0 B11R0.40 C#CC(=O)CC#CCCCCC 1458a_100000211873_100009816472 [0,0,0,0,0,0|1,0,3]=4 1 B11R0.40 C#CC(=O)CCCCCCCC 1458a_100000211873_100000210759 [0,0,0,0,0,0|1,0,3]=4 2 B11R0.40 C#CCCCCNCC(=O)OC 2230a_100000706060_100000747449 [0,0,0,0,0,0|1,0,3]=4 3 B11R0.40 C#CCCCCNCC(=O)OC 34a_100000706060_100000747449 [0,0,0,0,0,0|1,0,3]=4 4 B11R0.40 C#CCCCCOCC(=O)OC 34a_100000766709_100000747449 [0,0,0,0,0,0|1,0,3]=4 5 B11R0.40 C#CCCCCOCC(=O)OC 7a_100000766709_100000747449 [0,0,0,0,0,0|1,0,3]=4 6 B11R0.40 C#CCCCCSCC(=O)OC 62a_100000747449_100010269958 [0,0,0,0,0,0|1,0,3]=4 7 B11R0.40 C#CCCCCSCC(=O)OC 62a_100010269958_100000747449 [0,0,0,0,0,0|1,0,3]=4 8 B11R0.40 C=CC(=O)CC#CCCCCC 1458a_100000185746_100009816472 [0,0,0,0,0,0|1,0,3]=4 9 B11R0.40 C=CC(=O)CCCCCCCC 1458a_100000185746_100000210759 [0,0,0,0,0,0|1,0,3]=4 10 B11R0.40 C=CC(=O)NCCCCCCC 1626a_100000229938_100000185746 [0,0,0,0,0,0|2,0,2]=4 11 B11R0.40 C=CC(=O)NCCCCCCC 240690a_100000229938_200121576911 [0,0,0,0,0,0|2,0,2]=4 12 B11R0.40 C=CCCCCNCC(=O)OC 2230a_100000703577_100000747449 [0,0,0,0,0,0|1,0,3]=4 13 B11R0.40 C=CCCCCNCC(=O)OC 34a_100000703577_100000747449 [0,0,0,0,0,0|1,0,3]=4 14 B11R0.40 C=CCCCCOCC(=O)OC 34a_100000766645_100000747449 [0,0,0,0,0,0|1,0,3]=4 15 B11R0.40 C=CCCCCOCC(=O)OC 7a_100000766645_100000747449 [0,0,0,0,0,0|1,0,3]=4 16 B11R0.40 C=CCCCCSCC(=O)OC 62a_100000747449_100011215482 [0,0,0,0,0,0|1,0,3]=4 17 B11R0.40 C=CCCCCSCC(=O)OC 62a_100011215482_100000747449 [0,0,0,0,0,0|1,0,3]=4 18 B11R0.40 CC/C=C\CCOCC(=O)OC 34a_100016288707_100000747449 [0,0,0,0,0,0|1,0,3]=4 19 B11R0.40 CC/C=C\CCOCC(=O)OC 7a_100016288707_100000747449 [0,0,0,0,0,0|1,0,3]=4 20 B11R0.40 CC/C=C\CCSCC(=O)OC 62a_100000747449_100015370543 [0,0,0,0,0,0|1,0,3]=4 21 B11R0.40 CC/C=C\CCSCC(=O)OC 62a_100015370543_100000747449 [0,0,0,0,0,0|1,0,3]=4 22 B11R0.40 CC=CCCCOCC(=O)OC 34a_100020645299_100000747449 [0,0,0,0,0,0|1,0,3]=4 23 B11R0.40 CCC#CCCOCC(=O)OC 34a_100000036655_100000747449 [0,0,0,0,0,0|1,0,3]=4 24 B11R0.40 CCC#CCCOCC(=O)OC 7a_100000036655_100000747449 [0,0,0,0,0,0|1,0,3]=4 25 B11R0.40 CCC(=O)CCCCCCCO 1458a_100000210414_100000760002 [0,0,0,0,0,0|2,0,2]=4 26 B11R0.40 CCC(=O)CCCCCCCO 1458a_100011219782_100000210202 [0,0,0,0,0,0|2,0,2]=4 27 B11R0.40 CCC(=O)CCCCCCOC 1458a_100000210414_100011998445 [0,0,0,0,0,0|2,0,2]=4 28 B11R0.40 CCC(=O)COCCCCCBr 7a_100000746331_100000747405 [0,0,0,0,0,0|3,0,1]=4 29 B11R0.40 CCC(=O)COCCCCCCl 7a_100000746330_100000747405 [0,0,0,0,0,0|3,0,1]=4 30 B11R0.40 CCC(=O)COCCCCCF 34a_100000725409_100000729378 [0,0,0,0,0,0|3,0,1]=4 31 B11R0.40 CCC(=O)COCCCCCI 7a_200012148887_100000747405 [0,0,0,0,0,0|3,0,1]=4 32 B11R0.40 CCC(=O)COCCCCCO 34a_100000725409_100000746330 [0,0,0,0,0,0|3,0,1]=4 33 B11R0.40 CCC(=O)COCCCCOC 34a_100000725409_100000755781 [0,0,0,0,0,0|3,0,1]=4 34 B11R0.40 CCC(=O)COCCCCSC 7a_100011217163_100000747405 [0,0,0,0,0,0|3,0,1]=4 35 B11R0.40 CCC(=O)CSCCCCCF 62a_100000729378_100000747405 [0,0,0,0,0,0|3,0,1]=4 36 B11R0.40 CCC(=O)CSCCCCCF 62a_100000747405_100000729378 [0,0,0,0,0,0|3,0,1]=4 37 B11R0.40 CCC(=O)CSCCCCCO 62a_100000746330_100000747405 [0,0,0,0,0,0|3,0,1]=4 38 B11R0.40 CCC(=O)CSCCCCCO 62a_100000747405_100000746330 [0,0,0,0,0,0|3,0,1]=4 39 B11R0.40 CCC(=O)CSCCCCOC 62a_100000730899_100000747405 [0,0,0,0,0,0|3,0,1]=4 40 B11R0.40 CCC(=O)CSCCCCOC 62a_100000747405_100000730899 [0,0,0,0,0,0|3,0,1]=4 41 B11R0.40 CCC(=O)NCCCCCCO 240690a_100000686447_100000210414 [0,0,0,0,0,0|3,0,1]=4 42 B11R0.40 CCC(=O)NCCCCCCO 527a_100000686447_100000210414 [0,0,0,0,0,0|3,0,1]=4 43 B11R0.40 CCC(=O)NCCCCCOC 11a_100000747528_100000210414 [0,0,0,0,0,0|3,0,1]=4 44 B11R0.40 CCC(=O)NCCCCCOC 1626a_100000747528_100000210414 [0,0,0,0,0,0|3,0,1]=4 45 B11R0.40 CCC(=O)NCCCCCOC 240690a_100000747528_100000210414 [0,0,0,0,0,0|3,0,1]=4 46 B11R0.40 CCC(=O)NCCCCCOC 527a_100000747528_100000210414 [0,0,0,0,0,0|3,0,1]=4 47 B11R0.40 CCC/C=C/COCC(=O)OC 34a_100016278788_100000747449 [0,0,0,0,0,0|1,0,3]=4 48 B11R0.40 CCC/C=C/COCC(=O)OC 7a_100016278788_100000747449 [0,0,0,0,0,0|1,0,3]=4 49 B11R0.40 CCCC#CCOCC(=O)OC 34a_100000034806_100000747449 [0,0,0,0,0,0|1,0,3]=4 50 B11R0.40 CCCC#CCOCC(=O)OC 7a_100000034806_100000747449 [0,0,0,0,0,0|1,0,3]=4 51 B11R0.40 CCCCC/C=C/CC(=O)CC 1458a_100020675968_100000210202 [0,0,0,0,0,0|1,0,3]=4 52 B11R0.40 CCCCC/C=C/CC(=O)NC 11a_106832991635_100020675968 [0,0,0,0,0,0|1,0,3]=4 53 B11R0.40 CCCCC/C=C/CC(=O)NC 1626a_100102657272_100020675968 [0,0,0,0,0,0|1,0,3]=4 54 B11R0.40 CCCCC/C=C/CC(=O)NC 240690a_100102657272_100020675968 [0,0,0,0,0,0|1,0,3]=4 55 B11R0.40 CCCCCC#CCC(=O)CC 