 [0,1,0,1,0,0|1,0,0]=3 16049 B18R1.1224 COC(=O)CCCCCOCCN1CCOCC1 7a_100000074720_100000211760 [0,1,0,1,0,0|2,0,0]=4 16050 B18R1.1224 COC(=O)CCCCCOCCN1CCSCC1 7a_100000686052_100009816466 [0,1,0,1,0,0|2,0,0]=4 16051 B18R1.1224 COC(=O)CCCCCOCC[C@@H]1CNCCN1 34a_100016989929_100009816466 [0,1,0,1,0,0|2,0,0]=4 16052 B18R1.1224 COC(=O)CCCCCOCOC1CCCCC1 34a_100000074720_100011935260 [0,1,0,1,0,0|1,0,0]=3 16053 B18R1.1224 COC(=O)CCCCCOCOC1CCCCC1 7a_100000074720_100011935260 [0,1,0,1,0,0|1,0,0]=3 16054 B18R1.1224 COC(=O)CCCCCSCCC1CCCCC1 62a_100009816466_100012355289 [0,1,0,1,0,0|0,0,0]=2 16055 B18R1.1224 COC(=O)CCCCCSCCC1CCCCC1 62a_100012355289_100009816466 [0,1,0,1,0,0|0,0,0]=2 16056 B18R1.1224 COC(=O)CCCCCSCCC1CCOCC1 62a_100009816466_100011934994 [0,1,0,1,0,0|1,0,0]=3 16057 B18R1.1224 COC(=O)CCCCCSCCC1CCOCC1 62a_100011934994_100009816466 [0,1,0,1,0,0|1,0,0]=3 16058 B18R1.1224 COC(=O)CCCCCSCCC1OCCCO1 62a_100000764188_100009816466 [0,1,0,1,0,0|2,0,0]=4 16059 B18R1.1224 COC(=O)CCCCCSCCC1OCCCO1 62a_100009816466_100000764188 [0,1,0,1,0,0|2,0,0]=4 16060 B18R1.1224 COC(=O)CCCCCSCCN1CCCCC1 62a_100000739454_100009816466 [0,1,0,1,0,0|1,0,0]=3 16061 B18R1.1224 COC(=O)CCCCCSCCN1CCCCC1 62a_100009816466_100000739454 [0,1,0,1,0,0|1,0,0]=3 16062 B18R1.1224 COC(=O)CCCCCSCCN1CCOCC1 62a_100009816466_100000211760 [0,1,0,1,0,0|2,0,0]=4 16063 B18R1.1224 COC(=O)CCCCCSCOC1CCCCC1 62a_100009816466_100011935260 [0,1,0,1,0,0|1,0,0]=3 16064 B18R1.1224 COC(=O)CCCCCSCOC1CCCCC1 62a_100011935260_100009816466 [0,1,0,1,0,0|1,0,0]=3 16065 B18R1.1224 COC(=O)CCCCNCCCC1CCCCC1 2230a_100011211642_100000204269 [0,1,0,1,0,0|0,0,0]=2 16066 B18R1.1224 COC(=O)CCCCNCCCC1CCCCC1 34a_100011211642_100000204269 [0,1,0,1,0,0|0,0,0]=2 16067 B18R1.1224 COC(=O)CCCCNCCOC1CCCCC1 34a_100015206981_100000204269 [0,1,0,1,0,0|1,0,0]=3 16068 B18R1.1224 COC(=O)CCCCOCCCC1CCCCC1 34a_100000059025_100011713725 [0,1,0,1,0,0|0,0,0]=2 16069 B18R1.1224 COC(=O)CCCCOCCCC1CCCCC1 34a_100000198086_100000204269 [0,1,0,1,0,0|0,0,0]=2 16070 B18R1.1224 COC(=O)CCCCOCCCC1CCCCC1 7a_100000059025_100011713725 [0,1,0,1,0,0|0,0,0]=2 16071 B18R1.1224 COC(=O)CCCCOCCCC1CCCCC1 7a_100000198086_100000204269 [0,1,0,1,0,0|0,0,0]=2 16072 B18R1.1224 COC(=O)CCCCOCCCC1CCCCN1 34a_100011934581_100000204269 [0,1,0,1,0,0|1,0,0]=3 16073 B18R1.1224 COC(=O)CCCCOCCCC1CCCNC1 34a_100150707839_100000204269 [0,1,0,1,0,0|1,0,0]=3 16074 B18R1.1224 COC(=O)CCCCOCCCC1CCNCC1 34a_100016988962_100000204269 [0,1,0,1,0,0|1,0,0]=3 16075 B18R1.1224 COC(=O)CCCCOCCCN1CCCCC1 34a_100000059025_100000690320 [0,1,0,1,0,0|1,0,0]=3 16076 B18R1.1224 COC(=O)CCCCOCCCN1CCCCC1 34a_100000212458_100000204269 [0,1,0,1,0,0|1,0,0]=3 16077 B18R1.1224 COC(=O)CCCCOCCCN1CCCCC1 7a_100000059025_100000007876 [0,1,0,1,0,0|1,0,0]=3 16078 B18R1.1224 COC(=O)CCCCOCCCN1CCOCC1 34a_100000059025_100000748698 [0,1,0,1,0,0|2,0,0]=4 16079 B18R1.1224 COC(=O)CCCCOCCCN1CCOCC1 34a_100000212840_100000204269 [0,1,0,1,0,0|2,0,0]=4 16080 B18R1.1224 COC(=O)CCCCOCCCN1CCOCC1 7a_100000059025_100000748698 [0,1,0,1,0,0|2,0,0]=4 16081 B18R1.1224 COC(=O)CCCCOCCNC1CCCCC1 34a_100000200466_100000204269 [0,1,0,1,0,0|1,0,0]=3 16082 B18R1.1224 COC(=O)CCCCOCCNC1CCOCC1 34a_100000708129_100000204269 [0,1,0,1,0,0|2,0,0]=4 16083 B18R1.1224 COC(=O)CCCCOCCOC1CCCCC1 34a_100000059025_100011211530 [0,1,0,1,0,0|1,0,0]=3 16084 B18R1.1224 COC(=O)CCCCOCCOC1CCCCC1 34a_100011249652_100000204269 [0,1,0,1,0,0|1,0,0]=3 16085 B18R1.1224 COC(=O)CCCCOCCOC1CCCCC1 7a_100000059025_100011211530 [0,1,0,1,0,0|1,0,0]=3 16086 B18R1.1224 COC(=O)CCCCOCCOC1CCCCC1 7a_100011249652_100000204269 [0,1,0,1,0,0|1,0,0]=3 16087 B18R1.1224 COC(=O)CCCCOCCOC1CCCCO1 34a_100000034223_100000204269 [0,1,0,1,0,0|2,0,0]=4 16088 B18R1.1224 COC(=O)CCCCOCCOC1CCCCO1 34a_100000059025_100000744793 [0,1,0,1,0,0|2,0,0]=4 16089 B18R1.1224 COC(=O)CCCCOCCOC1CCCCO1 7a_100000034223_100000204269 [0,1,0,1,0,0|2,0,0]=4 16090 B18R1.1224 COC(=O)CCCCOCCOC1CCCCO1 7a_100000059025_100000744793 [0,1,0,1,0,0|2,0,0]=4 16091 B18R1.1224 COC(=O)CCCCSCCCC1CCCCC1 62a_100000204269_100011713725 [0,1,0,1,0,0|0,0,0]=2 16092 B18R1.1224 COC(=O)CCCCSCCCC1CCCCC1 62a_100011713725_100000204269 [0,1,0,1,0,0|0,0,0]=2 16093 B18R1.1224 COC(=O)CCCCSCCCN1CCCCC1 62a_100000204269_100000007876 [0,1,0,1,0,0|1,0,0]=3 16094 B18R1.1224 COC(=O)CCCCSCCCN1CCCCC1 62a_100132302099_100000204269 [0,1,0,1,0,0|1,0,0]=3 16095 B18R1.1224 COC(=O)CCCCSCCCN1CCOCC1 62a_100000204269_100000748698 [0,1,0,1,0,0|2,0,0]=4 16096 B18R1.1224 COC(=O)CCCCSCCOC1CCCCC1 62a_100000204269_100011211530 [0,1,0,1,0,0|1,0,0]=3 16097 B18R1.1224 COC(=O)CCCCSCCOC1CCCCC1 62a_100011211530_100000204269 [0,1,0,1,0,0|1,0,0]=3 16098 B18R1.1224 COC(=O)CCCCSCCOC1CCCCO1 62a_100000204269_100000744793 [0,1,0,1,0,0|2,0,0]=4 16099 B18R1.1224 COC(=O)CCCCSCCOC1CCCCO1 62a_100000744793_100000204269 [0,1,0,1,0,0|2,0,0]=4 16100 B18R1.1224 COC(=O)CCCNCCCOC1CCCCC1 34a_100000205933_100000742333 [0,1,0,1,0,0|1,0,0]=3 16101 B18R1.1224 COC(=O)CCCOCCCCC1CCCCC1 34a_100011215267_100000742333 [0,1,0,1,0,0|0,0,0]=2 16102 B18R1.1224 COC(=O)CCCOCCCCC1CCCCC1 7a_100011215267_100011218270 [0,1,0,1,0,0|0,0,0]=2 16103 B18R1.1224 COC(=O)CCCOCCCCC1CCNCC1 34a_100016989291_100000742333 [0,1,0,1,0,0|1,0,0]=3 16104 B18R1.1224 COC(=O)CCCOCCCCN1CCOCC1 34a_100000723369_100000742333 [0,1,0,1,0,0|2,0,0]=4 16105 B18R1.1224 COC(=O)CCCSCCCOC1CCCCO1 62a_100000700653_100011218270 [0,1,0,1,0,0|2,0,0]=4 16106 B18R1.1224 COC(=O)CCCSCCCOC1CCCCO1 62a_100011218270_100000700653 [0,1,0,1,0,0|2,0,0]=4 16107 B18R1.1224 COC(=O)CCNCCCCCN1CCOCC1 2230a_100015187005_100000204255 [0,1,0,1,0,0|2,0,0]=4 16108 B18R1.1224 COC(=O)CCOCCCCCN1CCCCC1 34a_100011216611_100000742370 [0,1,0,1,0,0|1,0,0]=3 16109 B18R1.1224 COC(=O)CCOCCCCCN1CCCCC1 7a_100011216611_100000204255 [0,1,0,1,0,0|1,0,0]=3 16110 B18R1.1224 COC(=O)CCOCCOCCN1CCCCC1 34a_200011409831_100000742370 [0,1,0,1,0,0|2,0,0]=4 16111 B18R1.1224 COC(=O)CCOCCOCCN1CCCCC1 7a_200011409831_100000204255 [0,1,0,1,0,0|2,0,0]=4 16112 B18R1.1224 COC(=O)CCSCCCCOC1CCCCO1 62a_100000031530_100000204255 [0,1,0,1,0,0|2,0,0]=4 16113 B18R1.1224 COC(=O)CCSCCCCOC1CCCCO1 62a_100000204255_100000031530 [0,1,0,1,0,0|2,0,0]=4 16114 B18R1.1224 COC(=O)COCCNCCCC1CCCCC1 2230a_100011211642_100000090808 [0,1,0,1,0,0|1,0,0]=3 16115 B18R1.1224 COC(=O)COCCNCCCC1CCCCC1 34a_100011211642_100000090808 [0,1,0,1,0,0|1,0,0]=3 16116 B18R1.1224 COC(=O)COCCNCCOC1CCCCC1 34a_100015206981_100000090808 [0,1,0,1,0,0|2,0,0]=4 16117 B18R1.1224 COC(=O)COCCOCCCC1CCCCC1 34a_100000198086_100000090808 [0,1,0,1,0,0|1,0,0]=3 16118 B18R1.1224 COC(=O)COCCOCCCC1CCCCC1 7a_100000198086_100000090808 [0,1,0,1,0,0|1,0,0]=3 16119 B18R1.1224 COC(=O)COCCOCCCC1CCCCN1 34a_100011934581_100000090808 [0,1,0,1,0,0|2,0,0]=4 16120 B18R1.1224 COC(=O)COCCOCCCC1CCCNC1 34a_100150707839_100000090808 [0,1,0,1,0,0|2,0,0]=4 16121 B18R1.1224 COC(=O)COCCOCCCC1CCNCC1 34a_100016988962_100000090808 [0,1,0,1,0,0|2,0,0]=4 16122 B18R1.1224 COC(=O)COCCOCCCN1CCCCC1 34a_100000212458_100000090808 [0,1,0,1,0,0|2,0,0]=4 16123 B18R1.1224 COC(=O)COCCOCCNC1CCCCC1 34a_100000200466_100000090808 [0,1,0,1,0,0|2,0,0]=4 16124 B18R1.1224 COC(=O)COCCOCCOC1CCCCC1 34a_100011023656_100000210327 [0,1,0,1,0,0|2,0,0]=4 16125 B18R1.1224 COC(=O)COCCOCCOC1CCCCC1 34a_100011249652_100000090808 [0,1,0,1,0,0|2,0,0]=4 16126 B18R1.1224 COC(=O)COCCOCCOC1CCCCC1 7a_100011023656_100000210327 [0,1,0,1,0,0|2,0,0]=4 16127 B18R1.1224 COC(=O)COCCOCCOC1CCCCC1 7a_100011249652_100000090808 [0,1,0,1,0,0|2,0,0]=4 16128 B18R1.1224 COC(=O)COCCSCCCC1CCCCC1 62a_100000090808_100011713725 [0,1,0,1,0,0|1,0,0]=3 16129 B18R1.1224 COC(=O)COCCSCCCC1CCCCC1 62a_100011713725_100000090808 [0,1,0,1,0,0|1,0,0]=3 16130 B18R1.1224 COC(=O)COCCSCCCN1CCCCC1 62a_100000090808_100000007876 [0,1,0,1,0,0|2,0,0]=4 16131 B18R1.1224 COC(=O)COCCSCCCN1CCCCC1 62a_100132302099_100000090808 [0,1,0,1,0,0|2,0,0]=4 16132 B18R1.1224 COC(=O)COCCSCCOC1CCCCC1 62a_100000090808_100011211530 [0,1,0,1,0,0|2,0,0]=4 16133 B18R1.1224 COC(=O)COCCSCCOC1CCCCC1 62a_100011211530_100000090808 [0,1,0,1,0,0|2,0,0]=4 16134 B18R1.1260 CCCCCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100011215052 [0,1,0,1,0,0|1,0,0]=3 16135 B18R1.1260 CCCCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100011215454 [0,1,0,1,0,0|1,0,0]=3 16136 B18R1.1260 CCCCCCCCCCCNC1COC(=O)O1 34a_200011215754_100000032252 [0,1,0,1,0,0|1,0,0]=3 16137 B18R1.1260 CCCCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100011215454 [0,1,0,1,0,0|1,0,0]=3 16138 B18R1.1260 CCCCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100011215454 [0,1,0,1,0,0|1,0,0]=3 16139 B18R1.1260 CCCCCCCCCCCOC1COC(=O)O1 34a_100000210809_100000032252 [0,1,0,1,0,0|1,0,0]=3 16140 B18R1.1260 CCCCCCCCCCNCC1=CC(=O)OC1 34a_100000684558_100000716558 [0,1,0,1,0,0|0,0,2]=4 16141 B18R1.1260 CCCCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210320 [0,1,0,1,0,0|1,0,0]=3 16142 B18R1.1260 CCCCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210320 [0,1,0,1,0,0|1,0,0]=3 16143 B18R1.1260 CCCCCCCCCCNCC1CNC(=O)O1 2230a_100000684558_100000181169 [0,1,0,1,0,0|2,0,0]=4 16144 B18R1.1260 CCCCCCCCCCNCC1CNC(=O)O1 34a_100000684558_100000181169 [0,1,0,1,0,0|2,0,0]=4 16145 B18R1.1260 CCCCCCCCCCNCC1COC(=O)O1 34a_100000684558_100000073702 [0,1,0,1,0,0|1,0,0]=3 16146 B18R1.1260 CCCCCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000684558_100015189358 [0,1,0,1,0,0|2,0,0]=4 16147 B18R1.1260 CCCCCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210320 [0,1,0,1,0,0|2,0,0]=4 16148 B18R1.1260 CCCCCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210320 [0,1,0,1,0,0|2,0,0]=4 16149 B18R1.1260 CCCCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000684558_100015307671 [0,1,0,1,0,0|1,0,0]=3 16150 B18R1.1260 CCCCCCCCCCNC[C@H]1COC(=O)N1 34a_100000684558_100015307671 [0,1,0,1,0,0|1,0,0]=3 16151 B18R1.1260 CCCCCCCCCCOCC1=CC(=O)OC1 34a_100000210711_100000716558 [0,1,0,1,0,0|0,0,2]=4 16152 B18R1.1260 CCCCCCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210320 [0,1,0,1,0,0|2,0,0]=4 16153 B18R1.1260 CCCCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210320 [0,1,0,1,0,0|1,0,0]=3 16154 B18R1.1260 CCCCCCCCCCOCC1CNC(=O)O1 34a_100000210711_100000181169 [0,1,0,1,0,0|2,0,0]=4 16155 B18R1.1260 CCCCCCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210320 [0,1,0,1,0,0|2,0,0]=4 16156 B18R1.1260 CCCCCCCCCCOCC1CNC(=O)O1 7a_100000210711_100000181169 [0,1,0,1,0,0|2,0,0]=4 16157 B18R1.1260 CCCCCCCCCCOCC1COC(=O)O1 34a_100000210711_100000073702 [0,1,0,1,0,0|1,0,0]=3 16158 B18R1.1260 CCCCCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210711_100015189358 [0,1,0,1,0,0|2,0,0]=4 16159 B18R1.1260 CCCCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210711_100015307671 [0,1,0,1,0,0|1,0,0]=3 16160 B18R1.1260 CCCCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210711_100015307671 [0,1,0,1,0,0|1,0,0]=3 16161 B18R1.1260 CCCCCCCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210320 [0,1,0,1,0,0|0,0,2]=4 16162 B18R1.1260 CCCCCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210320 [0,1,0,1,0,0|2,0,0]=4 16163 B18R1.1260 CCCCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210320 [0,1,0,1,0,0|1,0,0]=3 16164 B18R1.1260 CCCCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210320 [0,1,0,1,0,0|2,0,0]=4 16165 B18R1.1260 CCCCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210320 [0,1,0,1,0,0|1,0,0]=3 16166 B18R1.1260 CCCCCCCCCOCCC1COS(=O)O1 7a_100000210712_100009840081 [0,1,0,1,0,0|2,0,0]=4 16167 B18R1.1260 NCCCCCCCCCCOC1COC(=O)O1 34a_100000066964_100000032252 [0,1,0,1,0,0|2,0,0]=4 16168 B18R1.1260 NCCCCCCCCCOCC1COC(=O)O1 34a_100000078944_100000073702 [0,1,0,1,0,0|2,0,0]=4 16169 B18R1.1260 NCCCCCCCCCOC[C@H]1COC(=O)N1 34a_100000078944_100015307671 [0,1,0,1,0,0|2,0,0]=4 16170 B18R1.1260 O=C1CC(CN1)CNCCCCCCCCCO 2230a_100016993742_100009813782 [0,1,0,1,0,0|2,0,0]=4 16171 B18R1.1260 O=C1CC(CN1)CNCCCCCCCCCO 34a_100016993742_100009813782 [0,1,0,1,0,0|2,0,0]=4 16172 B18R1.1260 O=C1CC(CN1)COCCCCCCCCCO 34a_100016041077_100009813782 [0,1,0,1,0,0|2,0,0]=4 16173 B18R1.1260 O=C1CC(CN1)NCCCCCCCCCCO 2230a_100000697751_100009813290 [0,1,0,1,0,0|2,0,0]=4 16174 B18R1.1260 O=C1CC(CN1)OCCCCCCCCCCO 34a_100000690082_100009813290 [0,1,0,1,0,0|2,0,0]=4 16175 B18R1.1260 O=C1CCC(C1)OCCCCCCCCCCO 34a_100012614533_100009813290 [0,1,0,1,0,0|2,0,0]=4 16176 B18R1.1260 O=C1CN(CN1)CCCCCCCCCCCO 2230a_200000708111_100009812471 [0,1,0,1,0,0|2,0,0]=4 16177 B18R1.1260 O=C1N[C@H](CO1)CNCCCCCCCCCO 2230a_100000078944_100015307671 [0,1,0,1,0,0|2,0,0]=4 16178 B18R1.1260 O=C1N[C@H](CO1)CNCCCCCCCCCO 34a_100000078944_100015307671 [0,1,0,1,0,0|2,0,0]=4 16179 B18R1.1260 O=C1N[C@H](CO1)COCCCCCCCCCBr 34a_100009813782_100015307671 [0,1,0,1,0,0|2,0,0]=4 16180 B18R1.1260 O=C1N[C@H](CO1)COCCCCCCCCCBr 7a_100009813782_100015307671 [0,1,0,1,0,0|2,0,0]=4 16181 B18R1.1260 O=C1N[C@H](CO1)COCCCCCCCCCCl 34a_100009868337_100015307671 [0,1,0,1,0,0|2,0,0]=4 16182 B18R1.1260 O=C1N[C@H](CO1)COCCCCCCCCCCl 7a_100009868337_100015307671 [0,1,0,1,0,0|2,0,0]=4 16183 B18R1.1260 O=C1N[C@H](CO1)CSCCCCCCCCCO 62a_100009813782_100015307671 [0,1,0,1,0,0|2,0,0]=4 16184 B18R1.1260 O=C1N[C@H](CO1)CSCCCCCCCCCO 62a_100015307671_100009813782 [0,1,0,1,0,0|2,0,0]=4 16185 B18R1.1260 O=C1OCC(O1)CNCCCCCCCCCO 34a_100000078944_100000073702 [0,1,0,1,0,0|2,0,0]=4 16186 B18R1.1260 O=C1OCC(O1)COCCCCCCCCCBr 34a_100009813782_100000073702 [0,1,0,1,0,0|2,0,0]=4 16187 B18R1.1260 O=C1OCC(O1)COCCCCCCCCCCl 34a_100009868337_100000073702 [0,1,0,1,0,0|2,0,0]=4 16188 B18R1.1260 O=C1OCC(O1)CSCCCCCCCCCO 62a_100000073702_100009813782 [0,1,0,1,0,0|2,0,0]=4 16189 B18R1.1260 O=C1OCC(O1)CSCCCCCCCCCO 62a_100009813782_100000073702 [0,1,0,1,0,0|2,0,0]=4 16190 B18R1.1260 O=C1OCC(O1)NCCCCCCCCCCO 34a_100000066964_100000032252 [0,1,0,1,0,0|2,0,0]=4 16191 B18R1.1260 O=C1OCC(O1)OCCCCCCCCCCBr 34a_100009813290_100000032252 [0,1,0,1,0,0|2,0,0]=4 16192 B18R1.1260 O=C1OCC(O1)OCCCCCCCCCCCl 34a_200000033068_100000032252 [0,1,0,1,0,0|2,0,0]=4 16193 B18R1.1260 O=C1OCC(O1)SCCCCCCCCCCO 62a_100009813290_100000032252 [0,1,0,1,0,0|2,0,0]=4 16194 B18R1.1314 CNC(=O)CCCN1CCCCC1CCCOC 2230a_100011804088_100000741757 [0,1,0,1,0,0|2,0,0]=4 16195 B18R1.1314 CNC(=O)CCCN1CCCCC1CCCOC 269982a_100011804088_100000741757 [0,1,0,1,0,0|2,0,0]=4 16196 B18R1.1314 CNC(=O)CCCN1CCCCC1CCCOC 34a_100011804088_100000741757 [0,1,0,1,0,0|2,0,0]=4 16197 B18R1.1314 COCCCC1CCCCN1CCCC(=O)OC 2230a_100011804088_100011218270 [0,1,0,1,0,0|1,0,0]=3 16198 B18R1.1314 COCCCC1CCCCN1CCCC(=O)OC 269982a_100011804088_100011218270 [0,1,0,1,0,0|1,0,0]=3 16199 B18R1.1314 COCCCC1CCCCN1CCCC(=O)OC 34a_100011804088_100000742333 [0,1,0,1,0,0|1,0,0]=3 16200 B18R1.4121 CCCCCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210681 [0,1,0,1,0,0|1,0,0]=3 16201 B18R1.4121 CCCCCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210614 [0,1,0,1,0,0|1,0,0]=3 16202 B18R1.4121 CCCCOCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000743108 [0,1,0,1,0,0|2,0,0]=4 16203 B18R1.4121 CCCCOCCN1CCOCC1CC(=O)OC 34a_100000731486_100000743108 [0,1,0,1,0,0|2,0,0]=4 16204 B18R1.4121 COC(=O)CC1COCCN1CCCCCCF 2230a_100000731486_100015922095 [0,1,0,1,0,0|2,0,0]=4 16205 B18R1.4121 COC(=O)CC1COCCN1CCCCCCF 34a_100000731486_100015922095 [0,1,0,1,0,0|2,0,0]=4 16206 B18R1.4121 COC(=O)CC1COCCN1CCCCCCO 2230a_100000731486_100000766143 [0,1,0,1,0,0|2,0,0]=4 16207 B18R1.4121 COC(=O)CC1COCCN1CCCCCCO 34a_100000731486_100000766143 [0,1,0,1,0,0|2,0,0]=4 16208 B18R1.4934 CCCC1CCCCC1OCCCCC(=O)OC 34a_100011217265_100000204269 [0,1,0,1,0,0|0,0,0]=2 16209 B18R1.4934 CCCC1CCCCC1OCCCCC(=O)OC 7a_100011217265_100000204269 [0,1,0,1,0,0|0,0,0]=2 16210 B18R1.4934 CCCC1CCCCC1OCCOCC(=O)OC 34a_100011217265_100000090808 [0,1,0,1,0,0|1,0,0]=3 16211 B18R1.4934 CCCC1CCCCC1OCCOCC(=O)OC 7a_100011217265_100000090808 [0,1,0,1,0,0|1,0,0]=3 16212 B18R1.4934 CCCC1CCCCN1CCCCCC(=O)OC 2230a_100000701414_100009816466 [0,1,0,1,0,0|0,0,0]=2 16213 B18R1.4934 CCCC1CCCCN1CCCCCC(=O)OC 269982a_100000701414_100009816466 [0,1,0,1,0,0|0,0,0]=2 16214 B18R1.4934 CCCC1CCCCN1CCCCCC(=O)OC 34a_100000701414_100009816466 [0,1,0,1,0,0|0,0,0]=2 16215 B18R1.4934 CCCC1COCCN1CCCCCC(=O)OC 2230a_102495339903_100009816466 [0,1,0,1,0,0|1,0,0]=3 16216 B18R1.4934 CCCC1COCCN1CCCCCC(=O)OC 269982a_102495339903_100009816466 [0,1,0,1,0,0|1,0,0]=3 16217 B18R1.4934 CCCC1COCCN1CCCCCC(=O)OC 34a_102495339903_100009816466 [0,1,0,1,0,0|1,0,0]=3 16218 B18R1.4934 COC(=O)CCCCCN1CCCCC1CC#N 2230a_100000133382_100009816466 [0,1,0,1,0,0|1,0,1]=4 16219 B18R1.4934 COC(=O)CCCCCN1CCCCC1CC#N 34a_100000133382_100009816466 [0,1,0,1,0,0|1,0,1]=4 16220 B18R1.4934 COC(=O)CCCCCN1CCCCC1CCO 2230a_100000211664_100009816466 [0,1,0,1,0,0|1,0,0]=3 16221 B18R1.4934 COC(=O)CCCCCN1CCCCC1CCO 269982a_100000211664_100009816466 [0,1,0,1,0,0|1,0,0]=3 16222 B18R1.4934 COC(=O)CCCCCN1CCCCC1CCO 34a_100000211664_100009816466 [0,1,0,1,0,0|1,0,0]=3 16223 B18R1.4934 COC(=O)CCCOCC1CCCCN1CCN 34a_100011473795_100000742333 [0,1,0,1,0,0|2,0,0]=4 16224 B18R1.4934 COCC1CCCCN1CCCCCC(=O)OC 2230a_100015184032_100009816466 [0,1,0,1,0,0|1,0,0]=3 16225 B18R1.4934 COCC1CCCCN1CCCCCC(=O)OC 269982a_100015184032_100009816466 [0,1,0,1,0,0|1,0,0]=3 16226 B18R1.4934 COCC1CCCCN1CCCCCC(=O)OC 34a_100015184032_100009816466 [0,1,0,1,0,0|1,0,0]=3 16227 B18R1.4934 COC[C@H]1COCCN1CCCCCC(=O)OC 2230a_100016989928_100009816466 [0,1,0,1,0,0|2,0,0]=4 16228 B18R1.4934 COC[C@H]1COCCN1CCCCCC(=O)OC 269982a_100016989928_100009816466 [0,1,0,1,0,0|2,0,0]=4 16229 B18R1.4934 COC[C@H]1COCCN1CCCCCC(=O)OC 34a_100016989928_100009816466 [0,1,0,1,0,0|2,0,0]=4 16230 B18R1.5429 CCCCCCCCCCCCNCC1CCO1 2230a_100000210451_100000103362 [0,1,0,1,0,0|1,0,1]=4 16231 B18R1.5429 CCCCCCCCCCCCNCC1CCO1 34a_100000210451_100000103362 [0,1,0,1,0,0|1,0,1]=4 16232 B18R1.5429 CCCCCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011215052 [0,1,0,1,0,0|1,0,1]=4 16233 B18R1.5429 CCCCCCCCCCCCNC[C@@H]1CCO1 270004a_100020831831_100011218549 [0,1,0,1,0,0|1,0,1]=4 16234 B18R1.5429 CCCCCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000759014 [0,1,0,1,0,0|1,0,1]=4 16235 B18R1.5429 CCCCCCCCCCCCOCC1CCO1 34a_100000039022_100000759014 [0,1,0,1,0,0|1,0,1]=4 16236 B18R1.5429 CCCCCCCCCCCCOCC1CCO1 34a_100000210810_100000103362 [0,1,0,1,0,0|1,0,1]=4 16237 B18R1.5429 CCCCCCCCCCCCOCC1CCO1 7a_100000210810_100000103362 [0,1,0,1,0,0|1,0,1]=4 16238 B18R1.5429 CCCCCCCCCCCCSCC1CCO1 62a_100000103362_100000759014 [0,1,0,1,0,0|1,0,1]=4 16239 B18R1.5445 C#CCCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100153394163 [0,1,0,1,0,0|0,0,2]=4 16240 B18R1.5445 C#CCCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100153394163 [0,1,0,1,0,0|0,0,2]=4 16241 B18R1.5445 C#CCCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100012276617 [0,1,0,1,0,0|0,0,2]=4 16242 B18R1.5445 C#CCCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100012276617 [0,1,0,1,0,0|0,0,2]=4 16243 B18R1.5445 C=CCCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100012355270 [0,1,0,1,0,0|0,0,2]=4 16244 B18R1.5445 C=CCCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100012355270 [0,1,0,1,0,0|0,0,2]=4 16245 B18R1.5445 C=CCCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100011215473 [0,1,0,1,0,0|0,0,2]=4 16246 B18R1.5445 C=CCCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100011215473 [0,1,0,1,0,0|0,0,2]=4 16247 B18R1.5445 CCCCC#CCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_200000047210 [0,1,0,1,0,0|0,0,2]=4 16248 B18R1.5445 CCCCC#CCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_200000047210 [0,1,0,1,0,0|0,0,2]=4 16249 B18R1.5445 CCCCCC#CCOC1CCCC1C(=O)OC 34a_200000081814_100009816472 [0,1,0,1,0,0|0,0,2]=4 16250 B18R1.5445 CCCCCC#CCOC1CCCC1C(=O)OC 7a_200000081814_100009816472 [0,1,0,1,0,0|0,0,2]=4 16251 B18R1.5445 CCCCCCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100011214924 [0,1,0,1,0,0|1,0,0]=3 16252 B18R1.5445 CCCCCCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210670 [0,1,0,1,0,0|1,0,0]=3 16253 B18R1.5445 CCCCCCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100011214924 [0,1,0,1,0,0|1,0,0]=3 16254 B18R1.5445 CCCCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011214924 [0,1,0,1,0,0|0,0,0]=2 16255 B18R1.5445 CCCCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210670 [0,1,0,1,0,0|0,0,0]=2 16256 B18R1.5445 CCCCCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100011214924 [0,1,0,1,0,0|1,0,0]=3 16257 B18R1.5445 CCCCCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210670 [0,1,0,1,0,0|1,0,0]=3 16258 B18R1.5445 CCCCCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210670 [0,1,0,1,0,0|1,0,0]=3 16259 B18R1.5445 CCCCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210759 [0,1,0,1,0,0|0,0,0]=2 16260 B18R1.5445 CCCCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210759 [0,1,0,1,0,0|0,0,0]=2 16261 B18R1.5445 CCOCCOCCOC1CCCC1C(=O)OC 34a_200000081814_100011211534 [0,1,0,1,0,0|2,0,0]=4 16262 B18R1.5445 CCOCCOCCOC1CCCC1C(=O)OC 7a_200000081814_100011211534 [0,1,0,1,0,0|2,0,0]=4 16263 B18R1.5445 CNC(=O)[C@@H]1CCCN1CCCCCCCCO 2230a_100015185040_100000033203 [0,1,0,1,0,0|2,0,0]=4 16264 B18R1.5445 CNC(=O)[C@@H]1CCCN1CCCCCCCCO 269982a_100015185040_100000033203 [0,1,0,1,0,0|2,0,0]=4 16265 B18R1.5445 CNC(=O)[C@@H]1CCCN1CCCCCCCCO 34a_100015185040_100000033203 [0,1,0,1,0,0|2,0,0]=4 16266 B18R1.5445 COC(=O)C1CCCC1OCCCCCCC#N 7a_200000081814_100009813337 [0,1,0,1,0,0|1,0,1]=4 16267 B18R1.5445 COC(=O)C1CCCC1OCCCCCCCO 34a_200000081814_100000760002 [0,1,0,1,0,0|1,0,0]=3 16268 B18R1.5445 COC(=O)C1CCCC1OCCCCCCCO 7a_200000081814_100000760002 [0,1,0,1,0,0|1,0,0]=3 16269 B18R1.5445 COC(=O)C1CSCN1CCCCCCCCO 269982a_200000724679_100000033203 [0,1,0,1,0,0|2,0,0]=4 16270 B18R1.5445 COC(=O)C1SCCN1CCCCCCCCO 2230a_100015296106_100000033203 [0,1,0,1,0,0|2,0,0]=4 16271 B18R1.5445 COC(=O)C1SCCN1CCCCCCCCO 269982a_100015296106_100000033203 [0,1,0,1,0,0|2,0,0]=4 16272 B18R1.5445 COC(=O)[C@@H]1CCCN1CCCCCCCCO 2230a_100000752040_100000033203 [0,1,0,1,0,0|1,0,0]=3 16273 B18R1.5445 COC(=O)[C@@H]1CCCN1CCCCCCCCO 269982a_100000752040_100000033203 [0,1,0,1,0,0|1,0,0]=3 16274 B18R1.5445 COCCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100011998445 [0,1,0,1,0,0|1,0,0]=3 16275 B18R1.5445 COCCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100011998445 [0,1,0,1,0,0|1,0,0]=3 16276 B18R1.5445 COCCOCCCOC1CCCC1C(=O)OC 34a_200000081814_100011216529 [0,1,0,1,0,0|2,0,0]=4 16277 B18R1.5445 COCCOCCCOC1CCCC1C(=O)OC 7a_200000081814_100011216529 [0,1,0,1,0,0|2,0,0]=4 16278 B18R1.6272 CCCCCNN=C1CCCCCC1C(=O)OC 4a_100000694160_100000183596 [0,1,0,1,0,0|1,0,1]=4 16279 B18R1.7654 CCC1C=CCN1CCCCCCCC(=O)OC 2230a_100000730860_100010004213 [0,1,0,1,0,0|0,0,2]=4 16280 B18R1.7654 CCC1C=CCN1CCCCCCCC(=O)OC 269982a_100000730860_100010004213 [0,1,0,1,0,0|0,0,2]=4 16281 B18R1.7654 CCC1C=CCN1CCCCCCCC(=O)OC 34a_100000730860_100010004213 [0,1,0,1,0,0|0,0,2]=4 16282 B18R1.7654 CCC1CCCN1CCCCCCCC(=O)OC 2230a_100000754278_100010004213 [0,1,0,1,0,0|0,0,0]=2 16283 B18R1.7654 CCC1CCCN1CCCCCCCC(=O)OC 269982a_100000754278_100010004213 [0,1,0,1,0,0|0,0,0]=2 16284 B18R1.7654 CCC1CCCN1CCCCCCCC(=O)OC 34a_100000754278_100010004213 [0,1,0,1,0,0|0,0,0]=2 16285 B18R1.7654 CCN1CCCC1CNCCCCCC(=O)OC 2230a_100000211693_100009816466 [0,1,0,1,0,0|1,0,0]=3 16286 B18R1.7654 CCN1CCC[C@@H]1COCCCCCC(=O)OC 34a_100011739246_100009816466 [0,1,0,1,0,0|1,0,0]=3 16287 B18R1.7654 CCN1CCC[C@@H]1COCCCCCC(=O)OC 7a_100011739246_100009816466 [0,1,0,1,0,0|1,0,0]=3 16288 B18R1.7654 COC(=O)CCCCCCCN1CCCC1C#N 2230a_100000701862_100010004213 [0,1,0,1,0,0|1,0,1]=4 16289 B18R1.7654 COC(=O)CCCCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100010004213 [0,1,0,1,0,0|1,0,1]=4 16290 B18R1.7654 COC(=O)CCCCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100010004213 [0,1,0,1,0,0|1,0,1]=4 16291 B18R1.7654 COC(=O)CCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100010004213 [0,1,0,1,0,0|1,0,0]=3 16292 B18R1.7654 COC(=O)CCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100010004213 [0,1,0,1,0,0|1,0,0]=3 16293 B18R1.7654 COC(=O)CCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100010004213 [0,1,0,1,0,0|1,0,0]=3 16294 B18R1.7654 COC(=O)CCCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100009815986 [0,1,0,1,0,0|1,0,1]=4 16295 B18R1.7654 COC(=O)CCCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100009815986 [0,1,0,1,0,0|1,0,1]=4 16296 B18R1.8761 C#CCCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100012276617 [0,1,0,1,0,0|0,0,2]=4 16297 B18R1.8761 C#CCCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100012276617 [0,1,0,1,0,0|0,0,2]=4 16298 B18R1.8761 C#CCCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100012276617 [0,1,0,1,0,0|0,0,2]=4 16299 B18R1.8761 C#CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100012094781 [0,1,0,1,0,0|0,0,2]=4 16300 B18R1.8761 C#CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100012094781 [0,1,0,1,0,0|0,0,2]=4 16301 B18R1.8761 C=CCCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100011215473 [0,1,0,1,0,0|0,0,2]=4 16302 B18R1.8761 C=CCCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100011215473 [0,1,0,1,0,0|0,0,2]=4 16303 B18R1.8761 C=CCCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100011215473 [0,1,0,1,0,0|0,0,2]=4 16304 B18R1.8761 C=CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000700193 [0,1,0,1,0,0|0,0,2]=4 16305 B18R1.8761 C=CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000700193 [0,1,0,1,0,0|0,0,2]=4 16306 B18R1.8761 CCCCCC#CCN1CCCCC1C(=O)OC 2230a_100000734855_100009816472 [0,1,0,1,0,0|0,0,2]=4 16307 B18R1.8761 CCCCCC#CCN1CCCCC1C(=O)OC 269982a_100000734855_100009816472 [0,1,0,1,0,0|0,0,2]=4 16308 B18R1.8761 CCCCCC#CCN1CCCCC1C(=O)OC 34a_100000734855_100009816472 [0,1,0,1,0,0|0,0,2]=4 16309 B18R1.8761 CCCCCCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210759 [0,1,0,1,0,0|1,0,0]=3 16310 B18R1.8761 CCCCCCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210759 [0,1,0,1,0,0|1,0,0]=3 16311 B18R1.8761 CCCCCCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210759 [0,1,0,1,0,0|1,0,0]=3 16312 B18R1.8761 CCCCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210759 [0,1,0,1,0,0|0,0,0]=2 16313 B18R1.8761 CCCCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210759 [0,1,0,1,0,0|0,0,0]=2 16314 B18R1.8761 CCCCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210759 [0,1,0,1,0,0|0,0,0]=2 16315 B18R1.8761 CCCCCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210759 [0,1,0,1,0,0|1,0,0]=3 16316 B18R1.8761 CCCCCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210759 [0,1,0,1,0,0|1,0,0]=3 16317 B18R1.8761 CCCCCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210614 [0,1,0,1,0,0|1,0,0]=3 16318 B18R1.8761 CCCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210614 [0,1,0,1,0,0|0,0,0]=2 16319 B18R1.8761 CCCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210614 [0,1,0,1,0,0|0,0,0]=2 16320 B18R1.8761 CCCCOCCOC1CCNCC1C(=O)OC 34a_200103168510_100000743108 [0,1,0,1,0,0|2,0,0]=4 16321 B18R1.8761 CCCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000743108 [0,1,0,1,0,0|1,0,0]=3 16322 B18R1.8761 CCCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000743108 [0,1,0,1,0,0|1,0,0]=3 16323 B18R1.8761 CCOCCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100011211534 [0,1,0,1,0,0|2,0,0]=4 16324 B18R1.8761 CCOCCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100011211534 [0,1,0,1,0,0|2,0,0]=4 16325 B18R1.8761 CCOCCOCCN1CCCCC1C(=O)OC 34a_100000734855_100011211534 [0,1,0,1,0,0|2,0,0]=4 16326 B18R1.8761 CNC(=O)C1CCCCN1CCCCCCCO 2230a_100011209383_100000760002 [0,1,0,1,0,0|2,0,0]=4 16327 B18R1.8761 CNC(=O)C1CCCCN1CCCCCCCO 269982a_100011209383_100000760002 [0,1,0,1,0,0|2,0,0]=4 16328 B18R1.8761 CNC(=O)C1CCCCN1CCCCCCCO 34a_100011209383_100000760002 [0,1,0,1,0,0|2,0,0]=4 16329 B18R1.8761 CNC(=O)C1CCCCN1CCCCCCOC 2230a_100011209383_100011998445 [0,1,0,1,0,0|2,0,0]=4 16330 B18R1.8761 CNC(=O)C1CCCCN1CCCCCCOC 269982a_100011209383_100011998445 [0,1,0,1,0,0|2,0,0]=4 16331 B18R1.8761 CNC(=O)C1CCCCN1CCCCCCOC 34a_100011209383_100011998445 [0,1,0,1,0,0|2,0,0]=4 16332 B18R1.8761 COC(=O)C1CCCCN1CCCCCCC#N 2230a_100000734855_100009813337 [0,1,0,1,0,0|1,0,1]=4 16333 B18R1.8761 COC(=O)C1CCCCN1CCCCCCC#N 269982a_100000734855_100009813337 [0,1,0,1,0,0|1,0,1]=4 16334 B18R1.8761 COC(=O)C1CCCCN1CCCCCCCO 2230a_100000734855_100000760002 [0,1,0,1,0,0|1,0,0]=3 16335 B18R1.8761 COC(=O)C1CCCCN1CCCCCCCO 269982a_100000734855_100000760002 [0,1,0,1,0,0|1,0,0]=3 16336 B18R1.8761 COC(=O)C1CCCCN1CCCCCCCO 34a_100000734855_100000760002 [0,1,0,1,0,0|1,0,0]=3 16337 B18R1.8761 COC(=O)C1CNCCC1OCCCCCCF 34a_200103168510_100015922095 [0,1,0,1,0,0|2,0,0]=4 16338 B18R1.8761 COC(=O)C1CNCCC1OCCCCCCO 34a_200103168510_100000766143 [0,1,0,1,0,0|2,0,0]=4 16339 B18R1.8761 COC(=O)C1COCCN1CCCCCCCO 2230a_100000765174_100000760002 [0,1,0,1,0,0|2,0,0]=4 16340 B18R1.8761 COC(=O)C1COCCN1CCCCCCCO 34a_100000765174_100000760002 [0,1,0,1,0,0|2,0,0]=4 16341 B18R1.8761 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCC#N 7a_100015709673_100009813376 [0,1,0,1,0,0|1,0,1]=4 16342 B18R1.8761 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCC=O 7a_100015709673_100000139337 [0,1,0,1,0,0|1,0,1]=4 16343 B18R1.8761 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCCF 34a_100015709673_100015922095 [0,1,0,1,0,0|1,0,0]=3 16344 B18R1.8761 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCCF 7a_100015709673_100015922095 [0,1,0,1,0,0|1,0,0]=3 16345 B18R1.8761 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCCO 34a_100015709673_100000766143 [0,1,0,1,0,0|1,0,0]=3 16346 B18R1.8761 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCCO 7a_100015709673_100000766143 [0,1,0,1,0,0|1,0,0]=3 16347 B18R1.8761 COCCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100011998445 [0,1,0,1,0,0|1,0,0]=3 16348 B18R1.8761 COCCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100011998445 [0,1,0,1,0,0|1,0,0]=3 16349 B18R1.8761 COCCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100011998445 [0,1,0,1,0,0|1,0,0]=3 16350 B18R1.8761 COCCCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100011998445 [0,1,0,1,0,0|2,0,0]=4 16351 B18R1.8761 COCCCCCCN1CCOCC1C(=O)OC 34a_100000765174_100011998445 [0,1,0,1,0,0|2,0,0]=4 16352 B18R1.8761 COCCOCCCN1CCCCC1C(=O)OC 2230a_100000734855_100011216529 [0,1,0,1,0,0|2,0,0]=4 16353 B18R1.8761 COCCOCCCN1CCCCC1C(=O)OC 269982a_100000734855_100011216529 [0,1,0,1,0,0|2,0,0]=4 16354 B18R1.8761 COCCOCCCN1CCCCC1C(=O)OC 34a_100000734855_100011216529 [0,1,0,1,0,0|2,0,0]=4 16355 B18R1.8761 COCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000695917 [0,1,0,1,0,0|2,0,0]=4 16356 B18R1.8761 COCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000695917 [0,1,0,1,0,0|2,0,0]=4 16357 B18R1.8771 C#CCCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100012276617 [0,1,0,1,0,0|0,0,2]=4 16358 B18R1.8771 C#CCCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100012276617 [0,1,0,1,0,0|0,0,2]=4 16359 B18R1.8771 C#CCCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100012276617 [0,1,0,1,0,0|0,0,2]=4 16360 B18R1.8771 C=CCCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011215473 [0,1,0,1,0,0|0,0,2]=4 16361 B18R1.8771 C=CCCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011215473 [0,1,0,1,0,0|0,0,2]=4 16362 B18R1.8771 C=CCCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011215473 [0,1,0,1,0,0|0,0,2]=4 16363 B18R1.8771 CCCCCC#CCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100009816472 [0,1,0,1,0,0|0,0,2]=4 16364 B18R1.8771 CCCCCC#CCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100009816472 [0,1,0,1,0,0|0,0,2]=4 16365 B18R1.8771 CCCCCC#CCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100009816472 [0,1,0,1,0,0|0,0,2]=4 16366 B18R1.8771 CCCCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210759 [0,1,0,1,0,0|0,0,0]=2 16367 B18R1.8771 CCCCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210759 [0,1,0,1,0,0|0,0,0]=2 16368 B18R1.8771 CCCCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210759 [0,1,0,1,0,0|0,0,0]=2 16369 B18R1.8771 CCOCCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011211534 [0,1,0,1,0,0|2,0,0]=4 16370 B18R1.8771 CCOCCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011211534 [0,1,0,1,0,0|2,0,0]=4 16371 B18R1.8771 CCOCCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011211534 [0,1,0,1,0,0|2,0,0]=4 16372 B18R1.8771 COC(=O)C[C@H]1CCCN1CCCCCCC#N 2230a_100025726698_100009813337 [0,1,0,1,0,0|1,0,1]=4 16373 B18R1.8771 COC(=O)C[C@H]1CCCN1CCCCCCC#N 269982a_100025726698_100009813337 [0,1,0,1,0,0|1,0,1]=4 16374 B18R1.8771 COC(=O)C[C@H]1CCCN1CCCCCCCO 2230a_100025726698_100000760002 [0,1,0,1,0,0|1,0,0]=3 16375 B18R1.8771 COC(=O)C[C@H]1CCCN1CCCCCCCO 269982a_100025726698_100000760002 [0,1,0,1,0,0|1,0,0]=3 16376 B18R1.8771 COC(=O)C[C@H]1CCCN1CCCCCCCO 34a_100025726698_100000760002 [0,1,0,1,0,0|1,0,0]=3 16377 B18R1.8771 COCCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011998445 [0,1,0,1,0,0|1,0,0]=3 16378 B18R1.8771 COCCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011998445 [0,1,0,1,0,0|1,0,0]=3 16379 B18R1.8771 COCCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011998445 [0,1,0,1,0,0|1,0,0]=3 16380 B18R1.8771 COCCOCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011216529 [0,1,0,1,0,0|2,0,0]=4 16381 B18R1.8771 COCCOCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100011216529 [0,1,0,1,0,0|2,0,0]=4 16382 B18R1.8771 COCCOCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011216529 [0,1,0,1,0,0|2,0,0]=4 16383 B18R1.13155 CCCCCCCCCCCN1CC[C@H](C1)OC 2230a_100000766984_100011215454 [0,1,0,1,0,0|1,0,1]=4 16384 B18R1.13155 CCCCCCCCCCCN1CC[C@H](C1)OC 269982a_100000766984_100011215454 [0,1,0,1,0,0|1,0,1]=4 16385 B18R1.13159 C=CCCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100009814027 [0,1,0,1,0,0|0,0,2]=4 16386 B18R1.13159 CCCCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100011215454 [0,1,0,1,0,0|0,0,0]=2 16387 B18R1.13159 COC(=O)C1CN1CCCCCCCCCCO 2230a_200009830135_100009813290 [0,1,0,1,0,0|1,0,0]=3 16388 B18R1.14113 CCCN1CCCC1COCCCCC(=O)OC 34a_200000694710_100000204269 [0,1,0,1,0,0|1,0,0]=3 16389 B18R1.14113 CCCN1CCCC1COCCCCC(=O)OC 7a_200000694710_100000204269 [0,1,0,1,0,0|1,0,0]=3 16390 B18R1.14113 CCCN1CCCC1COCCOCC(=O)OC 34a_200000694710_100000090808 [0,1,0,1,0,0|2,0,0]=4 16391 B18R1.14113 CCCN1CCCC1COCCOCC(=O)OC 7a_200000694710_100000090808 [0,1,0,1,0,0|2,0,0]=4 16392 B18R1.14113 COC[C@@H]1CCCN1CCCCCCC(=O)OC 2230a_100020646714_100009815986 [0,1,0,1,0,0|1,0,0]=3 16393 B18R1.14113 COC[C@@H]1CCCN1CCCCCCC(=O)OC 269982a_100020646714_100009815986 [0,1,0,1,0,0|1,0,0]=3 16394 B18R1.14113 COC[C@@H]1CCCN1CCCCCCC(=O)OC 34a_100020646714_100009815986 [0,1,0,1,0,0|1,0,0]=3 16395 B18R1.14470 COCC1CCN1CCCCCCCC(=O)OC 2230a_100015195929_100010004213 [0,1,0,1,0,0|1,0,0]=3 16396 B18R1.14470 COCC1CCN1CCCCCCCC(=O)OC 269982a_100015195929_100010004213 [0,1,0,1,0,0|1,0,0]=3 16397 B18R1.14470 COCC1CCN1CCCCCCCC(=O)OC 34a_100015195929_100010004213 [0,1,0,1,0,0|1,0,0]=3 16398 B18R1.21925 CCCCCCCCCCN1CCCC(C1)OC 2230a_100000695604_100000210320 [0,1,0,1,0,0|1,0,1]=4 16399 B18R1.21925 CCCCCCCCCCN1CCCC(C1)OC 269982a_100000695604_100000210320 [0,1,0,1,0,0|1,0,1]=4 16400 B18R1.21925 CCCCCCCCCCN1CCCC(C1)OC 34a_100000695604_100000210320 [0,1,0,1,0,0|1,0,1]=4 16401 B18R1.21926 CCCCCCCCCCCCNC1CCC1=O 34a_100000210451_100009892977 [0,1,0,1,0,0|1,0,0]=3 16402 B18R1.21926 CCCCCCCCCCCCOC1CCC1=O 34a_100000210810_100009892977 [0,1,0,1,0,0|1,0,0]=3 16403 B18R1.21926 CCCCCCCCCCCCOC1CCC1=O 7a_100000210810_100009892977 [0,1,0,1,0,0|1,0,0]=3 16404 B18R1.21926 CCCCCCCCCCCCSC1CCC1=O 62a_100009892977_100000759014 [0,1,0,1,0,0|1,0,0]=3 16405 B18R1.21926 CCCCCCCCCCNCCC1CCC1=O 2230a_100000684558_200016118888 [0,1,0,1,0,0|1,0,0]=3 16406 B18R1.21926 CCCCCCCCCCOCCC1CCC1=O 7a_100000210711_200016118888 [0,1,0,1,0,0|1,0,0]=3 16407 B18R1.21926 CCCCCCCCCCSCCC1CCC1=O 62a_200016118888_100000210320 [0,1,0,1,0,0|1,0,0]=3 16408 B18R1.21926 CCOCCCCCCCCCOC1CCC1=O 34a_100009875440_100009892977 [0,1,0,1,0,0|2,0,0]=4 16409 B18R1.21926 CCOCCCCCCCCCOC1CCC1=O 7a_100009875440_100009892977 [0,1,0,1,0,0|2,0,0]=4 16410 B18R1.21926 O=C1CCC1CCNCCCCCCCCCO 2230a_100000078944_200016118888 [0,1,0,1,0,0|2,0,0]=4 16411 B18R1.21926 O=C1CCC1CCOCCCCCCCCCBr 7a_100009813782_200016118888 [0,1,0,1,0,0|2,0,0]=4 16412 B18R1.21926 O=C1CCC1CCOCCCCCCCCCCl 7a_100009868337_200016118888 [0,1,0,1,0,0|2,0,0]=4 16413 B18R1.21926 O=C1CCC1CCSCCCCCCCCCO 62a_100009813782_200016118888 [0,1,0,1,0,0|2,0,0]=4 16414 B18R1.21926 O=C1CCC1CCSCCCCCCCCCO 62a_200016118888_100009813782 [0,1,0,1,0,0|2,0,0]=4 16415 B18R1.21926 O=C1CCC1OCCCCCCCCCCCBr 34a_100009812471_100009892977 [0,1,0,1,0,0|2,0,0]=4 16416 B18R1.21926 O=C1CCC1OCCCCCCCCCCCBr 7a_100009812471_100009892977 [0,1,0,1,0,0|2,0,0]=4 16417 B18R1.21926 O=C1CCC1SCCCCCCCCCCCO 62a_100009812471_100009892977 [0,1,0,1,0,0|2,0,0]=4 16418 B18R1.21935 CCCCCC1CCCC1NCCCC(=O)NC 269862a_100000740002_200000198059 [0,1,0,1,0,0|1,0,0]=3 16419 B18R1.21935 CCCCCC1CCCC1NCCCC(=O)NC 270004a_100000740002_200000198059 [0,1,0,1,0,0|1,0,0]=3 16420 B18R1.21935 CCCCCC1CCCC1NCCNC(=O)CC 269862a_100132302217_200000198059 [0,1,0,1,0,0|2,0,0]=4 16421 B18R1.21935 CCCCCC1CCCC1NCCNC(=O)CC 270004a_100132302217_200000198059 [0,1,0,1,0,0|2,0,0]=4 16422 B18R1.21935 CCCCCC1CCCC1NCCNC(=O)NC 269862a_100015205895_200000198059 [0,1,0,1,0,0|2,0,0]=4 16423 B18R1.33223 CCC(=O)COC1CCCCCCCCCCC1 7a_100000211378_100000747405 [0,1,0,1,0,0|1,0,0]=3 16424 B18R1.33223 CNC(=O)CNC1CCCCCCCCCCC1 2230a_100011194316_100000183359 [0,1,0,1,0,0|1,0,0]=3 16425 B18R1.33223 CNC(=O)CNC1CCCCCCCCCCC1 270004a_100000693194_100000210130 [0,1,0,1,0,0|1,0,0]=3 16426 B18R1.33223 CNC(=O)CNC1CCCCCCCCCCC1 34a_100011194316_100000183359 [0,1,0,1,0,0|1,0,0]=3 16427 B18R1.33223 CNC(=O)COC1CCCCCCCCCCC1 34a_100000211378_100000183359 [0,1,0,1,0,0|1,0,0]=3 16428 B18R1.33223 CNC(=O)COC1CCCCCCCCCCC1 7a_100000211378_100000183359 [0,1,0,1,0,0|1,0,0]=3 16429 B18R1.33223 COC(=O)CNC1CCCCCCCCCCC1 2230a_100011194316_100000747449 [0,1,0,1,0,0|0,0,0]=2 16430 B18R1.33223 COC(=O)CNC1CCCCCCCCCCC1 34a_100011194316_100000747449 [0,1,0,1,0,0|0,0,0]=2 16431 B18R1.33223 COC(=O)COC1CCCCCCCCCCC1 34a_100000211378_100000747449 [0,1,0,1,0,0|0,0,0]=2 16432 B18R1.33223 COC(=O)COC1CCCCCCCCCCC1 7a_100000211378_100000747449 [0,1,0,1,0,0|0,0,0]=2 16433 B18R1.33223 CO[C@H](C)CNC1CCCCCCCCCCC1 270004a_100020591295_100000210130 [0,1,0,1,0,0|1,0,1]=4 16434 B18R1.33918 COC(=O)CCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009813843 [0,1,0,1,0,0|1,0,0]=3 16435 B18R1.33918 COC(=O)CCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009813843 [0,1,0,1,0,0|1,0,0]=3 16436 B18R1.33918 COC(=O)CCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009813843 [0,1,0,1,0,0|1,0,0]=3 16437 B18R1.33918 COC(=O)CCCCCCCCOCC1CC1C 34a_100000744939_100010282707 [0,1,0,1,0,0|0,0,0]=2 16438 B18R1.33918 COC(=O)CCCCCCCCOCC1CC1C 7a_100000744939_100010282707 [0,1,0,1,0,0|0,0,0]=2 16439 B18R1.33919 COC(=O)CCCCCCCCCCN1CCC1 269982a_100000754969_100009812566 [0,1,0,1,0,0|0,0,0]=2 16440 B18R1.33919 COC(=O)CCCCCCCCCNC1CCC1 2230a_100000749019_100009813843 [0,1,0,1,0,0|0,0,0]=2 16441 B18R1.33919 COC(=O)CCCCCCCCCNC1CCC1 34a_100000749019_100009813843 [0,1,0,1,0,0|0,0,0]=2 16442 B18R1.33919 COC(=O)CCCCCCCCCNC1COC1 2230a_100016991112_100009813843 [0,1,0,1,0,0|1,0,0]=3 16443 B18R1.33919 COC(=O)CCCCCCCCCOC1CCC1 34a_100000748187_100009813843 [0,1,0,1,0,0|0,0,0]=2 16444 B18R1.33919 COC(=O)CCCCCCCCCOC1CSC1 7a_100000072292_100009813843 [0,1,0,1,0,0|1,0,0]=3 16445 B18R1.33919 COC(=O)CCCCCCCCNCC1CCC1 2230a_100000738700_100010282707 [0,1,0,1,0,0|0,0,0]=2 16446 B18R1.33919 COC(=O)CCCCCCCCNCC1CCC1 34a_100000738700_100010282707 [0,1,0,1,0,0|0,0,0]=2 16447 B18R1.33919 COC(=O)CCCCCCCCNCC1COC1 2230a_100015281925_100010282707 [0,1,0,1,0,0|1,0,0]=3 16448 B18R1.33919 COC(=O)CCCCCCCCNCC1COC1 34a_100015281925_100010282707 [0,1,0,1,0,0|1,0,0]=3 16449 B18R1.33919 COC(=O)CCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100010282707 [0,1,0,1,0,0|1,0,0]=3 16450 B18R1.33919 COC(=O)CCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100010282707 [0,1,0,1,0,0|1,0,0]=3 16451 B18R1.33919 COC(=O)CCCCCCCCOCC1CCC1 34a_100000035544_100000763275 [0,1,0,1,0,0|0,0,0]=2 16452 B18R1.33919 COC(=O)CCCCCCCCOCC1CCC1 34a_100000760304_100010282707 [0,1,0,1,0,0|0,0,0]=2 16453 B18R1.33919 COC(=O)CCCCCCCCOCC1CCC1 7a_100000035544_100000763275 [0,1,0,1,0,0|0,0,0]=2 16454 B18R1.33919 COC(=O)CCCCCCCCOCC1CCO1 34a_100000035544_100000103362 [0,1,0,1,0,0|1,0,0]=3 16455 B18R1.33919 COC(=O)CCCCCCCCOCC1CCO1 34a_100000039022_100010282707 [0,1,0,1,0,0|1,0,0]=3 16456 B18R1.33919 COC(=O)CCCCCCCCOCC1CCO1 7a_100000035544_100000103362 [0,1,0,1,0,0|1,0,0]=3 16457 B18R1.33919 COC(=O)CCCCCCCCOCC1CNC1 34a_100016987283_100010282707 [0,1,0,1,0,0|1,0,0]=3 16458 B18R1.33919 COC(=O)CCCCCCCCOCC1COC1 34a_100000035544_100010264016 [0,1,0,1,0,0|1,0,0]=3 16459 B18R1.33919 COC(=O)CCCCCCCCOCC1COC1 34a_100000060846_100010282707 [0,1,0,1,0,0|1,0,0]=3 16460 B18R1.33919 COC(=O)CCCCCCCCOCC1COC1 7a_100000035544_100010264016 [0,1,0,1,0,0|1,0,0]=3 16461 B18R1.33919 COC(=O)CCCCCCCCSCC1CCC1 62a_100000763275_100010282707 [0,1,0,1,0,0|0,0,0]=2 16462 B18R1.33919 COC(=O)CCCCCCCCSCC1CCC1 62a_100010282707_100000763275 [0,1,0,1,0,0|0,0,0]=2 16463 B18R1.33919 COC(=O)CCCCCCCCSCC1CCO1 62a_100000103362_100010282707 [0,1,0,1,0,0|1,0,0]=3 16464 B18R1.33919 COC(=O)CCCCCCCCSCC1CCO1 62a_100010282707_100000103362 [0,1,0,1,0,0|1,0,0]=3 16465 B18R1.33919 COC(=O)CCCCCCCCSCC1COC1 62a_100010264016_100010282707 [0,1,0,1,0,0|1,0,0]=3 16466 B18R1.33919 COC(=O)CCCCCCCCSCC1COC1 62a_100010282707_100010264016 [0,1,0,1,0,0|1,0,0]=3 16467 B18R1.33919 COC(=O)CCCCCCCOCCC1COC1 34a_100009855314_100010004213 [0,1,0,1,0,0|1,0,0]=3 16468 B18R1.33919 COC(=O)CCOCCOCCOCC1CCC1 34a_100010982084_100000763275 [0,1,0,1,0,0|2,0,0]=4 16469 B18R1.33919 COC(=O)CCOCCOCCOCC1CCC1 7a_100010982084_100000763275 [0,1,0,1,0,0|2,0,0]=4 16470 B18R1.34249 COC(=O)CCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100010282707 [0,1,0,1,0,0|0,0,0]=2 16471 B18R1.34249 COC(=O)CCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100010282707 [0,1,0,1,0,0|0,0,0]=2 16472 B18R1.34249 COC(=O)CCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100010282707 [0,1,0,1,0,0|0,0,0]=2 16473 B18R1.34249 COC(=O)CCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100010282707 [0,1,0,1,0,0|0,0,0]=2 16474 B18R1.34249 COC(=O)CCCCCCCCN1CCC[C@H]1C 34a_100015189458_100010282707 [0,1,0,1,0,0|0,0,0]=2 16475 B18R1.34249 COC(=O)CCCCCCCCN1CCSC1C 2230a_200011216479_100010282707 [0,1,0,1,0,0|1,0,0]=3 16476 B18R1.34249 COC(=O)CCCCCCCCN1CCSC1C 269982a_200011216479_100010282707 [0,1,0,1,0,0|1,0,0]=3 16477 B18R1.34249 COC(=O)CCCCCCCCN1CCSC1C 34a_200011216479_100010282707 [0,1,0,1,0,0|1,0,0]=3 16478 B18R1.34249 COC(=O)CCCCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100010004213 [0,1,0,1,0,0|2,0,0]=4 16479 B18R1.34249 COC(=O)CCCCCCCOC1CCCC1=O 34a_100011022521_100000709159 [0,1,0,1,0,0|1,0,1]=4 16480 B18R1.34249 COC(=O)CCCCCCCOC1CCCC1=O 34a_200000719330_100010004213 [0,1,0,1,0,0|1,0,1]=4 16481 B18R1.34249 COC(=O)CCCCCCCOC1CCCC1=O 7a_100011022521_100000211823 [0,1,0,1,0,0|1,0,1]=4 16482 B18R1.34249 COC(=O)CCCCCCCOC1CCCC1C 34a_100011216460_100010004213 [0,1,0,1,0,0|0,0,0]=2 16483 B18R1.34249 COC(=O)CCCCCCCOC1CCCC1C 7a_100011216460_100010004213 [0,1,0,1,0,0|0,0,0]=2 16484 B18R1.34249 COC(=O)CCCCCCCOC1COCC1O 34a_100011022521_200000725654 [0,1,0,1,0,0|2,0,0]=4 16485 B18R1.34249 COC(=O)CCCCCCCOC1COCC1O 7a_100011022521_200000725654 [0,1,0,1,0,0|2,0,0]=4 16486 B18R1.34249 COC(=O)CCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100010004213 [0,1,0,1,0,0|1,0,0]=3 16487 B18R1.34249 COC(=O)CCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100010004213 [0,1,0,1,0,0|1,0,0]=3 16488 B18R1.34249 COC(=O)CCCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100010004213 [0,1,0,1,0,0|1,0,0]=3 16489 B18R1.34249 COC(=O)CCCCCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100010004213 [0,1,0,1,0,0|2,0,0]=4 16490 B18R1.34249 COC(=O)CCCCCCCSC1CCCC1=O 62a_100000211823_100010004213 [0,1,0,1,0,0|1,0,1]=4 16491 B18R1.34249 COC(=O)CCCCCCCSC1CCCC1=O 62a_100010004213_100000211823 [0,1,0,1,0,0|1,0,1]=4 16492 B18R1.34249 COC(=O)CCCCCCCSC1COCC1O 62a_100010004213_200000725654 [0,1,0,1,0,0|2,0,0]=4 16493 B18R1.34249 COC(=O)CCCCCCCSC1COCC1O 62a_200000725654_100010004213 [0,1,0,1,0,0|2,0,0]=4 16494 B18R1.34249 COC(=O)CCCCCCCS[C@@H]1CCC[C@H]1O 62a_100010004213_200016002552 [0,1,0,1,0,0|1,0,0]=3 16495 B18R1.34249 COC(=O)CCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100010004213 [0,1,0,1,0,0|1,0,0]=3 16496 B18R1.34249 COC(=O)CCCCCCOCC1CCCN1C 34a_100000743107_100009815986 [0,1,0,1,0,0|1,0,0]=3 16497 B18R1.34249 COC(=O)CCCCCOCCC1CCCN1C 34a_100000074720_100000005710 [0,1,0,1,0,0|1,0,0]=3 16498 B18R1.34249 COC(=O)CCCCCOCCC1CCCN1C 34a_100011215177_100009816466 [0,1,0,1,0,0|1,0,0]=3 16499 B18R1.34249 COC(=O)CCCCCOCCC1CCCN1C 7a_100000074720_100000005710 [0,1,0,1,0,0|1,0,0]=3 16500 B18R1.34249 COC(=O)CCCCCOCCC1CCCN1C 7a_100011215177_100009816466 [0,1,0,1,0,0|1,0,0]=3 16501 B18R1.34249 COC(=O)CCCCCSCCC1CCCN1C 62a_100000005710_100009816466 [0,1,0,1,0,0|1,0,0]=3 16502 B18R1.34249 COC(=O)CCCCCSCCC1CCCN1C 62a_100009816466_100000005710 [0,1,0,1,0,0|1,0,0]=3 16503 B18R1.34254 COC(=O)CCCCCCCCCN1CCC1C 269982a_100000755817_100009813843 [0,1,0,1,0,0|0,0,0]=2 16504 B18R1.34254 COC(=O)CCCCCCCCCN1CCC1C 34a_100000755817_100009813843 [0,1,0,1,0,0|0,0,0]=2 16505 B18R1.34254 COC(=O)CCCCCCCCOC1CCC1=O 34a_100000035544_100009892977 [0,1,0,1,0,0|1,0,1]=4 16506 B18R1.34254 COC(=O)CCCCCCCCOC1CCC1=O 7a_100000035544_100009892977 [0,1,0,1,0,0|1,0,1]=4 16507 B18R1.34254 COC(=O)CCCCCCCCSC1CCC1=O 62a_100009892977_100010282707 [0,1,0,1,0,0|1,0,1]=4 16508 B18R1.34254 COC(=O)CCCCCCCCSC1CCC1=O 62a_100010282707_100009892977 [0,1,0,1,0,0|1,0,1]=4 16509 B18R1.34254 COC(=O)CCCCCCOCCC1CCC1=O 7a_100009863599_200016118888 [0,1,0,1,0,0|1,0,1]=4 16510 B18R1.34254 COC(=O)CCCCCCSCCC1CCC1=O 62a_100009815986_200016118888 [0,1,0,1,0,0|1,0,1]=4 16511 B18R1.34254 COC(=O)CCCCCCSCCC1CCC1=O 62a_200016118888_100009815986 [0,1,0,1,0,0|1,0,1]=4 16512 B18R1.37213 COC(=O)CCCCCCCCC=NNC1CC1 4a_100000701032_200010166605 [0,1,0,1,0,0|1,0,1]=4 16513 B18R1.37213 COC(=O)CCCCCCCCCCNC1CC1 34a_100000212008_100009812566 [0,1,0,1,0,0|0,0,0]=2 16514 B18R1.37213 COC(=O)CCCCCCCCCCOC1CC1 34a_100011003013_100000211595 [0,1,0,1,0,0|0,0,0]=2 16515 B18R1.37213 COC(=O)CCCCCCCCCNCC1CC1 2230a_100000735609_100009813843 [0,1,0,1,0,0|0,0,0]=2 16516 B18R1.37213 COC(=O)CCCCCCCCCNCC1CC1 34a_100000735609_100009813843 [0,1,0,1,0,0|0,0,0]=2 16517 B18R1.37213 COC(=O)CCCCCCCCCOCC1CC1 34a_100000211283_100009813843 [0,1,0,1,0,0|0,0,0]=2 16518 B18R1.37213 COC(=O)CCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100009813843 [0,1,0,1,0,0|1,0,0]=3 16519 B18R1.37213 COC(=O)CCCCCCCCCSCC1CC1 62a_100000756562_100009813843 [0,1,0,1,0,0|0,0,0]=2 16520 B18R1.37213 COC(=O)CCCCCCCCCSCC1CO1 62a_102125554688_100009813843 [0,1,0,1,0,0|1,0,0]=3 16521 B18R1.37213 COC(=O)CCCCCCCCCSCC1CS1 62a_100000031435_100009813843 [0,1,0,1,0,0|1,0,0]=3 16522 B18R1.37213 COC(=O)CCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100009813843 [0,1,0,1,0,0|1,0,0]=3 16523 B18R1.37213 COC(=O)CCCCCCCCNCCC1CC1 34a_100000764129_100010282707 [0,1,0,1,0,0|0,0,0]=2 16524 B18R1.37213 COC(=O)CCCCCCCCOCCC1CC1 34a_100000035544_100000694398 [0,1,0,1,0,0|0,0,0]=2 16525 B18R1.37213 COC(=O)CCCCCCCCOCCC1CC1 34a_100000754188_100010282707 [0,1,0,1,0,0|0,0,0]=2 16526 B18R1.37213 COC(=O)CCCCCCCCOCCC1CC1 7a_100000035544_100000764125 [0,1,0,1,0,0|0,0,0]=2 16527 B18R1.37213 COC(=O)CCCCCCCCOCCC1CC1 7a_100000754188_100010282707 [0,1,0,1,0,0|0,0,0]=2 16528 B18R1.37213 COC(=O)CCCCCCCCOCCC1CO1 34a_100000035544_100000732470 [0,1,0,1,0,0|1,0,0]=3 16529 B18R1.37213 COC(=O)CCCCCCCCOCCC1CO1 7a_100000035544_100000732470 [0,1,0,1,0,0|1,0,0]=3 16530 B18R1.37213 COC(=O)CCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100010282707 [0,1,0,1,0,0|1,0,0]=3 16531 B18R1.37213 COC(=O)CCCCCCCCSCCC1CC1 62a_100000764125_100010282707 [0,1,0,1,0,0|0,0,0]=2 16532 B18R1.37213 COC(=O)CCCCCCCCSCCC1CC1 62a_100010282707_100000764125 [0,1,0,1,0,0|0,0,0]=2 16533 B18R1.37213 COC(=O)CCCCCCCCSCCC1CO1 62a_100000732470_100010282707 [0,1,0,1,0,0|1,0,0]=3 16534 B18R1.37213 COC(=O)CCCCCCCCSCCC1CO1 62a_100010282707_100000732470 [0,1,0,1,0,0|1,0,0]=3 16535 B18R1.37213 COC(=O)CCCCCCCOCC#CC1CC1 34a_100000083941_100010004213 [0,1,0,1,0,0|0,0,2]=4 16536 B18R1.37213 COC(=O)CCCCCCCOCC#CC1CC1 34a_100011022521_100009895102 [0,1,0,1,0,0|0,0,2]=4 16537 B18R1.37213 COC(=O)CCCCCCCOCC#CC1CC1 7a_100000083941_100010004213 [0,1,0,1,0,0|0,0,2]=4 16538 B18R1.37213 COC(=O)CCCCCCCOCC#CC1CC1 7a_100011022521_100009895102 [0,1,0,1,0,0|0,0,2]=4 16539 B18R1.37213 COC(=O)CCCCCCCOCCCC1CO1 34a_100011022521_100000733510 [0,1,0,1,0,0|1,0,0]=3 16540 B18R1.37213 COC(=O)CCCCCCCOCCCC1CO1 7a_100011022521_100000733510 [0,1,0,1,0,0|1,0,0]=3 16541 B18R1.37213 COC(=O)CCCCCCCOCCNC1CC1 34a_100000738766_100010004213 [0,1,0,1,0,0|1,0,0]=3 16542 B18R1.37213 COC(=O)CCCCCCCSCC#CC1CC1 62a_100009895102_100010004213 [0,1,0,1,0,0|0,0,2]=4 16543 B18R1.37213 COC(=O)CCCCCCCSCC#CC1CC1 62a_100010004213_100009895102 [0,1,0,1,0,0|0,0,2]=4 16544 B18R1.37213 COC(=O)CCCCCCCSCCCC1CO1 62a_100000733510_100010004213 [0,1,0,1,0,0|1,0,0]=3 16545 B18R1.37213 COC(=O)CCCCCCCSCCCC1CO1 62a_100010004213_100000733510 [0,1,0,1,0,0|1,0,0]=3 16546 B18R1.37213 COC(=O)CCCCOCCCCOCC1CO1 34a_100010889290_100000204269 [0,1,0,1,0,0|2,0,0]=4 16547 B18R1.37213 COC(=O)CCCCOCCCCOCC1CO1 7a_100010889290_100000204269 [0,1,0,1,0,0|2,0,0]=4 16548 B18R1.37213 COC(=O)CCOCCOCCOCCC1CC1 34a_100010982084_100000694398 [0,1,0,1,0,0|2,0,0]=4 16549 B18R1.37213 COC(=O)CCOCCOCCOCCC1CC1 7a_100010982084_100000764125 [0,1,0,1,0,0|2,0,0]=4 16550 B18R1.37399 CNC(=O)CCCOCCCN1CCCCCC1 34a_100102886287_100000741757 [0,1,0,1,0,0|2,0,0]=4 16551 B18R1.37399 CNC(=O)CCCOCCCN1CCCCCC1 7a_100102886287_100000741757 [0,1,0,1,0,0|2,0,0]=4 16552 B18R1.37399 CNC(=O)CCOCCCCN1CCCCCC1 34a_100011305542_100012179268 [0,1,0,1,0,0|2,0,0]=4 16553 B18R1.37399 COC(=O)CCCCCCCN1CCCCCC1 2230a_100000185865_100010004213 [0,1,0,1,0,0|0,0,0]=2 16554 B18R1.37399 COC(=O)CCCCCCCN1CCCCCC1 269982a_100000185865_100010004213 [0,1,0,1,0,0|0,0,0]=2 16555 B18R1.37399 COC(=O)CCCCCCCN1CCCCCC1 34a_100000185865_100010004213 [0,1,0,1,0,0|0,0,0]=2 16556 B18R1.37399 COC(=O)CCCCCCCN1CCCOCC1 2230a_100000685342_100010004213 [0,1,0,1,0,0|1,0,0]=3 16557 B18R1.37399 COC(=O)CCCCCCCN1CCCOCC1 269982a_100000685342_100010004213 [0,1,0,1,0,0|1,0,0]=3 16558 B18R1.37399 COC(=O)CCCCCCCN1CCCOCC1 34a_100000685342_100010004213 [0,1,0,1,0,0|1,0,0]=3 16559 B18R1.37399 COC(=O)CCCCCCNC1CCCCCC1 2230a_100000210984_100009815986 [0,1,0,1,0,0|0,0,0]=2 16560 B18R1.37399 COC(=O)CCCCCCNC1CCCCCC1 34a_100000210984_100009815986 [0,1,0,1,0,0|0,0,0]=2 16561 B18R1.37399 COC(=O)CCCCCCOC1CCCCCC1 34a_100000210887_100009815986 [0,1,0,1,0,0|0,0,0]=2 16562 B18R1.37399 COC(=O)CCCCCCOC1CCCCCC1 34a_100009863599_100011217769 [0,1,0,1,0,0|0,0,0]=2 16563 B18R1.37399 COC(=O)CCCCCCOC1CCCCCC1 7a_100000210887_100009815986 [0,1,0,1,0,0|0,0,0]=2 16564 B18R1.37399 COC(=O)CCCCCCSC1CCCCCC1 62a_100009815986_100011217769 [0,1,0,1,0,0|0,0,0]=2 16565 B18R1.37399 COC(=O)CCCCCCSC1CCCCCC1 62a_100011217769_100009815986 [0,1,0,1,0,0|0,0,0]=2 16566 B18R1.37399 COC(=O)CCCCCNCC1CCCCCC1 2230a_100015204231_100009816466 [0,1,0,1,0,0|0,0,0]=2 16567 B18R1.37399 COC(=O)CCCCCNCC1CCCCCC1 34a_100015204231_100009816466 [0,1,0,1,0,0|0,0,0]=2 16568 B18R1.37399 COC(=O)CCCCCOCC1CCCCCC1 34a_100000074720_200000696569 [0,1,0,1,0,0|0,0,0]=2 16569 B18R1.37399 COC(=O)CCCCCOCC1CCCCCC1 34a_100000699130_100009816466 [0,1,0,1,0,0|0,0,0]=2 16570 B18R1.37399 COC(=O)CCCCCOCC1CCCCCC1 7a_100000074720_200000696569 [0,1,0,1,0,0|0,0,0]=2 16571 B18R1.37399 COC(=O)CCCCCOCC1CCCCCC1 7a_100000699130_100009816466 [0,1,0,1,0,0|0,0,0]=2 16572 B18R1.37399 COC(=O)CCCCCOCC1CNCCOC1 34a_100103147999_100009816466 [0,1,0,1,0,0|2,0,0]=4 16573 B18R1.37399 COC(=O)CCCCCSCC1CCCCCC1 62a_100009816466_200000696569 [0,1,0,1,0,0|0,0,0]=2 16574 B18R1.37399 COC(=O)CCCCCSCC1CCCCCC1 62a_200000696569_100009816466 [0,1,0,1,0,0|0,0,0]=2 16575 B18R1.37399 COC(=O)CCCCNCCC1CCCCCC1 2230a_100011532351_100000204269 [0,1,0,1,0,0|0,0,0]=2 16576 B18R1.37399 COC(=O)CCCCNCCC1CCCCCC1 34a_100011532351_100000204269 [0,1,0,1,0,0|0,0,0]=2 16577 B18R1.37399 COC(=O)CCCCOCCN1CCCCCC1 34a_100000238007_100000204269 [0,1,0,1,0,0|1,0,0]=3 16578 B18R1.37399 COC(=O)CCCCOCCN1CCCCCC1 7a_100000059025_100000722644 [0,1,0,1,0,0|1,0,0]=3 16579 B18R1.37399 COC(=O)CCCCSCCN1CCCCCC1 62a_100000204269_100000722644 [0,1,0,1,0,0|1,0,0]=3 16580 B18R1.37399 COC(=O)CCCCSCCN1CCCCCC1 62a_100000722644_100000204269 [0,1,0,1,0,0|1,0,0]=3 16581 B18R1.37399 COC(=O)CCCOCCCN1CCCCCC1 34a_100102886287_100000742333 [0,1,0,1,0,0|1,0,0]=3 16582 B18R1.37399 COC(=O)CCCOCCCN1CCCCCC1 7a_100102886287_100011218270 [0,1,0,1,0,0|1,0,0]=3 16583 B18R1.37399 COC(=O)CCOCCCCN1CCCCCC1 34a_100011305542_100000742370 [0,1,0,1,0,0|1,0,0]=3 16584 B18R1.37399 COC(=O)COCCNCCC1CCCCCC1 2230a_100011532351_100000090808 [0,1,0,1,0,0|1,0,0]=3 16585 B18R1.37399 COC(=O)COCCNCCC1CCCCCC1 34a_100011532351_100000090808 [0,1,0,1,0,0|1,0,0]=3 16586 B18R1.37399 COC(=O)COCCOCCN1CCCCCC1 34a_100000238007_100000090808 [0,1,0,1,0,0|2,0,0]=4 16587 B18R1.37399 COC(=O)COCCSCCN1CCCCCC1 62a_100000090808_100000722644 [0,1,0,1,0,0|2,0,0]=4 16588 B18R1.37399 COC(=O)COCCSCCN1CCCCCC1 62a_100000722644_100000090808 [0,1,0,1,0,0|2,0,0]=4 16589 B18R1.37990 C#CC1CCCCN1CCCCCCC(=O)OC 2230a_200020621307_100009815986 [0,1,0,1,0,0|0,0,2]=4 16590 B18R1.37990 C#CC1CCCCN1CCCCCCC(=O)OC 269982a_200020621307_100009815986 [0,1,0,1,0,0|0,0,2]=4 16591 B18R1.37990 C#CC1CCCCN1CCCCCCC(=O)OC 34a_200020621307_100009815986 [0,1,0,1,0,0|0,0,2]=4 16592 B18R1.37990 CCC1CCCCC1OCCCCCC(=O)OC 34a_100000210738_100009816466 [0,1,0,1,0,0|0,0,0]=2 16593 B18R1.37990 CCC1CCCCC1OCCCCCC(=O)OC 7a_100000210738_100009816466 [0,1,0,1,0,0|0,0,0]=2 16594 B18R1.37990 CCC1CCCCN1CCCCCCC(=O)OC 2230a_100000210034_100009815986 [0,1,0,1,0,0|0,0,0]=2 16595 B18R1.37990 CCC1CCCCN1CCCCCCC(=O)OC 269982a_100000210034_100009815986 [0,1,0,1,0,0|0,0,0]=2 16596 B18R1.37990 CCC1CCCCN1CCCCCCC(=O)OC 34a_100000210034_100009815986 [0,1,0,1,0,0|0,0,0]=2 16597 B18R1.37990 CCC1CCCCN1CCCNCCC(=O)NC 34a_100011191702_100012179268 [0,1,0,1,0,0|2,0,0]=4 16598 B18R1.37990 CCC1CCCCN1CCCNCCC(=O)OC 34a_100011191702_100000742370 [0,1,0,1,0,0|1,0,0]=3 16599 B18R1.37990 CCC1CCCCN1CCNCCCC(=O)NC 2230a_100000755458_100000741757 [0,1,0,1,0,0|2,0,0]=4 16600 B18R1.37990 CCC1CCCCN1CCNCCCC(=O)NC 34a_100000755458_100000741757 [0,1,0,1,0,0|2,0,0]=4 16601 B18R1.37990 CCC1CCCCN1CCNCCCC(=O)OC 2230a_100000755458_100011218270 [0,1,0,1,0,0|1,0,0]=3 16602 B18R1.37990 CCC1CCCCN1CCNCCCC(=O)OC 34a_100000755458_100000742333 [0,1,0,1,0,0|1,0,0]=3 16603 B18R1.37990 CCN1CCCCC1CNCCCCC(=O)OC 2230a_100000754393_100000204269 [0,1,0,1,0,0|1,0,0]=3 16604 B18R1.37990 CCN1CCCCC1CNCCCCC(=O)OC 34a_100000754393_100000204269 [0,1,0,1,0,0|1,0,0]=3 16605 B18R1.37990 CCN1CCCCC1CNCCOCC(=O)OC 2230a_100000754393_100000090808 [0,1,0,1,0,0|2,0,0]=4 16606 B18R1.37990 CCN1CCCCC1CNCCOCC(=O)OC 34a_100000754393_100000090808 [0,1,0,1,0,0|2,0,0]=4 16607 B18R1.37990 CCN1CCCCC1COCCCCC(=O)OC 34a_100000225091_100000204269 [0,1,0,1,0,0|1,0,0]=3 16608 B18R1.37990 CCN1CCCCC1COCCCCC(=O)OC 7a_100000225091_100000204269 [0,1,0,1,0,0|1,0,0]=3 16609 B18R1.37990 CCN1CCCCC1COCCOCC(=O)OC 34a_100000225091_100000090808 [0,1,0,1,0,0|2,0,0]=4 16610 B18R1.37990 CCN1CCCCC1COCCOCC(=O)OC 7a_100000225091_100000090808 [0,1,0,1,0,0|2,0,0]=4 16611 B18R1.37990 CC[C@H]1COCCN1CCCCCCC(=O)OC 2230a_100016988097_100009815986 [0,1,0,1,0,0|1,0,0]=3 16612 B18R1.37990 CC[C@H]1COCCN1CCCCCCC(=O)OC 269982a_100016988097_100009815986 [0,1,0,1,0,0|1,0,0]=3 16613 B18R1.37990 CC[C@H]1COCCN1CCCCCCC(=O)OC 34a_100016988097_100009815986 [0,1,0,1,0,0|1,0,0]=3 16614 B18R1.37990 CN[C@@H]1CCCC[C@H]1OCCCCCC(=O)OC 34a_100000708425_100009816466 [0,1,0,1,0,0|1,0,0]=3 16615 B18R1.37990 COC(=O)CCCCCCN1CCCCC1C#N 34a_100016989756_100009815986 [0,1,0,1,0,0|1,0,1]=4 16616 B18R1.37990 COC(=O)CCCCCCN1CCCCC1CO 2230a_100000210821_100009815986 [0,1,0,1,0,0|1,0,0]=3 16617 B18R1.37990 COC(=O)CCCCCCN1CCCCC1CO 269982a_100000210821_100009815986 [0,1,0,1,0,0|1,0,0]=3 16618 B18R1.37990 COC(=O)CCCCCCN1CCCCC1CO 34a_100000210821_100009815986 [0,1,0,1,0,0|1,0,0]=3 16619 B18R1.37990 COC(=O)CCCCCCN1CCOC[C@H]1CO 2230a_100000717676_100009815986 [0,1,0,1,0,0|2,0,0]=4 16620 B18R1.37990 COC(=O)CCCCCCN1CCOC[C@H]1CO 269982a_100000717676_100009815986 [0,1,0,1,0,0|2,0,0]=4 16621 B18R1.37990 COC(=O)CCCCCCN1CCOC[C@H]1CO 34a_100000717676_100009815986 [0,1,0,1,0,0|2,0,0]=4 16622 B18R1.37990 COC(=O)CCCCCNC1CCCCC1OC 34a_100011208099_100009816466 [0,1,0,1,0,0|1,0,0]=3 16623 B18R1.37990 COC(=O)CCCCCNC1CCOCC1CO 2230a_214813039666_100009816466 [0,1,0,1,0,0|2,0,0]=4 16624 B18R1.37990 COC(=O)CCCCCNC1CCOCC1CO 34a_214813039666_100009816466 [0,1,0,1,0,0|2,0,0]=4 16625 B18R1.37990 COC(=O)CCCCCOC1CCCCC1CN 34a_100011216029_100009816466 [0,1,0,1,0,0|1,0,0]=3 16626 B18R1.37990 COC(=O)CCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100009816466 [0,1,0,1,0,0|1,0,0]=3 16627 B18R1.37990 COC(=O)CCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100009816466 [0,1,0,1,0,0|1,0,0]=3 16628 B18R1.37990 COC(=O)CCCNCCN1CCCCC1CO 2230a_100011473795_100011218270 [0,1,0,1,0,0|2,0,0]=4 16629 B18R1.37990 COC(=O)CCCNCCN1CCCCC1CO 34a_100011473795_100000742333 [0,1,0,1,0,0|2,0,0]=4 16630 B18R1.37990 COC(=O)CCNCCCN1CCCCC1CO 34a_200011473794_100000742370 [0,1,0,1,0,0|2,0,0]=4 16631 B18R1.40321 CCCCCCCC1CCCC1NCC(=O)NC 269862a_100000693194_200011216720 [0,1,0,1,0,0|1,0,0]=3 16632 B18R1.40321 CCCCCCCC1CCCC1NCC(=O)NC 270004a_100000693194_200011216720 [0,1,0,1,0,0|1,0,0]=3 16633 B18R1.40321 CCCCCCCC1CCCC1NC[C@@H](C)OC 269862a_100020591295_200011216720 [0,1,0,1,0,0|1,0,1]=4 16634 B18R1.40321 CCCCCCCC1CCCC1NC[C@@H](C)OC 270004a_100020591295_200011216720 [0,1,0,1,0,0|1,0,1]=4 16635 B18R1.40547 C=CCCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011933949 [0,1,0,1,0,0|0,0,2]=4 16636 B18R1.40547 C=CCCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011933949 [0,1,0,1,0,0|0,0,2]=4 16637 B18R1.40547 CCC#CCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_200000036426 [0,1,0,1,0,0|0,0,2]=4 16638 B18R1.40547 CCC#CCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_200000036426 [0,1,0,1,0,0|0,0,2]=4 16639 B18R1.40547 CCCCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210320 [0,1,0,1,0,0|0,0,0]=2 16640 B18R1.40547 CCCCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210320 [0,1,0,1,0,0|0,0,0]=2 16641 B18R1.40547 COC(=O)[C@@H]1CCN1CCCCCCCCCO 2230a_102516456887_100009813782 [0,1,0,1,0,0|1,0,0]=3 16642 B18R1.40547 COC(=O)[C@@H]1CCN1CCCCCCCCCO 269982a_102516456887_100009813782 [0,1,0,1,0,0|1,0,0]=3 16643 B18R1.40569 CCCCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210320 [0,1,0,1,0,0|2,0,0]=4 16644 B18R1.40569 CCCCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210320 [0,1,0,1,0,0|2,0,0]=4 16645 B18R1.49463 CCCCCCCCCCCCNCC1(CO1)C 34a_100000210451_100000760498 [0,1,0,1,0,0|1,0,1]=4 16646 B18R1.49463 CCCCCCCCCCCCOCC1(CO1)C 34a_100000210810_100000760498 [0,1,0,1,0,0|1,0,1]=4 16647 B18R1.49463 CCCCCCCCCCCCSCC1(CO1)C 62a_100000760498_100000759014 [0,1,0,1,0,0|1,0,1]=4 16648 B18R1.180549 CCCCCCCCCCCCN1CC(C1)OC 269982a_100000755009_100000759014 [0,1,0,1,0,0|1,0,1]=4 16649 B18R1.180549 CCCCCCCCCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100011215454 [0,1,0,1,0,0|1,0,1]=4 16650 B18R1.371 CCCCCCC1CCCC1NCC(=O)NCC 270004a_100016988866_100000189428 [0,1,0,1,0,0|2,0,0]=4 16651 B18R1.848 CCNC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737597 [0,1,0,1,0,0|2,0,0]=4 16652 B18R1.848 CCOC(=O)CCCCCCCN1CCCOC1 2230a_100000131196_100009991516 [0,1,0,1,0,0|2,0,0]=4 16653 B18R1.848 CCOC(=O)CCCCCCCN1CCCOC1 269982a_100000131196_100009991516 [0,1,0,1,0,0|2,0,0]=4 16654 B18R1.848 CCOC(=O)CCCCCCCN1CCCOC1 34a_100000131196_100009991516 [0,1,0,1,0,0|2,0,0]=4 16655 B18R1.848 CCOC(=O)CCCCCCCN1CCOCC1 2230a_100015191051_100009991516 [0,1,0,1,0,0|2,0,0]=4 16656 B18R1.848 CCOC(=O)CCCCCCCN1CCOCC1 269982a_100015191051_100009991516 [0,1,0,1,0,0|2,0,0]=4 16657 B18R1.848 CCOC(=O)CCCCCCCN1CCOCC1 34a_100015191051_100009991516 [0,1,0,1,0,0|2,0,0]=4 16658 B18R1.848 CCOC(=O)CCCCCCCN1CCSCC1 2230a_100000737611_100009991516 [0,1,0,1,0,0|2,0,0]=4 16659 B18R1.848 CCOC(=O)CCCCCCCN1CCSCC1 269982a_100000737611_100009991516 [0,1,0,1,0,0|2,0,0]=4 16660 B18R1.848 CCOC(=O)CCCCCCNC1CCCCC1 2230a_100000182618_100009814379 [0,1,0,1,0,0|1,0,0]=3 16661 B18R1.848 CCOC(=O)CCCCCCNC1CCCCC1 34a_100000182618_100009814379 [0,1,0,1,0,0|1,0,0]=3 16662 B18R1.848 CCOC(=O)CCCCCCNC1CCCOC1 2230a_100000719290_100009814379 [0,1,0,1,0,0|2,0,0]=4 16663 B18R1.848 CCOC(=O)CCCCCCNC1CCCOC1 34a_100000719290_100009814379 [0,1,0,1,0,0|2,0,0]=4 16664 B18R1.848 CCOC(=O)CCCCCCNC1CCOCC1 2230a_100000741149_100009814379 [0,1,0,1,0,0|2,0,0]=4 16665 B18R1.848 CCOC(=O)CCCCCCNC1CCOCC1 34a_100000741149_100009814379 [0,1,0,1,0,0|2,0,0]=4 16666 B18R1.848 CCOC(=O)CCCCCCNC1CCSCC1 2230a_100000748639_100009814379 [0,1,0,1,0,0|2,0,0]=4 16667 B18R1.848 CCOC(=O)CCCCCCNC1CCSCC1 34a_100000748639_100009814379 [0,1,0,1,0,0|2,0,0]=4 16668 B18R1.848 CCOC(=O)CCCCCCOC1CCCCC1 34a_100000210231_100009814379 [0,1,0,1,0,0|1,0,0]=3 16669 B18R1.848 CCOC(=O)CCCCCCOC1CCCCC1 7a_100000210231_100009814379 [0,1,0,1,0,0|1,0,0]=3 16670 B18R1.848 CCOC(=O)CCCCCCOC1CCCCO1 34a_100000033831_100009814379 [0,1,0,1,0,0|2,0,0]=4 16671 B18R1.848 CCOC(=O)CCCCCCOC1CCCOC1 34a_100000754041_100009814379 [0,1,0,1,0,0|2,0,0]=4 16672 B18R1.848 CCOC(=O)CCCCCCOC1CCCSC1 7a_100015962668_100009814379 [0,1,0,1,0,0|2,0,0]=4 16673 B18R1.848 CCOC(=O)CCCCCCOC1CCOCC1 34a_100000744328_100009814379 [0,1,0,1,0,0|2,0,0]=4 16674 B18R1.848 CCOC(=O)CCCCCCOC1CCSCC1 34a_100000731022_100009814379 [0,1,0,1,0,0|2,0,0]=4 16675 B18R1.848 CCOC(=O)CCCCCCOC1CCSCC1 7a_100000731022_100009814379 [0,1,0,1,0,0|2,0,0]=4 16676 B18R1.848 CCOC(=O)CCCCCCSC1CCCCC1 62a_100000210327_100009814379 [0,1,0,1,0,0|1,0,0]=3 16677 B18R1.848 CCOC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_100000755133 [0,1,0,1,0,0|1,0,0]=3 16678 B18R1.848 CCOC(=O)CCCCCNCC1CCCCC1 34a_100000210473_100000755133 [0,1,0,1,0,0|1,0,0]=3 16679 B18R1.848 CCOC(=O)CCCCCNCC1CCCCO1 2230a_100000174945_100000755133 [0,1,0,1,0,0|2,0,0]=4 16680 B18R1.848 CCOC(=O)CCCCCNCC1CCCCO1 34a_100000174945_100000755133 [0,1,0,1,0,0|2,0,0]=4 16681 B18R1.848 CCOC(=O)CCCCCNCC1CCCOC1 2230a_100000720124_100000755133 [0,1,0,1,0,0|2,0,0]=4 16682 B18R1.848 CCOC(=O)CCCCCNCC1CCCOC1 34a_100000720124_100000755133 [0,1,0,1,0,0|2,0,0]=4 16683 B18R1.848 CCOC(=O)CCCCCNCC1CCOCC1 2230a_100000746373_100000755133 [0,1,0,1,0,0|2,0,0]=4 16684 B18R1.848 CCOC(=O)CCCCCNCC1CCOCC1 34a_100000746373_100000755133 [0,1,0,1,0,0|2,0,0]=4 16685 B18R1.848 CCOC(=O)CCCCCNCC1CCSCC1 2230a_100015188806_100000755133 [0,1,0,1,0,0|2,0,0]=4 16686 B18R1.848 CCOC(=O)CCCCCNCC1CCSCC1 34a_100015188806_100000755133 [0,1,0,1,0,0|2,0,0]=4 16687 B18R1.848 CCOC(=O)CCCCCOCC1CCCCC1 34a_100000212181_100000755133 [0,1,0,1,0,0|1,0,0]=3 16688 B18R1.848 CCOC(=O)CCCCCOCC1CCCCC1 7a_100000212181_100000755133 [0,1,0,1,0,0|1,0,0]=3 16689 B18R1.848 CCOC(=O)CCCCCOCC1CCCCC1 7a_100011214988_100000211423 [0,1,0,1,0,0|1,0,0]=3 16690 B18R1.848 CCOC(=O)CCCCCOCC1CCCCN1 34a_100000210821_100000755133 [0,1,0,1,0,0|2,0,0]=4 16691 B18R1.848 CCOC(=O)CCCCCOCC1CCCCO1 34a_100000211370_100000755133 [0,1,0,1,0,0|2,0,0]=4 16692 B18R1.848 CCOC(=O)CCCCCOCC1CCCCO1 7a_100000211370_100000755133 [0,1,0,1,0,0|2,0,0]=4 16693 B18R1.848 CCOC(=O)CCCCCOCC1CCCCO1 7a_100011214988_100000211543 [0,1,0,1,0,0|2,0,0]=4 16694 B18R1.848 CCOC(=O)CCCCCOCC1CCCNC1 34a_100000211344_100000755133 [0,1,0,1,0,0|2,0,0]=4 16695 B18R1.848 CCOC(=O)CCCCCOCC1CCCOC1 34a_100000741520_100000755133 [0,1,0,1,0,0|2,0,0]=4 16696 B18R1.848 CCOC(=O)CCCCCOCC1CCCOC1 7a_100011214988_100000741521 [0,1,0,1,0,0|2,0,0]=4 16697 B18R1.848 CCOC(=O)CCCCCOCC1CCNCC1 34a_100000738675_100000755133 [0,1,0,1,0,0|2,0,0]=4 16698 B18R1.848 CCOC(=O)CCCCCOCC1CCOCC1 34a_100000749013_100000755133 [0,1,0,1,0,0|2,0,0]=4 16699 B18R1.848 CCOC(=O)CCCCCOCC1CCOCC1 7a_100011214988_100000754603 [0,1,0,1,0,0|2,0,0]=4 16700 B18R1.848 CCOC(=O)CCCCCOCC1CCSCC1 34a_100000070558_100000755133 [0,1,0,1,0,0|2,0,0]=4 16701 B18R1.848 CCOC(=O)CCCCCOCC1CCSCC1 7a_100000070558_100000755133 [0,1,0,1,0,0|2,0,0]=4 16702 B18R1.848 CCOC(=O)CCCCCSCC1CCCCC1 62a_100000211423_100000755133 [0,1,0,1,0,0|1,0,0]=3 16703 B18R1.848 CCOC(=O)CCCCCSCC1CCCCC1 62a_100000755133_100000211423 [0,1,0,1,0,0|1,0,0]=3 16704 B18R1.848 CCOC(=O)CCCCCSCC1CCCCO1 62a_100000211543_100000755133 [0,1,0,1,0,0|2,0,0]=4 16705 B18R1.848 CCOC(=O)CCCCCSCC1CCCCO1 62a_100000755133_100000211543 [0,1,0,1,0,0|2,0,0]=4 16706 B18R1.848 CCOC(=O)CCCCCSCC1CCCOC1 62a_100000741521_100000755133 [0,1,0,1,0,0|2,0,0]=4 16707 B18R1.848 CCOC(=O)CCCCCSCC1CCCOC1 62a_100000755133_100000741521 [0,1,0,1,0,0|2,0,0]=4 16708 B18R1.848 CCOC(=O)CCCCCSCC1CCOCC1 62a_100000754603_100000755133 [0,1,0,1,0,0|2,0,0]=4 16709 B18R1.848 CCOC(=O)CCCCCSCC1CCOCC1 62a_100000755133_100000749018 [0,1,0,1,0,0|2,0,0]=4 16710 B18R1.848 CCOC(=O)CCCCNCCC1CCCCC1 2230a_100000738074_100000750268 [0,1,0,1,0,0|1,0,0]=3 16711 B18R1.848 CCOC(=O)CCCCNCCC1CCCCC1 34a_100000738074_100000750268 [0,1,0,1,0,0|1,0,0]=3 16712 B18R1.848 CCOC(=O)CCCCNCCC1CCCCO1 2230a_100015183643_100000750268 [0,1,0,1,0,0|2,0,0]=4 16713 B18R1.848 CCOC(=O)CCCCNCCC1CCCCO1 34a_100015183643_100000750268 [0,1,0,1,0,0|2,0,0]=4 16714 B18R1.848 CCOC(=O)CCCCNCCC1CCOCC1 2230a_100000755988_100000750268 [0,1,0,1,0,0|2,0,0]=4 16715 B18R1.848 CCOC(=O)CCCCNCCC1CCOCC1 34a_100000755988_100000750268 [0,1,0,1,0,0|2,0,0]=4 16716 B18R1.848 CCOC(=O)CCCCOCCC1CCCCC1 34a_100011217863_100000750268 [0,1,0,1,0,0|1,0,0]=3 16717 B18R1.848 CCOC(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000750268 [0,1,0,1,0,0|1,0,0]=3 16718 B18R1.848 CCOC(=O)CCCCOCCC1CCCCN1 34a_100000211664_100000750268 [0,1,0,1,0,0|2,0,0]=4 16719 B18R1.848 CCOC(=O)CCCCOCCC1CCCNC1 34a_100000752241_100000750268 [0,1,0,1,0,0|2,0,0]=4 16720 B18R1.848 CCOC(=O)CCCCOCCC1CCNCC1 34a_100015190746_100000750268 [0,1,0,1,0,0|2,0,0]=4 16721 B18R1.848 CCOC(=O)CCCCOCCC1CCOCC1 34a_100011933979_100000750268 [0,1,0,1,0,0|2,0,0]=4 16722 B18R1.848 CCOC(=O)CCCCOCCC1CCOCC1 7a_100011933979_100000750268 [0,1,0,1,0,0|2,0,0]=4 16723 B18R1.848 CCOC(=O)CCCCSCCC1CCCCC1 62a_100000750268_100012355289 [0,1,0,1,0,0|1,0,0]=3 16724 B18R1.848 CCOC(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000750268 [0,1,0,1,0,0|1,0,0]=3 16725 B18R1.848 CCOC(=O)CCCCSCCC1CCOCC1 62a_100000750268_100011934994 [0,1,0,1,0,0|2,0,0]=4 16726 B18R1.848 CCOC(=O)CCCCSCCC1CCOCC1 62a_100011934994_100000750268 [0,1,0,1,0,0|2,0,0]=4 16727 B18R1.848 CCOC(=O)CCCCSCCN1CCCCC1 62a_100000739454_100000750268 [0,1,0,1,0,0|2,0,0]=4 16728 B18R1.848 CCOC(=O)CCCCSCCN1CCCCC1 62a_100000750268_100000739454 [0,1,0,1,0,0|2,0,0]=4 16729 B18R1.848 CCOC(=O)CCCCSCOC1CCCCC1 62a_100000750268_100011935260 [0,1,0,1,0,0|2,0,0]=4 16730 B18R1.848 CCOC(=O)CCCCSCOC1CCCCC1 62a_100011935260_100000750268 [0,1,0,1,0,0|2,0,0]=4 16731 B18R1.848 CCOC(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100009991533 [0,1,0,1,0,0|1,0,0]=3 16732 B18R1.848 CCOC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100009991533 [0,1,0,1,0,0|1,0,0]=3 16733 B18R1.848 CCOC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100009991533 [0,1,0,1,0,0|2,0,0]=4 16734 B18R1.848 CCOC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100009991533 [0,1,0,1,0,0|1,0,0]=3 16735 B18R1.848 CCOC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100011215271 [0,1,0,1,0,0|1,0,0]=3 16736 B18R1.848 CCOC(=O)CCCOCCCC1CCCCC1 7a_100012001163_100011713725 [0,1,0,1,0,0|1,0,0]=3 16737 B18R1.848 CCOC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100009991533 [0,1,0,1,0,0|2,0,0]=4 16738 B18R1.848 CCOC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100009991533 [0,1,0,1,0,0|2,0,0]=4 16739 B18R1.848 CCOC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100009991533 [0,1,0,1,0,0|2,0,0]=4 16740 B18R1.848 CCOC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100009991533 [0,1,0,1,0,0|2,0,0]=4 16741 B18R1.848 CCOC(=O)CCCOCCCN1CCCCC1 7a_100012001163_100000007876 [0,1,0,1,0,0|2,0,0]=4 16742 B18R1.848 CCOC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100009991533 [0,1,0,1,0,0|2,0,0]=4 16743 B18R1.848 CCOC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100009991533 [0,1,0,1,0,0|2,0,0]=4 16744 B18R1.848 CCOC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100011215271 [0,1,0,1,0,0|2,0,0]=4 16745 B18R1.848 CCOC(=O)CCCOCCOC1CCCCC1 7a_100012001163_100011211530 [0,1,0,1,0,0|2,0,0]=4 16746 B18R1.848 CCOC(=O)CCCSCCCC1CCCCC1 62a_100009991533_100011713725 [0,1,0,1,0,0|1,0,0]=3 16747 B18R1.848 CCOC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100009991533 [0,1,0,1,0,0|1,0,0]=3 16748 B18R1.848 CCOC(=O)CCCSCCCN1CCCCC1 62a_100009991533_100000007876 [0,1,0,1,0,0|2,0,0]=4 16749 B18R1.848 CCOC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100009991533 [0,1,0,1,0,0|2,0,0]=4 16750 B18R1.848 CCOC(=O)CCCSCCOC1CCCCC1 62a_100009991533_100011211530 [0,1,0,1,0,0|2,0,0]=4 16751 B18R1.848 CCOC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100009991533 [0,1,0,1,0,0|2,0,0]=4 16752 B18R1.848 CCOC(=O)CCNCCCOC1CCCCC1 34a_100000205933_100000765890 [0,1,0,1,0,0|2,0,0]=4 16753 B18R1.848 CCOC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100000765890 [0,1,0,1,0,0|1,0,0]=3 16754 B18R1.848 CCOC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100011206558 [0,1,0,1,0,0|1,0,0]=3 16755 B18R1.848 CCOC(=O)CCOCCCCC1CCNCC1 34a_100016989291_100000765890 [0,1,0,1,0,0|2,0,0]=4 16756 B18R1.848 CCOC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000188475 [0,1,0,1,0,0|2,0,0]=4 16757 B18R1.848 CCOC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000188475 [0,1,0,1,0,0|2,0,0]=4 16758 B18R1.848 CCOC(=O)COCCCNCC1CCCCC1 2230a_100000210473_100009893628 [0,1,0,1,0,0|2,0,0]=4 16759 B18R1.848 CCOC(=O)COCCCNCC1CCCCC1 34a_100000210473_100009893628 [0,1,0,1,0,0|2,0,0]=4 16760 B18R1.848 CCOC(=O)COCCCOCC1CCCCC1 34a_100000212181_100009893628 [0,1,0,1,0,0|2,0,0]=4 16761 B18R1.848 CCOC(=O)COCCCOCC1CCCCC1 7a_100000212181_100009893628 [0,1,0,1,0,0|2,0,0]=4 16762 B18R1.848 CCOC(=O)COCCCSCC1CCCCC1 62a_100000211423_100009893628 [0,1,0,1,0,0|2,0,0]=4 16763 B18R1.848 CCOC(=O)COCCCSCC1CCCCC1 62a_100009893628_100000211423 [0,1,0,1,0,0|2,0,0]=4 16764 B18R1.848 CCOC(=O)COCCNCCC1CCCCC1 2230a_100000738074_100000088970 [0,1,0,1,0,0|2,0,0]=4 16765 B18R1.848 CCOC(=O)COCCNCCC1CCCCC1 34a_100000738074_100000088970 [0,1,0,1,0,0|2,0,0]=4 16766 B18R1.848 CCOC(=O)COCCOCCC1CCCCC1 34a_100011217863_100000088970 [0,1,0,1,0,0|2,0,0]=4 16767 B18R1.848 CCOC(=O)COCCOCCC1CCCCC1 7a_100011217863_100000088970 [0,1,0,1,0,0|2,0,0]=4 16768 B18R1.848 CCOC(=O)COCCSCCC1CCCCC1 62a_100000088970_100012355289 [0,1,0,1,0,0|2,0,0]=4 16769 B18R1.848 CCOC(=O)COCCSCCC1CCCCC1 62a_100012355289_100000088970 [0,1,0,1,0,0|2,0,0]=4 16770 B18R1.848 CCOC(=O)CSCCOCCC1CCCCC1 7a_200000230590_100011273959 [0,1,0,1,0,0|2,0,0]=4 16771 B18R1.848 CCOC(=O)NCCOCCCC1CCCCC1 34a_100000158857_100011713725 [0,1,0,1,0,0|2,0,0]=4 16772 B18R1.848 CCOC(=O)NCCOCCCC1CCCCC1 7a_100000198086_200011445536 [0,1,0,1,0,0|2,0,0]=4 16773 B18R1.848 CCOC(=O)NCCSCCCC1CCCCC1 62a_100011713725_200011445536 [0,1,0,1,0,0|2,0,0]=4 16774 B18R1.848 COCC(=O)CCCCCCOC1CCCCO1 1458a_100000210968_100000033462 [0,1,0,1,0,0|2,0,0]=4 16775 B18R1.938 CCOC(=O)CCCN1CCCCC1CCCO 2230a_100011934581_100009991533 [0,1,0,1,0,0|2,0,0]=4 16776 B18R1.938 CCOC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100009991533 [0,1,0,1,0,0|2,0,0]=4 16777 B18R1.938 CCOC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100009991533 [0,1,0,1,0,0|2,0,0]=4 16778 B18R1.938 CCOC(=O)CCCN1CCCCC1CCOC 2230a_100015186528_100009991533 [0,1,0,1,0,0|2,0,0]=4 16779 B18R1.938 CCOC(=O)CCCN1CCCCC1CCOC 269982a_100015186528_100009991533 [0,1,0,1,0,0|2,0,0]=4 16780 B18R1.938 CCOC(=O)CCCN1CCCCC1CCOC 34a_100015186528_100009991533 [0,1,0,1,0,0|2,0,0]=4 16781 B18R1.1108 CCCCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100011215454 [0,1,0,1,0,0|2,0,0]=4 16782 B18R1.1108 CCCCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011215454 [0,1,0,1,0,0|1,0,0]=3 16783 B18R1.1108 CCCCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210320 [0,1,0,1,0,0|2,0,0]=4 16784 B18R1.1108 CCCCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210320 [0,1,0,1,0,0|2,0,0]=4 16785 B18R1.1108 CCCCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210320 [0,1,0,1,0,0|2,0,0]=4 16786 B18R1.1108 CCCCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210320 [0,1,0,1,0,0|2,0,0]=4 16787 B18R1.1108 CCCCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100011214924 [0,1,0,1,0,0|2,0,0]=4 16788 B18R1.1108 CCCCCCCCCOCC1COCC(=O)N1 34a_200000101122_100011214924 [0,1,0,1,0,0|2,0,0]=4 16789 B18R1.1108 O=C1CN(CCO1)CCCCCCCCCCO 2230a_100000131268_100009813290 [0,1,0,1,0,0|2,0,0]=4 16790 B18R1.1312 CCOC(=O)CCN1CCCCC1CCCOC 2230a_100011804088_100011206558 [0,1,0,1,0,0|2,0,0]=4 16791 B18R1.1312 CCOC(=O)CCN1CCCCC1CCCOC 269982a_100011804088_100011206558 [0,1,0,1,0,0|2,0,0]=4 16792 B18R1.1312 CCOC(=O)CCN1CCCCC1CCCOC 34a_100011804088_100000765890 [0,1,0,1,0,0|2,0,0]=4 16793 B18R1.1445 CCOC(=O)CCCCCCCCN1CCCC1 2230a_100000188435_100010175975 [0,1,0,1,0,0|1,0,0]=3 16794 B18R1.1445 CCOC(=O)CCCCCCCCN1CCCC1 269982a_100000188435_100010175975 [0,1,0,1,0,0|1,0,0]=3 16795 B18R1.1445 CCOC(=O)CCCCCCCCN1CCSC1 2230a_100011215254_100010175975 [0,1,0,1,0,0|2,0,0]=4 16796 B18R1.1445 CCOC(=O)CCCCCCCCN1CCSC1 269982a_100011215254_100010175975 [0,1,0,1,0,0|2,0,0]=4 16797 B18R1.1445 CCOC(=O)CCCCCCCNC1CCCC1 2230a_100000211070_100009991516 [0,1,0,1,0,0|1,0,0]=3 16798 B18R1.1445 CCOC(=O)CCCCCCCNC1CCCC1 34a_100000211070_100009991516 [0,1,0,1,0,0|1,0,0]=3 16799 B18R1.1445 CCOC(=O)CCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100009991516 [0,1,0,1,0,0|2,0,0]=4 16800 B18R1.1445 CCOC(=O)CCCCCCCN[C@H]1CCOC1 2230a_100015188467_100009991516 [0,1,0,1,0,0|2,0,0]=4 16801 B18R1.1445 CCOC(=O)CCCCCCCN[C@H]1CCOC1 34a_100015188467_100009991516 [0,1,0,1,0,0|2,0,0]=4 16802 B18R1.1445 CCOC(=O)CCCCCCCOC1CCCC1 34a_100000210269_100009991516 [0,1,0,1,0,0|1,0,0]=3 16803 B18R1.1445 CCOC(=O)CCCCCCCOC1CCCC1 7a_100000210269_100009991516 [0,1,0,1,0,0|1,0,0]=3 16804 B18R1.1445 CCOC(=O)CCCCCCCOC1CCCO1 34a_100000085407_100009991516 [0,1,0,1,0,0|2,0,0]=4 16805 B18R1.1445 CCOC(=O)CCCCCCCOC1CCSC1 7a_100011232664_100009991516 [0,1,0,1,0,0|2,0,0]=4 16806 B18R1.1445 CCOC(=O)CCCCCCCO[C@H]1CCOC1 34a_100000717292_100009991516 [0,1,0,1,0,0|2,0,0]=4 16807 B18R1.1445 CCOC(=O)CCCCCCCSC1CCCC1 62a_100011217020_100009991516 [0,1,0,1,0,0|1,0,0]=3 16808 B18R1.1445 CCOC(=O)CCCCCCNCC1CCCC1 2230a_100000737975_100009814379 [0,1,0,1,0,0|1,0,0]=3 16809 B18R1.1445 CCOC(=O)CCCCCCNCC1CCCC1 34a_100000737975_100009814379 [0,1,0,1,0,0|1,0,0]=3 16810 B18R1.1445 CCOC(=O)CCCCCCNCC1CCOC1 2230a_100000737293_100009814379 [0,1,0,1,0,0|2,0,0]=4 16811 B18R1.1445 CCOC(=O)CCCCCCNCC1CCOC1 34a_100000737293_100009814379 [0,1,0,1,0,0|2,0,0]=4 16812 B18R1.1445 CCOC(=O)CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009814379 [0,1,0,1,0,0|2,0,0]=4 16813 B18R1.1445 CCOC(=O)CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100009814379 [0,1,0,1,0,0|2,0,0]=4 16814 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCC1 34a_100000742336_100009814379 [0,1,0,1,0,0|1,0,0]=3 16815 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCC1 7a_100000742336_100009814379 [0,1,0,1,0,0|1,0,0]=3 16816 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCO1 34a_100000210270_100009814379 [0,1,0,1,0,0|2,0,0]=4 16817 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCO1 7a_100000210270_100009814379 [0,1,0,1,0,0|2,0,0]=4 16818 B18R1.1445 CCOC(=O)CCCCCCOCC1CCNC1 34a_100000748654_100009814379 [0,1,0,1,0,0|2,0,0]=4 16819 B18R1.1445 CCOC(=O)CCCCCCOCC1CCOC1 34a_100000740260_100009814379 [0,1,0,1,0,0|2,0,0]=4 16820 B18R1.1445 CCOC(=O)CCCCCCOC[C@H]1CCCN1 34a_100000745186_100009814379 [0,1,0,1,0,0|2,0,0]=4 16821 B18R1.1445 CCOC(=O)CCCCCCSCC1CCCC1 62a_100000740388_100009814379 [0,1,0,1,0,0|1,0,0]=3 16822 B18R1.1445 CCOC(=O)CCCCCCSCC1CCCO1 62a_100000203698_100009814379 [0,1,0,1,0,0|2,0,0]=4 16823 B18R1.1445 CCOC(=O)CCCCCCSCC1CCOC1 62a_100000702531_100009814379 [0,1,0,1,0,0|2,0,0]=4 16824 B18R1.1445 CCOC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100000755133 [0,1,0,1,0,0|1,0,0]=3 16825 B18R1.1445 CCOC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100000755133 [0,1,0,1,0,0|1,0,0]=3 16826 B18R1.1445 CCOC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100000755133 [0,1,0,1,0,0|1,0,0]=3 16827 B18R1.1445 CCOC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100000755133 [0,1,0,1,0,0|1,0,0]=3 16828 B18R1.1445 CCOC(=O)CCCCCOCCC1CCCC1 7a_100011214988_100000760354 [0,1,0,1,0,0|1,0,0]=3 16829 B18R1.1445 CCOC(=O)CCCCCOCCC1CCNC1 34a_100016987287_100000755133 [0,1,0,1,0,0|2,0,0]=4 16830 B18R1.1445 CCOC(=O)CCCCCOCCC1CCOC1 34a_100011879284_100000755133 [0,1,0,1,0,0|2,0,0]=4 16831 B18R1.1445 CCOC(=O)CCCCCOCCN1CCCC1 7a_100011214988_100000004467 [0,1,0,1,0,0|2,0,0]=4 16832 B18R1.1445 CCOC(=O)CCCCCSCCC1CCCC1 62a_100000755133_100000760354 [0,1,0,1,0,0|1,0,0]=3 16833 B18R1.1445 CCOC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100000755133 [0,1,0,1,0,0|1,0,0]=3 16834 B18R1.1445 CCOC(=O)CCCCCSCCN1CCCC1 62a_100000700749_100000755133 [0,1,0,1,0,0|2,0,0]=4 16835 B18R1.1445 CCOC(=O)CCCCCSCCN1CCCC1 62a_100000755133_100000004467 [0,1,0,1,0,0|2,0,0]=4 16836 B18R1.1445 CCOC(=O)CCCCNCCCC1CCCC1 2230a_100000736752_100000750268 [0,1,0,1,0,0|1,0,0]=3 16837 B18R1.1445 CCOC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100000750268 [0,1,0,1,0,0|1,0,0]=3 16838 B18R1.1445 CCOC(=O)CCCCNCCOC1CCCC1 34a_100000741755_100000750268 [0,1,0,1,0,0|2,0,0]=4 16839 B18R1.1445 CCOC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100000750268 [0,1,0,1,0,0|1,0,0]=3 16840 B18R1.1445 CCOC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000750268 [0,1,0,1,0,0|1,0,0]=3 16841 B18R1.1445 CCOC(=O)CCCCOCCNC1CCCC1 34a_200000200444_100000750268 [0,1,0,1,0,0|2,0,0]=4 16842 B18R1.1445 CCOC(=O)CCCCOCCOC1CCCC1 34a_100000738311_100000750268 [0,1,0,1,0,0|2,0,0]=4 16843 B18R1.1445 CCOC(=O)CCCCOCCOC1CCCC1 7a_100000738311_100000750268 [0,1,0,1,0,0|2,0,0]=4 16844 B18R1.1445 CCOC(=O)CCCCSCCCC1CCCC1 62a_100000750268_100011713738 [0,1,0,1,0,0|1,0,0]=3 16845 B18R1.1445 CCOC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000750268 [0,1,0,1,0,0|1,0,0]=3 16846 B18R1.1445 CCOC(=O)CCCCSCCCN1CCCC1 62a_100000750268_100011445909 [0,1,0,1,0,0|2,0,0]=4 16847 B18R1.1445 CCOC(=O)CCCCSCCCN1CCCC1 62a_100016991639_100000750268 [0,1,0,1,0,0|2,0,0]=4 16848 B18R1.1445 CCOC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100009991533 [0,1,0,1,0,0|2,0,0]=4 16849 B18R1.1445 CCOC(=O)COCCCNCCC1CCCC1 2230a_100000739158_100009893628 [0,1,0,1,0,0|2,0,0]=4 16850 B18R1.1445 CCOC(=O)COCCCNCCC1CCCC1 34a_100000739158_100009893628 [0,1,0,1,0,0|2,0,0]=4 16851 B18R1.1445 CCOC(=O)COCCCOCCC1CCCC1 34a_100000749090_100009893628 [0,1,0,1,0,0|2,0,0]=4 16852 B18R1.1445 CCOC(=O)COCCCOCCC1CCCC1 7a_100000749090_100009893628 [0,1,0,1,0,0|2,0,0]=4 16853 B18R1.1445 CCOC(=O)COCCCSCCC1CCCC1 62a_100000760354_100009893628 [0,1,0,1,0,0|2,0,0]=4 16854 B18R1.1445 CCOC(=O)COCCCSCCC1CCCC1 62a_100009893628_100000760354 [0,1,0,1,0,0|2,0,0]=4 16855 B18R1.1445 CCOC(=O)COCCNCCCC1CCCC1 2230a_100000736752_100000088970 [0,1,0,1,0,0|2,0,0]=4 16856 B18R1.1445 CCOC(=O)COCCNCCCC1CCCC1 34a_100000736752_100000088970 [0,1,0,1,0,0|2,0,0]=4 16857 B18R1.1445 CCOC(=O)COCCOCCCC1CCCC1 34a_100011215328_100000088970 [0,1,0,1,0,0|2,0,0]=4 16858 B18R1.1445 CCOC(=O)COCCOCCCC1CCCC1 7a_100011215328_100000088970 [0,1,0,1,0,0|2,0,0]=4 16859 B18R1.1445 CCOC(=O)COCCSCCCC1CCCC1 62a_100000088970_100011713738 [0,1,0,1,0,0|2,0,0]=4 16860 B18R1.1445 CCOC(=O)COCCSCCCC1CCCC1 62a_100011713738_100000088970 [0,1,0,1,0,0|2,0,0]=4 16861 B18R1.1445 CCOC(=O)CSCCOCCCC1CCCC1 7a_200000230590_100011713738 [0,1,0,1,0,0|2,0,0]=4 16862 B18R1.1481 CCOC(=O)CCCCCCN1CCCCC1C 2230a_100000211376_100009814379 [0,1,0,1,0,0|1,0,0]=3 16863 B18R1.1481 CCOC(=O)CCCCCCN1CCCCC1C 269982a_100000211376_100009814379 [0,1,0,1,0,0|1,0,0]=3 16864 B18R1.1481 CCOC(=O)CCCCCCN1CCCCC1C 34a_100000211376_100009814379 [0,1,0,1,0,0|1,0,0]=3 16865 B18R1.1481 CCOC(=O)CCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100009814379 [0,1,0,1,0,0|2,0,0]=4 16866 B18R1.1481 CCOC(=O)CCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100009814379 [0,1,0,1,0,0|2,0,0]=4 16867 B18R1.1481 CCOC(=O)CCCCCCN1CCOC[C@@H]1C 34a_100009815349_100009814379 [0,1,0,1,0,0|2,0,0]=4 16868 B18R1.1481 CCOC(=O)CCCCCNC1CCCCC1C 2230a_100000211402_100000755133 [0,1,0,1,0,0|1,0,0]=3 16869 B18R1.1481 CCOC(=O)CCCCCNC1CCCCC1C 34a_100000211402_100000755133 [0,1,0,1,0,0|1,0,0]=3 16870 B18R1.1481 CCOC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000755133 [0,1,0,1,0,0|2,0,0]=4 16871 B18R1.1481 CCOC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000755133 [0,1,0,1,0,0|2,0,0]=4 16872 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1C 34a_100000211207_100000755133 [0,1,0,1,0,0|1,0,0]=3 16873 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1C 7a_100000211207_100000755133 [0,1,0,1,0,0|1,0,0]=3 16874 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1Cl 34a_100000038908_100000755133 [0,1,0,1,0,0|2,0,0]=4 16875 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1Cl 7a_100000038908_100000755133 [0,1,0,1,0,0|2,0,0]=4 16876 B18R1.1481 CCOC(=O)CCCCCOC1CCNCC1C 34a_100011998114_100000755133 [0,1,0,1,0,0|2,0,0]=4 16877 B18R1.1481 CCOC(=O)CCCCCOC1CNCCC1C 34a_100000696640_100000755133 [0,1,0,1,0,0|2,0,0]=4 16878 B18R1.1481 CCOC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000755133 [0,1,0,1,0,0|2,0,0]=4 16879 B18R1.1481 CCOC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000755133 [0,1,0,1,0,0|2,0,0]=4 16880 B18R1.1481 CCOC(=O)CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000755133 [0,1,0,1,0,0|2,0,0]=4 16881 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1F 62a_100000755133_100015423560 [0,1,0,1,0,0|2,0,0]=4 16882 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1F 62a_100015423560_100000755133 [0,1,0,1,0,0|2,0,0]=4 16883 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1O 62a_100000038908_100000755133 [0,1,0,1,0,0|2,0,0]=4 16884 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1O 62a_100000755133_100000038908 [0,1,0,1,0,0|2,0,0]=4 16885 B18R1.1481 CCOC(=O)CCCCNCC1CCCCC1O 34a_100011216029_100000750268 [0,1,0,1,0,0|2,0,0]=4 16886 B18R1.1481 CCOC(=O)CCCCNCC1CCCCN1C 34a_100011228421_100000750268 [0,1,0,1,0,0|2,0,0]=4 16887 B18R1.1481 CCOC(=O)CCCCOCC1CCCCN1C 34a_100000225079_100000750268 [0,1,0,1,0,0|2,0,0]=4 16888 B18R1.1481 CCOC(=O)CCCCSCC1CCCCN1C 62a_100000750268_100015185383 [0,1,0,1,0,0|2,0,0]=4 16889 B18R1.1481 CCOC(=O)CCCCSCC1CCCCN1C 62a_100015185383_100000750268 [0,1,0,1,0,0|2,0,0]=4 16890 B18R1.1481 CCOC(=O)CCCNCCN1CCCCC1C 2230a_100000739827_100009991533 [0,1,0,1,0,0|2,0,0]=4 16891 B18R1.1481 CCOC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100009991533 [0,1,0,1,0,0|2,0,0]=4 16892 B18R1.1481 CCOC(=O)CCCOCCC1CCCCN1C 7a_100012001163_100000211948 [0,1,0,1,0,0|2,0,0]=4 16893 B18R1.1481 CCOC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100009991533 [0,1,0,1,0,0|2,0,0]=4 16894 B18R1.1481 CCOC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100009991533 [0,1,0,1,0,0|2,0,0]=4 16895 B18R1.1481 CCOC(=O)CCCSCCC1CCCCN1C 62a_100009991533_100000211948 [0,1,0,1,0,0|2,0,0]=4 16896 B18R1.1481 CCOC(=O)CCNCCCN1CCCCC1C 34a_100000212276_100000765890 [0,1,0,1,0,0|2,0,0]=4 16897 B18R1.1481 CCOC(=O)CCOCCCN1CCCCC1C 34a_100000213889_100000765890 [0,1,0,1,0,0|2,0,0]=4 16898 B18R1.1481 CCOC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100011206558 [0,1,0,1,0,0|2,0,0]=4 16899 B18R1.1481 CCOC(=O)COCCCNC1CCCCC1C 2230a_100000211402_100009893628 [0,1,0,1,0,0|2,0,0]=4 16900 B18R1.1481 CCOC(=O)COCCCNC1CCCCC1C 34a_100000211402_100009893628 [0,1,0,1,0,0|2,0,0]=4 16901 B18R1.1481 CCOC(=O)COCCCOC1CCCCC1C 34a_100000211207_100009893628 [0,1,0,1,0,0|2,0,0]=4 16902 B18R1.1481 CCOC(=O)COCCCOC1CCCCC1C 7a_100000211207_100009893628 [0,1,0,1,0,0|2,0,0]=4 16903 B18R1.1482 CCOC(=O)CCCCCCN1CCCC1CC 2230a_100000754278_100009814379 [0,1,0,1,0,0|1,0,0]=3 16904 B18R1.1482 CCOC(=O)CCCCCCN1CCCC1CC 269982a_100000754278_100009814379 [0,1,0,1,0,0|1,0,0]=3 16905 B18R1.1482 CCOC(=O)CCCCCCN1CCCC1CC 34a_100000754278_100009814379 [0,1,0,1,0,0|1,0,0]=3 16906 B18R1.1482 CCOC(=O)CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009814379 [0,1,0,1,0,0|2,0,0]=4 16907 B18R1.1482 CCOC(=O)CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009814379 [0,1,0,1,0,0|2,0,0]=4 16908 B18R1.1482 CCOC(=O)CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100009814379 [0,1,0,1,0,0|2,0,0]=4 16909 B18R1.1482 CCOC(=O)CCCCNCC1CCCN1CC 2230a_100000211693_100000750268 [0,1,0,1,0,0|2,0,0]=4 16910 B18R1.1482 CCOC(=O)CCCCOC[C@H]1CCCN1CC 34a_100011739246_100000750268 [0,1,0,1,0,0|2,0,0]=4 16911 B18R1.1482 CCOC(=O)CCCCOC[C@H]1CCCN1CC 7a_100011739246_100000750268 [0,1,0,1,0,0|2,0,0]=4 16912 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CC 2230a_100000210034_100000755133 [0,1,0,1,0,0|1,0,0]=3 16913 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CC 269982a_100000210034_100000755133 [0,1,0,1,0,0|1,0,0]=3 16914 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CC 34a_100000210034_100000755133 [0,1,0,1,0,0|1,0,0]=3 16915 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CO 2230a_100000210821_100000755133 [0,1,0,1,0,0|2,0,0]=4 16916 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CO 269982a_100000210821_100000755133 [0,1,0,1,0,0|2,0,0]=4 16917 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CO 34a_100000210821_100000755133 [0,1,0,1,0,0|2,0,0]=4 16918 B18R1.4901 CCOC(=O)CCCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000755133 [0,1,0,1,0,0|2,0,0]=4 16919 B18R1.4901 CCOC(=O)CCCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000755133 [0,1,0,1,0,0|2,0,0]=4 16920 B18R1.4901 CCOC(=O)CCCCCN1CCOC[C@@H]1CC 34a_100016988097_100000755133 [0,1,0,1,0,0|2,0,0]=4 16921 B18R1.4901 CCOC(=O)CCCCNC1CCCCC1OC 34a_100011208099_100000750268 [0,1,0,1,0,0|2,0,0]=4 16922 B18R1.4901 CCOC(=O)CCCCOC1CCCCC1CC 34a_100000210738_100000750268 [0,1,0,1,0,0|1,0,0]=3 16923 B18R1.4901 CCOC(=O)CCCCOC1CCCCC1CC 7a_100000210738_100000750268 [0,1,0,1,0,0|1,0,0]=3 16924 B18R1.4901 CCOC(=O)CCCCOC1CCCCC1CN 34a_100011216029_100000750268 [0,1,0,1,0,0|2,0,0]=4 16925 B18R1.4901 CCOC(=O)CCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000750268 [0,1,0,1,0,0|2,0,0]=4 16926 B18R1.4901 CCOC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000750268 [0,1,0,1,0,0|2,0,0]=4 16927 B18R1.4901 CCOC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000750268 [0,1,0,1,0,0|2,0,0]=4 16928 B18R1.4901 CCOC(=O)CCCNCC1CCCCN1CC 2230a_100000754393_100009991533 [0,1,0,1,0,0|2,0,0]=4 16929 B18R1.4901 CCOC(=O)CCCNCC1CCCCN1CC 34a_100000754393_100009991533 [0,1,0,1,0,0|2,0,0]=4 16930 B18R1.4901 CCOC(=O)CCCOCC1CCCCN1CC 34a_100000225091_100009991533 [0,1,0,1,0,0|2,0,0]=4 16931 B18R1.4901 CCOC(=O)CCCOCC1CCCCN1CC 7a_100000225091_100011215271 [0,1,0,1,0,0|2,0,0]=4 16932 B18R1.4901 CCOC(=O)CCNCCN1CCCCC1CC 2230a_100000755458_100011206558 [0,1,0,1,0,0|2,0,0]=4 16933 B18R1.4901 CCOC(=O)CCNCCN1CCCCC1CC 34a_100000755458_100000765890 [0,1,0,1,0,0|2,0,0]=4 16934 B18R1.4901 CCOC(=O)CNCCCN1CCCCC1CC 34a_100011191702_100000188475 [0,1,0,1,0,0|2,0,0]=4 16935 B18R1.4901 CCOC(=O)COCCCN1CCCCC1CC 2230a_100000210034_100009893628 [0,1,0,1,0,0|2,0,0]=4 16936 B18R1.4901 CCOC(=O)COCCCN1CCCCC1CC 269982a_100000210034_100009893628 [0,1,0,1,0,0|2,0,0]=4 16937 B18R1.4901 CCOC(=O)COCCCN1CCCCC1CC 34a_100000210034_100009893628 [0,1,0,1,0,0|2,0,0]=4 16938 B18R1.4901 CCOC(=O)COCCOC1CCCCC1CC 34a_100000210738_100000088970 [0,1,0,1,0,0|2,0,0]=4 16939 B18R1.4901 CCOC(=O)COCCOC1CCCCC1CC 7a_100000210738_100000088970 [0,1,0,1,0,0|2,0,0]=4 16940 B18R1.4933 CCCC1CCCCC1OCCCC(=O)OCC 34a_100011217265_100009991533 [0,1,0,1,0,0|1,0,0]=3 16941 B18R1.4933 CCCC1CCCCC1OCCCC(=O)OCC 7a_100011217265_100011215271 [0,1,0,1,0,0|1,0,0]=3 16942 B18R1.4933 CCCC1CCCCC1OCCNC(=O)OCC 7a_100011217265_200011445536 [0,1,0,1,0,0|2,0,0]=4 16943 B18R1.4933 CCCC1CCCCN1CCCCC(=O)OCC 2230a_100000701414_100000750268 [0,1,0,1,0,0|1,0,0]=3 16944 B18R1.4933 CCCC1CCCCN1CCCCC(=O)OCC 269982a_100000701414_100000750268 [0,1,0,1,0,0|1,0,0]=3 16945 B18R1.4933 CCCC1CCCCN1CCCCC(=O)OCC 34a_100000701414_100000750268 [0,1,0,1,0,0|1,0,0]=3 16946 B18R1.4933 CCCC1CCCCN1CCOCC(=O)OCC 2230a_100000701414_100000088970 [0,1,0,1,0,0|2,0,0]=4 16947 B18R1.4933 CCCC1CCCCN1CCOCC(=O)OCC 269982a_100000701414_100000088970 [0,1,0,1,0,0|2,0,0]=4 16948 B18R1.4933 CCCC1CCCCN1CCOCC(=O)OCC 34a_100000701414_100000088970 [0,1,0,1,0,0|2,0,0]=4 16949 B18R1.4933 CCCC1COCCN1CCCCC(=O)OCC 2230a_102495339903_100000750268 [0,1,0,1,0,0|2,0,0]=4 16950 B18R1.4933 CCCC1COCCN1CCCCC(=O)OCC 269982a_102495339903_100000750268 [0,1,0,1,0,0|2,0,0]=4 16951 B18R1.4933 CCCC1COCCN1CCCCC(=O)OCC 34a_102495339903_100000750268 [0,1,0,1,0,0|2,0,0]=4 16952 B18R1.4933 CCOC(=O)CCCCN1CCCCC1CCO 2230a_100000211664_100000750268 [0,1,0,1,0,0|2,0,0]=4 16953 B18R1.4933 CCOC(=O)CCCCN1CCCCC1CCO 269982a_100000211664_100000750268 [0,1,0,1,0,0|2,0,0]=4 16954 B18R1.4933 CCOC(=O)CCCCN1CCCCC1CCO 34a_100000211664_100000750268 [0,1,0,1,0,0|2,0,0]=4 16955 B18R1.4933 CCOC(=O)CCCCN1CCCCC1COC 2230a_100015184032_100000750268 [0,1,0,1,0,0|2,0,0]=4 16956 B18R1.4933 CCOC(=O)CCCCN1CCCCC1COC 269982a_100015184032_100000750268 [0,1,0,1,0,0|2,0,0]=4 16957 B18R1.4933 CCOC(=O)CCCCN1CCCCC1COC 34a_100015184032_100000750268 [0,1,0,1,0,0|2,0,0]=4 16958 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210759 [0,1,0,1,0,0|2,0,0]=4 16959 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210759 [0,1,0,1,0,0|2,0,0]=4 16960 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000210759 [0,1,0,1,0,0|2,0,0]=4 16961 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210759 [0,1,0,1,0,0|1,0,0]=3 16962 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210759 [0,1,0,1,0,0|1,0,0]=3 16963 B18R1.13046 CCCCCCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210759 [0,1,0,1,0,0|2,0,0]=4 16964 B18R1.13046 CCCCCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210614 [0,1,0,1,0,0|1,0,0]=3 16965 B18R1.13046 CCCCOCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000743108 [0,1,0,1,0,0|2,0,0]=4 16966 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCCO 2230a_100000703725_100000760002 [0,1,0,1,0,0|2,0,0]=4 16967 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCCO 269982a_100000703725_100000760002 [0,1,0,1,0,0|2,0,0]=4 16968 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCOC 2230a_100000703725_100011998445 [0,1,0,1,0,0|2,0,0]=4 16969 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCOC 269982a_100000703725_100011998445 [0,1,0,1,0,0|2,0,0]=4 16970 B18R1.13046 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCCCF 7a_200015395474_100015922095 [0,1,0,1,0,0|2,0,0]=4 16971 B18R1.13046 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCCCO 7a_200015395474_100000766143 [0,1,0,1,0,0|2,0,0]=4 16972 B18R1.14112 CCCN1CCCC1COCCCC(=O)OCC 34a_200000694710_100009991533 [0,1,0,1,0,0|2,0,0]=4 16973 B18R1.14112 CCCN1CCCC1COCCCC(=O)OCC 7a_200000694710_100011215271 [0,1,0,1,0,0|2,0,0]=4 16974 B18R1.14112 CCOC(=O)CCCCCN1CCC[C@H]1COC 2230a_100020646714_100000755133 [0,1,0,1,0,0|2,0,0]=4 16975 B18R1.14112 CCOC(=O)CCCCCN1CCC[C@H]1COC 269982a_100020646714_100000755133 [0,1,0,1,0,0|2,0,0]=4 16976 B18R1.14112 CCOC(=O)CCCCCN1CCC[C@H]1COC 34a_100020646714_100000755133 [0,1,0,1,0,0|2,0,0]=4 16977 B18R1.14469 CCOC(=O)CCCCCCN1CCC1COC 2230a_100015195929_100009814379 [0,1,0,1,0,0|2,0,0]=4 16978 B18R1.14469 CCOC(=O)CCCCCCN1CCC1COC 269982a_100015195929_100009814379 [0,1,0,1,0,0|2,0,0]=4 16979 B18R1.14469 CCOC(=O)CCCCCCN1CCC1COC 34a_100015195929_100009814379 [0,1,0,1,0,0|2,0,0]=4 16980 B18R1.14770 CCOC1CCCCCCCCCCCCCC1 34a_200000037640_100000210202 [0,1,0,1,0,0|1,0,1]=4 16981 B18R1.14770 CCOC1CCCCCCCCCCCCCC1 7a_200000037640_100000210202 [0,1,0,1,0,0|1,0,1]=4 16982 B18R1.14770 FCOC1CCCCCCCCCCCCCC1 34a_200000037640_100015361967 [0,1,0,1,0,0|1,0,1]=4 16983 B18R1.14770 FCOC1CCCCCCCCCCCCCC1 7a_200000037640_100015361967 [0,1,0,1,0,0|1,0,1]=4 16984 B18R1.21916 CCCCCCCCCCCNC1CCCC1=O 2230a_200011215754_100000211823 [0,1,0,1,0,0|2,0,0]=4 16985 B18R1.21916 CCCCCCCCCCCNC1CCCC1=O 34a_200011215754_100000709159 [0,1,0,1,0,0|2,0,0]=4 16986 B18R1.21916 CCCCCCCCCCCNC1CCNC1=O 2230a_100016995588_100011215454 [0,1,0,1,0,0|2,0,0]=4 16987 B18R1.21916 CCCCCCCCCCCNC1CCNC1=O 34a_100016995588_100011215454 [0,1,0,1,0,0|2,0,0]=4 16988 B18R1.21916 CCCCCCCCCCCNC1CCOC1=O 2230a_200011215754_100000211211 [0,1,0,1,0,0|1,0,0]=3 16989 B18R1.21916 CCCCCCCCCCCNC1CCOC1=O 34a_200011215754_100000211211 [0,1,0,1,0,0|1,0,0]=3 16990 B18R1.21916 CCCCCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100011215454 [0,1,0,1,0,0|1,0,0]=3 16991 B18R1.21916 CCCCCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100011215454 [0,1,0,1,0,0|1,0,0]=3 16992 B18R1.21916 CCCCCCCCCCCOC1CCCC1=O 34a_100000210809_100000709159 [0,1,0,1,0,0|2,0,0]=4 16993 B18R1.21916 CCCCCCCCCCCOC1CCCC1=O 34a_200000719330_100011215454 [0,1,0,1,0,0|2,0,0]=4 16994 B18R1.21916 CCCCCCCCCCCOC1CCCC1=O 7a_100000210809_100000211823 [0,1,0,1,0,0|2,0,0]=4 16995 B18R1.21916 CCCCCCCCCCCOC1CCOC1=O 34a_100000210809_100000211211 [0,1,0,1,0,0|1,0,0]=3 16996 B18R1.21916 CCCCCCCCCCCOC1CCOC1=O 7a_100000210809_100000211211 [0,1,0,1,0,0|1,0,0]=3 16997 B18R1.21916 CCCCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011215454 [0,1,0,1,0,0|2,0,0]=4 16998 B18R1.21916 CCCCCCCCCCCSC1CCCC1=O 62a_100000211823_100011215454 [0,1,0,1,0,0|2,0,0]=4 16999 B18R1.21916 CCCCCCCCCCCSC1CCOC1=O 62a_100000211211_100011215454 [0,1,0,1,0,0|1,0,0]=3 17000 B18R1.21916 CCCCCCCCCCOCC1CCNC1=O 34a_100000133458_100000210320 [0,1,0,1,0,0|2,0,0]=4 17001 B18R1.21916 NCCCCCCCCCCOC1CCOC1=O 34a_100000066964_100000211211 [0,1,0,1,0,0|2,0,0]=4 17002 B18R1.21916 O=C1NOC[C@H]1NCCCCCCCCCCO 2230a_100000765999_100009813290 [0,1,0,1,0,0|2,0,0]=4 17003 B18R1.21916 O=C1NOC[C@H]1NCCCCCCCCCCO 34a_100000765999_100009813290 [0,1,0,1,0,0|2,0,0]=4 17004 B18R1.21916 O=C1OCCC1NCCCCCCCCCCO 2230a_100000066964_100000211211 [0,1,0,1,0,0|2,0,0]=4 17005 B18R1.21916 O=C1OCCC1NCCCCCCCCCCO 34a_100000066964_100000211211 [0,1,0,1,0,0|2,0,0]=4 17006 B18R1.21916 O=C1OCCC1OCCCCCCCCCCBr 34a_100009813290_100000211211 [0,1,0,1,0,0|2,0,0]=4 17007 B18R1.21916 O=C1OCCC1OCCCCCCCCCCBr 7a_100009813290_100000211211 [0,1,0,1,0,0|2,0,0]=4 17008 B18R1.21916 O=C1OCCC1OCCCCCCCCCCCl 34a_200000033068_100000211211 [0,1,0,1,0,0|2,0,0]=4 17009 B18R1.21916 O=C1OCCC1OCCCCCCCCCCCl 7a_200000033068_100000211211 [0,1,0,1,0,0|2,0,0]=4 17010 B18R1.21916 O=C1OCCC1SCCCCCCCCCCO 62a_100000211211_200000033068 [0,1,0,1,0,0|2,0,0]=4 17011 B18R1.21916 O=C1OCCC1SCCCCCCCCCCO 62a_100009813290_100000211211 [0,1,0,1,0,0|2,0,0]=4 17012 B18R1.21934 CCCCCC1CCCC1NCCC(=O)NCC 269862a_100025743525_200000198059 [0,1,0,1,0,0|2,0,0]=4 17013 B18R1.21934 CCCCCC1CCCC1NCCC(=O)NCC 270004a_100025743525_200000198059 [0,1,0,1,0,0|2,0,0]=4 17014 B18R1.23387 CCCCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210314 [0,1,0,1,0,0|1,0,0]=3 17015 B18R1.23387 CCCCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210757 [0,1,0,1,0,0|1,0,0]=3 17016 B18R1.23387 CCCCOCN1CCCCC1CC(=O)OCC 2230a_100116209990_100011995733 [0,1,0,1,0,0|2,0,0]=4 17017 B18R1.23387 CCCCOCN1CCCCC1CC(=O)OCC 269982a_100116209990_100011995733 [0,1,0,1,0,0|2,0,0]=4 17018 B18R1.23387 CCCOCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100011215938 [0,1,0,1,0,0|2,0,0]=4 17019 B18R1.23387 CCCOCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100011215938 [0,1,0,1,0,0|2,0,0]=4 17020 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCF 2230a_100116209990_100000729378 [0,1,0,1,0,0|2,0,0]=4 17021 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCF 269982a_100116209990_100000729378 [0,1,0,1,0,0|2,0,0]=4 17022 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCO 2230a_100116209990_100000746330 [0,1,0,1,0,0|2,0,0]=4 17023 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCO 269982a_100116209990_100000746330 [0,1,0,1,0,0|2,0,0]=4 17024 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCOC 2230a_100116209990_100000730899 [0,1,0,1,0,0|2,0,0]=4 17025 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCOC 269982a_100116209990_100000730899 [0,1,0,1,0,0|2,0,0]=4 17026 B18R1.23387 CCOCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100012232248 [0,1,0,1,0,0|2,0,0]=4 17027 B18R1.23387 CCOCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100012232248 [0,1,0,1,0,0|2,0,0]=4 17028 B18R1.28810 COCC(=O)C1CCCCCCCCCCC1=O 1458a_100000210968_200009990614 [0,1,0,1,0,0|1,0,1]=4 17029 B18R1.29002 CCOC(=O)CCCCN1CCCCCCCC1 2230a_100000039187_100000750268 [0,1,0,1,0,0|1,0,0]=3 17030 B18R1.29002 CCOC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000750268 [0,1,0,1,0,0|1,0,0]=3 17031 B18R1.29002 CCOC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100000750268 [0,1,0,1,0,0|1,0,0]=3 17032 B18R1.29002 CCOC(=O)COCCN1CCCCCCCC1 2230a_100000039187_100000088970 [0,1,0,1,0,0|2,0,0]=4 17033 B18R1.29002 CCOC(=O)COCCN1CCCCCCCC1 269982a_100000039187_100000088970 [0,1,0,1,0,0|2,0,0]=4 17034 B18R1.29002 CCOC(=O)COCCN1CCCCCCCC1 34a_100000039187_100000088970 [0,1,0,1,0,0|2,0,0]=4 17035 B18R1.29249 CCOC(=O)CCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100010175975 [0,1,0,1,0,0|2,0,0]=4 17036 B18R1.29249 CCOC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100010175975 [0,1,0,1,0,0|2,0,0]=4 17037 B18R1.29249 CCOC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100010175975 [0,1,0,1,0,0|2,0,0]=4 17038 B18R1.29249 CCOC(=O)CCCCCCCOCC1CC1C 34a_100000744939_100009991516 [0,1,0,1,0,0|1,0,0]=3 17039 B18R1.29249 CCOC(=O)CCCCCCCOCC1CC1C 7a_100000744939_100009991516 [0,1,0,1,0,0|1,0,0]=3 17040 B18R1.29250 CCOC(=O)CCCCCCCCCN1CCC1 269982a_100000754969_100009828014 [0,1,0,1,0,0|1,0,0]=3 17041 B18R1.29250 CCOC(=O)CCCCCCCCNC1CCC1 2230a_100000749019_100010175975 [0,1,0,1,0,0|1,0,0]=3 17042 B18R1.29250 CCOC(=O)CCCCCCCCNC1CCC1 34a_100000749019_100010175975 [0,1,0,1,0,0|1,0,0]=3 17043 B18R1.29250 CCOC(=O)CCCCCCCCNC1COC1 2230a_100016991112_100010175975 [0,1,0,1,0,0|2,0,0]=4 17044 B18R1.29250 CCOC(=O)CCCCCCCCOC1CCC1 34a_100000748187_100010175975 [0,1,0,1,0,0|1,0,0]=3 17045 B18R1.29250 CCOC(=O)CCCCCCCCOC1CSC1 7a_100000072292_100010175975 [0,1,0,1,0,0|2,0,0]=4 17046 B18R1.29250 CCOC(=O)CCCCCCCNCC1CCC1 2230a_100000738700_100009991516 [0,1,0,1,0,0|1,0,0]=3 17047 B18R1.29250 CCOC(=O)CCCCCCCNCC1CCC1 34a_100000738700_100009991516 [0,1,0,1,0,0|1,0,0]=3 17048 B18R1.29250 CCOC(=O)CCCCCCCNCC1COC1 2230a_100015281925_100009991516 [0,1,0,1,0,0|2,0,0]=4 17049 B18R1.29250 CCOC(=O)CCCCCCCNCC1COC1 34a_100015281925_100009991516 [0,1,0,1,0,0|2,0,0]=4 17050 B18R1.29250 CCOC(=O)CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009991516 [0,1,0,1,0,0|2,0,0]=4 17051 B18R1.29250 CCOC(=O)CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100009991516 [0,1,0,1,0,0|2,0,0]=4 17052 B18R1.29250 CCOC(=O)CCCCCCCOCC1CCC1 34a_100000760304_100009991516 [0,1,0,1,0,0|1,0,0]=3 17053 B18R1.29250 CCOC(=O)CCCCCCCOCC1CCO1 34a_100000039022_100009991516 [0,1,0,1,0,0|2,0,0]=4 17054 B18R1.29250 CCOC(=O)CCCCCCCOCC1CNC1 34a_100016987283_100009991516 [0,1,0,1,0,0|2,0,0]=4 17055 B18R1.29250 CCOC(=O)CCCCCCCOCC1COC1 34a_100000060846_100009991516 [0,1,0,1,0,0|2,0,0]=4 17056 B18R1.29250 CCOC(=O)CCCCCCCSCC1CCC1 62a_100000763275_100009991516 [0,1,0,1,0,0|1,0,0]=3 17057 B18R1.29250 CCOC(=O)CCCCCCCSCC1CCO1 62a_100000103362_100009991516 [0,1,0,1,0,0|2,0,0]=4 17058 B18R1.29250 CCOC(=O)CCCCCCCSCC1COC1 62a_100010264016_100009991516 [0,1,0,1,0,0|2,0,0]=4 17059 B18R1.29250 CCOC(=O)CCCCCCOCCC1COC1 34a_100009855314_100009814379 [0,1,0,1,0,0|2,0,0]=4 17060 B18R1.29395 CCNC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737597 [0,1,0,1,0,0|2,0,0]=4 17061 B18R1.29395 CCOC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100000755133 [0,1,0,1,0,0|1,0,0]=3 17062 B18R1.29395 CCOC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100000755133 [0,1,0,1,0,0|1,0,0]=3 17063 B18R1.29395 CCOC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100000755133 [0,1,0,1,0,0|1,0,0]=3 17064 B18R1.29395 CCOC(=O)CCCCNC1CCCCCCC1 2230a_100000211152_100000750268 [0,1,0,1,0,0|1,0,0]=3 17065 B18R1.29395 CCOC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100000750268 [0,1,0,1,0,0|1,0,0]=3 17066 B18R1.29395 CCOC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100000750268 [0,1,0,1,0,0|1,0,0]=3 17067 B18R1.29395 CCOC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000750268 [0,1,0,1,0,0|1,0,0]=3 17068 B18R1.29395 CCOC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100009991533 [0,1,0,1,0,0|1,0,0]=3 17069 B18R1.29395 CCOC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011215271 [0,1,0,1,0,0|1,0,0]=3 17070 B18R1.29395 CCOC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100011206558 [0,1,0,1,0,0|1,0,0]=3 17071 B18R1.29395 CCOC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000765890 [0,1,0,1,0,0|1,0,0]=3 17072 B18R1.29395 CCOC(=O)COCCCN1CCCCCCC1 2230a_100000211400_100009893628 [0,1,0,1,0,0|2,0,0]=4 17073 B18R1.29395 CCOC(=O)COCCCN1CCCCCCC1 269982a_100000211400_100009893628 [0,1,0,1,0,0|2,0,0]=4 17074 B18R1.29395 CCOC(=O)COCCCN1CCCCCCC1 34a_100000211400_100009893628 [0,1,0,1,0,0|2,0,0]=4 17075 B18R1.29395 CCOC(=O)COCCNC1CCCCCCC1 2230a_100000211152_100000088970 [0,1,0,1,0,0|2,0,0]=4 17076 B18R1.29395 CCOC(=O)COCCNC1CCCCCCC1 34a_100000211152_100000088970 [0,1,0,1,0,0|2,0,0]=4 17077 B18R1.29395 CCOC(=O)COCCOC1CCCCCCC1 34a_100000210054_100000088970 [0,1,0,1,0,0|2,0,0]=4 17078 B18R1.29395 CCOC(=O)COCCOC1CCCCCCC1 7a_100000210054_100000088970 [0,1,0,1,0,0|2,0,0]=4 17079 B18R1.29395 CCOC(=O)NCCOCC1CCCCCCC1 7a_100011216312_200011445536 [0,1,0,1,0,0|2,0,0]=4 17080 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100009991516 [0,1,0,1,0,0|1,0,0]=3 17081 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100009991516 [0,1,0,1,0,0|1,0,0]=3 17082 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100009991516 [0,1,0,1,0,0|1,0,0]=3 17083 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100009991516 [0,1,0,1,0,0|1,0,0]=3 17084 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@H]1C 34a_100015189458_100009991516 [0,1,0,1,0,0|1,0,0]=3 17085 B18R1.29583 CCOC(=O)CCCCCCCN1CCSC1C 2230a_200011216479_100009991516 [0,1,0,1,0,0|2,0,0]=4 17086 B18R1.29583 CCOC(=O)CCCCCCCN1CCSC1C 269982a_200011216479_100009991516 [0,1,0,1,0,0|2,0,0]=4 17087 B18R1.29583 CCOC(=O)CCCCCCCN1CCSC1C 34a_200011216479_100009991516 [0,1,0,1,0,0|2,0,0]=4 17088 B18R1.29583 CCOC(=O)CCCCCCOC1CCCC1C 34a_100011216460_100009814379 [0,1,0,1,0,0|1,0,0]=3 17089 B18R1.29583 CCOC(=O)CCCCCCOC1CCCC1C 7a_100011216460_100009814379 [0,1,0,1,0,0|1,0,0]=3 17090 B18R1.29583 CCOC(=O)CCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009814379 [0,1,0,1,0,0|2,0,0]=4 17091 B18R1.29583 CCOC(=O)CCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009814379 [0,1,0,1,0,0|2,0,0]=4 17092 B18R1.29583 CCOC(=O)CCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009814379 [0,1,0,1,0,0|2,0,0]=4 17093 B18R1.29583 CCOC(=O)CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009814379 [0,1,0,1,0,0|2,0,0]=4 17094 B18R1.29583 CCOC(=O)CCCCCOCC1CCCN1C 34a_100000743107_100000755133 [0,1,0,1,0,0|2,0,0]=4 17095 B18R1.29583 CCOC(=O)CCCCOCCC1CCCN1C 34a_100011215177_100000750268 [0,1,0,1,0,0|2,0,0]=4 17096 B18R1.29583 CCOC(=O)CCCCOCCC1CCCN1C 7a_100011215177_100000750268 [0,1,0,1,0,0|2,0,0]=4 17097 B18R1.29583 CCOC(=O)CCCCSCCC1CCCN1C 62a_100000005710_100000750268 [0,1,0,1,0,0|2,0,0]=4 17098 B18R1.29583 CCOC(=O)CCCCSCCC1CCCN1C 62a_100000750268_100000005710 [0,1,0,1,0,0|2,0,0]=4 17099 B18R1.29593 CCOC(=O)CCCCCCCCN1CCC1C 269982a_100000755817_100010175975 [0,1,0,1,0,0|1,0,0]=3 17100 B18R1.29593 CCOC(=O)CCCCCCCCN1CCC1C 34a_100000755817_100010175975 [0,1,0,1,0,0|1,0,0]=3 17101 B18R1.40331 CCCCCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210681 [0,1,0,1,0,0|1,0,0]=3 17102 B18R1.40331 CCCCCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210681 [0,1,0,1,0,0|1,0,0]=3 17103 B18R1.40331 CCCCCCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210681 [0,1,0,1,0,0|2,0,0]=4 17104 B18R1.40331 CCCCCCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210681 [0,1,0,1,0,0|2,0,0]=4 17105 B18R1.40331 CCCCCCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210681 [0,1,0,1,0,0|2,0,0]=4 17106 B18R1.40331 CCCCCCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210681 [0,1,0,1,0,0|2,0,0]=4 17107 B18R1.40331 CCCCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000210314 [0,1,0,1,0,0|1,0,0]=3 17108 B18R1.40331 CCCCOCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000743108 [0,1,0,1,0,0|2,0,0]=4 17109 B18R1.40331 CCCCOCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000743108 [0,1,0,1,0,0|2,0,0]=4 17110 B18R1.40331 CCCOCCOC1CCCCC1C(=O)OCC 7a_100000038711_100011215938 [0,1,0,1,0,0|2,0,0]=4 17111 B18R1.40331 CCOC(=O)C1CCCCC1OCCCCCF 7a_100000038711_100000729378 [0,1,0,1,0,0|2,0,0]=4 17112 B18R1.40331 CCOC(=O)C1CCCCC1OCCCCCO 7a_100000038711_100000746330 [0,1,0,1,0,0|2,0,0]=4 17113 B18R1.40331 CCOC(=O)C1CCCCC1OCCCCOC 7a_100000038711_100000730899 [0,1,0,1,0,0|2,0,0]=4 17114 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCF 2230a_100016990872_100015922095 [0,1,0,1,0,0|2,0,0]=4 17115 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCF 269982a_100016990872_100015922095 [0,1,0,1,0,0|2,0,0]=4 17116 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCO 2230a_100016990872_100000766143 [0,1,0,1,0,0|2,0,0]=4 17117 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCO 269982a_100016990872_100000766143 [0,1,0,1,0,0|2,0,0]=4 17118 B18R1.40331 CCOCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100012232248 [0,1,0,1,0,0|2,0,0]=4 17119 B18R1.42824 CCOC(=O)CCCCCCCCCNC1CC1 34a_100000212008_100009828014 [0,1,0,1,0,0|1,0,0]=3 17120 B18R1.42824 CCOC(=O)CCCCCCCCNCC1CC1 2230a_100000735609_100010175975 [0,1,0,1,0,0|1,0,0]=3 17121 B18R1.42824 CCOC(=O)CCCCCCCCNCC1CC1 34a_100000735609_100010175975 [0,1,0,1,0,0|1,0,0]=3 17122 B18R1.42824 CCOC(=O)CCCCCCCCOCC1CC1 34a_100000211283_100010175975 [0,1,0,1,0,0|1,0,0]=3 17123 B18R1.42824 CCOC(=O)CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100010175975 [0,1,0,1,0,0|2,0,0]=4 17124 B18R1.42824 CCOC(=O)CCCCCCCCSCC1CC1 62a_100000756562_100010175975 [0,1,0,1,0,0|1,0,0]=3 17125 B18R1.42824 CCOC(=O)CCCCCCCCSCC1CO1 62a_102125554688_100010175975 [0,1,0,1,0,0|2,0,0]=4 17126 B18R1.42824 CCOC(=O)CCCCCCCCSCC1CS1 62a_100000031435_100010175975 [0,1,0,1,0,0|2,0,0]=4 17127 B18R1.42824 CCOC(=O)CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100010175975 [0,1,0,1,0,0|2,0,0]=4 17128 B18R1.42824 CCOC(=O)CCCCCCCNCCC1CC1 34a_100000764129_100009991516 [0,1,0,1,0,0|1,0,0]=3 17129 B18R1.42824 CCOC(=O)CCCCCCCOCCC1CC1 34a_100000754188_100009991516 [0,1,0,1,0,0|1,0,0]=3 17130 B18R1.42824 CCOC(=O)CCCCCCCOCCC1CC1 7a_100000754188_100009991516 [0,1,0,1,0,0|1,0,0]=3 17131 B18R1.42824 CCOC(=O)CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100009991516 [0,1,0,1,0,0|2,0,0]=4 17132 B18R1.42824 CCOC(=O)CCCCCCCSCCC1CC1 62a_100000764125_100009991516 [0,1,0,1,0,0|1,0,0]=3 17133 B18R1.42824 CCOC(=O)CCCCCCCSCCC1CO1 62a_100000732470_100009991516 [0,1,0,1,0,0|2,0,0]=4 17134 B18R1.42824 CCOC(=O)CCCCCCOCCNC1CC1 34a_100000738766_100009814379 [0,1,0,1,0,0|2,0,0]=4 17135 B18R1.42824 CCOC(=O)CCCCCCSCCCC1CO1 62a_100000733510_100009814379 [0,1,0,1,0,0|2,0,0]=4 17136 B18R1.43007 CCOC(=O)CCCCCCN1CCCCCC1 2230a_100000185865_100009814379 [0,1,0,1,0,0|1,0,0]=3 17137 B18R1.43007 CCOC(=O)CCCCCCN1CCCCCC1 269982a_100000185865_100009814379 [0,1,0,1,0,0|1,0,0]=3 17138 B18R1.43007 CCOC(=O)CCCCCCN1CCCCCC1 34a_100000185865_100009814379 [0,1,0,1,0,0|1,0,0]=3 17139 B18R1.43007 CCOC(=O)CCCCCCN1CCCOCC1 2230a_100000685342_100009814379 [0,1,0,1,0,0|2,0,0]=4 17140 B18R1.43007 CCOC(=O)CCCCCCN1CCCOCC1 269982a_100000685342_100009814379 [0,1,0,1,0,0|2,0,0]=4 17141 B18R1.43007 CCOC(=O)CCCCCCN1CCCOCC1 34a_100000685342_100009814379 [0,1,0,1,0,0|2,0,0]=4 17142 B18R1.43007 CCOC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100000755133 [0,1,0,1,0,0|1,0,0]=3 17143 B18R1.43007 CCOC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100000755133 [0,1,0,1,0,0|1,0,0]=3 17144 B18R1.43007 CCOC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100000755133 [0,1,0,1,0,0|1,0,0]=3 17145 B18R1.43007 CCOC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100000755133 [0,1,0,1,0,0|1,0,0]=3 17146 B18R1.43007 CCOC(=O)CCCCCSC1CCCCCC1 62a_100000755133_100011217769 [0,1,0,1,0,0|1,0,0]=3 17147 B18R1.43007 CCOC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100000755133 [0,1,0,1,0,0|1,0,0]=3 17148 B18R1.43007 CCOC(=O)CCCCNCC1CCCCCC1 2230a_100015204231_100000750268 [0,1,0,1,0,0|1,0,0]=3 17149 B18R1.43007 CCOC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100000750268 [0,1,0,1,0,0|1,0,0]=3 17150 B18R1.43007 CCOC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100000750268 [0,1,0,1,0,0|1,0,0]=3 17151 B18R1.43007 CCOC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000750268 [0,1,0,1,0,0|1,0,0]=3 17152 B18R1.43007 CCOC(=O)CCCCSCC1CCCCCC1 62a_100000750268_200000696569 [0,1,0,1,0,0|1,0,0]=3 17153 B18R1.43007 CCOC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000750268 [0,1,0,1,0,0|1,0,0]=3 17154 B18R1.43007 CCOC(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100009991533 [0,1,0,1,0,0|1,0,0]=3 17155 B18R1.43007 CCOC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100009991533 [0,1,0,1,0,0|1,0,0]=3 17156 B18R1.43007 CCOC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100009991533 [0,1,0,1,0,0|2,0,0]=4 17157 B18R1.43007 CCOC(=O)CCCOCCN1CCCCCC1 7a_100012001163_100000722644 [0,1,0,1,0,0|2,0,0]=4 17158 B18R1.43007 CCOC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100009991533 [0,1,0,1,0,0|2,0,0]=4 17159 B18R1.43007 CCOC(=O)CCCSCCN1CCCCCC1 62a_100009991533_100000722644 [0,1,0,1,0,0|2,0,0]=4 17160 B18R1.43007 CCOC(=O)CCOCCCN1CCCCCC1 34a_100102886287_100000765890 [0,1,0,1,0,0|2,0,0]=4 17161 B18R1.43007 CCOC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100011206558 [0,1,0,1,0,0|2,0,0]=4 17162 B18R1.43007 CCOC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000188475 [0,1,0,1,0,0|2,0,0]=4 17163 B18R1.43007 CCOC(=O)COCCCNC1CCCCCC1 2230a_100000210984_100009893628 [0,1,0,1,0,0|2,0,0]=4 17164 B18R1.43007 CCOC(=O)COCCCNC1CCCCCC1 34a_100000210984_100009893628 [0,1,0,1,0,0|2,0,0]=4 17165 B18R1.43007 CCOC(=O)COCCCOC1CCCCCC1 34a_100000210887_100009893628 [0,1,0,1,0,0|2,0,0]=4 17166 B18R1.43007 CCOC(=O)COCCCOC1CCCCCC1 7a_100000210887_100009893628 [0,1,0,1,0,0|2,0,0]=4 17167 B18R1.43007 CCOC(=O)COCCCSC1CCCCCC1 62a_100009893628_100011217769 [0,1,0,1,0,0|2,0,0]=4 17168 B18R1.43007 CCOC(=O)COCCCSC1CCCCCC1 62a_100011217769_100009893628 [0,1,0,1,0,0|2,0,0]=4 17169 B18R1.43007 CCOC(=O)COCCNCC1CCCCCC1 2230a_100015204231_100000088970 [0,1,0,1,0,0|2,0,0]=4 17170 B18R1.43007 CCOC(=O)COCCNCC1CCCCCC1 34a_100015204231_100000088970 [0,1,0,1,0,0|2,0,0]=4 17171 B18R1.43007 CCOC(=O)COCCOCC1CCCCCC1 34a_100000699130_100000088970 [0,1,0,1,0,0|2,0,0]=4 17172 B18R1.43007 CCOC(=O)COCCOCC1CCCCCC1 7a_100000699130_100000088970 [0,1,0,1,0,0|2,0,0]=4 17173 B18R1.43007 CCOC(=O)COCCSCC1CCCCCC1 62a_100000088970_200000696569 [0,1,0,1,0,0|2,0,0]=4 17174 B18R1.43007 CCOC(=O)COCCSCC1CCCCCC1 62a_200000696569_100000088970 [0,1,0,1,0,0|2,0,0]=4 17175 B18R1.43007 CCOC(=O)CSCCOCC1CCCCCC1 7a_200000230590_200000696569 [0,1,0,1,0,0|2,0,0]=4 17176 B18R1.43424 CC=CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210699 [0,1,0,1,0,0|2,0,0]=4 17177 B18R1.43424 CC=CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210699 [0,1,0,1,0,0|2,0,0]=4 17178 B18R1.43424 CC=CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210699 [0,1,0,1,0,0|2,0,0]=4 17179 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000211992 [0,1,0,1,0,0|2,0,0]=4 17180 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000211992 [0,1,0,1,0,0|2,0,0]=4 17181 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000211992 [0,1,0,1,0,0|2,0,0]=4 17182 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000211992 [0,1,0,1,0,0|2,0,0]=4 17183 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 2708a_100011194316_100015525214 [0,1,0,1,0,0|2,0,0]=4 17184 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 2708a_100015525214_100011194316 [0,1,0,1,0,0|2,0,0]=4 17185 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 273464a_100011194316_100015525214 [0,1,0,1,0,0|2,0,0]=4 17186 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 273464a_100015525214_100011194316 [0,1,0,1,0,0|2,0,0]=4 17187 B18R1.43424 CNNC(=O)NC1CCCCCCCCCCC1 273464a_100011194316_100016993582 [0,1,0,1,0,0|2,0,0]=4 17188 B18R1.43424 COCC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210968 [0,1,0,1,0,0|1,0,0]=3 17189 B18R1.43424 COCC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210968 [0,1,0,1,0,0|1,0,0]=3 17190 B18R1.43424 COCC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210968 [0,1,0,1,0,0|1,0,0]=3 17191 B18R1.43424 COCC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000210968 [0,1,0,1,0,0|1,0,0]=3 17192 B18R1.43424 CSCC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000184570 [0,1,0,1,0,0|1,1,0]=4 17193 B18R1.43424 CSCC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000184570 [0,1,0,1,0,0|1,1,0]=4 17194 B18R1.43424 CSCC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000184570 [0,1,0,1,0,0|1,1,0]=4 17195 B18R1.43424 CSCC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000184570 [0,1,0,1,0,0|1,1,0]=4 17196 B18R1.43424 O=C(CCO)NC1CCCCCCCCCCC1 240690a_100011194316_100011216618 [0,1,0,1,0,0|2,0,0]=4 17197 B18R1.49730 C=CCCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_102130925996 [0,1,0,1,0,0|0,0,2]=4 17198 B18R1.49730 CCCCCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100000210684 [0,1,0,1,0,0|1,0,0]=3 17199 B18R1.49730 CCCCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100000210684 [0,1,0,1,0,0|0,0,0]=2 17200 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 11a_100000210451_100000210395 [0,1,0,1,0,0|2,0,0]=4 17201 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 1626a_100000210451_100000210395 [0,1,0,1,0,0|2,0,0]=4 17202 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 240690a_100000210451_100000210395 [0,1,0,1,0,0|2,0,0]=4 17203 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 527a_100000210451_100000210395 [0,1,0,1,0,0|2,0,0]=4 17204 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CO1 11a_100000210451_100000701028 [0,1,0,1,0,0|1,0,0]=3 17205 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CO1 1626a_100000210451_100000701028 [0,1,0,1,0,0|1,0,0]=3 17206 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CO1 240690a_100000210451_100000701028 [0,1,0,1,0,0|1,0,0]=3 17207 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CO1 527a_100000210451_100000701028 [0,1,0,1,0,0|1,0,0]=3 17208 B18R1.49730 CCCCCCCCCCCNCC(=O)C1CC1 2230a_200011215754_100000746382 [0,1,0,1,0,0|2,0,0]=4 17209 B18R1.49730 CCCCCCCCCCCNCC(=O)C1CC1 34a_200011215754_100000746382 [0,1,0,1,0,0|2,0,0]=4 17210 B18R1.49730 CCCCCCCCCCCOCC(=O)C1CC1 34a_100000210809_100000746382 [0,1,0,1,0,0|2,0,0]=4 17211 B18R1.49730 CCCCCCCCCCCOCC(=O)C1CC1 34a_100000686663_100011215454 [0,1,0,1,0,0|2,0,0]=4 17212 B18R1.49730 CCCCCCCCCCCOCC(=O)C1CC1 7a_100000210809_100000746382 [0,1,0,1,0,0|2,0,0]=4 17213 B18R1.49730 CCCCCCCCCCCSCC(=O)C1CC1 62a_100000746382_100011215454 [0,1,0,1,0,0|2,0,0]=4 17214 B18R1.49730 O=C(CCCCCCCCCCCCO)C1CC1 1458a_100000210395_100009813331 [0,1,0,1,0,0|2,0,0]=4 17215 B18R1.49730 O=C(CCCCCCCCCCCCO)C1CO1 1458a_100000701028_100009813331 [0,1,0,1,0,0|1,0,0]=3 17216 B18R1.49730 O=C(CCCCCCOCCCCCO)C1CO1 1458a_100000701028_200132310570 [0,1,0,1,0,0|2,0,0]=4 17217 B18R1.1053 COC(=O)CCCCCCCN1CCCC(C1)F 2230a_100000697950_100010004213 [0,1,0,1,0,0|1,0,0]=3 17218 B18R1.1053 COC(=O)CCCCCCCN1CCCC(C1)F 269982a_100000697950_100010004213 [0,1,0,1,0,0|1,0,0]=3 17219 B18R1.1053 COC(=O)CCCCCCCN1CCCC(C1)F 34a_100000697950_100010004213 [0,1,0,1,0,0|1,0,0]=3 17220 B18R1.1053 COC(=O)CCCCCCCN1CCCC(C1)O 2230a_100000211013_100010004213 [0,1,0,1,0,0|1,0,0]=3 17221 B18R1.1053 COC(=O)CCCCCCCN1CCCC(C1)O 269982a_100000211013_100010004213 [0,1,0,1,0,0|1,0,0]=3 17222 B18R1.1053 COC(=O)CCCCCCCN1CCC[C@@H](C1)C 2230a_100000717927_100010004213 [0,1,0,1,0,0|1,0,0]=3 17223 B18R1.1053 COC(=O)CCCCCCCN1CCC[C@@H](C1)C 269982a_100000717927_100010004213 [0,1,0,1,0,0|1,0,0]=3 17224 B18R1.1053 COC(=O)CCCCCCCN1CCC[C@@H](C1)C 34a_100000717927_100010004213 [0,1,0,1,0,0|1,0,0]=3 17225 B18R1.1053 COC(=O)CCCCCCCN1CCOC(C1)C 2230a_100000729577_100010004213 [0,1,0,1,0,0|2,0,0]=4 17226 B18R1.1053 COC(=O)CCCCCCCN1CCOC(C1)C 269982a_100000729577_100010004213 [0,1,0,1,0,0|2,0,0]=4 17227 B18R1.1053 COC(=O)CCCCCCCN1CCOC(C1)C 34a_100000729577_100010004213 [0,1,0,1,0,0|2,0,0]=4 17228 B18R1.1053 COC(=O)CCCCCCCN1CCOC(C1)O 2230a_100000688207_100010004213 [0,1,0,1,0,0|2,0,0]=4 17229 B18R1.1053 COC(=O)CCCCCCCN1CCOC(C1)O 269982a_100000688207_100010004213 [0,1,0,1,0,0|2,0,0]=4 17230 B18R1.1053 COC(=O)CCCCCCNC1CCCC(C1)C 2230a_100011194320_100009815986 [0,1,0,1,0,0|1,0,0]=3 17231 B18R1.1053 COC(=O)CCCCCCNC1CCCC(C1)C 34a_100011194320_100009815986 [0,1,0,1,0,0|1,0,0]=3 17232 B18R1.1053 COC(=O)CCCCCCNC1CCCC(C1)O 2230a_100015190357_100009815986 [0,1,0,1,0,0|1,0,0]=3 17233 B18R1.1053 COC(=O)CCCCCCOC1C=C(CCC1)C 34a_100011218613_100009815986 [0,1,0,1,0,0|1,0,1]=4 17234 B18R1.1053 COC(=O)CCCCCCOC1CCCC(=O)C1 34a_100012613340_100009815986 [0,1,0,1,0,0|1,0,1]=4 17235 B18R1.1053 COC(=O)CCCCCCOC1CCCC(C1)C 34a_100000211399_100009815986 [0,1,0,1,0,0|1,0,0]=3 17236 B18R1.1053 COC(=O)CCCCCCOC1CCOC(C1)C 34a_100011986385_100009815986 [0,1,0,1,0,0|2,0,0]=4 17237 B18R1.1053 COC(=O)CCCCCCOC1CCOC(C1)C 7a_100011986385_100009815986 [0,1,0,1,0,0|2,0,0]=4 17238 B18R1.1053 COC(=O)CCCCCNCC1CCCC(C1)O 2230a_100011254705_100009816466 [0,1,0,1,0,0|1,0,0]=3 17239 B18R1.1053 COC(=O)CCCCCOCC1CCCN(C1)C 34a_100000074720_100015183302 [0,1,0,1,0,0|2,0,0]=4 17240 B18R1.1053 COC(=O)CCCCCOCC1CCCN(C1)C 7a_100000074720_100000752043 [0,1,0,1,0,0|2,0,0]=4 17241 B18R1.1053 COC(=O)CCCCCOCC1CNCC(C1)C 34a_200012821172_100009816466 [0,1,0,1,0,0|2,0,0]=4 17242 B18R1.1053 COC(=O)CCCCCSCC1CCCN(C1)C 62a_100000752043_100009816466 [0,1,0,1,0,0|2,0,0]=4 17243 B18R1.1053 COC(=O)CCCCCSCC1CCCN(C1)C 62a_100009816466_100000752043 [0,1,0,1,0,0|2,0,0]=4 17244 B18R1.1053 COC(=O)CCCCNCCN1CCCC(C1)C 2230a_100000739826_100000204269 [0,1,0,1,0,0|2,0,0]=4 17245 B18R1.1053 COC(=O)CCCCOCCN1CCCC(C1)C 34a_100000059025_100000766211 [0,1,0,1,0,0|2,0,0]=4 17246 B18R1.1053 COC(=O)CCCCOCCN1CCCC(C1)C 7a_100000059025_100000766211 [0,1,0,1,0,0|2,0,0]=4 17247 B18R1.1053 COC(=O)CCCCSCCN1CCCC(C1)C 62a_100000204269_100000766211 [0,1,0,1,0,0|2,0,0]=4 17248 B18R1.1229 COC(=O)CCCCCCCC(=O)C1CCCC1 1458a_100000033222_100000179811 [0,1,0,1,0,0|0,0,1]=3 17249 B18R1.1229 COC(=O)CCCCCCCC(=O)C1CCCC1 1458a_100000210718_100010004213 [0,1,0,1,0,0|0,0,1]=3 17250 B18R1.1229 COC(=O)CCCCCCCC(=O)C1CCCS1 1458a_100012002731_100010004213 [0,1,0,1,0,0|1,0,1]=4 17251 B18R1.1229 COC(=O)CCCCCCCC(=O)C1CCOC1 1458a_100000033222_100000690089 [0,1,0,1,0,0|1,0,1]=4 17252 B18R1.1229 COC(=O)CCCCCCCC(=O)C1CCOC1 1458a_100011219752_100010004213 [0,1,0,1,0,0|1,0,1]=4 17253 B18R1.1229 COC(=O)CCCCCCCC(=O)N1CCCC1 240690a_100000188435_100000033222 [0,1,0,1,0,0|1,0,1]=4 17254 B18R1.1229 COC(=O)CCCCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100010004213 [0,1,0,1,0,0|1,0,1]=4 17255 B18R1.1229 COC(=O)CCCCCCCN(C)C1CCCC1 2230a_100000207505_100010004213 [0,1,0,1,0,0|1,0,0]=3 17256 B18R1.1229 COC(=O)CCCCCCCN(C)C1CCCC1 269982a_100000207505_100010004213 [0,1,0,1,0,0|1,0,0]=3 17257 B18R1.1229 COC(=O)CCCCCCCN(C)C1CCCC1 34a_100000207505_100010004213 [0,1,0,1,0,0|1,0,0]=3 17258 B18R1.1229 COC(=O)CCCCCCCN(C)C1CCOC1 2230a_100016988252_100010004213 [0,1,0,1,0,0|2,0,0]=4 17259 B18R1.1229 COC(=O)CCCCCCCN(C)C1CCOC1 269982a_100016988252_100010004213 [0,1,0,1,0,0|2,0,0]=4 17260 B18R1.1229 COC(=O)CCCCCCCN(C)C1CCOC1 34a_100016988252_100010004213 [0,1,0,1,0,0|2,0,0]=4 17261 B18R1.1229 COC(=O)CCCCCCNC(=O)C1CCCC1 188690a_100000739044_100000210718 [0,1,0,1,0,0|1,0,1]=4 17262 B18R1.1229 COC(=O)CCCCCCNC(C)C1CCCC1 2230a_100015185923_100009815986 [0,1,0,1,0,0|1,0,0]=3 17263 B18R1.1229 COC(=O)CCCCCCNC(C)C1CCCC1 34a_100015185923_100009815986 [0,1,0,1,0,0|1,0,0]=3 17264 B18R1.1229 COC(=O)CCCCCCNC(C)C1CCCO1 2230a_100025754208_100009815986 [0,1,0,1,0,0|2,0,0]=4 17265 B18R1.1229 COC(=O)CCCCCCNC(C)C1CCCO1 34a_100025754208_100009815986 [0,1,0,1,0,0|2,0,0]=4 17266 B18R1.1229 COC(=O)CCCCCCOC(C)C1CCCC1 34a_100011216366_100009815986 [0,1,0,1,0,0|1,0,0]=3 17267 B18R1.1229 COC(=O)CCCCCCOC(C)C1CCCC1 7a_100011216366_100009815986 [0,1,0,1,0,0|1,0,0]=3 17268 B18R1.1229 COC(=O)CCCCCOCC(C)N1CCCC1 7a_100000074720_200015187269 [0,1,0,1,0,0|2,0,0]=4 17269 B18R1.1229 COC(=O)CCCCCSCC(C)N1CCCC1 62a_100009816466_200015187269 [0,1,0,1,0,0|2,0,0]=4 17270 B18R1.1229 COC(=O)CCCCCSCC(C)N1CCCC1 62a_200015187269_100009816466 [0,1,0,1,0,0|2,0,0]=4 17271 B18R1.1229 COC(=O)CCCCOCCC(C)N1CCCC1 34a_100011935070_100000204269 [0,1,0,1,0,0|2,0,0]=4 17272 B18R1.1229 COC(=O)CCCCOCCC(C)N1CCCC1 7a_100011935070_100000204269 [0,1,0,1,0,0|2,0,0]=4 17273 B18R1.1760 CCCCCC(C)N1CCOCC1CC(=O)OC 2230a_100000731486_200011218191 [0,1,0,1,0,0|2,0,0]=4 17274 B18R1.1760 CCCCCC(C)N1CCOCC1CC(=O)OC 270004a_100000731486_100000211708 [0,1,0,1,0,0|2,0,0]=4 17275 B18R1.1760 CCCCCC(C)N1CCOCC1CC(=O)OC 34a_100000731486_200011218191 [0,1,0,1,0,0|2,0,0]=4 17276 B18R1.5915 CCN1CCC(C1)CNCCCCCC(=O)OC 2230a_100011224064_100009816466 [0,1,0,1,0,0|2,0,0]=4 17277 B18R1.5915 CCN1CCC(C1)COCCCCCC(=O)OC 7a_100000074720_100015184589 [0,1,0,1,0,0|2,0,0]=4 17278 B18R1.5915 CCN1CCC(C1)CSCCCCCC(=O)OC 62a_100009816466_100015184589 [0,1,0,1,0,0|2,0,0]=4 17279 B18R1.5915 CCN1CCC(C1)CSCCCCCC(=O)OC 62a_100015184589_100009816466 [0,1,0,1,0,0|2,0,0]=4 17280 B18R1.5915 CCN1CCC(C1)NCCCCCCC(=O)OC 2230a_100015188829_100009815986 [0,1,0,1,0,0|2,0,0]=4 17281 B18R1.5915 CCN1CCC(C1)OCCCCCCC(=O)OC 7a_100009863599_200011861547 [0,1,0,1,0,0|2,0,0]=4 17282 B18R1.5915 CCN1CCC(C1)SCCCCCCC(=O)OC 62a_100009815986_200011861547 [0,1,0,1,0,0|2,0,0]=4 17283 B18R1.5915 COC(=O)CCCCCCCN1CCC(C1)CO 2230a_100000748654_100010004213 [0,1,0,1,0,0|2,0,0]=4 17284 B18R1.5915 COC(=O)CCCCCCCN1CCC(C1)CO 269982a_100000748654_100010004213 [0,1,0,1,0,0|2,0,0]=4 17285 B18R1.5915 COC(=O)CCCCCCCN1CCC(C1)CO 34a_100000748654_100010004213 [0,1,0,1,0,0|2,0,0]=4 17286 B18R1.5915 COC(=O)CCCCCCCN1CC[C@H](C1)OC 2230a_100000766984_100010004213 [0,1,0,1,0,0|2,0,0]=4 17287 B18R1.5915 COC(=O)CCCCCCCN1CC[C@H](C1)OC 269982a_100000766984_100010004213 [0,1,0,1,0,0|2,0,0]=4 17288 B18R1.5915 COC(=O)CCCCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100009816466 [0,1,0,1,0,0|2,0,0]=4 17289 B18R1.5915 COC(=O)CCCCCOC[C@H]1CC[C@H](C1)CN 34a_206354213956_100009816466 [0,1,0,1,0,0|2,0,0]=4 17290 B18R1.7043 CCCCCC(=O)COC1CCCC1C(=O)OC 34a_200000081814_200012276598 [0,1,0,1,0,0|1,0,1]=4 17291 B18R1.7043 CCCCCC(=O)COC1CCCC1C(=O)OC 7a_200000081814_200012276598 [0,1,0,1,0,0|1,0,1]=4 17292 B18R1.10163 CCCCCC(=O)CN1CCCCC1C(=O)OC 2230a_100000734855_200012276598 [0,1,0,1,0,0|1,0,1]=4 17293 B18R1.10163 CCCCCC(=O)CN1CCCCC1C(=O)OC 269982a_100000734855_200012276598 [0,1,0,1,0,0|1,0,1]=4 17294 B18R1.10163 CCCCCC(=O)CN1CCCCC1C(=O)OC 34a_100000734855_200012276598 [0,1,0,1,0,0|1,0,1]=4 17295 B18R1.10163 CCCCCC(=O)NC1CCCCC1C(=O)OC 188690a_100015195387_100000212188 [0,1,0,1,0,0|1,0,1]=4 17296 B18R1.10163 CCCCCC(C)OC1CCNCC1C(=O)OC 34a_200103168510_200011218191 [0,1,0,1,0,0|2,0,0]=4 17297 B18R1.10163 CCCCCC(C)O[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_200011218191 [0,1,0,1,0,0|1,0,0]=3 17298 B18R1.10163 CCCCCC(C)O[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_200011218191 [0,1,0,1,0,0|1,0,0]=3 17299 B18R1.10174 CCCCCC(=O)CN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_200012276598 [0,1,0,1,0,0|1,0,1]=4 17300 B18R1.10174 CCCCCC(=O)CN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_200012276598 [0,1,0,1,0,0|1,0,1]=4 17301 B18R1.10174 CCCCCC(=O)CN1CCC[C@@H]1CC(=O)OC 34a_100025726698_200012276598 [0,1,0,1,0,0|1,0,1]=4 17302 B18R1.15132 CCOC1CN(C1)CCCCCCCC(=O)OC 269982a_100000732654_100010004213 [0,1,0,1,0,0|2,0,0]=4 17303 B18R1.15132 CCOC1CN(C1)CCCCCCCC(=O)OC 34a_100000732654_100010004213 [0,1,0,1,0,0|2,0,0]=4 17304 B18R1.15132 COCC1CC(C1)NCCCCCCC(=O)OC 2230a_100012180050_100009815986 [0,1,0,1,0,0|2,0,0]=4 17305 B18R1.15132 COCC1CN(C1)CCCCCCCC(=O)OC 2230a_100016993750_100010004213 [0,1,0,1,0,0|2,0,0]=4 17306 B18R1.15132 COCC1CN(C1)CCCCCCCC(=O)OC 269982a_100016993750_100010004213 [0,1,0,1,0,0|2,0,0]=4 17307 B18R1.15132 COCC1CN(C1)CCCCCCCC(=O)OC 34a_100016993750_100010004213 [0,1,0,1,0,0|2,0,0]=4 17308 B18R1.37671 COC(=O)CCCCCCCC(=O)CC1CCC1 1458a_100000033222_100000763275 [0,1,0,1,0,0|0,0,1]=3 17309 B18R1.37671 COC(=O)CCCCCCCC(=O)CC1CCC1 1458a_100000763092_100010004213 [0,1,0,1,0,0|0,0,1]=3 17310 B18R1.37671 COC(=O)CCCCCCCC(=O)CC1CCO1 1458a_100000033222_100000103362 [0,1,0,1,0,0|1,0,1]=4 17311 B18R1.37671 COC(=O)CCCCCCCC(=O)CC1COC1 1458a_100000033222_100010264016 [0,1,0,1,0,0|1,0,1]=4 17312 B18R1.37671 COC(=O)CCCCCCCC(=O)CC1COC1 1458a_100000687760_100010004213 [0,1,0,1,0,0|1,0,1]=4 17313 B18R1.37671 COC(=O)CCCCCCCC(=O)NC1CCC1 11a_100000749019_100000033222 [0,1,0,1,0,0|1,0,1]=4 17314 B18R1.37671 COC(=O)CCCCCCCC(=O)NC1CCC1 1626a_100000749019_100000033222 [0,1,0,1,0,0|1,0,1]=4 17315 B18R1.37671 COC(=O)CCCCCCCC(=O)NC1CCC1 