1458a_100000210414_100009816472 [0,0,0,0,0,0|1,0,2]=3 56 B11R0.40 CCCCCC#CCC(=O)CO 1458a_100000210174_100009816472 [0,0,0,0,0,0|2,0,2]=4 57 B11R0.40 CCCCCC=NNC(=O)CC 4a_100000183195_100000737632 [0,0,0,0,0,0|3,0,1]=4 58 B11R0.40 CCCCCCC=CC(=O)CC 1458a_200015324643_100000210202 [0,0,0,0,0,0|1,0,2]=3 59 B11R0.40 CCCCCCC=CC(=O)CF 1458a_200015324643_100015361967 [0,0,0,0,0,0|2,0,2]=4 60 B11R0.40 CCCCCCC=CC(=O)NC 11a_106832991635_200015324643 [0,0,0,0,0,0|1,0,2]=3 61 B11R0.40 CCCCCCC=CC(=O)NC 1626a_100102657272_200015324643 [0,0,0,0,0,0|1,0,2]=3 62 B11R0.40 CCCCCCC=CC(=O)NC 240690a_100102657272_200015324643 [0,0,0,0,0,0|1,0,2]=3 63 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210188_100000210202 [0,0,0,0,0,0|1,0,2]=3 64 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210414_100000210759 [0,0,0,0,0,0|1,0,2]=3 65 B11R0.40 CCCCCCCCC(=O)CF 1458a_100000210188_100015361967 [0,0,0,0,0,0|2,0,2]=4 66 B11R0.40 CCCCCCCCC(=O)CO 1458a_100000210174_100000210759 [0,0,0,0,0,0|2,0,2]=4 67 B11R0.40 CCCCCCCCC(=O)NC 11a_106832991635_100000210188 [0,0,0,0,0,0|1,0,2]=3 68 B11R0.40 CCCCCCCCC(=O)NC 1626a_100102657272_100000210188 [0,0,0,0,0,0|1,0,2]=3 69 B11R0.40 CCCCCCCCC(=O)NC 240690a_100102657272_100000210188 [0,0,0,0,0,0|1,0,2]=3 70 B11R0.40 CCCCCCCCC(=O)NC 527a_100102657272_100000210188 [0,0,0,0,0,0|1,0,2]=3 71 B11R0.40 CCCCCCCCC(C)OC 34a_100000210740_200000210301 [0,0,0,0,0,0|1,0,3]=4 72 B11R0.40 CCCCCCCCC(C)OC 7a_100000210740_200000210301 [0,0,0,0,0,0|1,0,3]=4 73 B11R0.40 CCCCCCCCC(C)O[13CH3] 34a_100000210740_200025704644 [0,0,0,0,0,0|1,0,3]=4 74 B11R0.40 CCCCCCCCC(C)O[13CH3] 7a_100000210740_200025704644 [0,0,0,0,0,0|1,0,3]=4 75 B11R0.40 CCCCCCCNC(=O)CC 11a_100000229938_100000210414 [0,0,0,0,0,0|2,0,1]=3 76 B11R0.40 CCCCCCCNC(=O)CC 1626a_100000229938_100000210414 [0,0,0,0,0,0|2,0,1]=3 77 B11R0.40 CCCCCCCNC(=O)CC 240690a_100000229938_100000210414 [0,0,0,0,0,0|2,0,1]=3 78 B11R0.40 CCCCCCCNC(=O)CC 527a_100000229938_100000210414 [0,0,0,0,0,0|2,0,1]=3 79 B11R0.40 CCCCCCCNC(=O)CO 240690a_100000229938_100000210174 [0,0,0,0,0,0|3,0,1]=4 80 B11R0.40 CCCCCCCNC(=O)CO 527a_100000229938_100000210174 [0,0,0,0,0,0|3,0,1]=4 81 B11R0.40 CCCCCCCNC(=O)NC 2708a_100000229938_106832991635 [0,0,0,0,0,0|2,0,1]=3 82 B11R0.40 CCCCCCCNC(=O)NC 