240690a_100000749019_100000033222 [0,1,0,1,0,0|1,0,1]=4 17316 B18R1.37671 COC(=O)CCCCCCCN(C)CC1CCC1 2230a_200000750244_100010004213 [0,1,0,1,0,0|1,0,0]=3 17317 B18R1.37671 COC(=O)CCCCCCCN(C)CC1CCC1 269982a_200000750244_100010004213 [0,1,0,1,0,0|1,0,0]=3 17318 B18R1.37671 COC(=O)CCCCCCCN(C)CC1CCC1 34a_200000750244_100010004213 [0,1,0,1,0,0|1,0,0]=3 17319 B18R1.37671 COC(=O)CCCCCCNC(=O)CC1CCC1 188690a_100000739044_100000763092 [0,1,0,1,0,0|1,0,1]=4 17320 B18R1.37672 COC(=O)CCCCCCCC(=O)CCC1CC1 1458a_100000033222_100000694398 [0,1,0,1,0,0|0,0,1]=3 17321 B18R1.37672 COC(=O)CCCCCCCC(=O)CCC1CC1 1458a_100000756386_100010004213 [0,1,0,1,0,0|0,0,1]=3 17322 B18R1.37672 COC(=O)CCCCCCCC(=O)CCC1CO1 1458a_100000033222_100000732470 [0,1,0,1,0,0|1,0,1]=4 17323 B18R1.37672 COC(=O)CCCCCCCC(=O)NCC1CC1 11a_100000735609_100000033222 [0,1,0,1,0,0|1,0,1]=4 17324 B18R1.37672 COC(=O)CCCCCCCC(=O)NCC1CC1 1626a_100000735609_100000033222 [0,1,0,1,0,0|1,0,1]=4 17325 B18R1.37672 COC(=O)CCCCCCCC(=O)NCC1CC1 240690a_100000735609_100000033222 [0,1,0,1,0,0|1,0,1]=4 17326 B18R1.37672 COC(=O)CCCCCCNC(=O)CCC1CC1 188690a_100000739044_100000756386 [0,1,0,1,0,0|1,0,1]=4 17327 B18R1.37673 COC(=O)CCCCCCCC(=O)N1CCC1C 11a_100000755817_100000033222 [0,1,0,1,0,0|1,0,1]=4 17328 B18R1.37673 COC(=O)CCCCCCCC(=O)N1CCC1C 240690a_100000755817_100000033222 [0,1,0,1,0,0|1,0,1]=4 17329 B18R1.39191 CCC1CC1C(=O)CCCCCCCC(=O)OC 1458a_200011661523_100010004213 [0,1,0,1,0,0|0,0,1]=3 17330 B18R1.39191 CCC1CC1C(=O)NCCCCCCC(=O)OC 188690a_100000739044_200011661523 [0,1,0,1,0,0|1,0,1]=4 17331 B18R1.40944 COCCCC1CCCN(C1)CCCC(=O)OC 2230a_200011934583_100011218270 [0,1,0,1,0,0|2,0,0]=4 17332 B18R1.40944 COCCCC1CCCN(C1)CCCC(=O)OC 269982a_200011934583_100011218270 [0,1,0,1,0,0|2,0,0]=4 17333 B18R1.40944 COCCCC1CCCN(C1)CCCC(=O)OC 34a_200011934583_100000742333 [0,1,0,1,0,0|2,0,0]=4 17334 B18R1.240037 COC(=O)CCCCCCNC1(CCCCC1)C 2230a_100000741114_100009815986 [0,1,0,1,0,0|1,0,0]=3 17335 B18R1.240037 COC(=O)CCCCCCNC1(CCCCC1)C 34a_100000741114_100009815986 [0,1,0,1,0,0|1,0,0]=3 17336 B18R1.240037 COC(=O)CCCCCCNC1(CCOCC1)C 2230a_100000692449_100009815986 [0,1,0,1,0,0|2,0,0]=4 17337 B18R1.240037 COC(=O)CCCCCCNC1(CCOCC1)C 34a_100000692449_100009815986 [0,1,0,1,0,0|2,0,0]=4 17338 B18R1.240037 COC(=O)CCCCCCOC1(CCCCC1)C 34a_100011215885_100009815986 [0,1,0,1,0,0|1,0,0]=3 17339 B18R1.240037 COC(=O)CCCCCCOC1(CCCCC1)C 7a_100011215885_100009815986 [0,1,0,1,0,0|1,0,0]=3 17340 B18R1.240037 COC(=O)CCCCCCOC1(CCOCC1)C 34a_100011827762_100009815986 [0,1,0,1,0,0|2,0,0]=4 17341 B18R1.240037 COC(=O)CCCCCCOC1(CCOCC1)C 7a_100011827762_100009815986 [0,1,0,1,0,0|2,0,0]=4 17342 B18R1.240037 COC(=O)CCCCCCOC1(CCSCC1)C 34a_200011004327_100009815986 [0,1,0,1,0,0|2,0,0]=4 17343 B18R1.240037 COC(=O)CCCCCCOC1(CCSCC1)C 7a_200011004327_100009815986 [0,1,0,1,0,0|2,0,0]=4 17344 B18R1.240037 COC(=O)CCCCCNCC1(CCCCC1)C 2230a_100000706052_100009816466 [0,1,0,1,0,0|1,0,0]=3 17345 B18R1.240037 COC(=O)CCCCCNCC1(CCCCC1)C 34a_100000706052_100009816466 [0,1,0,1,0,0|1,0,0]=3 17346 B18R1.240037 COC(=O)CCCCCNCC1(CCCCC1)O 2230a_100000748649_100009816466 [0,1,0,1,0,0|1,0,0]=3 17347 B18R1.240037 COC(=O)CCCCCNCC1(CCCCC1)O 34a_100000748649_100009816466 [0,1,0,1,0,0|1,0,0]=3 17348 B18R1.240037 COC(=O)CCCCCNCC1(CCOCC1)C 2230a_100000695556_100009816466 [0,1,0,1,0,0|2,0,0]=4 17349 B18R1.240037 COC(=O)CCCCCNCC1(CCOCC1)C 34a_100000695556_100009816466 [0,1,0,1,0,0|2,0,0]=4 17350 B18R1.240037 COC(=O)CCCCCNCC1(CCOCC1)F 2230a_100016991512_100009816466 [0,1,0,1,0,0|2,0,0]=4 17351 B18R1.240037 COC(=O)CCCCCNCC1(CCOCC1)F 34a_100016991512_100009816466 [0,1,0,1,0,0|2,0,0]=4 17352 B18R1.240037 COC(=O)CCCCCNCC1(CCOCC1)O 2230a_100000704115_100009816466 [0,1,0,1,0,0|2,0,0]=4 17353 B18R1.240037 COC(=O)CCCCCNCC1(CCOCC1)O 34a_100000704115_100009816466 [0,1,0,1,0,0|2,0,0]=4 17354 B18R1.240037 COC(=O)CCCCCNCC1(CCSCC1)O 2230a_100000758141_100009816466 [0,1,0,1,0,0|2,0,0]=4 17355 B18R1.240037 COC(=O)CCCCCOCC1(CCCCC1)C 34a_100000688186_100009816466 [0,1,0,1,0,0|1,0,0]=3 17356 B18R1.240037 COC(=O)CCCCCOCC1(CCCCC1)C 7a_100000688186_100009816466 [0,1,0,1,0,0|1,0,0]=3 17357 B18R1.240037 COC(=O)CCCCCOCC1(CCCCC1)F 34a_100000090305_100009816466 [0,1,0,1,0,0|1,0,0]=3 17358 B18R1.240037 COC(=O)CCCCCOCC1(CCCCC1)F 7a_100000090305_100009816466 [0,1,0,1,0,0|1,0,0]=3 17359 B18R1.240037 COC(=O)CCCCCOCC1(CCCCC1)N 34a_100000740034_100009816466 [0,1,0,1,0,0|1,0,0]=3 17360 B18R1.240037 COC(=O)CCCCCOCC1(CCNCC1)F 34a_100016990393_100009816466 [0,1,0,1,0,0|2,0,0]=4 17361 B18R1.240037 COC(=O)CCCCCOCC1(CCOCC1)C 34a_100000704393_100009816466 [0,1,0,1,0,0|2,0,0]=4 17362 B18R1.240037 COC(=O)CCCCCOCC1(CCOCC1)C 7a_100000704393_100009816466 [0,1,0,1,0,0|2,0,0]=4 17363 B18R1.240037 COC(=O)CCCCCOCC1(CCOCC1)N 34a_100000751404_100009816466 [0,1,0,1,0,0|2,0,0]=4 17364 B18R1.240037 COC(=O)CCCCNCCC1(CCCCC1)O 2230a_100102740465_100000204269 [0,1,0,1,0,0|1,0,0]=3 17365 B18R1.240037 COC(=O)CCCCNCCC1(CCCCC1)O 34a_100102740465_100000204269 [0,1,0,1,0,0|1,0,0]=3 17366 B18R1.240037 COC(=O)COCCNCCC1(CCCCC1)O 2230a_100102740465_100000090808 [0,1,0,1,0,0|2,0,0]=4 17367 B18R1.240037 COC(=O)COCCNCCC1(CCCCC1)O 34a_100102740465_100000090808 [0,1,0,1,0,0|2,0,0]=4 17368 B18R1.265533 COC(=O)CCCCCCN1C(CCCC1C)C 2230a_100000210447_100009815986 [0,1,0,1,0,0|1,0,0]=3 17369 B18R1.265533 COC(=O)CCCCCCN1C(CCCC1C)C 269982a_100000210447_100009815986 [0,1,0,1,0,0|1,0,0]=3 17370 B18R1.265533 COC(=O)CCCCCCN1C(CCCC1C)C 34a_100000210447_100009815986 [0,1,0,1,0,0|1,0,0]=3 17371 B18R1.265533 COC(=O)CCCCCCN1[C@@H](COC[C@@H]1C)C 2230a_100103153222_100009815986 [0,1,0,1,0,0|2,0,0]=4 17372 B18R1.265533 COC(=O)CCCCCCN1[C@@H](COC[C@@H]1C)C 269982a_100103153222_100009815986 [0,1,0,1,0,0|2,0,0]=4 17373 B18R1.265533 COC(=O)CCCCCCN1[C@@H](COC[C@@H]1C)C 34a_100103153222_100009815986 [0,1,0,1,0,0|2,0,0]=4 17374 B18R1.265533 COC(=O)CCCCCOC1C(CCCC1C)C 34a_100011218088_100009816466 [0,1,0,1,0,0|1,0,0]=3 17375 B18R1.265533 COC(=O)CCCCCOC1C(CCCC1C)C 7a_100011218088_100009816466 [0,1,0,1,0,0|1,0,0]=3 17376 B18R1.265533 COC(=O)CCCNCCN1C(CCCC1C)C 2230a_100000749955_100011218270 [0,1,0,1,0,0|2,0,0]=4 17377 B18R1.265533 COC(=O)CCCNCCN1C(CCCC1C)C 34a_100000749955_100000742333 [0,1,0,1,0,0|2,0,0]=4 17378 B18R1.265533 COC(=O)CCCOCCN1C(CCCC1C)C 34a_100011305576_100000742333 [0,1,0,1,0,0|2,0,0]=4 17379 B18R1.265533 COC(=O)CCCOCCN1C(CCCC1C)C 7a_100011305576_100011218270 [0,1,0,1,0,0|2,0,0]=4 17380 B18R1.828195 COC(=O)CCCCCCO[C@@]1(CCC[C@H]1N)C 34a_100015977457_100009815986 [0,1,0,1,0,0|2,0,0]=4 17381 B18R1.1574 COC(=O)C(C)CCNCCCOC1CCCC1 34a_100000747560_100000034942 [0,1,0,1,0,0|2,0,0]=4 17382 B18R1.1611 COC(=O)C(C)CCNCCN1CCCCC1C 2230a_100000739827_100000034942 [0,1,0,1,0,0|2,0,0]=4 17383 B18R1.1611 COC(=O)C(C)CCNCCN1CCCCC1C 34a_100000739827_100000034942 [0,1,0,1,0,0|2,0,0]=4 17384 B18R1.1611 COC(=O)C(C)CCOCCN1CCCCC1C 34a_100011305533_100000034942 [0,1,0,1,0,0|2,0,0]=4 17385 B18R1.1611 COC(=O)C(C)CCSCCC1CCCCN1C 62a_100000034942_100000211948 [0,1,0,1,0,0|2,0,0]=4 17386 B18R1.1611 COC(=O)C(C)CCSCCC1CCCCN1C 62a_100000211948_100000034942 [0,1,0,1,0,0|2,0,0]=4 17387 B18R1.1611 COC(=O)C(C)CNCCCN1CCCCC1C 34a_100000212276_100000698445 [0,1,0,1,0,0|2,0,0]=4 17388 B18R1.1611 COC(=O)C(C)COCCCN1CCCCC1C 34a_100000213889_100000698445 [0,1,0,1,0,0|2,0,0]=4 17389 B18R1.1642 C=C(COCCCCC1CCCCC1)C(=O)OC 34a_100011215267_100009813391 [0,1,0,1,0,0|1,0,1]=4 17390 B18R1.1642 COC(=O)C(=O)COCCCCC1CCCCC1 34a_100011215267_100011610305 [0,1,0,1,0,0|1,0,1]=4 17391 B18R1.1642 COC(=O)C(C)CCNCCCC1CCCCC1 2230a_100011211642_100000034942 [0,1,0,1,0,0|1,0,0]=3 17392 B18R1.1642 COC(=O)C(C)CCNCCCC1CCCCC1 34a_100011211642_100000034942 [0,1,0,1,0,0|1,0,0]=3 17393 B18R1.1642 COC(=O)C(C)CCNCCOC1CCCCC1 34a_100015206981_100000034942 [0,1,0,1,0,0|2,0,0]=4 17394 B18R1.1642 COC(=O)C(C)CCOCCCC1CCCCC1 34a_100000198086_100000034942 [0,1,0,1,0,0|1,0,0]=3 17395 B18R1.1642 COC(=O)C(C)CCOCCCC1CCCCC1 7a_100000198086_100000034942 [0,1,0,1,0,0|1,0,0]=3 17396 B18R1.1642 COC(=O)C(C)CCOCCCC1CCCCN1 34a_100011934581_100000034942 [0,1,0,1,0,0|2,0,0]=4 17397 B18R1.1642 COC(=O)C(C)CCOCCCC1CCCNC1 34a_100150707839_100000034942 [0,1,0,1,0,0|2,0,0]=4 17398 B18R1.1642 COC(=O)C(C)CCOCCCC1CCNCC1 34a_100016988962_100000034942 [0,1,0,1,0,0|2,0,0]=4 17399 B18R1.1642 COC(=O)C(C)CCOCCCN1CCCCC1 34a_100000212458_100000034942 [0,1,0,1,0,0|2,0,0]=4 17400 B18R1.1642 COC(=O)C(C)CCOCCNC1CCCCC1 34a_100000200466_100000034942 [0,1,0,1,0,0|2,0,0]=4 17401 B18R1.1642 COC(=O)C(C)CCOCCOC1CCCCC1 34a_100011249652_100000034942 [0,1,0,1,0,0|2,0,0]=4 17402 B18R1.1642 COC(=O)C(C)CCOCCOC1CCCCC1 7a_100011249652_100000034942 [0,1,0,1,0,0|2,0,0]=4 17403 B18R1.1642 COC(=O)C(C)CCSCCCC1CCCCC1 62a_100000034942_100011713725 [0,1,0,1,0,0|1,0,0]=3 17404 B18R1.1642 COC(=O)C(C)CCSCCCC1CCCCC1 62a_100011713725_100000034942 [0,1,0,1,0,0|1,0,0]=3 17405 B18R1.1642 COC(=O)C(C)CCSCCCN1CCCCC1 62a_100000034942_100000007876 [0,1,0,1,0,0|2,0,0]=4 17406 B18R1.1642 COC(=O)C(C)CCSCCCN1CCCCC1 62a_100132302099_100000034942 [0,1,0,1,0,0|2,0,0]=4 17407 B18R1.1642 COC(=O)C(C)CCSCCOC1CCCCC1 62a_100000034942_100011211530 [0,1,0,1,0,0|2,0,0]=4 17408 B18R1.1642 COC(=O)C(C)CCSCCOC1CCCCC1 62a_100011211530_100000034942 [0,1,0,1,0,0|2,0,0]=4 17409 B18R1.1642 COC(=O)C(C)CNCCCOC1CCCCC1 34a_100000205933_100000698445 [0,1,0,1,0,0|2,0,0]=4 17410 B18R1.1642 COC(=O)C(C)COCCCCC1CCCCC1 34a_100011215267_100000698445 [0,1,0,1,0,0|1,0,0]=3 17411 B18R1.1642 COC(=O)C(C)COCCCCC1CCNCC1 34a_100016989291_100000698445 [0,1,0,1,0,0|2,0,0]=4 17412 B18R1.1642 COC(=O)C(C)OCCCCCN1CCCCC1 34a_100011216611_100000211248 [0,1,0,1,0,0|2,0,0]=4 17413 B18R1.1642 COC(=O)C(C)OCCCCCN1CCCCC1 7a_100011216611_100000211248 [0,1,0,1,0,0|2,0,0]=4 17414 B18R1.4123 CCCCCCCN1CCCCC1(C)C(=O)OC 2230a_100015186357_100000210681 [0,1,0,1,0,0|1,0,0]=3 17415 B18R1.4123 CCCCCCCN1CCCCC1(C)C(=O)OC 269982a_100015186357_100000210681 [0,1,0,1,0,0|1,0,0]=3 17416 B18R1.4123 CCCCCCCN1CCCCC1(C)C(=O)OC 34a_100015186357_100000210614 [0,1,0,1,0,0|1,0,0]=3 17417 B18R1.4123 CCCCOCCN1CCCCC1(C)C(=O)OC 2230a_100015186357_100000743108 [0,1,0,1,0,0|2,0,0]=4 17418 B18R1.4123 CCCCOCCN1CCCCC1(C)C(=O)OC 269982a_100015186357_100000743108 [0,1,0,1,0,0|2,0,0]=4 17419 B18R1.4123 CCCCOCCN1CCCCC1(C)C(=O)OC 34a_100015186357_100000743108 [0,1,0,1,0,0|2,0,0]=4 17420 B18R1.4123 COC(=O)C1(CCCCN1CCCCCCF)C 2230a_100015186357_100015922095 [0,1,0,1,0,0|2,0,0]=4 17421 B18R1.4123 COC(=O)C1(CCCCN1CCCCCCF)C 269982a_100015186357_100015922095 [0,1,0,1,0,0|2,0,0]=4 17422 B18R1.4123 COC(=O)C1(CCCCN1CCCCCCF)C 34a_100015186357_100015922095 [0,1,0,1,0,0|2,0,0]=4 17423 B18R1.4123 COC(=O)C1(CCCCN1CCCCCCO)C 2230a_100015186357_100000766143 [0,1,0,1,0,0|2,0,0]=4 17424 B18R1.4123 COC(=O)C1(CCCCN1CCCCCCO)C 269982a_100015186357_100000766143 [0,1,0,1,0,0|2,0,0]=4 17425 B18R1.4123 COC(=O)C1(CCCCN1CCCCCCO)C 34a_100015186357_100000766143 [0,1,0,1,0,0|2,0,0]=4 17426 B18R1.4624 CCCCCC1CCCC1NCC(C)C(=O)NC 269862a_100015187722_200000198059 [0,1,0,1,0,0|2,0,0]=4 17427 B18R1.4624 CCCCCC1CCCC1NCC(C)C(=O)NC 270004a_100015187722_200000198059 [0,1,0,1,0,0|2,0,0]=4 17428 B18R1.7285 CCC1CCCCN1CCCNC(C)C(=O)OC 34a_100011191702_100000211248 [0,1,0,1,0,0|2,0,0]=4 17429 B18R1.7285 CCC1CCCCN1CCNCC(C)C(=O)OC 34a_100000755458_100000698445 [0,1,0,1,0,0|2,0,0]=4 17430 B18R1.7285 CCN1CCCCC1CNCCC(C)C(=O)OC 2230a_100000754393_100000034942 [0,1,0,1,0,0|2,0,0]=4 17431 B18R1.7285 CCN1CCCCC1CNCCC(C)C(=O)OC 34a_100000754393_100000034942 [0,1,0,1,0,0|2,0,0]=4 17432 B18R1.7285 CCN1CCCCC1COCCC(C)C(=O)OC 34a_100000225091_100000034942 [0,1,0,1,0,0|2,0,0]=4 17433 B18R1.7285 CCN1CCCCC1COCCC(C)C(=O)OC 7a_100000225091_100000034942 [0,1,0,1,0,0|2,0,0]=4 17434 B18R1.8773 CCCCCCCCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100000210759 [0,1,0,1,0,0|1,0,0]=3 17435 B18R1.8773 CCCCCCCCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100000210759 [0,1,0,1,0,0|1,0,0]=3 17436 B18R1.8773 CCCCCCCCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100000210759 [0,1,0,1,0,0|1,0,0]=3 17437 B18R1.8773 COC(=O)[C@@]1(CCCN1CCCCCCCO)C 2230a_100000719487_100000760002 [0,1,0,1,0,0|2,0,0]=4 17438 B18R1.8773 COC(=O)[C@@]1(CCCN1CCCCCCCO)C 269982a_100000719487_100000760002 [0,1,0,1,0,0|2,0,0]=4 17439 B18R1.8773 COC(=O)[C@@]1(CCCN1CCCCCCCO)C 34a_100000719487_100000760002 [0,1,0,1,0,0|2,0,0]=4 17440 B18R1.8773 COCCCCCCN1CCC[C@@]1(C)C(=O)OC 2230a_100000719487_100011998445 [0,1,0,1,0,0|2,0,0]=4 17441 B18R1.8773 COCCCCCCN1CCC[C@@]1(C)C(=O)OC 269982a_100000719487_100011998445 [0,1,0,1,0,0|2,0,0]=4 17442 B18R1.8773 COCCCCCCN1CCC[C@@]1(C)C(=O)OC 34a_100000719487_100011998445 [0,1,0,1,0,0|2,0,0]=4 17443 B18R1.10106 COC(=O)C(C)CCN1CCCCC1CCCO 2230a_100011934581_100000034942 [0,1,0,1,0,0|2,0,0]=4 17444 B18R1.10106 COC(=O)C(C)CCN1CCCCC1CCCO 269982a_100011934581_100000034942 [0,1,0,1,0,0|2,0,0]=4 17445 B18R1.10106 COC(=O)C(C)CCN1CCCCC1CCCO 34a_100011934581_100000034942 [0,1,0,1,0,0|2,0,0]=4 17446 B18R1.10106 COCCC1CCCCN1CCC(C)C(=O)OC 2230a_100015186528_100000034942 [0,1,0,1,0,0|2,0,0]=4 17447 B18R1.10106 COCCC1CCCCN1CCC(C)C(=O)OC 269982a_100015186528_100000034942 [0,1,0,1,0,0|2,0,0]=4 17448 B18R1.10106 COCCC1CCCCN1CCC(C)C(=O)OC 34a_100015186528_100000034942 [0,1,0,1,0,0|2,0,0]=4 17449 B18R1.14779 CCCC1CCCCC1OCCC(C)C(=O)OC 34a_100011217265_100000034942 [0,1,0,1,0,0|1,0,0]=3 17450 B18R1.14779 CCCC1CCCCC1OCCC(C)C(=O)OC 7a_100011217265_100000034942 [0,1,0,1,0,0|1,0,0]=3 17451 B18R1.21928 CCCCCCCCCNC1CCC(=O)N(C1)C 2230a_100011935005_100011214924 [0,1,0,1,0,0|2,0,0]=4 17452 B18R1.21928 CCCCCCCCCNC1CCC(=O)N(C1)C 34a_100011935005_100011214924 [0,1,0,1,0,0|2,0,0]=4 17453 B18R1.21942 COCCCC1CCCCN1CC(C)C(=O)OC 269982a_100011804088_100000698445 [0,1,0,1,0,0|2,0,0]=4 17454 B18R1.21942 COCCCC1CCCCN1CC(C)C(=O)OC 34a_100011804088_100000698445 [0,1,0,1,0,0|2,0,0]=4 17455 B18R1.24100 CCCN1CCCC1COCCC(C)C(=O)OC 34a_200000694710_100000034942 [0,1,0,1,0,0|2,0,0]=4 17456 B18R1.24100 CCCN1CCCC1COCCC(C)C(=O)OC 7a_200000694710_100000034942 [0,1,0,1,0,0|2,0,0]=4 17457 B18R1.35424 CCCCCCCCCN1CCC(C1)C(=O)NC 2230a_100020588580_100011214924 [0,1,0,1,0,0|2,0,0]=4 17458 B18R1.35424 CCCCCCCCCN1CCC(C1)C(=O)NC 269982a_100020588580_100000210670 [0,1,0,1,0,0|2,0,0]=4 17459 B18R1.35424 CCCCCCCCCN1CCC(C1)C(=O)NC 34a_100020588580_100011214924 [0,1,0,1,0,0|2,0,0]=4 17460 B18R1.35424 CCCCCCCCCN1CC[C@H](C1)C(=O)OC 2230a_100016989057_100011214924 [0,1,0,1,0,0|1,0,0]=3 17461 B18R1.35424 CCCCCCCCCN1CC[C@H](C1)C(=O)OC 269982a_100016989057_100000210670 [0,1,0,1,0,0|1,0,0]=3 17462 B18R1.35424 CCCCCCCCOC1CCC(C1)C(=O)OC 34a_100010257243_100000210759 [0,1,0,1,0,0|1,0,0]=3 17463 B18R1.35424 CCCCCCCCOC1CCC(C1)C(=O)OC 7a_100010257243_100000210759 [0,1,0,1,0,0|1,0,0]=3 17464 B18R1.35424 CCCCCCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_100000229938_200159312670 [0,1,0,1,0,0|1,0,0]=3 17465 B18R1.35424 CCCCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000210272_200159312670 [0,1,0,1,0,0|1,0,0]=3 17466 B18R1.35424 CCCCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100015302752_100000210614 [0,1,0,1,0,0|1,0,0]=3 17467 B18R1.35424 CCCCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100000210272_200159312670 [0,1,0,1,0,0|1,0,0]=3 17468 B18R1.35424 CCCCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100015302752_100000210614 [0,1,0,1,0,0|1,0,0]=3 17469 B18R1.35424 CCCCCCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_100000210614_200159312670 [0,1,0,1,0,0|1,0,0]=3 17470 B18R1.35424 CCCCCCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_200159312670_100000210316 [0,1,0,1,0,0|1,0,0]=3 17471 B18R1.35424 CCCCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000210238_200159312670 [0,1,0,1,0,0|2,0,0]=4 17472 B18R1.35424 CCCCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100015302752_100000743108 [0,1,0,1,0,0|2,0,0]=4 17473 B18R1.35424 CCCCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100000210238_200159312670 [0,1,0,1,0,0|2,0,0]=4 17474 B18R1.35424 CCCCOCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_100015302752_100000743108 [0,1,0,1,0,0|2,0,0]=4 17475 B18R1.35424 CCCCOCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_100000743108_200159312670 [0,1,0,1,0,0|2,0,0]=4 17476 B18R1.35424 CCCCOCCSC[C@H]1CC[C@H](C1)C(=O)OC 62a_200159312670_100000743108 [0,1,0,1,0,0|2,0,0]=4 17477 B18R1.35424 CCCCSCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_100025743550_200159312670 [0,1,0,1,0,0|2,0,0]=4 17478 B18R1.35424 CCCCSCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_200000230436_200159312670 [0,1,0,1,0,0|2,0,0]=4 17479 B18R1.35424 CCCCSCCOC[C@H]1CC[C@H](C1)C(=O)OC 7a_200000230436_200159312670 [0,1,0,1,0,0|2,0,0]=4 17480 B18R1.35424 CCCOCCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_100011217757_200159312670 [0,1,0,1,0,0|2,0,0]=4 17481 B18R1.35424 CCCOCCCNC[C@H]1CC[C@H](C1)C(=O)OC 34a_100011217757_200159312670 [0,1,0,1,0,0|2,0,0]=4 17482 B18R1.35424 CNCCCCCOC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000722520_200159312670 [0,1,0,1,0,0|2,0,0]=4 17483 B18R1.35424 COC(=O)C1CCC(C1)OCCCCCCCO 34a_100010257243_100000760002 [0,1,0,1,0,0|2,0,0]=4 17484 B18R1.35424 COC(=O)C1CCC(C1)OCCCCCCCO 7a_100010257243_100000760002 [0,1,0,1,0,0|2,0,0]=4 17485 B18R1.35424 COC(=O)[C@@H]1CCN(C1)CCCCCCCCO 2230a_100016989057_100000033203 [0,1,0,1,0,0|2,0,0]=4 17486 B18R1.35424 COC(=O)[C@@H]1CCN(C1)CCCCCCCCO 269982a_100016989057_100000033203 [0,1,0,1,0,0|2,0,0]=4 17487 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)CNCCCCCCO 2230a_100000686447_200159312670 [0,1,0,1,0,0|2,0,0]=4 17488 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)CNCCCCCCO 34a_100000686447_200159312670 [0,1,0,1,0,0|2,0,0]=4 17489 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCBr 34a_100011215345_200159312670 [0,1,0,1,0,0|2,0,0]=4 17490 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCBr 7a_100011215345_200159312670 [0,1,0,1,0,0|2,0,0]=4 17491 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCCl 34a_100000766143_200159312670 [0,1,0,1,0,0|2,0,0]=4 17492 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCCl 7a_100000766143_200159312670 [0,1,0,1,0,0|2,0,0]=4 17493 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCF 34a_100000732779_200159312670 [0,1,0,1,0,0|2,0,0]=4 17494 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCF 34a_100015302752_100015922095 [0,1,0,1,0,0|2,0,0]=4 17495 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCF 7a_100000732779_200159312670 [0,1,0,1,0,0|2,0,0]=4 17496 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCF 7a_100015302752_100015922095 [0,1,0,1,0,0|2,0,0]=4 17497 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCN 34a_100000686447_200159312670 [0,1,0,1,0,0|2,0,0]=4 17498 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCO 34a_100015302752_100000766143 [0,1,0,1,0,0|2,0,0]=4 17499 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)COCCCCCCO 7a_100015302752_100000766143 [0,1,0,1,0,0|2,0,0]=4 17500 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCCCF 62a_100015922095_200159312670 [0,1,0,1,0,0|2,0,0]=4 17501 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCCCF 62a_200159312670_100015922095 [0,1,0,1,0,0|2,0,0]=4 17502 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCCCO 62a_100000766143_200159312670 [0,1,0,1,0,0|2,0,0]=4 17503 B18R1.35424 COC(=O)[C@@H]1CC[C@@H](C1)CSCCCCCCO 62a_200159312670_100000766143 [0,1,0,1,0,0|2,0,0]=4 17504 B18R1.35424 COCCCCCCOC1CCC(C1)C(=O)OC 34a_100010257243_100011998445 [0,1,0,1,0,0|2,0,0]=4 17505 B18R1.35424 COCCCCCCOC1CCC(C1)C(=O)OC 7a_100010257243_100011998445 [0,1,0,1,0,0|2,0,0]=4 17506 B18R1.35424 COCCCCCNC[C@H]1CC[C@H](C1)C(=O)OC 2230a_100000747528_200159312670 [0,1,0,1,0,0|2,0,0]=4 17507 B18R1.35424 COCCCCCNC[C@H]1CC[C@H](C1)C(=O)OC 34a_100000747528_200159312670 [0,1,0,1,0,0|2,0,0]=4 17508 B18R1.40554 CCCCCCCCCCN1CC(C1)C(=O)NC 34a_100000703363_100000210320 [0,1,0,1,0,0|2,0,0]=4 17509 B18R1.40554 CCCCCCCCCCN1CC(C1)C(=O)OC 269982a_100015188540_100000210320 [0,1,0,1,0,0|1,0,0]=3 17510 B18R1.40554 CCCCCCCCCNC1CC(C1)C(=O)OC 34a_100000212291_100009897219 [0,1,0,1,0,0|1,0,0]=3 17511 B18R1.40554 CCCCCCCCCOC1CC(C1)C(=O)OC 34a_100000210712_100009897219 [0,1,0,1,0,0|1,0,0]=3 17512 B18R1.40554 CCCCCCCCCOC1CC(C1)C(=O)OC 7a_100000076263_100000210328 [0,1,0,1,0,0|1,0,0]=3 17513 B18R1.40554 CCCCCCCCCOC1CC(C1)C(=O)OC 7a_100000210712_100009897219 [0,1,0,1,0,0|1,0,0]=3 17514 B18R1.40554 CCCCCCCCCSC1CC(C1)C(=O)OC 62a_100009897219_100000210670 [0,1,0,1,0,0|1,0,0]=3 17515 B18R1.40554 CCCCCCCCOCC1CC(C1)C(=O)OC 34a_100009884387_100000210759 [0,1,0,1,0,0|1,0,0]=3 17516 B18R1.40554 CCCCCCCCOCC1CC(C1)C(=O)OC 7a_100009884387_100000210759 [0,1,0,1,0,0|1,0,0]=3 17517 B18R1.40554 CCCCCCOCCOC1CC(C1)C(=O)OC 34a_100000691444_100009897219 [0,1,0,1,0,0|2,0,0]=4 17518 B18R1.40554 CCCCCCOCCOC1CC(C1)C(=O)OC 7a_100000691444_100009897219 [0,1,0,1,0,0|2,0,0]=4 17519 B18R1.40554 CCCCNCCCCOC1CC(C1)C(=O)OC 34a_200011216965_100009897219 [0,1,0,1,0,0|2,0,0]=4 17520 B18R1.40554 CCCCOCCCCOC1CC(C1)C(=O)OC 34a_200000760531_100009897219 [0,1,0,1,0,0|2,0,0]=4 17521 B18R1.40554 CCCCOCCCCOC1CC(C1)C(=O)OC 7a_200000760531_100009897219 [0,1,0,1,0,0|2,0,0]=4 17522 B18R1.40554 COC(=O)C1CC(C1)COCCCCCCCO 34a_100009884387_100000760002 [0,1,0,1,0,0|2,0,0]=4 17523 B18R1.40554 COC(=O)C1CC(C1)COCCCCCCCO 7a_100009884387_100000760002 [0,1,0,1,0,0|2,0,0]=4 17524 B18R1.40554 COC(=O)C1CC(C1)NCCCCCCCCO 34a_102515433106_100009897219 [0,1,0,1,0,0|2,0,0]=4 17525 B18R1.40554 COC(=O)C1CC(C1)OCCCCCCCCBr 34a_100009813846_100009897219 [0,1,0,1,0,0|2,0,0]=4 17526 B18R1.40554 COC(=O)C1CC(C1)OCCCCCCCCBr 7a_100009813846_100009897219 [0,1,0,1,0,0|2,0,0]=4 17527 B18R1.40554 COC(=O)C1CC(C1)OCCCCCCCCCl 34a_100000033203_100009897219 [0,1,0,1,0,0|2,0,0]=4 17528 B18R1.40554 COC(=O)C1CC(C1)OCCCCCCCCCl 7a_100000033203_100009897219 [0,1,0,1,0,0|2,0,0]=4 17529 B18R1.40554 COC(=O)C1CC(C1)OCCCCCCCCN 34a_102515433106_100009897219 [0,1,0,1,0,0|2,0,0]=4 17530 B18R1.40554 COC(=O)C1CC(C1)OCCCCCCCCO 7a_100000076263_100000033203 [0,1,0,1,0,0|2,0,0]=4 17531 B18R1.40554 COC(=O)C1CC(C1)SCCCCCCCCO 62a_100000033203_100009897219 [0,1,0,1,0,0|2,0,0]=4 17532 B18R1.40554 COC(=O)C1CC(C1)SCCCCCCCCO 62a_100009897219_100000033203 [0,1,0,1,0,0|2,0,0]=4 17533 B18R1.40554 COC(=O)C1CN(C1)CCCCCCCCCO 269982a_100015188540_100009813782 [0,1,0,1,0,0|2,0,0]=4 17534 B18R1.40554 COCCCCCCOCC1CC(C1)C(=O)OC 34a_100009884387_100011998445 [0,1,0,1,0,0|2,0,0]=4 17535 B18R1.40554 COCCCCCCOCC1CC(C1)C(=O)OC 7a_100009884387_100011998445 [0,1,0,1,0,0|2,0,0]=4 17536 B18R1.44810 C=C(CNCCC1CCCCCCC1)C(=O)OC 34a_100011532352_100009813391 [0,1,0,1,0,0|1,0,1]=4 17537 B18R1.44810 COC(=O)C(=O)CNCCC1CCCCCCC1 34a_100011532352_100011610305 [0,1,0,1,0,0|1,0,1]=4 17538 B18R1.44810 COC(=O)C(C)CCOCC1CCCCCCC1 34a_100011216312_100000034942 [0,1,0,1,0,0|1,0,0]=3 17539 B18R1.44810 COC(=O)C(C)CCOCC1CCCCCCC1 7a_100011216312_100000034942 [0,1,0,1,0,0|1,0,0]=3 17540 B18R1.44810 COC(=O)C(C)CNCCC1CCCCCCC1 34a_100011532352_100000698445 [0,1,0,1,0,0|1,0,0]=3 17541 B18R1.44978 COC(=O)C(C)CCNCCC1CCCCCC1 2230a_100011532351_100000034942 [0,1,0,1,0,0|1,0,0]=3 17542 B18R1.44978 COC(=O)C(C)CCNCCC1CCCCCC1 34a_100011532351_100000034942 [0,1,0,1,0,0|1,0,0]=3 17543 B18R1.44978 COC(=O)C(C)CCOCCN1CCCCCC1 34a_100000238007_100000034942 [0,1,0,1,0,0|2,0,0]=4 17544 B18R1.44978 COC(=O)C(C)CCSCCN1CCCCCC1 62a_100000034942_100000722644 [0,1,0,1,0,0|2,0,0]=4 17545 B18R1.44978 COC(=O)C(C)CCSCCN1CCCCCC1 62a_100000722644_100000034942 [0,1,0,1,0,0|2,0,0]=4 17546 B18R1.44978 COC(=O)C(C)COCCCN1CCCCCC1 34a_100102886287_100000698445 [0,1,0,1,0,0|2,0,0]=4 17547 B18R1.44978 COC(=O)C(C)OCCCCN1CCCCCC1 34a_100011305542_100000211248 [0,1,0,1,0,0|2,0,0]=4 17548 B18R1.33489 C=C1CC(C1)CNCCCCCCCC(=O)OC 2230a_100102567296_100010004213 [0,1,0,1,0,0|1,0,1]=4 17549 B18R1.33489 C=C1CC(C1)CNCCCCCCCC(=O)OC 34a_100102567296_100010004213 [0,1,0,1,0,0|1,0,1]=4 17550 B18R1.33489 C=C1CC(C1)COCCCCCCCC(=O)OC 34a_100011011225_100010004213 [0,1,0,1,0,0|1,0,1]=4 17551 B18R1.33489 C=C1CC(C1)NCCCCCCCCC(=O)OC 2230a_100132301982_100010282707 [0,1,0,1,0,0|1,0,1]=4 17552 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)C 2230a_100000702820_100009813843 [0,1,0,1,0,0|1,0,0]=3 17553 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)C 269982a_100000702820_100009813843 [0,1,0,1,0,0|1,0,0]=3 17554 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)C 34a_100000702820_100009813843 [0,1,0,1,0,0|1,0,0]=3 17555 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)F 2230a_100000690557_100009813843 [0,1,0,1,0,0|1,0,0]=3 17556 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)F 269982a_100000690557_100009813843 [0,1,0,1,0,0|1,0,0]=3 17557 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)F 34a_100000690557_100009813843 [0,1,0,1,0,0|1,0,0]=3 17558 B18R1.33489 COC(=O)CCCCCCCCCN1CC(C1)O 269982a_100000749847_100009813843 [0,1,0,1,0,0|1,0,0]=3 17559 B18R1.33489 COC(=O)CCCCCCCCNC1CC(C1)F 2230a_100016993743_100010282707 [0,1,0,1,0,0|1,0,0]=3 17560 B18R1.33489 COC(=O)CCCCCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100010282707 [0,1,0,1,0,0|1,0,0]=3 17561 B18R1.33489 COC(=O)CCCCCCCCSC1CC(=O)C1 62a_100009894365_100010282707 [0,1,0,1,0,0|1,0,1]=4 17562 B18R1.33489 COC(=O)CCCCCCCNCC1CC(C1)O 2230a_100016992100_100010004213 [0,1,0,1,0,0|1,0,0]=3 17563 B18R1.33489 COC(=O)CCCCCCCOCC1CC(=O)C1 34a_100000101936_100010004213 [0,1,0,1,0,0|1,0,1]=4 17564 B18R1.33489 COC(=O)CCCCCCCOCC1CC(=O)C1 7a_100011022521_100009874392 [0,1,0,1,0,0|1,0,1]=4 17565 B18R1.33489 COC(=O)CCCCCCCOCC1CC(C1)Cl 34a_100009874164_100010004213 [0,1,0,1,0,0|1,0,0]=3 17566 B18R1.33489 COC(=O)CCCCCCCSCC1CC(=O)C1 62a_100009874392_100010004213 [0,1,0,1,0,0|1,0,1]=4 17567 B18R1.33489 COC(=O)CCCCCCCSCC1CC(=O)C1 62a_100010004213_100009874392 [0,1,0,1,0,0|1,0,1]=4 17568 B18R1.33495 COC(=O)CCCCCCN1CCN(C[C@@H]1C)C 2230a_100012002466_100009815986 [0,1,0,1,0,0|2,0,0]=4 17569 B18R1.33495 COC(=O)CCCCCCN1CCN(C[C@@H]1C)C 269982a_100012002466_100009815986 [0,1,0,1,0,0|2,0,0]=4 17570 B18R1.33495 COC(=O)CCCCCOC1CCC(CC1C)C 34a_100011539931_100009816466 [0,1,0,1,0,0|1,0,0]=3 17571 B18R1.33495 COC(=O)CCCCCOC1CCC(CC1C)C 7a_100011539931_100009816466 [0,1,0,1,0,0|1,0,0]=3 17572 B18R1.37296 COC(=O)CCCCCCN1CCCC(CC1)C 2230a_100025706717_100009815986 [0,1,0,1,0,0|1,0,0]=3 17573 B18R1.37296 COC(=O)CCCCCCN1CCCC(CC1)C 269982a_100025706717_100009815986 [0,1,0,1,0,0|1,0,0]=3 17574 B18R1.37296 COC(=O)CCCCCCN1CCCC(CC1)C 34a_100025706717_100009815986 [0,1,0,1,0,0|1,0,0]=3 17575 B18R1.37296 COC(=O)CCCCCCN1CCCC(CC1)O 2230a_100015186869_100009815986 [0,1,0,1,0,0|1,0,0]=3 17576 B18R1.37296 COC(=O)CCCCCCN1CCCC(CC1)O 269982a_100015186869_100009815986 [0,1,0,1,0,0|1,0,0]=3 17577 B18R1.37296 COC(=O)CCCCCCN1CCCN(CC1)C 2230a_100000211313_100009815986 [0,1,0,1,0,0|2,0,0]=4 17578 B18R1.37296 COC(=O)CCCCCCN1CCCN(CC1)C 269982a_100000211313_100009815986 [0,1,0,1,0,0|2,0,0]=4 17579 B18R1.240036 COC(=O)CCCCCCCCNC1(CCC1)C 2230a_100000692455_100010282707 [0,1,0,1,0,0|1,0,0]=3 17580 B18R1.240036 COC(=O)CCCCCCCCNC1(CCC1)C 34a_100000692455_100010282707 [0,1,0,1,0,0|1,0,0]=3 17581 B18R1.240036 COC(=O)CCCCCCCCNC1(COC1)C 2230a_100000732644_100010282707 [0,1,0,1,0,0|2,0,0]=4 17582 B18R1.240036 COC(=O)CCCCCCCCOC1(CCC1)C 34a_100000759064_100010282707 [0,1,0,1,0,0|1,0,0]=3 17583 B18R1.240036 COC(=O)CCCCCCCCOC1(CCC1)C 7a_100000759064_100010282707 [0,1,0,1,0,0|1,0,0]=3 17584 B18R1.240036 COC(=O)CCCCCCCCOC1(CSC1)C 7a_100016018533_100010282707 [0,1,0,1,0,0|2,0,0]=4 17585 B18R1.240036 COC(=O)CCCCCCCNCC1(CCC1)C 2230a_100000706607_100010004213 [0,1,0,1,0,0|1,0,0]=3 17586 B18R1.240036 COC(=O)CCCCCCCNCC1(CCC1)O 2230a_100000752638_100010004213 [0,1,0,1,0,0|1,0,0]=3 17587 B18R1.240036 COC(=O)CCCCCCCNCC1(COC1)C 2230a_100020631278_100010004213 [0,1,0,1,0,0|2,0,0]=4 17588 B18R1.240036 COC(=O)CCCCCCCNCC1(COC1)O 2230a_100010264505_100010004213 [0,1,0,1,0,0|2,0,0]=4 17589 B18R1.240036 COC(=O)CCCCCCCOCC1(CCC1)C 34a_100011022521_100000726658 [0,1,0,1,0,0|1,0,0]=3 17590 B18R1.240036 COC(=O)CCCCCCCOCC1(CCC1)C 7a_100011022521_100000726658 [0,1,0,1,0,0|1,0,0]=3 17591 B18R1.240036 COC(=O)CCCCCCCOCC1(COC1)C 34a_100011022521_100009817586 [0,1,0,1,0,0|2,0,0]=4 17592 B18R1.240036 COC(=O)CCCCCCCOCC1(COC1)C 7a_100011022521_100009817586 [0,1,0,1,0,0|2,0,0]=4 17593 B18R1.240036 COC(=O)CCCCCCCOCC1(CSC1)C 34a_100000732658_100010004213 [0,1,0,1,0,0|2,0,0]=4 17594 B18R1.240036 COC(=O)CCCCCCCOCC1(CSC1)C 7a_100000732658_100010004213 [0,1,0,1,0,0|2,0,0]=4 17595 B18R1.240036 COC(=O)CCCCCCCSCC1(CCC1)C 62a_100000726658_100010004213 [0,1,0,1,0,0|1,0,0]=3 17596 B18R1.240036 COC(=O)CCCCCCCSCC1(CCC1)C 62a_100010004213_100000726658 [0,1,0,1,0,0|1,0,0]=3 17597 B18R1.240036 COC(=O)CCCCCCCSCC1(COC1)C 62a_100009817586_100010004213 [0,1,0,1,0,0|2,0,0]=4 17598 B18R1.240036 COC(=O)CCCCCCCSCC1(COC1)C 62a_100010004213_100009817586 [0,1,0,1,0,0|2,0,0]=4 17599 B18R1.242986 COC(=O)CCCCCN1CCCN(CC1C)C 269982a_100011935175_100009816466 [0,1,0,1,0,0|2,0,0]=4 17600 B18R1.328370 COC(=O)CCCCCCCCCC(=O)C1CC1 1458a_100000210395_100009813843 [0,1,0,1,0,0|0,0,1]=3 17601 B18R1.328370 COC(=O)CCCCCCCCCC(=O)C1CO1 1458a_100000701028_100009813843 [0,1,0,1,0,0|1,0,1]=4 17602 B18R1.328370 COC(=O)CCCCCCCCCN(C)C1CC1 2230a_100000226674_100009813843 [0,1,0,1,0,0|1,0,0]=3 17603 B18R1.328370 COC(=O)CCCCCCCCCN(C)C1CC1 269982a_100000226674_100009813843 [0,1,0,1,0,0|1,0,0]=3 17604 B18R1.328370 COC(=O)CCCCCCCCNC(C)C1CC1 2230a_100000700016_100010282707 [0,1,0,1,0,0|1,0,0]=3 17605 B18R1.328370 COC(=O)CCCCCCCCNC(C)C1CC1 34a_100000700016_100010282707 [0,1,0,1,0,0|1,0,0]=3 17606 B18R1.328370 COC(=O)CCCCCCCCOC(C)C1CC1 34a_100000744524_100010282707 [0,1,0,1,0,0|1,0,0]=3 17607 B18R1.328370 COC(=O)CCCCCCCCOC(C)C1CC1 7a_100000744524_100010282707 [0,1,0,1,0,0|1,0,0]=3 17608 B18R1.328370 COC(=O)CCCCCCCNCC(O)C1CC1 2230a_100000751198_100010004213 [0,1,0,1,0,0|1,0,0]=3 17609 B18R1.328370 COC(=O)CCCCCCCNCC(O)C1CC1 34a_100000751198_100010004213 [0,1,0,1,0,0|1,0,0]=3 17610 B18R1.328370 COC(=O)CCCCCCCOCC(=O)C1CC1 34a_100000686663_100010004213 [0,1,0,1,0,0|1,0,1]=4 17611 B18R1.328370 COC(=O)CCCCCCCOCC(=O)C1CC1 34a_100011022521_100000746382 [0,1,0,1,0,0|1,0,1]=4 17612 B18R1.328370 COC(=O)CCCCCCCOCC(=O)C1CC1 7a_100011022521_100000746382 [0,1,0,1,0,0|1,0,1]=4 17613 B18R1.328370 COC(=O)CCCCCCCOC[C@H](N)C1CC1 34a_100020623730_100010004213 [0,1,0,1,0,0|1,0,0]=3 17614 B18R1.328370 COC(=O)CCCCCCCSCC(=O)C1CC1 62a_100000746382_100010004213 [0,1,0,1,0,0|1,0,1]=4 17615 B18R1.328370 COC(=O)CCCCCCCSCC(=O)C1CC1 62a_100010004213_100000746382 [0,1,0,1,0,0|1,0,1]=4 17616 B18R1.1223 COC(=O)CCCCCCCCN1CCC(C1)O 2230a_100011215560_100010282707 [0,1,0,1,0,0|1,0,0]=3 17617 B18R1.1223 COC(=O)CCCCCCCCN1CCC(C1)O 269982a_100011215560_100010282707 [0,1,0,1,0,0|1,0,0]=3 17618 B18R1.1223 COC(=O)CCCCCCCCN1CC[C@@H](C1)F 2230a_100015203821_100010282707 [0,1,0,1,0,0|1,0,0]=3 17619 B18R1.1223 COC(=O)CCCCCCCCN1CC[C@@H](C1)F 269982a_100015203821_100010282707 [0,1,0,1,0,0|1,0,0]=3 17620 B18R1.1223 COC(=O)CCCCCCCCN1CC[C@@H](C1)F 34a_100015203821_100010282707 [0,1,0,1,0,0|1,0,0]=3 17621 B18R1.1223 COC(=O)CCCCCCCCN1CC[C@H](C1)C 2230a_100016987628_100010282707 [0,1,0,1,0,0|1,0,0]=3 17622 B18R1.1223 COC(=O)CCCCCCCCN1CC[C@H](C1)C 269982a_100016987628_100010282707 [0,1,0,1,0,0|1,0,0]=3 17623 B18R1.1223 COC(=O)CCCCCCCCN1CC[C@H](C1)C 34a_100016987628_100010282707 [0,1,0,1,0,0|1,0,0]=3 17624 B18R1.1223 COC(=O)CCCCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100010004213 [0,1,0,1,0,0|1,0,0]=3 17625 B18R1.1223 COC(=O)CCCCCCCOC1CCC(=O)C1 34a_100012614533_100010004213 [0,1,0,1,0,0|1,0,1]=4 17626 B18R1.1223 COC(=O)CCCCCCCOC1CCC(C1)C 34a_100000698185_100010004213 [0,1,0,1,0,0|1,0,0]=3 17627 B18R1.1223 COC(=O)CCCCCCCOC1CCN(C1)C 7a_100011022521_200012183744 [0,1,0,1,0,0|2,0,0]=4 17628 B18R1.1223 COC(=O)CCCCCCCSC1CCN(C1)C 62a_100010004213_200012183744 [0,1,0,1,0,0|2,0,0]=4 17629 B18R1.1223 COC(=O)CCCCCCOCC1CCN(C1)C 34a_100009863599_200000690779 [0,1,0,1,0,0|2,0,0]=4 17630 B18R1.1223 COC(=O)CCCCCCOCC1CCN(C1)C 7a_100009863599_200000690779 [0,1,0,1,0,0|2,0,0]=4 17631 B18R1.1223 COC(=O)CCCCCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100009815986 [0,1,0,1,0,0|2,0,0]=4 17632 B18R1.1223 COC(=O)CCCCCCSCC1CCN(C1)C 62a_100009815986_200000690779 [0,1,0,1,0,0|2,0,0]=4 17633 B18R1.1223 COC(=O)CCCCCCSCC1CCN(C1)C 62a_200000690779_100009815986 [0,1,0,1,0,0|2,0,0]=4 17634 B18R1.1410 CCCCC(C)CCCCOCC1COC(=O)O1 34a_200011021034_100000073702 [0,1,0,1,0,0|2,0,0]=4 17635 B18R1.1410 CCCCC(C)CCCCOC[C@H]1COC(=O)N1 34a_200011021034_100015307671 [0,1,0,1,0,0|2,0,0]=4 17636 B18R1.1410 CCCCC(C)CCCCOC[C@H]1COC(=O)N1 7a_200011021034_100015307671 [0,1,0,1,0,0|2,0,0]=4 17637 B18R1.5452 CCC1CN(CCN1CCCCCC(=O)OC)C 2230a_100011941019_100009816466 [0,1,0,1,0,0|2,0,0]=4 17638 B18R1.5452 CCC1CN(CCN1CCCCCC(=O)OC)C 269982a_100011941019_100009816466 [0,1,0,1,0,0|2,0,0]=4 17639 B18R1.6509 COC(=O)CCCCCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100009815986 [0,1,0,1,0,0|2,0,0]=4 17640 B18R1.6509 COC(=O)CCCCCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100009815986 [0,1,0,1,0,0|2,0,0]=4 17641 B18R1.6509 COC(=O)CCCCCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100009815986 [0,1,0,1,0,0|2,0,0]=4 17642 B18R1.6509 COC(=O)CCCCCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100009815986 [0,1,0,1,0,0|2,0,0]=4 17643 B18R1.6509 COC(=O)CCCCCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100009815986 [0,1,0,1,0,0|2,0,0]=4 17644 B18R1.34250 COC(=O)CCCCCCN1C[C@H](OC[C@H]1C)C 2230a_100016991869_100009815986 [0,1,0,1,0,0|2,0,0]=4 17645 B18R1.34250 COC(=O)CCCCCCN1C[C@H](OC[C@H]1C)C 269982a_100016991869_100009815986 [0,1,0,1,0,0|2,0,0]=4 17646 B18R1.34250 COC(=O)CCCCCCN1C[C@H](OC[C@H]1C)C 34a_100016991869_100009815986 [0,1,0,1,0,0|2,0,0]=4 17647 B18R1.34250 COC(=O)CCCCCOC1CC(CCC1C)C 34a_100011217446_100009816466 [0,1,0,1,0,0|1,0,0]=3 17648 B18R1.34250 COC(=O)CCCCCOC1CC(CCC1C)C 7a_100011217446_100009816466 [0,1,0,1,0,0|1,0,0]=3 17649 B18R1.37849 COC(=O)CCCCCCCCC(=O)C1CCC1 1458a_100000036616_100000749161 [0,1,0,1,0,0|0,0,1]=3 17650 B18R1.37849 COC(=O)CCCCCCCCC(=O)C1CCC1 1458a_100000209988_100010282707 [0,1,0,1,0,0|0,0,1]=3 17651 B18R1.37849 COC(=O)CCCCCCCCC(=O)C1CCO1 1458a_100000089072_100010282707 [0,1,0,1,0,0|1,0,1]=4 17652 B18R1.37849 COC(=O)CCCCCCCCC(=O)C1COC1 1458a_100000036616_100000687716 [0,1,0,1,0,0|1,0,1]=4 17653 B18R1.37849 COC(=O)CCCCCCCCC(=O)C1COC1 1458a_100000758290_100010282707 [0,1,0,1,0,0|1,0,1]=4 17654 B18R1.37849 COC(=O)CCCCCCCCC(=O)N1CCC1 11a_100000754969_100000036616 [0,1,0,1,0,0|1,0,1]=4 17655 B18R1.37849 COC(=O)CCCCCCCCC(=O)N1CCC1 240690a_100000754969_100000036616 [0,1,0,1,0,0|1,0,1]=4 17656 B18R1.37849 COC(=O)CCCCCCCCN(C)C1CCC1 2230a_100000758072_100010282707 [0,1,0,1,0,0|1,0,0]=3 17657 B18R1.37849 COC(=O)CCCCCCCCN(C)C1CCC1 269982a_100000758072_100010282707 [0,1,0,1,0,0|1,0,0]=3 17658 B18R1.37849 COC(=O)CCCCCCCCN(C)C1CCC1 34a_100000758072_100010282707 [0,1,0,1,0,0|1,0,0]=3 17659 B18R1.37849 COC(=O)CCCCCCCCN(C)C1COC1 2230a_100102693430_100010282707 [0,1,0,1,0,0|2,0,0]=4 17660 B18R1.37849 COC(=O)CCCCCCCCN(C)C1COC1 269982a_100102693430_100010282707 [0,1,0,1,0,0|2,0,0]=4 17661 B18R1.37849 COC(=O)CCCCCCCNC(=O)C1CCC1 188690a_100000687944_100000209988 [0,1,0,1,0,0|1,0,1]=4 17662 B18R1.37849 COC(=O)CCCCCCCNC(C)C1CCC1 2230a_100016994624_100010004213 [0,1,0,1,0,0|1,0,0]=3 17663 B18R1.37849 COC(=O)CCCCCCCNC(C)C1CCC1 34a_100016994624_100010004213 [0,1,0,1,0,0|1,0,0]=3 17664 B18R1.37849 COC(=O)CCCCCCCOC(C)C1CCC1 34a_100000766398_100010004213 [0,1,0,1,0,0|1,0,0]=3 17665 B18R1.37849 COC(=O)CCCCCCCOC(C)C1CCC1 7a_100000766398_100010004213 [0,1,0,1,0,0|1,0,0]=3 17666 B18R1.37849 COC(=O)CCCCCCOCC(=O)C1CCC1 34a_100009863599_100000686122 [0,1,0,1,0,0|1,0,1]=4 17667 B18R1.37849 COC(=O)CCCCCCOCC(=O)C1CCC1 7a_100009863599_100000686122 [0,1,0,1,0,0|1,0,1]=4 17668 B18R1.37849 COC(=O)CCCCCCOC[C@@H](N)C1COC1 34a_217856628679_100009815986 [0,1,0,1,0,0|2,0,0]=4 17669 B18R1.37849 COC(=O)CCCCCCSCC(=O)C1CCC1 62a_100000686122_100009815986 [0,1,0,1,0,0|1,0,1]=4 17670 B18R1.37849 COC(=O)CCCCCCSCC(=O)C1CCC1 62a_100009815986_100000686122 [0,1,0,1,0,0|1,0,1]=4 17671 B18R1.37851 COC(=O)CCCCCCCCC(=O)CC1CC1 1458a_100000036616_100000742324 [0,1,0,1,0,0|0,0,1]=3 17672 B18R1.37851 COC(=O)CCCCCCCCC(=O)CC1CC1 1458a_100000738066_100010282707 [0,1,0,1,0,0|0,0,1]=3 17673 B18R1.37851 COC(=O)CCCCCCCCC(=O)CC1CO1 1458a_100000036616_100011216344 [0,1,0,1,0,0|1,0,1]=4 17674 B18R1.37851 COC(=O)CCCCCCCCC(=O)CC1CS1 1458a_100000036616_100000031435 [0,1,0,1,0,0|1,0,1]=4 17675 B18R1.37851 COC(=O)CCCCCCCCC(=O)C[C@@H]1CO1 1458a_100000036616_100000745022 [0,1,0,1,0,0|1,0,1]=4 17676 B18R1.37851 COC(=O)CCCCCCCCC(=O)NC1CC1 1626a_100000212008_100000036616 [0,1,0,1,0,0|1,0,1]=4 17677 B18R1.37851 COC(=O)CCCCCCCCC(=O)NC1CC1 240690a_100000212008_100000036616 [0,1,0,1,0,0|1,0,1]=4 17678 B18R1.37851 COC(=O)CCCCCCCCN(C)CC1CC1 2230a_100000741881_100010282707 [0,1,0,1,0,0|1,0,0]=3 17679 B18R1.37851 COC(=O)CCCCCCCCN(C)CC1CC1 269982a_100000741881_100010282707 [0,1,0,1,0,0|1,0,0]=3 17680 B18R1.37851 COC(=O)CCCCCCCNC(=O)CC1CC1 188690a_100000687944_100000738066 [0,1,0,1,0,0|1,0,1]=4 17681 B18R1.39394 CCC1CN(C1)CCCCCCCCC(=O)OC 2230a_100015205115_100010282707 [0,1,0,1,0,0|1,0,0]=3 17682 B18R1.39394 CCC1CN(C1)CCCCCCCCC(=O)OC 269982a_100015205115_100010282707 [0,1,0,1,0,0|1,0,0]=3 17683 B18R1.39394 CCN1CC(C1)NCCCCCCCC(=O)OC 2230a_200015199589_100010004213 [0,1,0,1,0,0|2,0,0]=4 17684 B18R1.39394 COC(=O)CCCCCCCCN1CC(C1)CF 269982a_100010363649_100010282707 [0,1,0,1,0,0|2,0,0]=4 17685 B18R1.39394 COC(=O)CCCCCCCCN1CC(C1)CF 34a_100010363649_100010282707 [0,1,0,1,0,0|2,0,0]=4 17686 B18R1.39394 COC(=O)CCCCCCCCN1CC(C1)CO 269982a_100016987283_100010282707 [0,1,0,1,0,0|2,0,0]=4 17687 B18R1.39394 COC(=O)CCCCCCCCN1CC(C1)CO 34a_100016987283_100010282707 [0,1,0,1,0,0|2,0,0]=4 17688 B18R1.39394 COC(=O)CCCCCCCCN1CC(C1)OC 269982a_100000755009_100010282707 [0,1,0,1,0,0|2,0,0]=4 17689 B18R1.39394 COC(=O)CCCCCCCCN1CC(C1)SC 269982a_100016990038_100010282707 [0,1,0,1,0,0|2,0,0]=4 17690 B18R1.39394 COC(=O)CCCCCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100010004213 [0,1,0,1,0,0|2,0,0]=4 17691 B18R1.39394 COC(=O)CCCCCCCSC1CC(C1)CO 62a_100009874164_100010004213 [0,1,0,1,0,0|2,0,0]=4 17692 B18R1.39394 COC(=O)CCCCCCCSC1CC(C1)CO 62a_100010004213_100009874164 [0,1,0,1,0,0|2,0,0]=4 17693 B18R1.41862 CCCCC(C)CCCCOCCC1CCC1=O 7a_200011021034_200016118888 [0,1,0,1,0,0|2,0,0]=4 17694 B18R1.242050 COC(=O)CCCCCCCN1C(CCC1C)C 2230a_100000687148_100010004213 [0,1,0,1,0,0|1,0,0]=3 17695 B18R1.242050 COC(=O)CCCCCCCN1C(CCC1C)C 269982a_100000687148_100010004213 [0,1,0,1,0,0|1,0,0]=3 17696 B18R1.242050 COC(=O)CCCCCCCN1C(CCC1C)C 34a_100000687148_100010004213 [0,1,0,1,0,0|1,0,0]=3 17697 B18R1.245570 COC(=O)CCCCCCCNC1(CCOC1)C 2230a_100000693475_100010004213 [0,1,0,1,0,0|2,0,0]=4 17698 B18R1.245570 COC(=O)CCCCCCCOC1(CCCC1)C 34a_100000751722_100010004213 [0,1,0,1,0,0|1,0,0]=3 17699 B18R1.245570 COC(=O)CCCCCCCOC1(CCCC1)C 7a_100000751722_100010004213 [0,1,0,1,0,0|1,0,0]=3 17700 B18R1.245570 COC(=O)CCCCCCNCC1(CCCC1)O 2230a_100000737848_100009815986 [0,1,0,1,0,0|1,0,0]=3 17701 B18R1.245570 COC(=O)CCCCCCOCC1(CCCC1)N 34a_100000749328_100009815986 [0,1,0,1,0,0|1,0,0]=3 17702 B18R1.245570 COC(=O)CCCCCCOC[C@@]1(CCCN1)C 34a_100016195882_100009815986 [0,1,0,1,0,0|2,0,0]=4 17703 B18R1.245570 COC(=O)CCCCCNCCC1(CCCC1)O 34a_100000719956_100009816466 [0,1,0,1,0,0|1,0,0]=3 17704 B18R1.268663 COC(=O)CCCCCCCCC(=O)C1CC1C 1458a_100000211227_100010282707 [0,1,0,1,0,0|0,0,1]=3 17705 B18R1.268663 COC(=O)CCCCCCCCC(=O)[C@@H]1C[C@@H]1F 1458a_100015396687_100010282707 [0,1,0,1,0,0|1,0,1]=4 17706 B18R1.268663 COC(=O)CCCCCCCNC(=O)C1CC1C 188690a_100000687944_100000211227 [0,1,0,1,0,0|1,0,1]=4 17707 B18R1.699 CCCCCCCCCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210670 [0,1,0,1,0,0|1,0,1]=4 17708 B18R1.1310 CCCCCCCCCC(=O)CC1COC(=O)O1 1458a_100000210558_100000073702 [0,1,0,1,0,0|1,0,1]=4 17709 B18R1.1310 CCCCCCCCCC(=O)C[C@H]1COC(=O)N1 1458a_100000210558_100015307671 [0,1,0,1,0,0|1,0,1]=4 17710 B18R1.1310 CCCCCCCCCC(C)OC1COC(=O)O1 34a_100011218016_100000032252 [0,1,0,1,0,0|2,0,0]=4 17711 B18R1.1310 CCCCCCCCCN(C)CC1COC(=O)O1 269982a_100000232482_100000073702 [0,1,0,1,0,0|2,0,0]=4 17712 B18R1.1310 CCCCCCCCCN(C)C[C@H]1COC(=O)N1 2230a_100000232482_100015307671 [0,1,0,1,0,0|2,0,0]=4 17713 B18R1.1310 CCCCCCCCCN(C)C[C@H]1COC(=O)N1 269982a_100000232482_100015307671 [0,1,0,1,0,0|2,0,0]=4 17714 B18R1.23713 CCCC1CCCCN1C(=O)CCCC(=O)OC 11a_100000701414_100000239890 [0,1,0,1,0,0|1,0,1]=4 17715 B18R1.23713 CCCC1CCCCN1C(=O)CCCC(=O)OC 1626a_100000701414_100000239890 [0,1,0,1,0,0|1,0,1]=4 17716 B18R1.23713 CCCC1CCCCN1C(=O)CCCC(=O)OC 240690a_100000701414_100000239890 [0,1,0,1,0,0|1,0,1]=4 17717 B18R1.23713 CCCC1CCCCN1C(=O)CCCC(=O)OC 527a_100000701414_100000239890 [0,1,0,1,0,0|1,0,1]=4 17718 B18R1.23713 CCCN1CCCCC1C(=O)CCCC(=O)OC 1458a_100000743559_100011218270 [0,1,0,1,0,0|1,0,1]=4 17719 B18R1.24265 CCCCCCCCCC(=O)CCC1CCC1=O 1458a_100000210558_200016118888 [0,1,0,1,0,0|1,0,1]=4 17720 B18R1.24265 CCCCCCCCCN(C)CCC1CCC1=O 2230a_100000232482_200016118888 [0,1,0,1,0,0|2,0,0]=4 17721 B18R1.24265 CCCCCCCCCN(C)CCC1CCC1=O 269982a_100000232482_200016118888 [0,1,0,1,0,0|2,0,0]=4 17722 B18R1.33868 COC(=O)CCCC(=O)CCC1CCCCN1C 1458a_100000239890_100000211948 [0,1,0,1,0,0|1,0,1]=4 17723 B18R1.33868 COC(=O)CCCC(=O)CCC1CCCCN1C 1458a_100000718493_100011218270 [0,1,0,1,0,0|1,0,1]=4 17724 B18R1.33868 COC(=O)CCCC(=O)COC1CCCCC1C 1458a_100011223357_100011218270 [0,1,0,1,0,0|1,0,1]=4 17725 B18R1.33868 COC(=O)CCCN(C)CCC1CCCCN1C 269982a_100000739225_100000211948 [0,1,0,1,0,0|2,0,0]=4 17726 B18R1.33868 COC(=O)CCCN(C)CCN1CCCCC1C 2230a_200011233311_100011218270 [0,1,0,1,0,0|2,0,0]=4 17727 B18R1.33868 COC(=O)CCCN(C)CCN1CCCCC1C 269982a_200011233311_100011218270 [0,1,0,1,0,0|2,0,0]=4 17728 B18R1.33876 COC(=O)CCCC(=O)NCCCC1CCCC1 11a_100000736752_100000239890 [0,1,0,1,0,0|1,0,1]=4 17729 B18R1.33876 COC(=O)CCCC(=O)NCCCC1CCCC1 1626a_100000736752_100000239890 [0,1,0,1,0,0|1,0,1]=4 17730 B18R1.33876 COC(=O)CCCC(=O)NCCCC1CCCC1 240690a_100000736752_100000239890 [0,1,0,1,0,0|1,0,1]=4 17731 B18R1.33876 COC(=O)CCCC(=O)NCCCC1CCCC1 527a_100000736752_100000239890 [0,1,0,1,0,0|1,0,1]=4 17732 B18R1.34845 CNC(=O)CCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000741757 [0,1,0,1,0,0|1,0,1]=4 17733 B18R1.34845 COC(=O)CCCC(=O)CCCC1CCCCC1 1458a_100000211478_100011218270 [0,1,0,1,0,0|0,0,1]=3 17734 B18R1.34845 COC(=O)CCCC(=O)CCCC1CCCCC1 1458a_100000239890_100011713725 [0,1,0,1,0,0|0,0,1]=3 17735 B18R1.34845 COC(=O)CCCC(=O)CCCN1CCCCC1 1458a_100000239890_100000690320 [0,1,0,1,0,0|1,0,1]=4 17736 B18R1.34845 COC(=O)CCCC(=O)CCCN1CCCCC1 1458a_100000742516_100011218270 [0,1,0,1,0,0|1,0,1]=4 17737 B18R1.34845 COC(=O)CCCC(=O)CCOC1CCCCC1 1458a_100000239890_100011211530 [0,1,0,1,0,0|1,0,1]=4 17738 B18R1.34845 COC(=O)CCCC(=O)NCCC1CCCCC1 11a_100000738074_100000239890 [0,1,0,1,0,0|1,0,1]=4 17739 B18R1.34845 COC(=O)CCCC(=O)NCCC1CCCCC1 1626a_100000738074_100000239890 [0,1,0,1,0,0|1,0,1]=4 17740 B18R1.34845 COC(=O)CCCC(=O)NCCC1CCCCC1 240690a_100000738074_100000239890 [0,1,0,1,0,0|1,0,1]=4 17741 B18R1.34845 COC(=O)CCCC(=O)NCCC1CCCCC1 527a_100000738074_100000239890 [0,1,0,1,0,0|1,0,1]=4 17742 B18R1.34845 COC(=O)CCCN(C)CCCC1CCCCC1 269982a_100000739225_100011713725 [0,1,0,1,0,0|1,0,0]=3 17743 B18R1.34845 COC(=O)CCCN(C)CCCN1CCCCC1 269982a_100000739225_100000690320 [0,1,0,1,0,0|2,0,0]=4 17744 B18R1.34845 COC(=O)CCCN(C)CCOC1CCCCC1 269982a_100000739225_100011211530 [0,1,0,1,0,0|2,0,0]=4 17745 B18R1.34845 COC(=O)CCNC(=O)CCCC1CCCCC1 188690a_100000683876_100000211478 [0,1,0,1,0,0|1,0,1]=4 17746 B18R1.34845 COC(=O)CSCC(=O)CCCC1CCCCC1 1458a_100000191316_100011713725 [0,1,0,1,0,0|1,0,1]=4 17747 B18R1.35422 CCCCCCCCCN1CC(C1)CC(=O)OC 269982a_100016993681_100000210670 [0,1,0,1,0,0|1,0,0]=3 17748 B18R1.35422 COC(=O)CC1CN(C1)CCCCCCCCO 269982a_100016993681_100000033203 [0,1,0,1,0,0|2,0,0]=4 17749 B18R1.195342 CCCCCCCCCC(=O)C1CC1C(=O)OC 1458a_100000750770_100000210670 [0,1,0,1,0,0|0,0,1]=3 17750 B18R1.195342 CCCCCCCCCC(=O)N1CC1C(=O)OC 240690a_200009830135_100000210558 [0,1,0,1,0,0|1,0,1]=4 17751 B18R1.195342 CCCCCCCCCC(C)N1CC1C(=O)OC 270004a_200009830135_100011215753 [0,1,0,1,0,0|1,0,0]=3 17752 B18R1.195342 CCCCCCCCNC(=O)C1CC1C(=O)OC 11a_100000229939_100000750770 [0,1,0,1,0,0|1,0,1]=4 17753 B18R1.195342 CCCCCCCCNC(=O)C1CC1C(=O)OC 240690a_100000229939_100000750770 [0,1,0,1,0,0|1,0,1]=4 17754 B18R1.195342 COC(=O)C1CC1C(=O)CCCCCCCCO 1458a_100000750770_100000033203 [0,1,0,1,0,0|1,0,1]=4 17755 B18R1.195360 CCCCCCCCCC(=O)[C@H]1CCC(=O)N1C 1458a_100010979499_100000210670 [0,1,0,1,0,0|1,0,1]=4 17756 B18R1.243198 COC(=O)CCCC(=O)N1CCCCCCCC1 11a_100000039187_100000239890 [0,1,0,1,0,0|1,0,1]=4 17757 B18R1.243198 COC(=O)CCCC(=O)N1CCCCCCCC1 1626a_100000039187_100000239890 [0,1,0,1,0,0|1,0,1]=4 17758 B18R1.243198 COC(=O)CCCC(=O)N1CCCCCCCC1 240690a_100000039187_100000239890 [0,1,0,1,0,0|1,0,1]=4 17759 B18R1.243198 COC(=O)CCCC(=O)N1CCCCCCCC1 527a_100000039187_100000239890 [0,1,0,1,0,0|1,0,1]=4 17760 B18R1.243219 COC(=O)CCCC(=O)CCN1CCCCCC1 1458a_100000239890_100000722644 [0,1,0,1,0,0|1,0,1]=4 17761 B18R1.243219 COC(=O)CCCC(=O)CCN1CCCCCC1 1458a_100000740320_100011218270 [0,1,0,1,0,0|1,0,1]=4 17762 B18R1.243219 COC(=O)CCCC(=O)NCC1CCCCCC1 11a_100015204231_100000239890 [0,1,0,1,0,0|1,0,1]=4 17763 B18R1.243219 COC(=O)CCCC(=O)NCC1CCCCCC1 1626a_100015204231_100000239890 [0,1,0,1,0,0|1,0,1]=4 17764 B18R1.243219 COC(=O)CCCC(=O)NCC1CCCCCC1 240690a_100015204231_100000239890 [0,1,0,1,0,0|1,0,1]=4 17765 B18R1.243219 COC(=O)CCCC(=O)NCC1CCCCCC1 527a_100015204231_100000239890 [0,1,0,1,0,0|1,0,1]=4 17766 B18R1.243219 COC(=O)CCCN(C)CCN1CCCCCC1 269982a_100000739225_100000722644 [0,1,0,1,0,0|2,0,0]=4 17767 B18R1.243219 COC(=O)CCCN(C)CCN1CCCCCC1 269982a_106744473495_100011218270 [0,1,0,1,0,0|2,0,0]=4 17768 B18R1.243376 COC(=O)CCCC(=O)NC1CCCCCCC1 11a_100000211152_100000239890 [0,1,0,1,0,0|1,0,1]=4 17769 B18R1.243376 COC(=O)CCCC(=O)NC1CCCCCCC1 1626a_100000211152_100000239890 [0,1,0,1,0,0|1,0,1]=4 17770 B18R1.243376 COC(=O)CCCC(=O)NC1CCCCCCC1 240690a_100000211152_100000239890 [0,1,0,1,0,0|1,0,1]=4 17771 B18R1.243376 COC(=O)CCCC(=O)NC1CCCCCCC1 527a_100000211152_100000239890 [0,1,0,1,0,0|1,0,1]=4 17772 B18R1.1059 C=C1CCC(CC1)COCCCCCC(=O)OC 34a_100000074039_100009816466 [0,1,0,1,0,0|1,0,1]=4 17773 B18R1.1059 C=C1CCN(CC1)CCCCCCCC(=O)OC 2230a_100000752442_100010004213 [0,1,0,1,0,0|1,0,1]=4 17774 B18R1.1059 C=C1CCN(CC1)CCCCCCCC(=O)OC 269982a_100000752442_100010004213 [0,1,0,1,0,0|1,0,1]=4 17775 B18R1.1059 C=C1CCN(CC1)CCCCCCCC(=O)OC 34a_100000752442_100010004213 [0,1,0,1,0,0|1,0,1]=4 17776 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)C 2230a_100000188429_100010004213 [0,1,0,1,0,0|1,0,0]=3 17777 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)C 269982a_100000188429_100010004213 [0,1,0,1,0,0|1,0,0]=3 17778 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)C 34a_100000188429_100010004213 [0,1,0,1,0,0|1,0,0]=3 17779 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)F 2230a_100015193889_100010004213 [0,1,0,1,0,0|1,0,0]=3 17780 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)F 269982a_100015193889_100010004213 [0,1,0,1,0,0|1,0,0]=3 17781 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)F 34a_100015193889_100010004213 [0,1,0,1,0,0|1,0,0]=3 17782 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)O 2230a_100025773856_100010004213 [0,1,0,1,0,0|1,0,0]=3 17783 B18R1.1059 COC(=O)CCCCCCCN1CCC(CC1)O 269982a_100025773856_100010004213 [0,1,0,1,0,0|1,0,0]=3 17784 B18R1.1059 COC(=O)CCCCCCCN1CCN(CC1)C 2230a_100000188432_100010004213 [0,1,0,1,0,0|2,0,0]=4 17785 B18R1.1059 COC(=O)CCCCCCCN1CCN(CC1)C 269982a_100000188432_100010004213 [0,1,0,1,0,0|2,0,0]=4 17786 B18R1.1059 COC(=O)CCCCCCCN1CCS(=O)CC1 2230a_100000752083_100010004213 [0,1,0,1,0,0|2,0,0]=4 17787 B18R1.1059 COC(=O)CCCCCCCN1CCS(=O)CC1 269982a_100000752083_100010004213 [0,1,0,1,0,0|2,0,0]=4 17788 B18R1.1059 COC(=O)CCCCCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100009815986 [0,1,0,1,0,0|1,0,0]=3 17789 B18R1.1059 COC(=O)CCCCCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100009815986 [0,1,0,1,0,0|1,0,0]=3 17790 B18R1.1059 COC(=O)CCCCCCOC1CCC(=O)CC1 34a_100000764474_100009815986 [0,1,0,1,0,0|1,0,1]=4 17791 B18R1.1059 COC(=O)CCCCCCOC1CCC(=O)CC1 7a_100000764474_100009815986 [0,1,0,1,0,0|1,0,1]=4 17792 B18R1.1059 COC(=O)CCCCCCOC1CCC(CC1)C 34a_100000210714_100009815986 [0,1,0,1,0,0|1,0,0]=3 17793 B18R1.1059 COC(=O)CCCCCCOC1CCC(CC1)C 34a_100009863599_200011216234 [0,1,0,1,0,0|1,0,0]=3 17794 B18R1.1059 COC(=O)CCCCCCOC1CCC(CC1)C 7a_100000210714_100009815986 [0,1,0,1,0,0|1,0,0]=3 17795 B18R1.1059 COC(=O)CCCCCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100009815986 [0,1,0,1,0,0|1,0,0]=3 17796 B18R1.1059 COC(=O)CCCCCCSC1CCC(CC1)C 62a_100009815986_200011216234 [0,1,0,1,0,0|1,0,0]=3 17797 B18R1.1059 COC(=O)CCCCCCSC1CCN(CC1)C 62a_100009815986_100011215917 [0,1,0,1,0,0|2,0,0]=4 17798 B18R1.1059 COC(=O)CCCCCNCC1CCC(CC1)C 2230a_103436935547_100009816466 [0,1,0,1,0,0|1,0,0]=3 17799 B18R1.1059 COC(=O)CCCCCNCC1CCC(CC1)C 34a_103436935547_100009816466 [0,1,0,1,0,0|1,0,0]=3 17800 B18R1.1059 COC(=O)CCCCCOCC1CCC(=O)CC1 34a_100000062911_100009816466 [0,1,0,1,0,0|1,0,1]=4 17801 B18R1.1059 COC(=O)CCCCCOCC1CCC(CC1)C 34a_100000701341_100009816466 [0,1,0,1,0,0|1,0,0]=3 17802 B18R1.1059 COC(=O)CCCCCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100009816466 [0,1,0,1,0,0|1,0,0]=3 17803 B18R1.1059 COC(=O)CCCCCSCC1CCN(CC1)C 62a_100009816466_100015183002 [0,1,0,1,0,0|2,0,0]=4 17804 B18R1.1059 COC(=O)CCCCCSCC1CCN(CC1)C 62a_100015183002_100009816466 [0,1,0,1,0,0|2,0,0]=4 17805 B18R1.1059 COC(=O)CCCCNCCC1CCC(CC1)O 34a_200011935226_100000204269 [0,1,0,1,0,0|1,0,0]=3 17806 B18R1.1059 COC(=O)CCCCOCCC1CCC(CC1)N 34a_100000070672_100000204269 [0,1,0,1,0,0|1,0,0]=3 17807 B18R1.1059 COC(=O)CCCOCCCC1CCN(CC1)C 34a_100000083870_100000742333 [0,1,0,1,0,0|2,0,0]=4 17808 B18R1.1059 COC(=O)CCCOCCCC1CCN(CC1)C 7a_100000083870_100011218270 [0,1,0,1,0,0|2,0,0]=4 17809 B18R1.1059 COC(=O)CCCOCCCN1CCC(CC1)C 34a_200000213400_100000742333 [0,1,0,1,0,0|2,0,0]=4 17810 B18R1.1059 COC(=O)COCCNCCC1CCC(CC1)O 34a_200011935226_100000090808 [0,1,0,1,0,0|2,0,0]=4 17811 B18R1.1059 COC(=O)COCCOCCC1CCC(CC1)N 34a_100000070672_100000090808 [0,1,0,1,0,0|2,0,0]=4 17812 B18R1.1084 COC(=O)CCCCCNC1CCCC(C1C)C 2230a_100000211273_100009816466 [0,1,0,1,0,0|1,0,0]=3 17813 B18R1.1084 COC(=O)CCCCCNC1CCCC(C1C)C 34a_100000211273_100009816466 [0,1,0,1,0,0|1,0,0]=3 17814 B18R1.1084 COC(=O)CCCCCOC1CCCC(C1C)C 34a_100011217532_100009816466 [0,1,0,1,0,0|1,0,0]=3 17815 B18R1.1084 COC(=O)CCCCCOC1CCCC(C1C)C 7a_100011217532_100009816466 [0,1,0,1,0,0|1,0,0]=3 17816 B18R1.33502 CCC(C)C1CCCCC1NCCCC(=O)NC 269862a_100000740002_100011216798 [0,1,0,1,0,0|2,0,0]=4 17817 B18R1.33502 CCN(C)CCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100015186262 [0,1,0,1,0,0|2,0,0]=4 17818 B18R1.34258 COC(=O)CCCCCCN1CCC[C@@]1(C)CO 2230a_100016195882_100009815986 [0,1,0,1,0,0|2,0,0]=4 17819 B18R1.34258 COC(=O)CCCCCCN1CCC[C@@]1(C)CO 269982a_100016195882_100009815986 [0,1,0,1,0,0|2,0,0]=4 17820 B18R1.34258 COC(=O)CCCCCCN1CCC[C@@]1(C)CO 34a_100016195882_100009815986 [0,1,0,1,0,0|2,0,0]=4 17821 B18R1.245571 COC(=O)CCCCCCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100010282707 [0,1,0,1,0,0|1,0,0]=3 17822 B18R1.245571 COC(=O)CCCCCCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100010282707 [0,1,0,1,0,0|1,0,0]=3 17823 B18R1.328191 COC(=O)CCCCCCCCCNC1(CC1)C 2230a_100000757604_100009813843 [0,1,0,1,0,0|1,0,0]=3 17824 B18R1.328191 COC(=O)CCCCCCCCCOC1(CC1)C 7a_100011725673_100009813843 [0,1,0,1,0,0|1,0,0]=3 17825 B18R1.328191 COC(=O)CCCCCCCCNCC1(CC1)C 2230a_100000766693_100010282707 [0,1,0,1,0,0|1,0,0]=3 17826 B18R1.328191 COC(=O)CCCCCCCCNCC1(CC1)O 2230a_100011936951_100010282707 [0,1,0,1,0,0|1,0,0]=3 17827 B18R1.328191 COC(=O)CCCCCCCCOCC1(CC1)C 7a_100000698024_100010282707 [0,1,0,1,0,0|1,0,0]=3 17828 B18R1.328191 COC(=O)CCCCCCCCOCC1(CC1)F 34a_200000703853_100010282707 [0,1,0,1,0,0|1,0,0]=3 17829 B18R1.328191 COC(=O)CCCCCCCCOCC1(CC1)F 7a_200000703853_100010282707 [0,1,0,1,0,0|1,0,0]=3 17830 B18R1.328191 COC(=O)CCCCCCCCOCC1(CO1)C 34a_100000035544_100000760498 [0,1,0,1,0,0|2,0,0]=4 17831 B18R1.328191 COC(=O)CCCCCCCCSCC1(CO1)C 62a_100000760498_100010282707 [0,1,0,1,0,0|2,0,0]=4 17832 B18R1.328191 COC(=O)CCCCCCCCSCC1(CO1)C 62a_100010282707_100000760498 [0,1,0,1,0,0|2,0,0]=4 17833 B18R1.1145 CCCCCCCCCCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210319 [0,1,0,1,0,0|1,0,1]=4 17834 B18R1.7319 CCC1CCCCC1OCC(=O)CCC(=O)OC 34a_100000210738_100000691467 [0,1,0,1,0,0|1,0,1]=4 17835 B18R1.7319 CCC1CCCCC1OCC(=O)CCC(=O)OC 7a_100000210738_100000691467 [0,1,0,1,0,0|1,0,1]=4 17836 B18R1.10265 COC(=O)CCC(=O)CNCCC1CCCCC1 2230a_100000738074_100000691467 [0,1,0,1,0,0|1,0,1]=4 17837 B18R1.10265 COC(=O)CCC(=O)CNCCC1CCCCC1 34a_100000738074_100000691467 [0,1,0,1,0,0|1,0,1]=4 17838 B18R1.10265 COC(=O)CCC(=O)COCCC1CCCCC1 34a_100011217863_100000691467 [0,1,0,1,0,0|1,0,1]=4 17839 B18R1.10265 COC(=O)CCC(=O)COCCC1CCCCC1 7a_100011217863_100000691467 [0,1,0,1,0,0|1,0,1]=4 17840 B18R1.10265 COC(=O)CCC(=O)CSCCC1CCCCC1 62a_100000691467_100012355289 [0,1,0,1,0,0|1,0,1]=4 17841 B18R1.10265 COC(=O)CCC(=O)CSCCC1CCCCC1 62a_100012355289_100000691467 [0,1,0,1,0,0|1,0,1]=4 17842 B18R1.10265 COC(=O)CCC(=O)NCCCC1CCCCC1 11a_100011211642_100000187943 [0,1,0,1,0,0|1,0,1]=4 17843 B18R1.10265 COC(=O)CCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000187943 [0,1,0,1,0,0|1,0,1]=4 17844 B18R1.10265 COC(=O)CCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000187943 [0,1,0,1,0,0|1,0,1]=4 17845 B18R1.10265 COC(=O)CCC(=O)NCCCC1CCCCC1 527a_100011211642_100000187943 [0,1,0,1,0,0|1,0,1]=4 17846 B18R1.10265 COC(=O)CNC(=O)CCCCC1CCCCC1 188690a_100000185156_200011215547 [0,1,0,1,0,0|1,0,1]=4 17847 B18R1.10280 COC(=O)CCC(=O)CNCCCC1CCCC1 2230a_100000736752_100000691467 [0,1,0,1,0,0|1,0,1]=4 17848 B18R1.10280 COC(=O)CCC(=O)CNCCCC1CCCC1 34a_100000736752_100000691467 [0,1,0,1,0,0|1,0,1]=4 17849 B18R1.10280 COC(=O)CCC(=O)COCCCC1CCCC1 34a_100011215328_100000691467 [0,1,0,1,0,0|1,0,1]=4 17850 B18R1.10280 COC(=O)CCC(=O)COCCCC1CCCC1 7a_100011215328_100000691467 [0,1,0,1,0,0|1,0,1]=4 17851 B18R1.10280 COC(=O)CCC(=O)CSCCCC1CCCC1 62a_100000691467_100011713738 [0,1,0,1,0,0|1,0,1]=4 17852 B18R1.10280 COC(=O)CCC(=O)CSCCCC1CCCC1 62a_100011713738_100000691467 [0,1,0,1,0,0|1,0,1]=4 17853 B18R1.13569 CCCCCCCCCCC(C)OC1CCC1=O 34a_100011215000_100009892977 [0,1,0,1,0,0|2,0,0]=4 17854 B18R1.13569 CCCCCCCCCCC(C)OC1CCC1=O 7a_100011215000_100009892977 [0,1,0,1,0,0|2,0,0]=4 17855 B18R1.23647 CCCC1CCCCN1CC(=O)CCC(=O)OC 2230a_100000701414_100000691467 [0,1,0,1,0,0|1,0,1]=4 17856 B18R1.23647 CCCC1CCCCN1CC(=O)CCC(=O)OC 269982a_100000701414_100000691467 [0,1,0,1,0,0|1,0,1]=4 17857 B18R1.23647 CCCC1CCCCN1CC(=O)CCC(=O)OC 34a_100000701414_100000691467 [0,1,0,1,0,0|1,0,1]=4 17858 B18R1.40737 CCCCCCCN1CCC(CC1C(=O)OC)O 2230a_100020629045_100000210681 [0,1,0,1,0,0|1,0,0]=3 17859 B18R1.40737 CCCCCCCN1CCC(CC1C(=O)OC)O 269982a_100020629045_100000210681 [0,1,0,1,0,0|1,0,0]=3 17860 B18R1.40737 CCCCOCCN1CCC(CC1C(=O)OC)O 2230a_100020629045_100000743108 [0,1,0,1,0,0|2,0,0]=4 17861 B18R1.40737 CCCCOCCN1CCC(CC1C(=O)OC)O 269982a_100020629045_100000743108 [0,1,0,1,0,0|2,0,0]=4 17862 B18R1.40737 COC(=O)C1CC(CCN1CCCCCCF)O 2230a_100020629045_100015922095 [0,1,0,1,0,0|2,0,0]=4 17863 B18R1.40737 COC(=O)C1CC(CCN1CCCCCCF)O 269982a_100020629045_100015922095 [0,1,0,1,0,0|2,0,0]=4 17864 B18R1.40737 COC(=O)C1CC(CCN1CCCCCCO)O 2230a_100020629045_100000766143 [0,1,0,1,0,0|2,0,0]=4 17865 B18R1.40737 COC(=O)C1CC(CCN1CCCCCCO)O 269982a_100020629045_100000766143 [0,1,0,1,0,0|2,0,0]=4 17866 B18R1.41394 CCCCCC1CCCC1N(C)CCC(=O)NC 270004a_100000750875_200000198059 [0,1,0,1,0,0|2,0,0]=4 17867 B18R1.103948 COC(=O)CCC(=O)CNC1CCCCCCC1 2230a_100000211152_100000691467 [0,1,0,1,0,0|1,0,1]=4 17868 B18R1.103948 COC(=O)CCC(=O)CNC1CCCCCCC1 34a_100000211152_100000691467 [0,1,0,1,0,0|1,0,1]=4 17869 B18R1.103948 COC(=O)CCC(=O)COC1CCCCCCC1 34a_100000210054_100000691467 [0,1,0,1,0,0|1,0,1]=4 17870 B18R1.103948 COC(=O)CCC(=O)COC1CCCCCCC1 7a_100000210054_100000691467 [0,1,0,1,0,0|1,0,1]=4 17871 B18R1.104188 COC(=O)CCC(=O)CN1CCCCCCCC1 2230a_100000039187_100000691467 [0,1,0,1,0,0|1,0,1]=4 17872 B18R1.104188 COC(=O)CCC(=O)CN1CCCCCCCC1 269982a_100000039187_100000691467 [0,1,0,1,0,0|1,0,1]=4 17873 B18R1.104188 COC(=O)CCC(=O)CN1CCCCCCCC1 34a_100000039187_100000691467 [0,1,0,1,0,0|1,0,1]=4 17874 B18R1.119270 C=C1C[C@H](N(C1)CCCCCCCC)C(=O)OC 2230a_100025771018_100000210759 [0,1,0,1,0,0|1,0,1]=4 17875 B18R1.119270 CCCCCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100000210759 [0,1,0,1,0,0|1,0,0]=3 17876 B18R1.119270 CCCCCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100000210759 [0,1,0,1,0,0|1,0,0]=3 17877 B18R1.119270 CCCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100000210759 [0,1,0,1,0,0|1,0,0]=3 17878 B18R1.119270 CCCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100000210759 [0,1,0,1,0,0|1,0,0]=3 17879 B18R1.119270 CCCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100000210759 [0,1,0,1,0,0|1,0,0]=3 17880 B18R1.119270 COC(=O)[C@@H]1C[C@@H](CN1CCCCCCCO)F 2230a_100000724535_100000760002 [0,1,0,1,0,0|2,0,0]=4 17881 B18R1.119270 COC(=O)[C@@H]1C[C@@H](CN1CCCCCCCO)F 269982a_100000724535_100000760002 [0,1,0,1,0,0|2,0,0]=4 17882 B18R1.119270 COC(=O)[C@@H]1C[C@@H](CN1CCCCCCCO)F 34a_100000724535_100000760002 [0,1,0,1,0,0|2,0,0]=4 17883 B18R1.119270 COC(=O)[C@@H]1C[C@H](CN1CCCCCCCO)O 2230a_100000753705_100000760002 [0,1,0,1,0,0|2,0,0]=4 17884 B18R1.119270 COC(=O)[C@@H]1C[C@H](CN1CCCCCCCO)O 269982a_100000753705_100000760002 [0,1,0,1,0,0|2,0,0]=4 17885 B18R1.119270 COCCCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 2230a_100000753705_100011998445 [0,1,0,1,0,0|2,0,0]=4 17886 B18R1.119270 COCCCCCCN1C[C@@H](C[C@H]1C(=O)OC)O 269982a_100000753705_100011998445 [0,1,0,1,0,0|2,0,0]=4 17887 B18R1.119270 COCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 2230a_100000724535_100011998445 [0,1,0,1,0,0|2,0,0]=4 17888 B18R1.119270 COCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 269982a_100000724535_100011998445 [0,1,0,1,0,0|2,0,0]=4 17889 B18R1.119270 COCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F 34a_100000724535_100011998445 [0,1,0,1,0,0|2,0,0]=4 17890 B18R1.244052 COC(=O)CCC(=O)CNCC1CCCCCC1 2230a_100015204231_100000691467 [0,1,0,1,0,0|1,0,1]=4 17891 B18R1.244052 COC(=O)CCC(=O)CNCC1CCCCCC1 34a_100015204231_100000691467 [0,1,0,1,0,0|1,0,1]=4 17892 B18R1.244052 COC(=O)CCC(=O)COCC1CCCCCC1 34a_100000699130_100000691467 [0,1,0,1,0,0|1,0,1]=4 17893 B18R1.244052 COC(=O)CCC(=O)COCC1CCCCCC1 7a_100000699130_100000691467 [0,1,0,1,0,0|1,0,1]=4 17894 B18R1.244052 COC(=O)CCC(=O)CSCC1CCCCCC1 62a_100000691467_200000696569 [0,1,0,1,0,0|1,0,1]=4 17895 B18R1.244052 COC(=O)CCC(=O)CSCC1CCCCCC1 62a_200000696569_100000691467 [0,1,0,1,0,0|1,0,1]=4 17896 B18R1.244052 COC(=O)CCC(=O)NCCC1CCCCCC1 11a_100011532351_100000187943 [0,1,0,1,0,0|1,0,1]=4 17897 B18R1.244052 COC(=O)CCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000187943 [0,1,0,1,0,0|1,0,1]=4 17898 B18R1.244052 COC(=O)CCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000187943 [0,1,0,1,0,0|1,0,1]=4 17899 B18R1.244052 COC(=O)CCC(=O)NCCC1CCCCCC1 527a_100011532351_100000187943 [0,1,0,1,0,0|1,0,1]=4 17900 B18R1.244052 COC(=O)CCN(C)CCCN1CCCCCC1 269982a_200000231118_100000204255 [0,1,0,1,0,0|2,0,0]=4 17901 B18R1.481876 CCCCCCCCCOC1(CCC(=O)CC1)C 34a_100012184276_100011214924 [0,1,0,1,0,0|2,0,0]=4 17902 B18R1.481876 CCCCCCCCCOC1(CCC(=O)CC1)C 7a_100012184276_100000210328 [0,1,0,1,0,0|2,0,0]=4 17903 B18R1.769 COC(=O)CC(C)NCCCN1CCCCC1C 34a_100000212276_100009817358 [0,1,0,1,0,0|2,0,0]=4 17904 B18R1.769 COC(=O)CC(C)OCCCN1CCCCC1C 34a_100000213889_100009817358 [0,1,0,1,0,0|2,0,0]=4 17905 B18R1.769 COC(=O)CC(C)OCCCN1CCCCC1C 7a_100000213889_100009817358 [0,1,0,1,0,0|2,0,0]=4 17906 B18R1.769 COC(=O)C[C@@H](O)CNCCN1CCCCC1C 34a_100000739827_100000754131 [0,1,0,1,0,0|2,0,0]=4 17907 B18R1.769 COC(=O)C[C@@H](O)COCCN1CCCCC1C 34a_100011305533_100000754131 [0,1,0,1,0,0|2,0,0]=4 17908 B18R1.769 COC(=O)C[C@@H](O)CSCCC1CCCCN1C 62a_100000211948_100000754131 [0,1,0,1,0,0|2,0,0]=4 17909 B18R1.769 COC(=O)C[C@@H](O)CSCCC1CCCCN1C 62a_100000754131_100000211948 [0,1,0,1,0,0|2,0,0]=4 17910 B18R1.803 COC(=O)CC(=O)CCCCCN1CCCCC1 1458a_100012051570_100000747449 [0,1,0,1,0,0|1,0,1]=4 17911 B18R1.803 COC(=O)CC(=O)CSCCCC1CCCCC1 62a_100000210525_100011713725 [0,1,0,1,0,0|1,0,1]=4 17912 B18R1.803 COC(=O)CC(=O)CSCCCC1CCCCC1 62a_100011713725_100000210525 [0,1,0,1,0,0|1,0,1]=4 17913 B18R1.803 COC(=O)CC(C)NCCCOC1CCCCC1 34a_100000205933_100009817358 [0,1,0,1,0,0|2,0,0]=4 17914 B18R1.803 COC(=O)CC(C)OCCCCC1CCCCC1 34a_100011215267_100009817358 [0,1,0,1,0,0|1,0,0]=3 17915 B18R1.803 COC(=O)CC(C)OCCCCC1CCCCC1 7a_100011215267_100009817358 [0,1,0,1,0,0|1,0,0]=3 17916 B18R1.803 COC(=O)CC(C)OCCCCC1CCNCC1 34a_100016989291_100009817358 [0,1,0,1,0,0|2,0,0]=4 17917 B18R1.803 COC(=O)C[C@@H](O)CNCCCC1CCCCC1 34a_100011211642_100000754131 [0,1,0,1,0,0|1,0,0]=3 17918 B18R1.803 COC(=O)C[C@@H](O)CNCCOC1CCCCC1 34a_100015206981_100000754131 [0,1,0,1,0,0|2,0,0]=4 17919 B18R1.803 COC(=O)C[C@@H](O)COCCCC1CCCCC1 34a_100000198086_100000754131 [0,1,0,1,0,0|1,0,0]=3 17920 B18R1.803 COC(=O)C[C@@H](O)COCCCC1CCCCC1 7a_100000198086_100000754131 [0,1,0,1,0,0|1,0,0]=3 17921 B18R1.803 COC(=O)C[C@@H](O)COCCCC1CCCCN1 34a_100011934581_100000754131 [0,1,0,1,0,0|2,0,0]=4 17922 B18R1.803 COC(=O)C[C@@H](O)COCCCC1CCCNC1 34a_100150707839_100000754131 [0,1,0,1,0,0|2,0,0]=4 17923 B18R1.803 COC(=O)C[C@@H](O)COCCCC1CCNCC1 34a_100016988962_100000754131 [0,1,0,1,0,0|2,0,0]=4 17924 B18R1.803 COC(=O)C[C@@H](O)COCCCN1CCCCC1 34a_100000212458_100000754131 [0,1,0,1,0,0|2,0,0]=4 17925 B18R1.803 COC(=O)C[C@@H](O)COCCNC1CCCCC1 34a_100000200466_100000754131 [0,1,0,1,0,0|2,0,0]=4 17926 B18R1.803 COC(=O)C[C@@H](O)COCCOC1CCCCC1 34a_100011249652_100000754131 [0,1,0,1,0,0|2,0,0]=4 17927 B18R1.803 COC(=O)C[C@@H](O)COCCOC1CCCCC1 7a_100011249652_100000754131 [0,1,0,1,0,0|2,0,0]=4 17928 B18R1.803 COC(=O)C[C@@H](O)CSCCCC1CCCCC1 62a_100000754131_100011713725 [0,1,0,1,0,0|1,0,0]=3 17929 B18R1.803 COC(=O)C[C@@H](O)CSCCCC1CCCCC1 62a_100011713725_100000754131 [0,1,0,1,0,0|1,0,0]=3 17930 B18R1.803 COC(=O)C[C@@H](O)CSCCCN1CCCCC1 62a_100000754131_100000007876 [0,1,0,1,0,0|2,0,0]=4 17931 B18R1.803 COC(=O)C[C@@H](O)CSCCCN1CCCCC1 62a_100132302099_100000754131 [0,1,0,1,0,0|2,0,0]=4 17932 B18R1.803 COC(=O)C[C@@H](O)CSCCOC1CCCCC1 62a_100000754131_100011211530 [0,1,0,1,0,0|2,0,0]=4 17933 B18R1.803 COC(=O)C[C@@H](O)CSCCOC1CCCCC1 62a_100011211530_100000754131 [0,1,0,1,0,0|2,0,0]=4 17934 B18R1.817 COC(=O)C[C@@H](O)CNCCCOC1CCCC1 34a_100000747560_100000754131 [0,1,0,1,0,0|2,0,0]=4 17935 B18R1.7315 CCC1CCCCN1CCNC(C)CC(=O)OC 2230a_100000755458_100009817358 [0,1,0,1,0,0|2,0,0]=4 17936 B18R1.7315 