2708a_100102657272_100000229938 [0,0,0,0,0,0|2,0,1]=3 83 B11R0.40 CCCCCCCNC(=O)NC 273464a_100000229938_100102657272 [0,0,0,0,0,0|2,0,1]=3 84 B11R0.40 CCCCCCCNC(=O)NC 273464a_100102657272_100000229938 [0,0,0,0,0,0|2,0,1]=3 85 B11R0.40 CCCCCCCNC(=O)NC 512a_100000229938_100102657272 [0,0,0,0,0,0|2,0,1]=3 86 B11R0.40 CCCCCCCNC(=O)NC 512a_106832991638_100000229938 [0,0,0,0,0,0|2,0,1]=3 87 B11R0.40 CCCCCCCSC(C)OC 62a_100000210614_100009879195 [0,0,0,0,0,0|2,0,2]=4 88 B11R0.40 CCCCCCCSC(C)OC 62a_100009879195_100000210316 [0,0,0,0,0,0|2,0,2]=4 89 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000210581_100000183359 [0,0,0,0,0,0|2,0,1]=3 90 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000693194_100000210314 [0,0,0,0,0,0|2,0,1]=3 91 B11R0.40 CCCCCCNCC(=O)OC 2230a_100000210581_100000747449 [0,0,0,0,0,0|1,0,1]=2 92 B11R0.40 CCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210314 [0,0,0,0,0,0|2,0,2]=4 93 B11R0.40 CCCCCCOCC(=O)CC 34a_100000725409_100000210314 [0,0,0,0,0,0|2,0,1]=3 94 B11R0.40 CCCCCCOCC(=O)CC 7a_100000210259_100000747405 [0,0,0,0,0,0|2,0,1]=3 95 B11R0.40 CCCCCCOCC(=O)NC 34a_100000210259_100000183359 [0,0,0,0,0,0|2,0,1]=3 96 B11R0.40 CCCCCCOCC(=O)NC 34a_100000750040_100000210314 [0,0,0,0,0,0|2,0,1]=3 97 B11R0.40 CCCCCCOCC(=O)NC 7a_100000210259_100000183359 [0,0,0,0,0,0|2,0,1]=3 98 B11R0.40 CCCCCCOCC(=O)OC 34a_100000210259_100000747449 [0,0,0,0,0,0|1,0,1]=2 99 B11R0.40 CCCCCCOCC(=O)OC 7a_100000210259_100000747449 [0,0,0,0,0,0|1,0,1]=2 100 B11R0.40 CCCCCCOCC(C)OC 34a_100000690652_100000210314 [0,0,0,0,0,0|2,0,2]=4 101 B11R0.40 CCCCCCSCC(=O)CC 62a_100000210314_100000747405 [0,0,0,0,0,0|2,0,1]=3 102 B11R0.40 CCCCCCSCC(=O)CC 62a_100000747405_100000210757 [0,0,0,0,0,0|2,0,1]=3 103 B11R0.40 CCCCCCSCC(=O)NC 62a_100000183359_100000210757 [0,0,0,0,0,0|2,0,1]=3 104 B11R0.40 CCCCCCSCC(=O)NC 62a_100000210314_100000183359 [0,0,0,0,0,0|2,0,1]=3 105 B11R0.40 CCCCCCSCC(=O)OC 62a_100000210314_100000747449 [0,0,0,0,0,0|1,0,1]=2 106 B11R0.40 CCCCCCSCC(=O)OC 62a_100000747449_100000210757 [0,0,0,0,0,0|1,0,1]=2 107 B11R0.40 CCCCCNCCC(=O)NC 2230a_100000209983_100000737683 [0,0,0,0,0,0|2,0,2]=4 108 B11R0.40 CCCCCNCCC(=O)NC 2230a_100000738227_100000210326 [0,0,0,0,0,0|2,0,2]=4 109 B11R0.40 CCCCCNCCC(=O)NC 34a_100000738227_100000718602 [0,0,0,0,0,0|2,0,2]=4 110 B11R0.40 CCCCCNCCC(=O)OC 2230a_100000209983_100000204255 [0,0,0,0,0,0|1,0,2]=3 111 B11R0.40 CCCCCNN=CC(=O)OC 4a_100000694160_200011823558 [0,0,0,0,0,0|2,0,1]=3 112 B11R0.40 CCCCCOCCC(=O)NC 34a_100000210253_100012179268 [0,0,0,0,0,0|2,0,2]=4 113 B11R0.40 CCCCCOCCC(=O)NC 34a_100000754576_100000718602 [0,0,0,0,0,0|2,0,2]=4 114 B11R0.40 CCCCCOCCC(=O)NC 7a_100000210253_100000737683 [0,0,0,0,0,0|2,0,2]=4 115 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [0,0,0,0,0,0|1,0,2]=3 116 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [0,0,0,0,0,0|1,0,2]=3 117 B11R0.40 CCCCCSCCC(=O)NC 62a_100000210326_100000737683 [0,0,0,0,0,0|2,0,2]=4 118 B11R0.40 CCCCCSCCC(=O)NC 62a_100000737683_100000210326 [0,0,0,0,0,0|2,0,2]=4 119 B11R0.40 CCCCCSCCC(=O)OC 62a_100000204255_100000210326 [0,0,0,0,0,0|1,0,2]=3 120 B11R0.40 CCCCCSCCC(=O)OC 62a_100000210326_100000204255 [0,0,0,0,0,0|1,0,2]=3 121 B11R0.40 CCCCCSCOC(=O)OC 62a_100000210326_100000139417 [0,0,0,0,0,0|2,0,1]=3 122 B11R0.40 CCCCNC/C=C/C(=O)OC 2230a_100000102301_100000742655 [0,0,0,0,0,0|1,0,2]=3 123 B11R0.40 CCCCNC/C=C/C(=O)OC 7a_106832991798_100000742655 [0,0,0,0,0,0|1,0,2]=3 124 B11R0.40 CCCCNCCCC(=O)NC 2230a_100000102301_100000741757 [0,0,0,0,0,0|2,0,2]=4 125 B11R0.40 CCCCNCCCC(=O)NC 2230a_100000740002_100000210211 [0,0,0,0,0,0|2,0,2]=4 126 B11R0.40 CCCCNCCCC(=O)NC 34a_100000740002_100000210210 [0,0,0,0,0,0|2,0,2]=4 127 B11R0.40 CCCCNCCCC(=O)NC 7a_106832991798_100000741757 [0,0,0,0,0,0|2,0,2]=4 128 B11R0.40 CCCCNCCCC(=O)OC 2230a_100000102301_100011218270 [0,0,0,0,0,0|1,0,2]=3 129 B11R0.40 CCCCNCCCC(=O)OC 7a_106832991798_100011218270 [0,0,0,0,0,0|1,0,2]=3 130 B11R0.40 CCCCNCCNC(=O)CC 34a_100132302217_100000210210 [0,0,0,0,0,0|3,0,1]=4 131 B11R0.40 CCCCNCCNC(=O)NC 34a_100015205895_100000210210 [0,0,0,0,0,0|3,0,1]=4 132 B11R0.40 CCCCNCCOC(=O)NC 7a_106832991798_200011997002 [0,0,0,0,0,0|3,0,1]=4 133 B11R0.40 CCCCNN=CCC(=O)OC 4a_100025702795_200011552997 [0,0,0,0,0,0|2,0,2]=4 134 B11R0.40 CCCCOC/C=C/C(=O)OC 34a_100000210227_100000742655 [0,0,0,0,0,0|1,0,2]=3 135 B11R0.40 CCCCOC/C=C/C(=O)OC 7a_100000210227_100000742655 [0,0,0,0,0,0|1,0,2]=3 136 B11R0.40 CCCCOCCCC(=O)NC 34a_100000210227_100000741757 [0,0,0,0,0,0|2,0,2]=4 137 B11R0.40 CCCCOCCCC(=O)NC 7a_100000210227_100000741757 [0,0,0,0,0,0|2,0,2]=4 138 B11R0.40 CCCCOCCCC(=O)OC 34a_100000210227_100000742333 [0,0,0,0,0,0|1,0,2]=3 139 B11R0.40 CCCCOCCCC(=O)OC 7a_100000210227_100011218270 [0,0,0,0,0,0|1,0,2]=3 140 B11R0.40 CCCCOCCNC(=O)CC 34a_200000158885_100000210210 [0,0,0,0,0,0|3,0,1]=4 141 B11R0.40 CCCCOCCNC(=O)CC 7a_200000158885_100000210211 [0,0,0,0,0,0|3,0,1]=4 142 B11R0.40 CCCCOCCNC(=O)OC 34a_100000757965_100000210210 [0,0,0,0,0,0|2,0,1]=3 143 B11R0.40 CCCCOCCOC(=O)CC 7a_200000031056_100000210211 [0,0,0,0,0,0|3,0,1]=4 144 B11R0.40 CCCCOCCOC(=O)NC 34a_100000210227_200011997002 [0,0,0,0,0,0|3,0,1]=4 145 B11R0.40 CCCCOCCOC(=O)NC 7a_100000210227_200011997002 [0,0,0,0,0,0|3,0,1]=4 146 B11R0.40 CCCCOCCOC(=O)OC 34a_100010262106_100000210210 [0,0,0,0,0,0|2,0,1]=3 147 B11R0.40 CCCCOCNCC(=O)NC 2230a_100000693194_100011995733 [0,0,0,0,0,0|3,0,1]=4 148 B11R0.40 CCCCOCOCC(=O)CC 34a_100000725409_100011995733 [0,0,0,0,0,0|3,0,1]=4 149 B11R0.40 CCCCOCOCC(=O)NC 34a_100000750040_100011995733 [0,0,0,0,0,0|3,0,1]=4 150 B11R0.40 CCCCOCSCC(=O)CC 62a_100000747405_100011995733 [0,0,0,0,0,0|3,0,1]=4 151 B11R0.40 CCCCOCSCC(=O)CC 62a_100011995733_100000747405 [0,0,0,0,0,0|3,0,1]=4 152 B11R0.40 CCCCOCSCC(=O)NC 62a_100000183359_100011995733 [0,0,0,0,0,0|3,0,1]=4 153 B11R0.40 CCCCOCSCC(=O)NC 62a_100011995733_100000183359 [0,0,0,0,0,0|3,0,1]=4 154 B11R0.40 CCCCOCSCC(=O)OC 62a_100000747449_100011995733 [0,0,0,0,0,0|2,0,1]=3 155 B11R0.40 CCCCOCSCC(=O)OC 62a_100011995733_100000747449 [0,0,0,0,0,0|2,0,1]=3 156 B11R0.40 CCCCSC/C=C/C(=O)OC 62a_100000210211_100000742655 [0,0,0,0,0,0|1,0,2]=3 157 B11R0.40 CCCCSC/C=C/C(=O)OC 62a_100000742655_100000210210 [0,0,0,0,0,0|1,0,2]=3 158 B11R0.40 CCCCSCCCC(=O)NC 62a_100000210211_100000741757 [0,0,0,0,0,0|2,0,2]=4 159 B11R0.40 CCCCSCCCC(=O)NC 62a_100000741757_100000210210 [0,0,0,0,0,0|2,0,2]=4 160 B11R0.40 CCCCSCCCC(=O)OC 62a_100000210211_100011218270 [0,0,0,0,0,0|1,0,2]=3 161 B11R0.40 CCCCSCCCC(=O)OC 62a_100011218270_100000210210 [0,0,0,0,0,0|1,0,2]=3 162 B11R0.40 CCCCSCCNC(=O)CC 11a_100025743550_100000210414 [0,0,0,0,0,0|3,0,1]=4 163 B11R0.40 CCCCSCCNC(=O)CC 1626a_100025743550_100000210414 [0,0,0,0,0,0|3,0,1]=4 164 B11R0.40 CCCCSCCNC(=O)CC 240690a_100025743550_100000210414 [0,0,0,0,0,0|3,0,1]=4 165 B11R0.40 