CCC1CCCCN1CCNC(C)CC(=O)OC 34a_100000755458_100009817358 [0,1,0,1,0,0|2,0,0]=4 17937 B18R1.7315 CCN1CCCCC1CNC[C@H](O)CC(=O)OC 34a_100000754393_100000754131 [0,1,0,1,0,0|2,0,0]=4 17938 B18R1.7315 CCN1CCCCC1COC[C@H](O)CC(=O)OC 34a_100000225091_100000754131 [0,1,0,1,0,0|2,0,0]=4 17939 B18R1.7315 CCN1CCCCC1COC[C@H](O)CC(=O)OC 7a_100000225091_100000754131 [0,1,0,1,0,0|2,0,0]=4 17940 B18R1.13682 CCCCCCC1CCCC1N(C)CC(=O)NC 270004a_100000189611_100000189428 [0,1,0,1,0,0|2,0,0]=4 17941 B18R1.13682 CCCCCCC1CCCC1N(C)CC(=O)OC 270004a_100000198492_100000189428 [0,1,0,1,0,0|1,0,0]=3 17942 B18R1.23678 CCCC1CCCCC1OC[C@H](O)CC(=O)OC 34a_100011217265_100000754131 [0,1,0,1,0,0|1,0,0]=3 17943 B18R1.23678 CCCC1CCCCC1OC[C@H](O)CC(=O)OC 7a_100011217265_100000754131 [0,1,0,1,0,0|1,0,0]=3 17944 B18R1.24134 CCCN1CCCC1COC[C@H](O)CC(=O)OC 34a_200000694710_100000754131 [0,1,0,1,0,0|2,0,0]=4 17945 B18R1.24134 CCCN1CCCC1COC[C@H](O)CC(=O)OC 7a_200000694710_100000754131 [0,1,0,1,0,0|2,0,0]=4 17946 B18R1.28350 COC(=O)CC(C)OCCCN1CCCCCC1 34a_100102886287_100009817358 [0,1,0,1,0,0|2,0,0]=4 17947 B18R1.28350 COC(=O)CC(C)OCCCN1CCCCCC1 7a_100102886287_100009817358 [0,1,0,1,0,0|2,0,0]=4 17948 B18R1.28350 COC(=O)C[C@@H](O)CNCCC1CCCCCC1 34a_100011532351_100000754131 [0,1,0,1,0,0|1,0,0]=3 17949 B18R1.28350 COC(=O)C[C@@H](O)COCCN1CCCCCC1 34a_100000238007_100000754131 [0,1,0,1,0,0|2,0,0]=4 17950 B18R1.28350 COC(=O)C[C@@H](O)CSCCN1CCCCCC1 62a_100000722644_100000754131 [0,1,0,1,0,0|2,0,0]=4 17951 B18R1.28350 COC(=O)C[C@@H](O)CSCCN1CCCCCC1 62a_100000754131_100000722644 [0,1,0,1,0,0|2,0,0]=4 17952 B18R1.28556 COC(=O)CC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000211351 [0,1,0,1,0,0|1,0,1]=4 17953 B18R1.28556 COC(=O)CC(C)NCCC1CCCCCCC1 2230a_100011532352_100009817358 [0,1,0,1,0,0|1,0,0]=3 17954 B18R1.28556 COC(=O)CC(C)NCCC1CCCCCCC1 34a_100011532352_100009817358 [0,1,0,1,0,0|1,0,0]=3 17955 B18R1.28556 COC(=O)C[C@@H](O)COCC1CCCCCCC1 34a_100011216312_100000754131 [0,1,0,1,0,0|1,0,0]=3 17956 B18R1.28556 COC(=O)C[C@@H](O)COCC1CCCCCCC1 7a_100011216312_100000754131 [0,1,0,1,0,0|1,0,0]=3 17957 B18R1.34999 CCCCCCCCCCNC1CC(=O)N(C1)C 2230a_100000748898_100000210320 [0,1,0,1,0,0|2,0,0]=4 17958 B18R1.34999 CCCCCCCCCCNC1CC(=O)N(C1)C 34a_100000748898_100000210320 [0,1,0,1,0,0|2,0,0]=4 17959 B18R1.34999 CCCCCCCCCOCC1CC(=O)N(C1)C 34a_100015185614_100011214924 [0,1,0,1,0,0|2,0,0]=4 17960 B18R1.36298 COC(=O)C[C@@H](O)CN1CCCCC1CCCO 34a_100011934581_100000754131 [0,1,0,1,0,0|2,0,0]=4 17961 B18R1.36298 COCCC1CCCCN1C[C@H](O)CC(=O)OC 34a_100015186528_100000754131 [0,1,0,1,0,0|2,0,0]=4 17962 B18R1.41202 COCCCC1CCCCN1C(C)CC(=O)OC 2230a_100011804088_100009817358 [0,1,0,1,0,0|2,0,0]=4 17963 B18R1.41202 COCCCC1CCCCN1C(C)CC(=O)OC 269982a_100011804088_100009817358 [0,1,0,1,0,0|2,0,0]=4 17964 B18R1.41202 COCCCC1CCCCN1C(C)CC(=O)OC 34a_100011804088_100009817358 [0,1,0,1,0,0|2,0,0]=4 17965 B18R1.41515 CCCCCCCCCCCC(=O)C1CCC1=O 1458a_100000210736_100009892977 [0,1,0,1,0,0|1,0,1]=4 17966 B18R1.375 CCCCCCC1CCCC1NCC(=O)N(C)C 270004a_100015183351_100000189428 [0,1,0,1,0,0|2,0,0]=4 17967 B18R1.955 CCCCC1CCCC1NCCCC(=O)N(C)C 269862a_200000744827_100000750825 [0,1,0,1,0,0|2,0,0]=4 17968 B18R1.955 CCCCC1CCCC1NCCCC(=O)N(C)C 270004a_200000744827_100000750825 [0,1,0,1,0,0|2,0,0]=4 17969 B18R1.4457 CN(C)C(=O)CCCCNCCCC1CCCC1 34a_100000736752_100000752486 [0,1,0,1,0,0|2,0,0]=4 17970 B18R1.4457 CN(C)C(=O)CCCCOCCCC1CCCC1 34a_100011215328_100000752486 [0,1,0,1,0,0|2,0,0]=4 17971 B18R1.4457 CN(C)C(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000752486 [0,1,0,1,0,0|2,0,0]=4 17972 B18R1.4457 CN(C)C(=O)CCCCSCCCC1CCCC1 62a_100000752486_100011713738 [0,1,0,1,0,0|2,0,0]=4 17973 B18R1.4457 CN(C)C(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000752486 [0,1,0,1,0,0|2,0,0]=4 17974 B18R1.4475 CN(C)C(=O)CCCCNCCC1CCCCC1 34a_100000738074_100000752486 [0,1,0,1,0,0|2,0,0]=4 17975 B18R1.4475 CN(C)C(=O)CCCCOCCC1CCCCC1 34a_100011217863_100000752486 [0,1,0,1,0,0|2,0,0]=4 17976 B18R1.4475 CN(C)C(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000752486 [0,1,0,1,0,0|2,0,0]=4 17977 B18R1.4475 CN(C)C(=O)CCCCSCCC1CCCCC1 62a_100000752486_100012355289 [0,1,0,1,0,0|2,0,0]=4 17978 B18R1.4475 CN(C)C(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000752486 [0,1,0,1,0,0|2,0,0]=4 17979 B18R1.4475 CN(C)C(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100000737642 [0,1,0,1,0,0|2,0,0]=4 17980 B18R1.4475 CN(C)C(=O)CCCNCCCC1CCCCC1 2230a_200000744827_100011713725 [0,1,0,1,0,0|2,0,0]=4 17981 B18R1.4475 CN(C)C(=O)CCCOCCCC1CCCCC1 7a_100000198086_100000737642 [0,1,0,1,0,0|2,0,0]=4 17982 B18R1.4475 CN(C)C(=O)CCCSCCCC1CCCCC1 62a_100000737642_100011713725 [0,1,0,1,0,0|2,0,0]=4 17983 B18R1.4475 CN(C)C(=O)CCCSCCCC1CCCCC1 62a_100011713725_100000737642 [0,1,0,1,0,0|2,0,0]=4 17984 B18R1.4475 CN(C)C(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737620 [0,1,0,1,0,0|2,0,0]=4 17985 B18R1.4936 CCCC1CCCCC1NCCCC(=O)N(C)C 269862a_200000744827_100011218038 [0,1,0,1,0,0|2,0,0]=4 17986 B18R1.4936 CCCC1CCCCC1NCCCC(=O)N(C)C 270004a_200000744827_100011218038 [0,1,0,1,0,0|2,0,0]=4 17987 B18R1.4936 CCCC1CCCCC1OCCCC(=O)N(C)C 7a_100011217265_100000737642 [0,1,0,1,0,0|2,0,0]=4 17988 B18R1.4936 CCCC1CCCCN1CCCCC(=O)N(C)C 269982a_100000701414_100000752486 [0,1,0,1,0,0|2,0,0]=4 17989 B18R1.4936 CCCC1CCCCN1CCCCC(=O)N(C)C 34a_100000701414_100000752486 [0,1,0,1,0,0|2,0,0]=4 17990 B18R1.8768 CCCCCCCCN1CCC[C@H]1C(=O)N(C)C 2230a_100020603401_100000210759 [0,1,0,1,0,0|2,0,0]=4 17991 B18R1.8768 CCCCCCCCN1CCC[C@H]1C(=O)N(C)C 34a_100020603401_100000210759 [0,1,0,1,0,0|2,0,0]=4 17992 B18R1.21937 CCCCCC1CCCC1NCCC(=O)N(C)C 269862a_100000738053_200000198059 [0,1,0,1,0,0|2,0,0]=4 17993 B18R1.21937 CCCCCC1CCCC1NCCC(=O)N(C)C 270004a_100000738053_200000198059 [0,1,0,1,0,0|2,0,0]=4 17994 B18R1.37992 CCC1CCCCC1OCCCCC(=O)N(C)C 34a_100000210738_100000752486 [0,1,0,1,0,0|2,0,0]=4 17995 B18R1.37992 CCC1CCCCC1OCCCCC(=O)N(C)C 7a_100000210738_100000752486 [0,1,0,1,0,0|2,0,0]=4 17996 B18R1.52682 CN(C)C(=O)CCCCNCC1CCCCCC1 34a_100015204231_100000752486 [0,1,0,1,0,0|2,0,0]=4 17997 B18R1.52682 CN(C)C(=O)CCCCOCC1CCCCCC1 34a_100000699130_100000752486 [0,1,0,1,0,0|2,0,0]=4 17998 B18R1.52682 CN(C)C(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000752486 [0,1,0,1,0,0|2,0,0]=4 17999 B18R1.52682 CN(C)C(=O)CCCCSCC1CCCCCC1 62a_100000752486_200000696569 [0,1,0,1,0,0|2,0,0]=4 18000 B18R1.52682 CN(C)C(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000752486 [0,1,0,1,0,0|2,0,0]=4 18001 B18R1.52682 CN(C)C(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100000737642 [0,1,0,1,0,0|2,0,0]=4 18002 B18R1.52728 C=C(C)C(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000185857 [0,1,0,1,0,0|2,0,0]=4 18003 B18R1.52728 C=C(C)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000185857 [0,1,0,1,0,0|2,0,0]=4 18004 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210198 [0,1,0,1,0,0|2,0,0]=4 18005 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210198 [0,1,0,1,0,0|2,0,0]=4 18006 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210198 [0,1,0,1,0,0|2,0,0]=4 18007 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000210198 [0,1,0,1,0,0|2,0,0]=4 18008 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000062450 [0,1,0,1,0,0|2,0,0]=4 18009 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000062450 [0,1,0,1,0,0|2,0,0]=4 18010 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000062450 [0,1,0,1,0,0|2,0,0]=4 18011 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000062450 [0,1,0,1,0,0|2,0,0]=4 18012 B18R1.52728 CN(C)C(=O)NC1CCCCCCCCCCC1 2708a_100011194316_100102631434 [0,1,0,1,0,0|2,0,0]=4 18013 B18R1.52728 C[C@@H](O)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000717761 [0,1,0,1,0,0|2,0,0]=4 18014 B18R1.52728 C[C@H](O)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_217856618621 [0,1,0,1,0,0|2,0,0]=4 18015 B18R1.52728 C[C@H](O)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_217856618621 [0,1,0,1,0,0|2,0,0]=4 18016 B18R1.52838 CN(C)C(=O)CCCCNC1CCCCCCC1 34a_100000211152_100000752486 [0,1,0,1,0,0|2,0,0]=4 18017 B18R1.52838 CN(C)C(=O)CCCCOC1CCCCCCC1 34a_100000210054_100000752486 [0,1,0,1,0,0|2,0,0]=4 18018 B18R1.52838 CN(C)C(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000752486 [0,1,0,1,0,0|2,0,0]=4 18019 B18R1.52838 CN(C)C(=O)CCCOCC1CCCCCCC1 7a_100011216312_100000737642 [0,1,0,1,0,0|2,0,0]=4 18020 B18R1.52838 CN(C)C(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737620 [0,1,0,1,0,0|2,0,0]=4 18021 B18R1.177008 CN(C)C(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000752486 [0,1,0,1,0,0|2,0,0]=4 18022 B18R1.177008 CN(C)C(=O)CCCCN1CCCCCCCC1 34a_100000039187_100000752486 [0,1,0,1,0,0|2,0,0]=4 18023 B18R1.177008 CN(C)C(=O)CCCNC1CCCCCCCC1 270004a_200000744827_100000038600 [0,1,0,1,0,0|2,0,0]=4 18024 B18R1.1093 CNC(=O)C1CCCCN1CCCCCC(C)C 2230a_100011209383_100000210682 [0,1,0,1,0,0|2,0,0]=4 18025 B18R1.1093 CNC(=O)C1CCCCN1CCCCCC(C)C 269982a_100011209383_100000210682 [0,1,0,1,0,0|2,0,0]=4 18026 B18R1.1093 CNC(=O)C1CCCCN1CCCCCC(C)C 34a_100011209383_100000210682 [0,1,0,1,0,0|2,0,0]=4 18027 B18R1.1093 COC(=O)C1CCCCN1CCCCCC(C)C 2230a_100000734855_100000210682 [0,1,0,1,0,0|1,0,0]=3 18028 B18R1.1093 COC(=O)C1CCCCN1CCCCCC(C)C 269982a_100000734855_100000210682 [0,1,0,1,0,0|1,0,0]=3 18029 B18R1.1093 COC(=O)C1CCCCN1CCCCCC(C)C 34a_100000734855_100000210682 [0,1,0,1,0,0|1,0,0]=3 18030 B18R1.1093 COC(=O)C1CNCCC1OCCCCC(C)C 34a_200103168510_100011216152 [0,1,0,1,0,0|2,0,0]=4 18031 B18R1.1093 COC(=O)C1COCCN1CCCCCC(C)C 2230a_100000765174_100000210682 [0,1,0,1,0,0|2,0,0]=4 18032 B18R1.1093 COC(=O)C1COCCN1CCCCCC(C)C 34a_100000765174_100000210682 [0,1,0,1,0,0|2,0,0]=4 18033 B18R1.1093 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCC(=O)C 34a_100015709673_100009817362 [0,1,0,1,0,0|1,0,1]=4 18034 B18R1.1093 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCC(=O)C 7a_100015709673_100000735457 [0,1,0,1,0,0|1,0,1]=4 18035 B18R1.1093 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCC(C)C 34a_100015709673_100011216152 [0,1,0,1,0,0|1,0,0]=3 18036 B18R1.1093 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCC(C)C 7a_100015709673_100011216152 [0,1,0,1,0,0|1,0,0]=3 18037 B18R1.2223 COC(=O)CCCN1CCCCC1CCN(C)C 269982a_100000243220_100011218270 [0,1,0,1,0,0|2,0,0]=4 18038 B18R1.4857 COC(=O)CC1COCCN1CCCCC(C)C 2230a_100000731486_100011216152 [0,1,0,1,0,0|2,0,0]=4 18039 B18R1.4857 COC(=O)CC1COCCN1CCCCC(C)C 34a_100000731486_100011216152 [0,1,0,1,0,0|2,0,0]=4 18040 B18R1.4865 COC(=O)C[C@H]1CCCN1CCCCCC(C)C 2230a_100025726698_100000210682 [0,1,0,1,0,0|1,0,0]=3 18041 B18R1.4865 COC(=O)C[C@H]1CCCN1CCCCCC(C)C 269982a_100025726698_100000210682 [0,1,0,1,0,0|1,0,0]=3 18042 B18R1.4865 COC(=O)C[C@H]1CCCN1CCCCCC(C)C 34a_100025726698_100000210682 [0,1,0,1,0,0|1,0,0]=3 18043 B18R1.9219 CC(C)CCCCCCCOCC1COC(=O)O1 34a_200000210741_100000073702 [0,1,0,1,0,0|2,0,0]=4 18044 B18R1.9219 CC(C)CCCCCCCOC[C@H]1COC(=O)N1 34a_200000210741_100015307671 [0,1,0,1,0,0|2,0,0]=4 18045 B18R1.9219 CC(C)CCCCCCCOC[C@H]1COC(=O)N1 7a_200000210741_100015307671 [0,1,0,1,0,0|2,0,0]=4 18046 B18R1.17691 CC(C)CCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210682 [0,1,0,1,0,0|2,0,0]=4 18047 B18R1.17691 CC(C)CCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210682 [0,1,0,1,0,0|2,0,0]=4 18048 B18R1.17819 CC(C)CCCCCCCOCCC1CCC1=O 7a_200000210741_200016118888 [0,1,0,1,0,0|2,0,0]=4 18049 B18R1.32939 COC(=O)C1CCCC1OCCCCCC(C)C 34a_200000081814_100000210682 [0,1,0,1,0,0|1,0,0]=3 18050 B18R1.32939 COC(=O)C1CCCC1OCCCCCC(C)C 7a_200000081814_100000210682 [0,1,0,1,0,0|1,0,0]=3 18051 B18R1.33008 COC(=O)CCCCCCCN1CCCC1(C)C 2230a_100000761399_100010004213 [0,1,0,1,0,0|1,0,0]=3 18052 B18R1.33008 COC(=O)CCCCCCCN1CCCC1(C)C 269982a_100000761399_100010004213 [0,1,0,1,0,0|1,0,0]=3 18053 B18R1.33008 COC(=O)CCCCCCCN1CCCC1(C)C 34a_100000761399_100010004213 [0,1,0,1,0,0|1,0,0]=3 18054 B18R1.33008 COC(=O)CCCCCCCN1CCSC1(C)C 2230a_100011217261_100010004213 [0,1,0,1,0,0|2,0,0]=4 18055 B18R1.33008 COC(=O)CCCCCCCN1CCSC1(C)C 269982a_100011217261_100010004213 [0,1,0,1,0,0|2,0,0]=4 18056 B18R1.33008 COC(=O)CCCCCCCN1CCSC1(C)C 34a_100011217261_100010004213 [0,1,0,1,0,0|2,0,0]=4 18057 B18R1.33008 COC(=O)CCCCCCCN1COCC1(C)C 2230a_100000043020_100010004213 [0,1,0,1,0,0|2,0,0]=4 18058 B18R1.33008 COC(=O)CCCCCCCN1COCC1(C)C 269982a_100000043020_100010004213 [0,1,0,1,0,0|2,0,0]=4 18059 B18R1.33008 COC(=O)CCCCCCNC1CCCC1(F)F 2230a_100000767123_100009815986 [0,1,0,1,0,0|2,0,0]=4 18060 B18R1.33008 COC(=O)CCCCCCNC1CCCC1(F)F 34a_100000767123_100009815986 [0,1,0,1,0,0|2,0,0]=4 18061 B18R1.33008 COC(=O)CCCCCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100009815986 [0,1,0,1,0,0|1,0,0]=3 18062 B18R1.33008 COC(=O)CCCCCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100009815986 [0,1,0,1,0,0|1,0,0]=3 18063 B18R1.33008 COC(=O)CCCCCCOC1CCCC1(C)C 34a_100000726220_100009815986 [0,1,0,1,0,0|1,0,0]=3 18064 B18R1.33008 COC(=O)CCCCCCOC1CCCC1(C)C 7a_100000726220_100009815986 [0,1,0,1,0,0|1,0,0]=3 18065 B18R1.33008 COC(=O)CCCCCCOC1CCCC1(F)F 34a_100009863599_100119073726 [0,1,0,1,0,0|2,0,0]=4 18066 B18R1.33008 COC(=O)CCCCCCSC1CCCC1(F)F 62a_100009815986_100119073726 [0,1,0,1,0,0|2,0,0]=4 18067 B18R1.33008 COC(=O)CCCCCCSC1CCCC1(F)F 62a_100119073726_100009815986 [0,1,0,1,0,0|2,0,0]=4 18068 B18R1.33008 COC(=O)CCCCNCCN1CCCC1(C)C 2230a_100015204988_100000204269 [0,1,0,1,0,0|2,0,0]=4 18069 B18R1.33148 COC(=O)CCCCN1CCCCCC1C(C)C 2230a_100000697956_100000204269 [0,1,0,1,0,0|1,0,0]=3 18070 B18R1.33148 COC(=O)CCCCN1CCCCCC1C(C)C 269982a_100000697956_100000204269 [0,1,0,1,0,0|1,0,0]=3 18071 B18R1.33148 COC(=O)CCCCN1CCCCCC1C(C)C 34a_100000697956_100000204269 [0,1,0,1,0,0|1,0,0]=3 18072 B18R1.33148 COC(=O)COCCN1CCCCCC1C(C)C 2230a_100000697956_100000090808 [0,1,0,1,0,0|2,0,0]=4 18073 B18R1.33148 COC(=O)COCCN1CCCCCC1C(C)C 34a_100000697956_100000090808 [0,1,0,1,0,0|2,0,0]=4 18074 B18R1.33500 COC(=O)CCCCN1CCCCC1CN(C)C 2230a_100000746231_100000204269 [0,1,0,1,0,0|2,0,0]=4 18075 B18R1.33500 COC(=O)CCCCN1CCCCC1CN(C)C 269982a_100000746231_100000204269 [0,1,0,1,0,0|2,0,0]=4 18076 B18R1.33500 COC(=O)CCCCN1CCOCC1CC(C)C 2230a_100000755734_100000204269 [0,1,0,1,0,0|2,0,0]=4 18077 B18R1.33500 COC(=O)CCCCN1CCOCC1CC(C)C 269982a_100000755734_100000204269 [0,1,0,1,0,0|2,0,0]=4 18078 B18R1.33500 COC(=O)CCCCN1CCOCC1CC(C)C 34a_100000755734_100000204269 [0,1,0,1,0,0|2,0,0]=4 18079 B18R1.33500 COC(=O)CCCOC1CCCCC1NC(C)C 34a_100000692356_100000742333 [0,1,0,1,0,0|2,0,0]=4 18080 B18R1.33500 COC(=O)CNCCC1CCCCN1CC(C)C 2230a_200011919211_100000747449 [0,1,0,1,0,0|2,0,0]=4 18081 B18R1.33500 COC(=O)CNCCC1CCCCN1CC(C)C 34a_200011919211_100000747449 [0,1,0,1,0,0|2,0,0]=4 18082 B18R1.33923 COC(=O)CCCCCN1CCCCC1C(C)C 2230a_100000757267_100009816466 [0,1,0,1,0,0|1,0,0]=3 18083 B18R1.33923 COC(=O)CCCCCN1CCCCC1C(C)C 269982a_100000757267_100009816466 [0,1,0,1,0,0|1,0,0]=3 18084 B18R1.33923 COC(=O)CCCCCN1CCCCC1C(C)C 34a_100000757267_100009816466 [0,1,0,1,0,0|1,0,0]=3 18085 B18R1.33923 COC(=O)CCCCCN1CCOC[C@@H]1C(C)C 2230a_100025712635_100009816466 [0,1,0,1,0,0|2,0,0]=4 18086 B18R1.33923 COC(=O)CCCCCN1CCOC[C@@H]1C(C)C 269982a_100025712635_100009816466 [0,1,0,1,0,0|2,0,0]=4 18087 B18R1.33923 COC(=O)CCCCCN1CCOC[C@@H]1C(C)C 34a_100025712635_100009816466 [0,1,0,1,0,0|2,0,0]=4 18088 B18R1.33923 COC(=O)CCCCOC1CCCCC1C(C)C 34a_100011709184_100000204269 [0,1,0,1,0,0|1,0,0]=3 18089 B18R1.33923 COC(=O)CCCCOC1CCCCC1C(C)C 7a_100011709184_100000204269 [0,1,0,1,0,0|1,0,0]=3 18090 B18R1.33923 COC(=O)CCNCCC1CCCCN1C(C)C 2230a_100011919236_100000204255 [0,1,0,1,0,0|2,0,0]=4 18091 B18R1.33923 COC(=O)CCNCCC1CCCCN1C(C)C 34a_100011919236_100000742370 [0,1,0,1,0,0|2,0,0]=4 18092 B18R1.33923 COC(=O)COCCOC1CCCCC1C(C)C 34a_100011709184_100000090808 [0,1,0,1,0,0|2,0,0]=4 18093 B18R1.33923 COC(=O)COCCOC1CCCCC1C(C)C 7a_100011709184_100000090808 [0,1,0,1,0,0|2,0,0]=4 18094 B18R1.33927 COC(=O)CCCCCN1CCCC1CC(C)C 2230a_100000748429_100009816466 [0,1,0,1,0,0|1,0,0]=3 18095 B18R1.33927 COC(=O)CCCCCN1CCCC1CC(C)C 269982a_100000748429_100009816466 [0,1,0,1,0,0|1,0,0]=3 18096 B18R1.33927 COC(=O)CCCCCN1CCCC1CC(C)C 34a_100000748429_100009816466 [0,1,0,1,0,0|1,0,0]=3 18097 B18R1.33927 COC(=O)CCCCCN1CCC[C@@H]1CN(C)C 269982a_200020645772_100009816466 [0,1,0,1,0,0|2,0,0]=4 18098 B18R1.34255 COC(=O)CCCCCCN1CCOCC1(C)C 2230a_100000724681_100009815986 [0,1,0,1,0,0|2,0,0]=4 18099 B18R1.34255 COC(=O)CCCCCCN1CCOCC1(C)C 269982a_100000724681_100009815986 [0,1,0,1,0,0|2,0,0]=4 18100 B18R1.34255 COC(=O)CCCCCCN1CCOCC1(C)C 34a_100000724681_100009815986 [0,1,0,1,0,0|2,0,0]=4 18101 B18R1.34255 COC(=O)CCCCCNC1CCCCC1(F)F 2230a_100000686509_100009816466 [0,1,0,1,0,0|2,0,0]=4 18102 B18R1.34255 COC(=O)CCCCCNC1CCCCC1(F)F 34a_100000686509_100009816466 [0,1,0,1,0,0|2,0,0]=4 18103 B18R1.34255 COC(=O)CCCCCOC1CCCCC1(F)F 34a_100000074720_200009832135 [0,1,0,1,0,0|2,0,0]=4 18104 B18R1.34255 COC(=O)CCCCCOC1CCNCC1(C)C 34a_100000709803_100009816466 [0,1,0,1,0,0|2,0,0]=4 18105 B18R1.34255 COC(=O)CCCCCSC1CCCCC1(F)F 62a_100009816466_200009832135 [0,1,0,1,0,0|2,0,0]=4 18106 B18R1.34255 COC(=O)CCCCCSC1CCCCC1(F)F 62a_200009832135_100009816466 [0,1,0,1,0,0|2,0,0]=4 18107 B18R1.34257 COC(=O)CCCCCCN1CCCC1C(C)C 2230a_100000762757_100009815986 [0,1,0,1,0,0|1,0,0]=3 18108 B18R1.34257 COC(=O)CCCCCCN1CCCC1C(C)C 269982a_100000762757_100009815986 [0,1,0,1,0,0|1,0,0]=3 18109 B18R1.34257 COC(=O)CCCCCCN1CCCC1C(C)C 34a_100000762757_100009815986 [0,1,0,1,0,0|1,0,0]=3 18110 B18R1.37196 CNC(=O)CCCN1CCCCCC1CC(C)C 2230a_100000759364_100000741757 [0,1,0,1,0,0|2,0,0]=4 18111 B18R1.37196 CNC(=O)CCCN1CCCCCC1CC(C)C 269982a_100000759364_100000741757 [0,1,0,1,0,0|2,0,0]=4 18112 B18R1.37196 CNC(=O)CCCN1CCCCCC1CC(C)C 34a_100000759364_100000741757 [0,1,0,1,0,0|2,0,0]=4 18113 B18R1.37196 COC(=O)CCCN1CCCCCC1CC(C)C 2230a_100000759364_100011218270 [0,1,0,1,0,0|1,0,0]=3 18114 B18R1.37196 COC(=O)CCCN1CCCCCC1CC(C)C 269982a_100000759364_100011218270 [0,1,0,1,0,0|1,0,0]=3 18115 B18R1.37196 COC(=O)CCCN1CCCCCC1CC(C)C 34a_100000759364_100000742333 [0,1,0,1,0,0|1,0,0]=3 18116 B18R1.240035 COC(=O)CCCCCCCCNC1CC1(F)F 2230a_100020610826_100010282707 [0,1,0,1,0,0|2,0,0]=4 18117 B18R1.240035 COC(=O)CCCCCCCCNC1CC1(F)F 34a_100020610826_100010282707 [0,1,0,1,0,0|2,0,0]=4 18118 B18R1.240035 COC(=O)CCCCCCCOCC1CC1(C)C 34a_100000728257_100010004213 [0,1,0,1,0,0|1,0,0]=3 18119 B18R1.240035 COC(=O)CCCCCCCOCC1CC1(C)C 7a_100000728257_100010004213 [0,1,0,1,0,0|1,0,0]=3 18120 B18R1.240035 COC(=O)CCCCCCCOCC1CC1(F)F 34a_100000056500_100010004213 [0,1,0,1,0,0|2,0,0]=4 18121 B18R1.240035 COC(=O)CCCCCCCOCC1CC1(F)F 34a_100011022521_100009817841 [0,1,0,1,0,0|2,0,0]=4 18122 B18R1.240035 COC(=O)CCCCCCCOCC1CC1(F)F 7a_100000056500_100010004213 [0,1,0,1,0,0|2,0,0]=4 18123 B18R1.240035 COC(=O)CCCCCCCOCC1CC1(F)F 7a_100011022521_100009817841 [0,1,0,1,0,0|2,0,0]=4 18124 B18R1.240035 COC(=O)CCCCCCCOCC1OC1(C)C 34a_200010283642_100010004213 [0,1,0,1,0,0|2,0,0]=4 18125 B18R1.240035 COC(=O)CCCCCCCOCC1OC1(C)C 7a_200010283642_100010004213 [0,1,0,1,0,0|2,0,0]=4 18126 B18R1.240035 COC(=O)CCCCCCCSCC1CC1(F)F 62a_100009817841_100010004213 [0,1,0,1,0,0|2,0,0]=4 18127 B18R1.240035 COC(=O)CCCCCCCSCC1CC1(F)F 62a_100010004213_100009817841 [0,1,0,1,0,0|2,0,0]=4 18128 B18R1.240035 COC(=O)CCCCCCOCCC1CC1(F)F 34a_100009864177_100009815986 [0,1,0,1,0,0|2,0,0]=4 18129 B18R1.240035 COC(=O)CCCCCCOCCC1CC1(F)F 7a_100009864177_100009815986 [0,1,0,1,0,0|2,0,0]=4 18130 B18R2.112 CCCC1CCCCC1NC2CCC(=O)NC2 269862a_100000748762_100011218038 [0,0,0,2,0,0|2,0,0]=4 18131 B18R2.112 CCCC1CCCCC1NC2CCC(=O)NC2 270004a_100000748762_100011218038 [0,0,0,2,0,0|2,0,0]=4 18132 B18R2.270 O=C1CCC(CC1)COCCC2CCCCC2 34a_100000062911_100011209188 [0,0,0,2,0,0|2,0,0]=4 18133 B18R2.270 O=C1CCC(CC1)OCCCC2CCCCC2 34a_100000764474_100011713725 [0,0,0,2,0,0|2,0,0]=4 18134 B18R2.270 O=C1CCC(CC1)OCCCC2CCCCC2 7a_100000764474_100011713725 [0,0,0,2,0,0|2,0,0]=4 18135 B18R2.270 O=C1CCC(CN1)NCCCC2CCCCC2 2230a_100000748762_100011713725 [0,0,0,2,0,0|2,0,0]=4 18136 B18R2.270 O=C1CCC(CN1)NCCCC2CCCCC2 34a_100000748762_100011713725 [0,0,0,2,0,0|2,0,0]=4 18137 B18R2.270 O=C1CCC(CN1)OCCCC2CCCCC2 34a_100000079199_100011713725 [0,0,0,2,0,0|2,0,0]=4 18138 B18R2.2658 CCCCC1CCCC1NC2CCC(=O)NC2 269862a_100000748762_100000750825 [0,0,0,2,0,0|2,0,0]=4 18139 B18R2.2658 CCCCC1CCCC1NC2CCC(=O)NC2 270004a_100000748762_100000750825 [0,0,0,2,0,0|2,0,0]=4 18140 B18R2.8990 O=C1CCC(CC1)COCCCC2CCCC2 34a_100000062911_100011713738 [0,0,0,2,0,0|2,0,0]=4 18141 B18R2.92836 O=C1CCC(CN1)NC2CCCCCCCC2 270004a_100000748762_100000038600 [0,0,0,2,0,0|2,0,0]=4 18142 B18R2.94225 O=C1CCC(CC1)COCC2CCCCCC2 34a_100000062911_200000696569 [0,0,0,2,0,0|2,0,0]=4 18143 B18R2.3922 CN1C(=O)CCCC1CNCC2CCCCC2 2230a_200010383782_100000211423 [0,0,0,2,0,0|2,0,0]=4 18144 B18R2.3922 CN1C(=O)CCCC1CNCC2CCCCC2 269862a_200010383782_100000211278 [0,0,0,2,0,0|2,0,0]=4 18145 B18R2.3922 CN1C(=O)CCCC1CNCC2CCCCC2 34a_200010383782_100000211423 [0,0,0,2,0,0|2,0,0]=4 18146 B18R2.3930 CN1C(=O)CCCC1CNCCC2CCCC2 2230a_200010383782_100000760354 [0,0,0,2,0,0|2,0,0]=4 18147 B18R2.3930 CN1C(=O)CCCC1CNCCC2CCCC2 34a_200010383782_100000760354 [0,0,0,2,0,0|2,0,0]=4 18148 B18R2.31260 CN1C(=O)CCCC1CNC2CCCCCC2 270004a_200010383782_100000210131 [0,0,0,2,0,0|2,0,0]=4 18149 B18R2.31260 CN1C(=O)CCCC1CNC2CCCCCC2 34a_200010383782_100011217769 [0,0,0,2,0,0|2,0,0]=4 18150 B18R2.39767 CC1CCCCC1NCC2CCCC(=O)N2C 269862a_200010383782_100000210921 [0,0,0,2,0,0|2,0,0]=4 18151 B18R2.39767 CC1CCCCC1NCC2CCCC(=O)N2C 270004a_200010383782_100000210921 [0,0,0,2,0,0|2,0,0]=4 18152 B18R2.106092 CCC1CCCC1NCC2CCCC(=O)N2C 269862a_200010383782_100000749056 [0,0,0,2,0,0|2,0,0]=4 18153 B18R2.106092 CCC1CCCC1NCC2CCCC(=O)N2C 270004a_200010383782_100000749056 [0,0,0,2,0,0|2,0,0]=4 18154 B18R2.2616 CCC(=O)CN1CCCCC1C2CCCCC2 269982a_100011219272_100000747405 [0,0,0,2,0,0|2,0,0]=4 18155 B18R2.2616 CCC(=O)NC1CCCCC1C2CCCCC2 11a_200011339469_100000210414 [0,0,0,2,0,0|2,0,0]=4 18156 B18R2.2616 CCC(=O)NC1CCCCC1C2CCCCC2 1626a_200011339469_100000210414 [0,0,0,2,0,0|2,0,0]=4 18157 B18R2.2616 CCC(=O)NC1CCCCC1C2CCCCC2 240690a_200011339469_100000210414 [0,0,0,2,0,0|2,0,0]=4 18158 B18R2.2616 CCC(=O)NC1CCCCC1C2CCCCC2 527a_200011339469_100000210414 [0,0,0,2,0,0|2,0,0]=4 18159 B18R2.2616 CNC(=O)CN1CCCCC1C2CCCCC2 2230a_100011219272_100000183359 [0,0,0,2,0,0|2,0,0]=4 18160 B18R2.2616 CNC(=O)CN1CCCCC1C2CCCCC2 269982a_100011219272_100000183359 [0,0,0,2,0,0|2,0,0]=4 18161 B18R2.2616 CNC(=O)CN1CCCCC1C2CCCCC2 34a_100011219272_100000183359 [0,0,0,2,0,0|2,0,0]=4 18162 B18R2.2616 CNC(=O)NC1CCCCC1C2CCCCC2 2708a_100102657272_200011339469 [0,0,0,2,0,0|2,0,0]=4 18163 B18R2.2616 CNC(=O)NC1CCCCC1C2CCCCC2 2708a_200011339469_106832991635 [0,0,0,2,0,0|2,0,0]=4 18164 B18R2.2616 CNC(=O)NC1CCCCC1C2CCCCC2 273464a_100102657272_200011339469 [0,0,0,2,0,0|2,0,0]=4 18165 B18R2.2616 CNC(=O)NC1CCCCC1C2CCCCC2 273464a_200011339469_100102657272 [0,0,0,2,0,0|2,0,0]=4 18166 B18R2.2616 CNC(=O)NC1CCCCC1C2CCCCC2 512a_106832991638_200011339469 [0,0,0,2,0,0|2,0,0]=4 18167 B18R2.2616 COC(=O)CC1COCCN1C2CCCCC2 270004a_100000731486_100000210434 [0,0,0,2,0,0|2,0,0]=4 18168 B18R2.2616 COC(=O)CC1COCCN1C2CCCCC2 34a_100000731486_100000210327 [0,0,0,2,0,0|2,0,0]=4 18169 B18R2.2616 COC(=O)CN1CCCCC1C2CCCCC2 2230a_100011219272_100000747449 [0,0,0,2,0,0|1,0,0]=3 18170 B18R2.2616 COC(=O)CN1CCCCC1C2CCCCC2 269982a_100011219272_100000747449 [0,0,0,2,0,0|1,0,0]=3 18171 B18R2.2616 COC(=O)CN1CCCCC1C2CCCCC2 34a_100011219272_100000747449 [0,0,0,2,0,0|1,0,0]=3 18172 B18R2.2616 COC(=O)CN1CCOC[C@@H]1C2CCCCC2 2230a_100015984746_100000747449 [0,0,0,2,0,0|2,0,0]=4 18173 B18R2.2616 COC(=O)CN1CCOC[C@@H]1C2CCCCC2 269982a_100015984746_100000747449 [0,0,0,2,0,0|2,0,0]=4 18174 B18R2.2616 COC(=O)CN1CCOC[C@@H]1C2CCCCC2 34a_100015984746_100000747449 [0,0,0,2,0,0|2,0,0]=4 18175 B18R2.126836 COC(=O)CC1COCCN1CC2CCCC2 2230a_100000731486_100000740388 [0,0,0,2,0,0|2,0,0]=4 18176 B18R2.126836 COC(=O)CC1COCCN1CC2CCCC2 34a_100000731486_100000740388 [0,0,0,2,0,0|2,0,0]=4 18177 B18R2.126836 COC(=O)CN1CCCCC1CN2CCCC2 2230a_200011224931_100000747449 [0,0,0,2,0,0|2,0,0]=4 18178 B18R2.126836 COC(=O)CN1CCCCC1CN2CCCC2 269982a_200011224931_100000747449 [0,0,0,2,0,0|2,0,0]=4 18179 B18R2.5164 CCCC1CCCCC1OCCC2CCC2=O 7a_100011217265_200016118888 [0,0,0,2,0,0|2,0,0]=4 18180 B18R2.5268 CCCC1CCCCC1NCC2CNC(=O)C2 269862a_100016993742_100011218038 [0,0,0,2,0,0|2,0,0]=4 18181 B18R2.5268 CCCC1CCCCC1OCC2COC(=O)O2 34a_100011217265_100000073702 [0,0,0,2,0,0|2,0,0]=4 18182 B18R2.5268 CCCC1CCCCC1OC[C@H]2COC(=O)N2 34a_100011217265_100015307671 [0,0,0,2,0,0|2,0,0]=4 18183 B18R2.5268 CCCC1CCCCC1OC[C@H]2COC(=O)N2 7a_100011217265_100015307671 [0,0,0,2,0,0|2,0,0]=4 18184 B18R2.46045 CCCC1CCCCC1N2CC[C@H]2C(=O)OC 270004a_102516456887_100011218038 [0,0,0,2,0,0|1,0,0]=3 18185 B18R2.46045 CCOC1CCCCC1N2CC[C@H]2C(=O)OC 270004a_102516456887_200000031474 [0,0,0,2,0,0|2,0,0]=4 18186 B18R2.741502 CNC(=O)CCCN1CCCC2C1CCCC2 2230a_100000211887_100000741757 [0,0,0,2,0,0|2,0,0]=4 18187 B18R2.741502 CNC(=O)CCCN1CCCC2C1CCCC2 269982a_100000211887_100000741757 [0,0,0,2,0,0|2,0,0]=4 18188 B18R2.741502 CNC(=O)CCCN1CCCC2C1CCCC2 34a_100000211887_100000741757 [0,0,0,2,0,0|2,0,0]=4 18189 B18R2.741502 CNC(=O)CCNC1CCCC2C1CCCC2 269862a_100000738227_100000032293 [0,0,0,2,0,0|2,0,0]=4 18190 B18R2.741502 CNC(=O)CCOC1CCCC2C1CCCC2 34a_100000042559_100012179268 [0,0,0,2,0,0|2,0,0]=4 18191 B18R2.741502 CNC(=O)CCOC1CCCC2C1CCCC2 7a_100000042559_100000737683 [0,0,0,2,0,0|2,0,0]=4 18192 B18R2.741502 COC(=O)CCCN1CCCC2C1CCCC2 2230a_100000211887_100011218270 [0,0,0,2,0,0|1,0,0]=3 18193 B18R2.741502 COC(=O)CCCN1CCCC2C1CCCC2 269982a_100000211887_100011218270 [0,0,0,2,0,0|1,0,0]=3 18194 B18R2.741502 COC(=O)CCCN1CCCC2C1CCCC2 34a_100000211887_100000742333 [0,0,0,2,0,0|1,0,0]=3 18195 B18R2.741502 COC(=O)CCCN1CCOC2C1CCCC2 2230a_200000741227_100011218270 [0,0,0,2,0,0|2,0,0]=4 18196 B18R2.741502 COC(=O)CCCN1CCOC2C1CCCC2 269982a_200000741227_100011218270 [0,0,0,2,0,0|2,0,0]=4 18197 B18R2.741502 COC(=O)CCCN1CCOC2C1CCCC2 34a_200000741227_100000742333 [0,0,0,2,0,0|2,0,0]=4 18198 B18R2.741502 COC(=O)CCOC1CCCC2C1CCCC2 34a_100000042559_100000742370 [0,0,0,2,0,0|1,0,0]=3 18199 B18R2.741502 COC(=O)CCOC1CCCC2C1CCCC2 7a_100000042559_100000204255 [0,0,0,2,0,0|1,0,0]=3 18200 B18R2.741502 COC(=O)CNC[C@@H]1CCCN2[C@@H]1CCCC2 34a_100015187183_100000747449 [0,0,0,2,0,0|2,0,0]=4 18201 B18R2.741502 COC(=O)COC[C@@H]1CCCN2[C@@H]1CCCC2 34a_200009815849_100000747449 [0,0,0,2,0,0|2,0,0]=4 18202 B18R2.741502 COC(=O)COC[C@@H]1CCCN2[C@@H]1CCCC2 7a_200009815849_100000747449 [0,0,0,2,0,0|2,0,0]=4 18203 B18R2.28873 CCCC1CCCC1N2CCC[C@H]2C(=O)NC 270004a_100015185040_100000723119 [0,0,0,2,0,0|2,0,0]=4 18204 B18R2.28873 CCCC1CCCC1N2CCC[C@H]2C(=O)OC 270004a_100000752040_100000723119 [0,0,0,2,0,0|1,0,0]=3 18205 B18R2.28873 CCCC1CCCC1N2CCSC2C(=O)OC 270004a_100015296106_100000723119 [0,0,0,2,0,0|2,0,0]=4 18206 B18R2.28873 CCCC1CCCC1N2CSCC2C(=O)OC 270004a_200000724679_100000723119 [0,0,0,2,0,0|2,0,0]=4 18207 B18R2.95701 COC(=O)CCCCCN1C2CCC1COC2 2230a_100015205251_100009816466 [0,0,0,2,0,0|2,0,0]=4 18208 B18R2.95701 COC(=O)CCCCCN1C2CCC1COC2 269982a_100015205251_100009816466 [0,0,0,2,0,0|2,0,0]=4 18209 B18R2.95701 COC(=O)CCCCCN1C2CCC1COC2 34a_100015205251_100009816466 [0,0,0,2,0,0|2,0,0]=4 18210 B18R2.101717 COC(=O)CCCCCN1C[C@@H]2C[C@H]1CN2C 2230a_100025763010_100009816466 [0,0,0,2,0,0|2,0,0]=4 18211 B18R2.101717 COC(=O)CCCCCN1C[C@@H]2C[C@H]1CN2C 269982a_100025763010_100009816466 [0,0,0,2,0,0|2,0,0]=4 18212 B18R2.102045 COC(=O)CCCN1CC2CCCN2CC1C 2230a_200159271516_100011218270 [0,0,0,2,0,0|2,0,0]=4 18213 B18R2.102045 COC(=O)CCCN1CC2CCCN2CC1C 269982a_200159271516_100011218270 [0,0,0,2,0,0|2,0,0]=4 18214 B18R2.102045 COC(=O)CCCN1CC2CCCN2CC1C 34a_200159271516_100000742333 [0,0,0,2,0,0|2,0,0]=4 18215 B18R2.918304 COC(=O)CCCCCN1CCCC1C2CC2 2230a_200000757794_100009816466 [0,0,0,2,0,0|1,0,0]=3 18216 B18R2.918304 COC(=O)CCCCCN1CCCC1C2CC2 269982a_200000757794_100009816466 [0,0,0,2,0,0|1,0,0]=3 18217 B18R2.918304 COC(=O)CCCCCN1CCCC1C2CC2 34a_200000757794_100009816466 [0,0,0,2,0,0|1,0,0]=3 18218 B18R2.2273117 CNC(=O)CCCNCC12CCCC1CCC2 2230a_100159271432_100000741757 [0,0,0,2,0,0|2,0,0]=4 18219 B18R2.2273117 CNC(=O)CCCNCC12CCCC1CCC2 34a_100159271432_100000741757 [0,0,0,2,0,0|2,0,0]=4 18220 B18R2.2273117 COC(=O)CCCNCC12CCCC1CCC2 2230a_100159271432_100011218270 [0,0,0,2,0,0|1,0,0]=3 18221 B18R2.2273117 COC(=O)CCCNCC12CCCC1CCC2 34a_100159271432_100000742333 [0,0,0,2,0,0|1,0,0]=3 18222 B18R2.2273117 COC(=O)CCCOCC12CCCN1CCC2 34a_100000722608_100000742333 [0,0,0,2,0,0|2,0,0]=4 18223 B18R2.2273117 COC(=O)CCCOCC12CCCN1CCC2 7a_100000722608_100011218270 [0,0,0,2,0,0|2,0,0]=4 18224 B18R2.2273117 COC(=O)CCNCCC12CCCN1CCC2 34a_100020630938_100000742370 [0,0,0,2,0,0|2,0,0]=4 18225 B18R2.321 CNC(=O)CCN1CCCC1C2CCCCC2 2230a_100011206067_100000737683 [0,0,0,2,0,0|2,0,0]=4 18226 B18R2.321 CNC(=O)CCN1CCCC1C2CCCCC2 269982a_100011206067_100000737683 [0,0,0,2,0,0|2,0,0]=4 18227 B18R2.321 CNC(=O)CCN1CCCC1C2CCCCC2 34a_100011206067_100012179268 [0,0,0,2,0,0|2,0,0]=4 18228 B18R2.321 COC(=O)CCN1CCCC1C2CCCCC2 2230a_100011206067_100000204255 [0,0,0,2,0,0|1,0,0]=3 18229 B18R2.321 COC(=O)CCN1CCCC1C2CCCCC2 269982a_100011206067_100000204255 [0,0,0,2,0,0|1,0,0]=3 18230 B18R2.321 COC(=O)CCN1CCCC1C2CCCCC2 34a_100011206067_100000742370 [0,0,0,2,0,0|1,0,0]=3 18231 B18R2.2310 COC(=O)CCCN1CCOC12CCCCC2 269982a_200015422347_100011218270 [0,0,0,2,0,0|2,0,0]=4 18232 B18R2.2310 COC(=O)CCCN1CCOC12CCCCC2 34a_200015422347_100000742333 [0,0,0,2,0,0|2,0,0]=4 18233 B18R2.3701 O=C1CC(CN1)CNCCCC2CCCCC2 2230a_100016993742_100011713725 [0,0,0,2,0,0|2,0,0]=4 18234 B18R2.3701 O=C1CC(CN1)CNCCCC2CCCCC2 34a_100016993742_100011713725 [0,0,0,2,0,0|2,0,0]=4 18235 B18R2.3701 O=C1CC(CN1)COCCCC2CCCCC2 34a_100016041077_100011713725 [0,0,0,2,0,0|2,0,0]=4 18236 B18R2.3701 O=C1N[C@H](CO1)CNCCCC2CCCCC2 2230a_100011211642_100015307671 [0,0,0,2,0,0|2,0,0]=4 18237 B18R2.3701 O=C1N[C@H](CO1)CNCCCC2CCCCC2 34a_100011211642_100015307671 [0,0,0,2,0,0|2,0,0]=4 18238 B18R2.3701 O=C1N[C@H](CO1)COCCCC2CCCCC2 34a_100000198086_100015307671 [0,0,0,2,0,0|2,0,0]=4 18239 B18R2.3701 O=C1N[C@H](CO1)COCCCC2CCCCC2 7a_100000198086_100015307671 [0,0,0,2,0,0|2,0,0]=4 18240 B18R2.3701 O=C1N[C@H](CO1)CSCCCC2CCCCC2 62a_100011713725_100015307671 [0,0,0,2,0,0|2,0,0]=4 18241 B18R2.3701 O=C1N[C@H](CO1)CSCCCC2CCCCC2 62a_100015307671_100011713725 [0,0,0,2,0,0|2,0,0]=4 18242 B18R2.3701 O=C1OCC(O1)CNCCCC2CCCCC2 34a_100011211642_100000073702 [0,0,0,2,0,0|2,0,0]=4 18243 B18R2.3701 O=C1OCC(O1)COCCCC2CCCCC2 34a_100000198086_100000073702 [0,0,0,2,0,0|2,0,0]=4 18244 B18R2.3701 O=C1OCC(O1)CSCCCC2CCCCC2 62a_100000073702_100011713725 [0,0,0,2,0,0|2,0,0]=4 18245 B18R2.3701 O=C1OCC(O1)CSCCCC2CCCCC2 62a_100011713725_100000073702 [0,0,0,2,0,0|2,0,0]=4 18246 B18R2.3701 O=C1OCC(O1)OCCCCC2CCCCC2 34a_100011215267_100000032252 [0,0,0,2,0,0|2,0,0]=4 18247 B18R2.6514 O=C1CCC1CCNCCCC2CCCCC2 2230a_100011211642_200016118888 [0,0,0,2,0,0|2,0,0]=4 18248 B18R2.6514 O=C1CCC1CCOCCCC2CCCCC2 7a_100000198086_200016118888 [0,0,0,2,0,0|2,0,0]=4 18249 B18R2.6514 O=C1CCC1CCSCCCC2CCCCC2 62a_100011713725_200016118888 [0,0,0,2,0,0|2,0,0]=4 18250 B18R2.6514 O=C1CCC1CCSCCCC2CCCCC2 62a_200016118888_100011713725 [0,0,0,2,0,0|2,0,0]=4 18251 B18R2.9309 CNC(=O)C1CCCCN1CC2CCCCC2 2230a_100011209383_100000211423 [0,0,0,2,0,0|2,0,0]=4 18252 B18R2.9309 CNC(=O)C1CCCCN1CC2CCCCC2 269982a_100011209383_100000211423 [0,0,0,2,0,0|2,0,0]=4 18253 B18R2.9309 