CCCCSCCNC(=O)CC 527a_100025743550_100000210414 [0,0,0,0,0,0|3,0,1]=4 166 B11R0.40 CCCCSCCNC(=O)NC 2708a_100025743550_106832991635 [0,0,0,0,0,0|3,0,1]=4 167 B11R0.40 CCCCSCCNC(=O)NC 2708a_100102657272_100025743550 [0,0,0,0,0,0|3,0,1]=4 168 B11R0.40 CCCCSCCNC(=O)NC 273464a_100025743550_100102657272 [0,0,0,0,0,0|3,0,1]=4 169 B11R0.40 CCCCSCCNC(=O)NC 273464a_100102657272_100025743550 [0,0,0,0,0,0|3,0,1]=4 170 B11R0.40 CCCCSCCNC(=O)NC 512a_100025743550_100102657272 [0,0,0,0,0,0|3,0,1]=4 171 B11R0.40 CCCCSCCNC(=O)NC 512a_106832991638_100025743550 [0,0,0,0,0,0|3,0,1]=4 172 B11R0.40 CCCCSCCOC(=O)NC 62a_100000210211_200011997002 [0,0,0,0,0,0|3,0,1]=4 173 B11R0.40 CCCCSCCOC(=O)NC 62a_200011997002_100000210210 [0,0,0,0,0,0|3,0,1]=4 174 B11R0.40 CCCOCCCCC(=O)OC 34a_100000059025_100000210303 [0,0,0,0,0,0|1,0,2]=3 175 B11R0.40 CCCOCCCCC(=O)OC 34a_100000210258_100000204269 [0,0,0,0,0,0|1,0,2]=3 176 B11R0.40 CCCOCCCCC(=O)OC 7a_100000059025_100000210303 [0,0,0,0,0,0|1,0,2]=3 177 B11R0.40 CCCOCCCNC(=O)CC 1626a_100011217757_100000210414 [0,0,0,0,0,0|3,0,1]=4 178 B11R0.40 CCCOCCCNC(=O)CC 240690a_100011217757_100000210414 [0,0,0,0,0,0|3,0,1]=4 179 B11R0.40 CCCOCCCNC(=O)CC 527a_100011217757_100000210414 [0,0,0,0,0,0|3,0,1]=4 180 B11R0.40 CCCOCCCNC(=O)NC 2708a_100011217757_106832991635 [0,0,0,0,0,0|3,0,1]=4 181 B11R0.40 CCCOCCCNC(=O)NC 2708a_100102657272_100011217757 [0,0,0,0,0,0|3,0,1]=4 182 B11R0.40 CCCOCCCNC(=O)NC 273464a_100011217757_100102657272 [0,0,0,0,0,0|3,0,1]=4 183 B11R0.40 CCCOCCCNC(=O)NC 273464a_100102657272_100011217757 [0,0,0,0,0,0|3,0,1]=4 184 B11R0.40 CCCOCCCNC(=O)NC 512a_100011217757_100102657272 [0,0,0,0,0,0|3,0,1]=4 185 B11R0.40 CCCOCCCNC(=O)NC 512a_106832991638_100011217757 [0,0,0,0,0,0|3,0,1]=4 186 B11R0.40 CCCOCCNCC(=O)NC 2230a_100000693194_100011215938 [0,0,0,0,0,0|3,0,1]=4 187 B11R0.40 CCCOCCNCC(=O)NC 2230a_100161115042_100000183359 [0,0,0,0,0,0|3,0,1]=4 188 B11R0.40 CCCOCCNCC(=O)NC 34a_100161115042_100000183359 [0,0,0,0,0,0|3,0,1]=4 189 B11R0.40 CCCOCCNCC(=O)OC 2230a_100161115042_100000747449 [0,0,0,0,0,0|2,0,1]=3 190 B11R0.40 CCCOCCNCC(=O)OC 34a_100161115042_100000747449 [0,0,0,0,0,0|2,0,1]=3 191 B11R0.40 CCCOCCOCC(=O)CC 34a_100000725409_100011215938 [0,0,0,0,0,0|3,0,1]=4 192 B11R0.40 CCCOCCOCC(=O)CC 