CNC(=O)C1CCCCN1CC2CCCCC2 34a_100011209383_100000211423 [0,0,0,2,0,0|2,0,0]=4 18254 B18R2.9309 COC(=O)C1CCCCN1CC2CCCCC2 2230a_100000734855_100000211423 [0,0,0,2,0,0|1,0,0]=3 18255 B18R2.9309 COC(=O)C1CCCCN1CC2CCCCC2 269982a_100000734855_100000211423 [0,0,0,2,0,0|1,0,0]=3 18256 B18R2.9309 COC(=O)C1CCCCN1CC2CCCCC2 34a_100000734855_100000211423 [0,0,0,2,0,0|1,0,0]=3 18257 B18R2.9309 COC(=O)C1CCCCN1CC2CCCCO2 2230a_100000734855_100000211543 [0,0,0,2,0,0|2,0,0]=4 18258 B18R2.9309 COC(=O)C1CCCCN1CC2CCCCO2 269982a_100000734855_100000211543 [0,0,0,2,0,0|2,0,0]=4 18259 B18R2.9309 COC(=O)C1CCCCN1CC2CCCCO2 34a_100000734855_100000211543 [0,0,0,2,0,0|2,0,0]=4 18260 B18R2.9309 COC(=O)C1CCCCN1CC2CCCOC2 2230a_100000734855_100000741521 [0,0,0,2,0,0|2,0,0]=4 18261 B18R2.9309 COC(=O)C1CCCCN1CC2CCCOC2 269982a_100000734855_100000741521 [0,0,0,2,0,0|2,0,0]=4 18262 B18R2.9309 COC(=O)C1CCCCN1CC2CCCOC2 34a_100000734855_100000741521 [0,0,0,2,0,0|2,0,0]=4 18263 B18R2.9309 COC(=O)C1CCCCN1CC2CCOCC2 2230a_100000734855_100000754603 [0,0,0,2,0,0|2,0,0]=4 18264 B18R2.9309 COC(=O)C1CCCCN1CC2CCOCC2 269982a_100000734855_100000754603 [0,0,0,2,0,0|2,0,0]=4 18265 B18R2.9309 COC(=O)C1CCCCN1CC2CCOCC2 34a_100000734855_100000754603 [0,0,0,2,0,0|2,0,0]=4 18266 B18R2.9309 COC(=O)C1CCCCN1CC2CCSCC2 270004a_100000734855_100000067145 [0,0,0,2,0,0|2,0,0]=4 18267 B18R2.9309 COC(=O)C1CNCCC1OC2CCCCC2 34a_200103168510_100000210327 [0,0,0,2,0,0|2,0,0]=4 18268 B18R2.9309 COC(=O)C1COCCN1CC2CCCCC2 2230a_100000765174_100000211423 [0,0,0,2,0,0|2,0,0]=4 18269 B18R2.9309 COC(=O)C1COCCN1CC2CCCCC2 34a_100000765174_100000211423 [0,0,0,2,0,0|2,0,0]=4 18270 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCCCC2 34a_100015709673_100000210327 [0,0,0,2,0,0|1,0,0]=3 18271 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCCCC2 7a_100015709673_100000210327 [0,0,0,2,0,0|1,0,0]=3 18272 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCCOC2 34a_100015709673_100000693364 [0,0,0,2,0,0|2,0,0]=4 18273 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCCOC2 7a_100015709673_100000693364 [0,0,0,2,0,0|2,0,0]=4 18274 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCOCC2 7a_100015709673_100000686592 [0,0,0,2,0,0|2,0,0]=4 18275 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCSCC2 34a_100015709673_100000069128 [0,0,0,2,0,0|2,0,0]=4 18276 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1OC2CCSCC2 7a_100015709673_100011500858 [0,0,0,2,0,0|2,0,0]=4 18277 B18R2.9397 CNC(=O)CCCNCC1CC12CCCCC2 2230a_100015185624_100000741757 [0,0,0,2,0,0|2,0,0]=4 18278 B18R2.9397 CNC(=O)CCCNCC1CC12CCCCC2 34a_100015185624_100000741757 [0,0,0,2,0,0|2,0,0]=4 18279 B18R2.9397 COC(=O)CCCNCC1CC12CCCCC2 2230a_100015185624_100011218270 [0,0,0,2,0,0|1,0,0]=3 18280 B18R2.9397 COC(=O)CCCNCC1CC12CCCCC2 34a_100015185624_100000742333 [0,0,0,2,0,0|1,0,0]=3 18281 B18R2.9460 COC(=O)[C@@H]1CCN1CCCC2CCCCC2 2230a_102516456887_100011713725 [0,0,0,2,0,0|1,0,0]=3 18282 B18R2.9460 COC(=O)[C@@H]1CCN1CCCC2CCCCC2 269982a_102516456887_100011713725 [0,0,0,2,0,0|1,0,0]=3 18283 B18R2.9460 COC(=O)[C@@H]1CCN1CCCN2CCCCC2 2230a_102516456887_100000690320 [0,0,0,2,0,0|2,0,0]=4 18284 B18R2.9460 COC(=O)[C@@H]1CCN1CCCN2CCCCC2 269982a_102516456887_100000690320 [0,0,0,2,0,0|2,0,0]=4 18285 B18R2.9460 COC(=O)[C@@H]1CCN1CCOC2CCCCC2 2230a_102516456887_100011211530 [0,0,0,2,0,0|2,0,0]=4 18286 B18R2.9460 COC(=O)[C@@H]1CCN1CCOC2CCCCC2 269982a_102516456887_100011211530 [0,0,0,2,0,0|2,0,0]=4 18287 B18R2.9485 CNC(=O)[C@@H]1CCCN1CCC2CCCCC2 2230a_100015185040_100012355289 [0,0,0,2,0,0|2,0,0]=4 18288 B18R2.9485 CNC(=O)[C@@H]1CCCN1CCC2CCCCC2 269982a_100015185040_100011273959 [0,0,0,2,0,0|2,0,0]=4 18289 B18R2.9485 CNC(=O)[C@@H]1CCCN1CCC2CCCCC2 270004a_100015185040_100011713444 [0,0,0,2,0,0|2,0,0]=4 18290 B18R2.9485 CNC(=O)[C@@H]1CCCN1CCC2CCCCC2 34a_100015185040_100011209188 [0,0,0,2,0,0|2,0,0]=4 18291 B18R2.9485 COC(=O)C1CCCC1OCC2CCCCC2 34a_200000081814_100000211423 [0,0,0,2,0,0|1,0,0]=3 18292 B18R2.9485 COC(=O)C1CCCC1OCC2CCCCC2 7a_200000081814_100000211423 [0,0,0,2,0,0|1,0,0]=3 18293 B18R2.9485 COC(=O)C1CCCC1OCC2CCCCO2 34a_200000081814_100000211543 [0,0,0,2,0,0|2,0,0]=4 18294 B18R2.9485 COC(=O)C1CCCC1OCC2CCCCO2 7a_200000081814_100000211543 [0,0,0,2,0,0|2,0,0]=4 18295 B18R2.9485 COC(=O)C1CCCC1OCC2CCCOC2 34a_200000081814_100000741521 [0,0,0,2,0,0|2,0,0]=4 18296 B18R2.9485 COC(=O)C1CCCC1OCC2CCCOC2 7a_200000081814_100000741521 [0,0,0,2,0,0|2,0,0]=4 18297 B18R2.9485 COC(=O)C1CCCC1OCC2CCOCC2 34a_200000081814_100000754603 [0,0,0,2,0,0|2,0,0]=4 18298 B18R2.9485 COC(=O)C1CCCC1OCC2CCOCC2 7a_200000081814_100000754603 [0,0,0,2,0,0|2,0,0]=4 18299 B18R2.9485 COC(=O)C1CSCN1CCC2CCCCC2 269982a_200000724679_100011273959 [0,0,0,2,0,0|2,0,0]=4 18300 B18R2.9485 COC(=O)C1CSCN1CCC2CCCCC2 270004a_200000724679_100011713444 [0,0,0,2,0,0|2,0,0]=4 18301 B18R2.9485 COC(=O)C1SCCN1CCC2CCCCC2 2230a_100015296106_100012355289 [0,0,0,2,0,0|2,0,0]=4 18302 B18R2.9485 COC(=O)C1SCCN1CCC2CCCCC2 269982a_100015296106_100011273959 [0,0,0,2,0,0|2,0,0]=4 18303 B18R2.9485 COC(=O)C1SCCN1CCC2CCCCC2 270004a_100015296106_100011713444 [0,0,0,2,0,0|2,0,0]=4 18304 B18R2.9485 COC(=O)[C@@H]1CCCN1CCC2CCCCC2 2230a_100000752040_100012355289 [0,0,0,2,0,0|1,0,0]=3 18305 B18R2.9485 COC(=O)[C@@H]1CCCN1CCC2CCCCC2 269982a_100000752040_100011273959 [0,0,0,2,0,0|1,0,0]=3 18306 B18R2.9485 COC(=O)[C@@H]1CCCN1CCC2CCCCC2 270004a_100000752040_100011713444 [0,0,0,2,0,0|1,0,0]=3 18307 B18R2.9485 COC(=O)[C@@H]1CCCN1CCC2CCOCC2 2230a_100000752040_100011934994 [0,0,0,2,0,0|2,0,0]=4 18308 B18R2.9485 COC(=O)[C@@H]1CCCN1CCC2CCOCC2 269982a_100000752040_100011934994 [0,0,0,2,0,0|2,0,0]=4 18309 B18R2.9485 COC(=O)[C@@H]1CCCN1CCN2CCCCC2 2230a_100000752040_100000739454 [0,0,0,2,0,0|2,0,0]=4 18310 B18R2.9485 COC(=O)[C@@H]1CCCN1CCN2CCCCC2 269982a_100000752040_100000739454 [0,0,0,2,0,0|2,0,0]=4 18311 B18R2.9485 COC(=O)[C@@H]1CCCN1COC2CCCCC2 2230a_100000752040_100011935260 [0,0,0,2,0,0|2,0,0]=4 18312 B18R2.9485 COC(=O)[C@@H]1CCCN1COC2CCCCC2 269982a_100000752040_100011935260 [0,0,0,2,0,0|2,0,0]=4 18313 B18R2.9586 COC(=O)CN1CCCC1CN2CCCCC2 2230a_200000725506_100000747449 [0,0,0,2,0,0|2,0,0]=4 18314 B18R2.9586 COC(=O)CN1CCCC1CN2CCCCC2 269982a_200000725506_100000747449 [0,0,0,2,0,0|2,0,0]=4 18315 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCCC2 2230a_100025726698_100000211423 [0,0,0,2,0,0|1,0,0]=3 18316 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCCC2 269982a_100025726698_100000211423 [0,0,0,2,0,0|1,0,0]=3 18317 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCCC2 34a_100025726698_100000211423 [0,0,0,2,0,0|1,0,0]=3 18318 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCCO2 2230a_100025726698_100000211543 [0,0,0,2,0,0|2,0,0]=4 18319 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCCO2 269982a_100025726698_100000211543 [0,0,0,2,0,0|2,0,0]=4 18320 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCCO2 34a_100025726698_100000211543 [0,0,0,2,0,0|2,0,0]=4 18321 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCOC2 2230a_100025726698_100000741521 [0,0,0,2,0,0|2,0,0]=4 18322 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCOC2 269982a_100025726698_100000741521 [0,0,0,2,0,0|2,0,0]=4 18323 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCCOC2 34a_100025726698_100000741521 [0,0,0,2,0,0|2,0,0]=4 18324 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCOCC2 2230a_100025726698_100000754603 [0,0,0,2,0,0|2,0,0]=4 18325 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCOCC2 269982a_100025726698_100000754603 [0,0,0,2,0,0|2,0,0]=4 18326 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCOCC2 34a_100025726698_100000754603 [0,0,0,2,0,0|2,0,0]=4 18327 B18R2.9586 COC(=O)C[C@H]1CCCN1CC2CCSCC2 270004a_100025726698_100000067145 [0,0,0,2,0,0|2,0,0]=4 18328 B18R2.101469 COC(=O)CCCCN1CCN2CCC1CC2 269982a_100000027273_100000204269 [0,0,0,2,0,0|2,0,0]=4 18329 B18R2.101497 COC(=O)CCCCCCN1C2CCC1CC2 2230a_100000735658_100009815986 [0,0,0,2,0,0|1,0,0]=3 18330 B18R2.101497 COC(=O)CCCCCCN1C2CCC1CC2 269982a_100000735658_100009815986 [0,0,0,2,0,0|1,0,0]=3 18331 B18R2.101497 COC(=O)CCCCCCN1C2CCC1CC2 34a_100000735658_100009815986 [0,0,0,2,0,0|1,0,0]=3 18332 B18R2.101497 COC(=O)CCCCCOC1C2CCC1CC2 34a_100000074720_100009813300 [0,0,0,2,0,0|1,0,0]=3 18333 B18R2.101497 COC(=O)CCCCCSC1C2CCC1CC2 62a_100009813300_100009816466 [0,0,0,2,0,0|1,0,0]=3 18334 B18R2.101497 COC(=O)CCCCCSC1C2CCC1CC2 62a_100009816466_100009813300 [0,0,0,2,0,0|1,0,0]=3 18335 B18R2.101607 COC(=O)CCCCCCCN1CC2CC2C1 2230a_100000741873_100010004213 [0,0,0,2,0,0|1,0,0]=3 18336 B18R2.101607 COC(=O)CCCCCCCN1CC2CC2C1 269982a_100000741873_100010004213 [0,0,0,2,0,0|1,0,0]=3 18337 B18R2.101607 COC(=O)CCCCCCCN1CC2CC2C1 34a_100000741873_100010004213 [0,0,0,2,0,0|1,0,0]=3 18338 B18R2.101719 COC(=O)CCCCCN1CC2CCC1CC2 2230a_100000750499_100009816466 [0,0,0,2,0,0|1,0,0]=3 18339 B18R2.101719 COC(=O)CCCCCN1CC2CCC1CC2 269982a_100000750499_100009816466 [0,0,0,2,0,0|1,0,0]=3 18340 B18R2.101719 COC(=O)CCCCCN1CC2CCC1CC2 34a_100000750499_100009816466 [0,0,0,2,0,0|1,0,0]=3 18341 B18R2.101719 COC(=O)CCCCN[C@H]1CN2CCC1CC2 2230a_100016987387_100000204269 [0,0,0,2,0,0|2,0,0]=4 18342 B18R2.694211 COC(=O)CCCCCCOC1CCC2C1C2 34a_200012295571_100009815986 [0,0,0,2,0,0|1,0,0]=3 18343 B18R2.699674 COC(=O)CCCCCCNC1C2C1COC2 2230a_100000702821_100009815986 [0,0,0,2,0,0|2,0,0]=4 18344 B18R2.699674 COC(=O)CCCCCCNC1C2C1COC2 34a_100000702821_100009815986 [0,0,0,2,0,0|2,0,0]=4 18345 B18R2.699674 COC(=O)CCCCCOCC1C2C1CNC2 34a_100000045132_100009816466 [0,0,0,2,0,0|2,0,0]=4 18346 B18R2.2546 CCCCCC1CCCC1NC2CNC(=O)C2 269862a_100000697751_200000198059 [0,0,0,2,0,0|2,0,0]=4 18347 B18R2.8274 CCCCC1CCCC1NCC2CNC(=O)C2 269862a_100016993742_100000750825 [0,0,0,2,0,0|2,0,0]=4 18348 B18R2.29762 O=C1N[C@H](CO1)COCC2CCCCCCC2 34a_100011216312_100015307671 [0,0,0,2,0,0|2,0,0]=4 18349 B18R2.29762 O=C1N[C@H](CO1)COCC2CCCCCCC2 7a_100011216312_100015307671 [0,0,0,2,0,0|2,0,0]=4 18350 B18R2.29762 O=C1OCC(O1)COCC2CCCCCCC2 34a_100011216312_100000073702 [0,0,0,2,0,0|2,0,0]=4 18351 B18R2.29762 O=C1OCC(O1)NCCC2CCCCCCC2 34a_100011532352_100000032252 [0,0,0,2,0,0|2,0,0]=4 18352 B18R2.264814 O=C1N[C@H](CO1)CNCCC2CCCCCC2 2230a_100011532351_100015307671 [0,0,0,2,0,0|2,0,0]=4 18353 B18R2.264814 O=C1N[C@H](CO1)CNCCC2CCCCCC2 34a_100011532351_100015307671 [0,0,0,2,0,0|2,0,0]=4 18354 B18R2.264814 O=C1OCC(O1)CNCCC2CCCCCC2 34a_100011532351_100000073702 [0,0,0,2,0,0|2,0,0]=4 18355 B18R2.101777 CNC(=O)CCN1C(CCC2C1CCCC2)C 2230a_100132302184_100000737683 [0,0,0,2,0,0|2,0,0]=4 18356 B18R2.101777 CNC(=O)CCN1C(CCC2C1CCCC2)C 269982a_100132302184_100000737683 [0,0,0,2,0,0|2,0,0]=4 18357 B18R2.101777 CNC(=O)CCN1C(CCC2C1CCCC2)C 34a_100132302184_100012179268 [0,0,0,2,0,0|2,0,0]=4 18358 B18R2.101777 COC(=O)CCN1C(CCC2C1CCCC2)C 2230a_100132302184_100000204255 [0,0,0,2,0,0|1,0,0]=3 18359 B18R2.101777 COC(=O)CCN1C(CCC2C1CCCC2)C 269982a_100132302184_100000204255 [0,0,0,2,0,0|1,0,0]=3 18360 B18R2.101777 COC(=O)CCN1C(CCC2C1CCCC2)C 34a_100132302184_100000742370 [0,0,0,2,0,0|1,0,0]=3 18361 B18R2.9335 COC(=O)CCCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000204269 [0,0,0,2,0,0|1,0,0]=3 18362 B18R2.9335 COC(=O)CCCCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000204269 [0,0,0,2,0,0|1,0,0]=3 18363 B18R2.9335 COC(=O)CCCCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000204269 [0,0,0,2,0,0|1,0,0]=3 18364 B18R2.9335 COC(=O)COCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000090808 [0,0,0,2,0,0|2,0,0]=4 18365 B18R2.9335 COC(=O)COCCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000090808 [0,0,0,2,0,0|2,0,0]=4 18366 B18R2.9469 CNC(=O)CCCN1CCC2CCCCC2C1 2230a_100000211783_100000741757 [0,0,0,2,0,0|2,0,0]=4 18367 B18R2.9469 CNC(=O)CCCN1CCC2CCCCC2C1 269982a_100000211783_100000741757 [0,0,0,2,0,0|2,0,0]=4 18368 B18R2.9469 CNC(=O)CCCN1CCC2CCCCC2C1 34a_100000211783_100000741757 [0,0,0,2,0,0|2,0,0]=4 18369 B18R2.9469 CNC(=O)CCNC1CCC2CCCCC2C1 270004a_100000738227_100000211418 [0,0,0,2,0,0|2,0,0]=4 18370 B18R2.9469 CNC(=O)CCOC1CCC2CCCCC2C1 34a_100000211317_100012179268 [0,0,0,2,0,0|2,0,0]=4 18371 B18R2.9469 CNC(=O)CCOC1CCC2CCCCC2C1 7a_100000211317_100000737683 [0,0,0,2,0,0|2,0,0]=4 18372 B18R2.9469 COC(=O)CCCN1CCC2CCCCC2C1 2230a_100000211783_100011218270 [0,0,0,2,0,0|1,0,0]=3 18373 B18R2.9469 COC(=O)CCCN1CCC2CCCCC2C1 269982a_100000211783_100011218270 [0,0,0,2,0,0|1,0,0]=3 18374 B18R2.9469 COC(=O)CCCN1CCC2CCCCC2C1 34a_100000211783_100000742333 [0,0,0,2,0,0|1,0,0]=3 18375 B18R2.9469 COC(=O)CCCN1CCN2CCCCC2C1 2230a_100000746566_100011218270 [0,0,0,2,0,0|2,0,0]=4 18376 B18R2.9469 COC(=O)CCCN1CCN2CCCCC2C1 269982a_100000746566_100011218270 [0,0,0,2,0,0|2,0,0]=4 18377 B18R2.9469 COC(=O)CCCN1CCN2CCCCC2C1 34a_100000746566_100000742333 [0,0,0,2,0,0|2,0,0]=4 18378 B18R2.9469 COC(=O)CCOC1CCC2CCCCC2C1 34a_100000211317_100000742370 [0,0,0,2,0,0|1,0,0]=3 18379 B18R2.9469 COC(=O)CCOC1CCC2CCCCC2C1 7a_100000211317_100000204255 [0,0,0,2,0,0|1,0,0]=3 18380 B18R2.9515 CNC(=O)C1CCCCN1C2CCCCC2C 270004a_100011209383_100000210921 [0,0,0,2,0,0|2,0,0]=4 18381 B18R2.9515 COC(=O)C1CCCCN1C2CCCCC2C 270004a_100000734855_100000210921 [0,0,0,2,0,0|1,0,0]=3 18382 B18R2.9515 COC(=O)C1CCCCN1C2CCCCC2F 269982a_100000734855_100015423560 [0,0,0,2,0,0|2,0,0]=4 18383 B18R2.9515 COC(=O)C1CCCCN1C2CCCCC2F 34a_100000734855_100015423560 [0,0,0,2,0,0|2,0,0]=4 18384 B18R2.9515 COC(=O)C1CCCCN1C2CCCCC2O 269982a_100000734855_100000038908 [0,0,0,2,0,0|2,0,0]=4 18385 B18R2.9515 COC(=O)C1CCCCN1C2CCCCC2O 34a_100000734855_100000038908 [0,0,0,2,0,0|2,0,0]=4 18386 B18R2.9515 COC(=O)C1CCCCN1C2CCNCC2C 270004a_100000734855_100000703950 [0,0,0,2,0,0|2,0,0]=4 18387 B18R2.9515 COC(=O)C1CCCCN1C2CCOCC2C 270004a_100000734855_100000755695 [0,0,0,2,0,0|2,0,0]=4 18388 B18R2.9515 COC(=O)C1COCCN1C2CCCCC2C 270004a_100000765174_100000210921 [0,0,0,2,0,0|2,0,0]=4 18389 B18R2.96191 COC(=O)[C@@H]1CCN1CCC2CCCCN2C 2230a_102516456887_100000211948 [0,0,0,2,0,0|2,0,0]=4 18390 B18R2.96191 COC(=O)[C@@H]1CCN1CCC2CCCCN2C 269982a_102516456887_100000211948 [0,0,0,2,0,0|2,0,0]=4 18391 B18R2.96614 COC(=O)C1CCCC1OC2CCCCC2F 34a_200000081814_100015423560 [0,0,0,2,0,0|2,0,0]=4 18392 B18R2.96614 COC(=O)C1CCCC1OC2CCCCC2O 34a_200000081814_100000038908 [0,0,0,2,0,0|2,0,0]=4 18393 B18R2.96614 COC(=O)[C@@H]1CCCN1CC2CCCCN2C 269982a_100000752040_100015185383 [0,0,0,2,0,0|2,0,0]=4 18394 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCCCC2C 270004a_100025726698_100000210921 [0,0,0,2,0,0|1,0,0]=3 18395 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCCCC2F 269982a_100025726698_100015423560 [0,0,0,2,0,0|2,0,0]=4 18396 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCCCC2F 34a_100025726698_100015423560 [0,0,0,2,0,0|2,0,0]=4 18397 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCCCC2O 269982a_100025726698_100000038908 [0,0,0,2,0,0|2,0,0]=4 18398 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCCCC2O 34a_100025726698_100000038908 [0,0,0,2,0,0|2,0,0]=4 18399 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCNCC2C 270004a_100025726698_100000703950 [0,0,0,2,0,0|2,0,0]=4 18400 B18R2.98018 COC(=O)C[C@H]1CCCN1C2CCOCC2C 270004a_100025726698_100000755695 [0,0,0,2,0,0|2,0,0]=4 18401 B18R2.918366 COC(=O)CCCCCCN1CC2CCC1C2 2230a_100000743476_100009815986 [0,0,0,2,0,0|1,0,0]=3 18402 B18R2.918366 COC(=O)CCCCCCN1CC2CCC1C2 269982a_100000743476_100009815986 [0,0,0,2,0,0|1,0,0]=3 18403 B18R2.918366 COC(=O)CCCCCCN1CC2CCC1C2 34a_100000743476_100009815986 [0,0,0,2,0,0|1,0,0]=3 18404 B18R2.918366 COC(=O)CCCCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100009815986 [0,0,0,2,0,0|2,0,0]=4 18405 B18R2.918366 COC(=O)CCCCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100009815986 [0,0,0,2,0,0|2,0,0]=4 18406 B18R2.918366 COC(=O)CCCCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100009815986 [0,0,0,2,0,0|2,0,0]=4 18407 B18R2.918366 COC(=O)CCCCCNC1CC2CCC1C2 2230a_100000758229_100009816466 [0,0,0,2,0,0|1,0,0]=3 18408 B18R2.918366 COC(=O)CCCCCNC1CC2CCC1C2 34a_100000758229_100009816466 [0,0,0,2,0,0|1,0,0]=3 18409 B18R2.918366 COC(=O)CCCCCOC1CC2CCC1C2 34a_100000074720_100000727232 [0,0,0,2,0,0|1,0,0]=3 18410 B18R2.918366 COC(=O)CCCCCOC1CC2CCC1C2 34a_100000211339_100009816466 [0,0,0,2,0,0|1,0,0]=3 18411 B18R2.918366 COC(=O)CCCCCSC1CC2CCC1C2 62a_100000727232_100009816466 [0,0,0,2,0,0|1,0,0]=3 18412 B18R2.918366 COC(=O)CCCCCSC1CC2CCC1C2 62a_100009816466_100000727232 [0,0,0,2,0,0|1,0,0]=3 18413 B18R2.918366 COC(=O)CCCCOCC1CC2CCC1C2 34a_100000229996_100000204269 [0,0,0,2,0,0|1,0,0]=3 18414 B18R2.918366 COC(=O)CCCOCCN1CC2CCC1C2 34a_200011499663_100000742333 [0,0,0,2,0,0|2,0,0]=4 18415 B18R2.918366 COC(=O)COCCOCC1CC2CCC1C2 34a_100000229996_100000090808 [0,0,0,2,0,0|2,0,0]=4 18416 B18R2.9320 COC(=O)CN[C@@H]1CCCC[C@H]1N2CCCC2 34a_100009820197_100000747449 [0,0,0,2,0,0|2,0,0]=4 18417 B18R2.9340 COC(=O)CCN1CCCC1CN2CCCC2 2230a_100000746075_100000204255 [0,0,0,2,0,0|2,0,0]=4 18418 B18R2.9340 COC(=O)CCN1CCCC1CN2CCCC2 269982a_100000746075_100000204255 [0,0,0,2,0,0|2,0,0]=4 18419 B18R2.9495 CNC(=O)C1CCCCN1CCC2CCCC2 2230a_100011209383_100000760354 [0,0,0,2,0,0|2,0,0]=4 18420 B18R2.9495 CNC(=O)C1CCCCN1CCC2CCCC2 269982a_100011209383_100000760354 [0,0,0,2,0,0|2,0,0]=4 18421 B18R2.9495 CNC(=O)C1CCCCN1CCC2CCCC2 34a_100011209383_100000760354 [0,0,0,2,0,0|2,0,0]=4 18422 B18R2.9495 COC(=O)C1CCCCN1CCC2CCCC2 2230a_100000734855_100000760354 [0,0,0,2,0,0|1,0,0]=3 18423 B18R2.9495 COC(=O)C1CCCCN1CCC2CCCC2 269982a_100000734855_100000760354 [0,0,0,2,0,0|1,0,0]=3 18424 B18R2.9495 COC(=O)C1CCCCN1CCC2CCCC2 34a_100000734855_100000760354 [0,0,0,2,0,0|1,0,0]=3 18425 B18R2.9495 COC(=O)C1CCCCN1CCN2CCCC2 269982a_100000734855_100000004467 [0,0,0,2,0,0|2,0,0]=4 18426 B18R2.9495 COC(=O)C1CNCCC1OCC2CCCC2 34a_200103168510_100000740388 [0,0,0,2,0,0|2,0,0]=4 18427 B18R2.9495 COC(=O)C1COCCN1CCC2CCCC2 2230a_100000765174_100000760354 [0,0,0,2,0,0|2,0,0]=4 18428 B18R2.9495 COC(=O)C1COCCN1CCC2CCCC2 34a_100000765174_100000760354 [0,0,0,2,0,0|2,0,0]=4 18429 B18R2.9495 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CCCC2 34a_100015709673_100000740388 [0,0,0,2,0,0|1,0,0]=3 18430 B18R2.9495 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CCCC2 7a_100015709673_100000740388 [0,0,0,2,0,0|1,0,0]=3 18431 B18R2.9495 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CCCO2 7a_100015709673_100000203698 [0,0,0,2,0,0|2,0,0]=4 18432 B18R2.9495 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CCOC2 34a_100015709673_100011261433 [0,0,0,2,0,0|2,0,0]=4 18433 B18R2.9495 COC(=O)[C@@H]1CCCC[C@@H]1OCC2CCOC2 7a_100015709673_100000702531 [0,0,0,2,0,0|2,0,0]=4 18434 B18R2.9568 CNC(=O)[C@@H]1CCCN1CCCC2CCCC2 2230a_100015185040_100011713738 [0,0,0,2,0,0|2,0,0]=4 18435 B18R2.9568 CNC(=O)[C@@H]1CCCN1CCCC2CCCC2 269982a_100015185040_100011713738 [0,0,0,2,0,0|2,0,0]=4 18436 B18R2.9568 CNC(=O)[C@@H]1CCCN1CCCC2CCCC2 34a_100015185040_100011713738 [0,0,0,2,0,0|2,0,0]=4 18437 B18R2.9568 COC(=O)C1CCCC1OCCC2CCCC2 34a_200000081814_100000760354 [0,0,0,2,0,0|1,0,0]=3 18438 B18R2.9568 COC(=O)C1CCCC1OCCC2CCCC2 7a_200000081814_100000760354 [0,0,0,2,0,0|1,0,0]=3 18439 B18R2.9568 COC(=O)C1CCCC1OCCN2CCCC2 7a_200000081814_100000004467 [0,0,0,2,0,0|2,0,0]=4 18440 B18R2.9568 COC(=O)C1CSCN1CCCC2CCCC2 269982a_200000724679_100011713738 [0,0,0,2,0,0|2,0,0]=4 18441 B18R2.9568 COC(=O)C1SCCN1CCCC2CCCC2 2230a_100015296106_100011713738 [0,0,0,2,0,0|2,0,0]=4 18442 B18R2.9568 COC(=O)C1SCCN1CCCC2CCCC2 269982a_100015296106_100011713738 [0,0,0,2,0,0|2,0,0]=4 18443 B18R2.9568 COC(=O)[C@@H]1CCCN1CCCC2CCCC2 2230a_100000752040_100011713738 [0,0,0,2,0,0|1,0,0]=3 18444 B18R2.9568 COC(=O)[C@@H]1CCCN1CCCC2CCCC2 269982a_100000752040_100011713738 [0,0,0,2,0,0|1,0,0]=3 18445 B18R2.9568 COC(=O)[C@@H]1CCCN1CCCN2CCCC2 2230a_100000752040_100011445909 [0,0,0,2,0,0|2,0,0]=4 18446 B18R2.9568 COC(=O)[C@@H]1CCCN1CCCN2CCCC2 269982a_100000752040_100011445909 [0,0,0,2,0,0|2,0,0]=4 18447 B18R2.10035 CNC(=O)CCCN1CCCC1C2CCCC2 2230a_100000743374_100000741757 [0,0,0,2,0,0|2,0,0]=4 18448 B18R2.10035 CNC(=O)CCCN1CCCC1C2CCCC2 269982a_100000743374_100000741757 [0,0,0,2,0,0|2,0,0]=4 18449 B18R2.10035 CNC(=O)CCCN1CCCC1C2CCCC2 34a_100000743374_100000741757 [0,0,0,2,0,0|2,0,0]=4 18450 B18R2.10035 CNC(=O)CCNC1CCCC1C2CCCC2 269862a_100000738227_100011216175 [0,0,0,2,0,0|2,0,0]=4 18451 B18R2.10035 CNC(=O)CCNC1CCCC1C2CCCC2 270004a_100000738227_100011216175 [0,0,0,2,0,0|2,0,0]=4 18452 B18R2.10035 COC(=O)CCCN1CCCC1C2CCCC2 2230a_100000743374_100011218270 [0,0,0,2,0,0|1,0,0]=3 18453 B18R2.10035 COC(=O)CCCN1CCCC1C2CCCC2 269982a_100000743374_100011218270 [0,0,0,2,0,0|1,0,0]=3 18454 B18R2.10035 COC(=O)CCCN1CCCC1C2CCCC2 34a_100000743374_100000742333 [0,0,0,2,0,0|1,0,0]=3 18455 B18R2.98046 COC(=O)C[C@H]1CCCN1CCC2CCCC2 2230a_100025726698_100000760354 [0,0,0,2,0,0|1,0,0]=3 18456 B18R2.98046 COC(=O)C[C@H]1CCCN1CCC2CCCC2 269982a_100025726698_100000760354 [0,0,0,2,0,0|1,0,0]=3 18457 B18R2.98046 COC(=O)C[C@H]1CCCN1CCC2CCCC2 34a_100025726698_100000760354 [0,0,0,2,0,0|1,0,0]=3 18458 B18R2.98046 COC(=O)C[C@H]1CCCN1CCN2CCCC2 269982a_100025726698_100000004467 [0,0,0,2,0,0|2,0,0]=4 18459 B18R2.12460 CCC1CCCCC1N2CCC[C@H]2C(=O)NC 270004a_100015185040_100000757040 [0,0,0,2,0,0|2,0,0]=4 18460 B18R2.12460 CCC1CCCCC1N2CCC[C@H]2C(=O)OC 270004a_100000752040_100000757040 [0,0,0,2,0,0|1,0,0]=3 18461 B18R2.12460 CCC1CCCCC1N2CCSC2C(=O)OC 270004a_100015296106_100000757040 [0,0,0,2,0,0|2,0,0]=4 18462 B18R2.12460 CCC1CCCCC1N2CSCC2C(=O)OC 270004a_200000724679_100000757040 [0,0,0,2,0,0|2,0,0]=4 18463 B18R2.12460 COC(=O)[C@@H]1CCCN1C2CCCCC2CO 270004a_100000752040_100009861125 [0,0,0,2,0,0|2,0,0]=4 18464 B18R2.12460 COC(=O)[C@@H]1CCCN1C2CCCCC2OC 270004a_100000752040_100000740605 [0,0,0,2,0,0|2,0,0]=4 18465 B18R2.123070 CCCCCC1CCCC1N2CC2C(=O)OC 270004a_200009830135_200000198059 [0,0,0,2,0,0|1,0,0]=3 18466 B18R2.10650 COC(=O)CCCN1CCN2CCCC2C1C 2230a_200000066283_100011218270 [0,0,0,2,0,0|2,0,0]=4 18467 B18R2.10650 COC(=O)CCCN1CCN2CCCC2C1C 269982a_200000066283_100011218270 [0,0,0,2,0,0|2,0,0]=4 18468 B18R2.10650 COC(=O)CCCN1CCN2CCCC2C1C 34a_200000066283_100000742333 [0,0,0,2,0,0|2,0,0]=4 18469 B18R2.3283 CCC1CCCC1N2CCCCC2C(=O)NC 270004a_100011209383_100000749056 [0,0,0,2,0,0|2,0,0]=4 18470 B18R2.3283 CCC1CCCC1N2CCCCC2C(=O)OC 270004a_100000734855_100000749056 [0,0,0,2,0,0|1,0,0]=3 18471 B18R2.3283 CCC1CCCC1N2CCOCC2C(=O)OC 270004a_100000765174_100000749056 [0,0,0,2,0,0|2,0,0]=4 18472 B18R2.97212 COC(=O)[C@@H]1CCCC[C@@H]1OCCCC2CO2 34a_100015709673_100000733510 [0,0,0,2,0,0|2,0,0]=4 18473 B18R2.97212 COC(=O)[C@@H]1CCCC[C@@H]1OCCCC2CO2 7a_100015709673_100000733510 [0,0,0,2,0,0|2,0,0]=4 18474 B18R2.97230 CNC(=O)C1CCCCN1C2CCCCCC2 269982a_100011209383_100011217769 [0,0,0,2,0,0|2,0,0]=4 18475 B18R2.97230 CNC(=O)C1CCCCN1C2CCCCCC2 270004a_100011209383_100000210131 [0,0,0,2,0,0|2,0,0]=4 18476 B18R2.97230 CNC(=O)C1CCCCN1C2CCCCCC2 34a_100011209383_100011217769 [0,0,0,2,0,0|2,0,0]=4 18477 B18R2.97230 COC(=O)C1CCCCN1C2CCCCCC2 269982a_100000734855_100011217769 [0,0,0,2,0,0|1,0,0]=3 18478 B18R2.97230 COC(=O)C1CCCCN1C2CCCCCC2 270004a_100000734855_100000210131 [0,0,0,2,0,0|1,0,0]=3 18479 B18R2.97230 COC(=O)C1CCCCN1C2CCCCCC2 34a_100000734855_100011217769 [0,0,0,2,0,0|1,0,0]=3 18480 B18R2.97230 COC(=O)C1CCCCN1C2CCCNCC2 270004a_100000734855_100015187895 [0,0,0,2,0,0|2,0,0]=4 18481 B18R2.97230 COC(=O)C1COCCN1C2CCCCCC2 270004a_100000765174_100000210131 [0,0,0,2,0,0|2,0,0]=4 18482 B18R2.97230 COC(=O)C1COCCN1C2CCCCCC2 34a_100000765174_100011217769 [0,0,0,2,0,0|2,0,0]=4 18483 B18R2.12422 CCC1CCCC1N2CCC[C@@H]2CC(=O)OC 270004a_100025726698_100000749056 [0,0,0,2,0,0|1,0,0]=3 18484 B18R2.716976 COC(=O)C[C@H]1CCCN1C2CCCCCC2 269982a_100025726698_100011217769 [0,0,0,2,0,0|1,0,0]=3 18485 B18R2.716976 COC(=O)C[C@H]1CCCN1C2CCCCCC2 270004a_100025726698_100000210131 [0,0,0,2,0,0|1,0,0]=3 18486 B18R2.716976 COC(=O)C[C@H]1CCCN1C2CCCCCC2 34a_100025726698_100011217769 [0,0,0,2,0,0|1,0,0]=3 18487 B18R2.716976 COC(=O)C[C@H]1CCCN1C2CCCNCC2 270004a_100025726698_100015187895 [0,0,0,2,0,0|2,0,0]=4 18488 B18R2.871642 CCCCCCCN1CC2CC1C2C(=O)OC 2230a_200010453038_100000210681 [0,0,0,2,0,0|1,0,0]=3 18489 B18R2.871642 CCCCCCCN1CC2CC1C2C(=O)OC 269982a_200010453038_100000210681 [0,0,0,2,0,0|1,0,0]=3 18490 B18R2.871642 CCCCCCCN1CC2CC1C2C(=O)OC 34a_200010453038_100000210614 [0,0,0,2,0,0|1,0,0]=3 18491 B18R2.871642 CCCCOCCN1CC2CC1C2C(=O)OC 2230a_200010453038_100000743108 [0,0,0,2,0,0|2,0,0]=4 18492 B18R2.871642 CCCCOCCN1CC2CC1C2C(=O)OC 269982a_200010453038_100000743108 [0,0,0,2,0,0|2,0,0]=4 18493 B18R2.871642 CCCCOCCN1CC2CC1C2C(=O)OC 34a_200010453038_100000743108 [0,0,0,2,0,0|2,0,0]=4 18494 B18R2.871642 COC(=O)C1C2CC1N(C2)CCCCCCF 2230a_200010453038_100015922095 [0,0,0,2,0,0|2,0,0]=4 18495 B18R2.871642 COC(=O)C1C2CC1N(C2)CCCCCCF 269982a_200010453038_100015922095 [0,0,0,2,0,0|2,0,0]=4 18496 B18R2.871642 COC(=O)C1C2CC1N(C2)CCCCCCF 34a_200010453038_100015922095 [0,0,0,2,0,0|2,0,0]=4 18497 B18R2.871642 COC(=O)C1C2CC1N(C2)CCCCCCO 2230a_200010453038_100000766143 [0,0,0,2,0,0|2,0,0]=4 18498 B18R2.871642 COC(=O)C1C2CC1N(C2)CCCCCCO 269982a_200010453038_100000766143 [0,0,0,2,0,0|2,0,0]=4 18499 B18R2.871642 COC(=O)C1C2CC1N(C2)CCCCCCO 34a_200010453038_100000766143 [0,0,0,2,0,0|2,0,0]=4 18500 B18R2.40094 O=C1CCC1CCOCC2CCCCCCC2 7a_100011216312_200016118888 [0,0,0,2,0,0|2,0,0]=4 18501 B18R2.527423 O=C1CCC1CCNCCC2CCCCCC2 2230a_100011532351_200016118888 [0,0,0,2,0,0|2,0,0]=4 18502 B18R2.95251 COC(=O)CCOC[C@@H]1CCCN1CC2CC2 34a_100012446949_100000742370 [0,0,0,2,0,0|2,0,0]=4 18503 B18R2.95251 COC(=O)CCOC[C@@H]1CCCN1CC2CC2 7a_100012446949_100000204255 [0,0,0,2,0,0|2,0,0]=4 18504 B18R2.100523 CCCCC1CCCC1N2CC[C@H]2C(=O)OC 270004a_102516456887_100000750825 [0,0,0,2,0,0|1,0,0]=3 18505 B18R2.103875 CCN1C[C@H]2C[C@@H]1CN2CCCCC(=O)OC 2230a_200016994038_100000204269 [0,0,0,2,0,0|2,0,0]=4 18506 B18R2.103875 CCN1C[C@H]2C[C@@H]1CN2CCCCC(=O)OC 269982a_200016994038_100000204269 [0,0,0,2,0,0|2,0,0]=4 18507 B18R2.9577 COC(=O)[C@@H]1CCCN1CCC2CCCN2C 2230a_100000752040_100000005710 [0,0,0,2,0,0|2,0,0]=4 18508 B18R2.9577 COC(=O)[C@@H]1CCCN1CCC2CCCN2C 269982a_100000752040_100000005710 [0,0,0,2,0,0|2,0,0]=4 18509 B18R2.97776 CNC(=O)[C@@H]1CCCN1CC2CCCCCC2 2230a_100015185040_200000696569 [0,0,0,2,0,0|2,0,0]=4 18510 B18R2.97776 CNC(=O)[C@@H]1CCCN1CC2CCCCCC2 269982a_100015185040_200000696569 [0,0,0,2,0,0|2,0,0]=4 18511 B18R2.97776 CNC(=O)[C@@H]1CCCN1CC2CCCCCC2 34a_100015185040_200000696569 [0,0,0,2,0,0|2,0,0]=4 18512 B18R2.97776 COC(=O)C1CCCC1OC2CCCCCC2 34a_200000081814_100011217769 [0,0,0,2,0,0|1,0,0]=3 18513 B18R2.97776 COC(=O)C1CSCN1CC2CCCCCC2 269982a_200000724679_200000696569 [0,0,0,2,0,0|2,0,0]=4 18514 B18R2.97776 COC(=O)C1SCCN1CC2CCCCCC2 2230a_100015296106_200000696569 [0,0,0,2,0,0|2,0,0]=4 18515 B18R2.97776 COC(=O)C1SCCN1CC2CCCCCC2 269982a_100015296106_200000696569 [0,0,0,2,0,0|2,0,0]=4 18516 B18R2.97776 COC(=O)[C@@H]1CCCN1CC2CCCCCC2 2230a_100000752040_200000696569 [0,0,0,2,0,0|1,0,0]=3 18517 B18R2.97776 COC(=O)[C@@H]1CCCN1CC2CCCCCC2 269982a_100000752040_200000696569 [0,0,0,2,0,0|1,0,0]=3 18518 B18R2.97930 CNC(=O)[C@@H]1CCCN1C2CCCCCCC2 270004a_100015185040_100000210524 [0,0,0,2,0,0|2,0,0]=4 18519 B18R2.97930 COC(=O)C1CSCN1C2CCCCCCC2 270004a_200000724679_100000210524 [0,0,0,2,0,0|2,0,0]=4 18520 B18R2.97930 COC(=O)C1SCCN1C2CCCCCCC2 270004a_100015296106_100000210524 [0,0,0,2,0,0|2,0,0]=4 18521 B18R2.97930 COC(=O)[C@@H]1CCCN1C2CCCCCCC2 270004a_100000752040_100000210524 [0,0,0,2,0,0|1,0,0]=3 18522 B18R2.8510 CCCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 2230a_100102885509_100000210211 [0,0,0,2,0,0|1,0,0]=3 18523 B18R2.8510 CCCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 269982a_100102885509_100000210211 [0,0,0,2,0,0|1,0,0]=3 18524 B18R2.8510 CCCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 34a_100102885509_100000210210 [0,0,0,2,0,0|1,0,0]=3 18525 B18R2.8510 CCOCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 269982a_100102885509_100000739092 [0,0,0,2,0,0|2,0,0]=4 18526 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCCF 2230a_100102885509_100011934791 [0,0,0,2,0,0|2,0,0]=4 18527 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCCF 269982a_100102885509_100011934791 [0,0,0,2,0,0|2,0,0]=4 18528 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCCF 34a_100102885509_100011934791 [0,0,0,2,0,0|2,0,0]=4 18529 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCCO 2230a_100102885509_100000230001 [0,0,0,2,0,0|2,0,0]=4 18530 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCCO 269982a_100102885509_100011215043 [0,0,0,2,0,0|2,0,0]=4 18531 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCCO 34a_100102885509_100000230001 [0,0,0,2,0,0|2,0,0]=4 18532 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCSC 2230a_100102885509_100000751147 [0,0,0,2,0,0|2,0,0]=4 18533 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCSC 269982a_100102885509_100000212216 [0,0,0,2,0,0|2,0,0]=4 18534 B18R2.8510 COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCSC 34a_100102885509_100000212216 [0,0,0,2,0,0|2,0,0]=4 18535 B18R2.8510 COCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 2230a_100102885509_100011201679 [0,0,0,2,0,0|2,0,0]=4 18536 B18R2.8510 COCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 269982a_100102885509_100000233755 [0,0,0,2,0,0|2,0,0]=4 18537 B18R2.8510 COCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)OC 34a_100102885509_100011201679 [0,0,0,2,0,0|2,0,0]=4 18538 B18R2.742238 COC(=O)CCCCCCN1CCC12COC2 2230a_100015204706_100009815986 [0,0,0,2,0,0|2,0,0]=4 18539 B18R2.742238 COC(=O)CCCCCCN1CCC12COC2 269982a_100015204706_100009815986 [0,0,0,2,0,0|2,0,0]=4 18540 B18R2.10003 COC(=O)CCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100009816466 [0,0,0,2,0,0|1,0,0]=3 18541 B18R2.10003 COC(=O)CCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100009816466 [0,0,0,2,0,0|1,0,0]=3 18542 B18R2.10003 COC(=O)CCCCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100009816466 [0,0,0,2,0,0|1,0,0]=3 18543 B18R2.10003 COC(=O)CCCCCN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100009816466 [0,0,0,2,0,0|2,0,0]=4 18544 B18R2.10003 COC(=O)CCCCCN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100009816466 [0,0,0,2,0,0|2,0,0]=4 18545 B18R2.10003 COC(=O)CCCCCN1C[C@H]2COC[C@H]2C1 34a_100000700037_100009816466 [0,0,0,2,0,0|2,0,0]=4 18546 B18R2.95604 CNC(=O)CCCOC1CCC2CCCC2C1 34a_100000073670_100000741757 [0,0,0,2,0,0|2,0,0]=4 18547 B18R2.95604 CNC(=O)CCCOC1CCC2CCCC2C1 7a_100000073670_100000741757 [0,0,0,2,0,0|2,0,0]=4 18548 B18R2.95604 COC(=O)CCCCN1CCN2CCC[C@@H]2C1 2230a_100000008389_100000204269 [0,0,0,2,0,0|2,0,0]=4 18549 B18R2.95604 COC(=O)CCCCN1CCN2CCC[C@@H]2C1 269982a_100000008389_100000204269 [0,0,0,2,0,0|2,0,0]=4 18550 B18R2.95604 COC(=O)CCCCN1CCN2CCC[C@@H]2C1 34a_100000008389_100000204269 [0,0,0,2,0,0|2,0,0]=4 18551 B18R2.95604 COC(=O)CCCOC1CCC2CCCC2C1 34a_100000073670_100000742333 [0,0,0,2,0,0|1,0,0]=3 18552 B18R2.95604 COC(=O)CCCOC1CCC2CCCC2C1 7a_100000073670_100011218270 [0,0,0,2,0,0|1,0,0]=3 18553 B18R2.702427 COC(=O)[C@@H]1CCN1CCN2CCCCCC2 269982a_102516456887_100000722644 [0,0,0,2,0,0|2,0,0]=4 18554 B18R2.708757 COC(=O)[C@@H]1CCN1C2CCCCCCCC2 270004a_102516456887_100000038600 [0,0,0,2,0,0|1,0,0]=3 18555 B18R2.96328 COC(=O)CCCCCCN1CCCC12CC2 2230a_100020620911_100009815986 [0,0,0,2,0,0|1,0,0]=3 18556 B18R2.96328 COC(=O)CCCCCCN1CCCC12CC2 269982a_100020620911_100009815986 [0,0,0,2,0,0|1,0,0]=3 18557 B18R2.96328 COC(=O)CCCCCCN1CCCC12CC2 34a_100020620911_100009815986 [0,0,0,2,0,0|1,0,0]=3