7a_100000752267_100000747405 [0,0,0,0,0,0|3,0,1]=4 193 B11R0.40 CCCOCCOCC(=O)NC 34a_100000750040_100011215938 [0,0,0,0,0,0|3,0,1]=4 194 B11R0.40 CCCOCCOCC(=O)NC 34a_100000752267_100000183359 [0,0,0,0,0,0|3,0,1]=4 195 B11R0.40 CCCOCCOCC(=O)NC 7a_100000752267_100000183359 [0,0,0,0,0,0|3,0,1]=4 196 B11R0.40 CCCOCCOCC(=O)OC 34a_100000210258_100000090808 [0,0,0,0,0,0|2,0,1]=3 197 B11R0.40 CCCOCCOCC(=O)OC 34a_100000752267_100000747449 [0,0,0,0,0,0|2,0,1]=3 198 B11R0.40 CCCOCCOCC(=O)OC 7a_100000752267_100000747449 [0,0,0,0,0,0|2,0,1]=3 199 B11R0.40 CCCOCCSCC(=O)CC 62a_100000747405_100011215938 [0,0,0,0,0,0|3,0,1]=4 200 B11R0.40 CCCOCCSCC(=O)CC 62a_100011215938_100000747405 [0,0,0,0,0,0|3,0,1]=4 201 B11R0.40 CCCOCCSCC(=O)NC 62a_100000183359_100011215938 [0,0,0,0,0,0|3,0,1]=4 202 B11R0.40 CCCOCCSCC(=O)NC 62a_100011215938_100000183359 [0,0,0,0,0,0|3,0,1]=4 203 B11R0.40 CCCOCCSCC(=O)OC 62a_100000747449_100011215938 [0,0,0,0,0,0|2,0,1]=3 204 B11R0.40 CCCOCCSCC(=O)OC 62a_100011215938_100000747449 [0,0,0,0,0,0|2,0,1]=3 205 B11R0.40 CCCSCCCCC(=O)OC 62a_100000204269_100000210303 [0,0,0,0,0,0|1,0,2]=3 206 B11R0.40 CCCSCCCCC(=O)OC 62a_100000210303_100000204269 [0,0,0,0,0,0|1,0,2]=3 207 B11R0.40 CCCSCCNCC(=O)NC 2230a_100020603323_100000183359 [0,0,0,0,0,0|3,0,1]=4 208 B11R0.40 CCCSCCNCC(=O)OC 2230a_100020603323_100000747449 [0,0,0,0,0,0|2,0,1]=3 209 B11R0.40 CCCSCCOCC(=O)CC 7a_200000230433_100000747405 [0,0,0,0,0,0|3,0,1]=4 210 B11R0.40 CCCSCCOCC(=O)NC 34a_200000230433_100000183359 [0,0,0,0,0,0|3,0,1]=4 211 B11R0.40 CCCSCCOCC(=O)NC 7a_200000230433_100000183359 [0,0,0,0,0,0|3,0,1]=4 212 B11R0.40 CCCSCCOCC(=O)OC 34a_200000230433_100000747449 [0,0,0,0,0,0|2,0,1]=3 213 B11R0.40 CCCSCCOCC(=O)OC 62a_100000090808_100000210303 [0,0,0,0,0,0|2,0,1]=3 214 B11R0.40 CCCSCCOCC(=O)OC 62a_100000210303_100000090808 [0,0,0,0,0,0|2,0,1]=3 215 B11R0.40 CCCSCCOCC(=O)OC 7a_200000230433_100000747449 [0,0,0,0,0,0|2,0,1]=3 216 B11R0.40 CCNCCCCCC(=O)OC 2230a_100015525214_100009816466 [0,0,0,0,0,0|1,0,2]=3 217 B11R0.40 CCOCCCCCC(=O)OC 34a_100000074720_100000210202 [0,0,0,0,0,0|1,0,2]=3 218 B11R0.40 CCOCCCCCC(=O)OC 34a_100121572206_100009816466 [0,0,0,0,0,0|1,0,2]=3 219 B11R0.40 CCOCCCCCC(=O)OC 7a_100000074720_100000210202 [0,0,0,0,0,0|1,0,2]=3 220 B11R0.40 CCOCCCNCC(=O)NC 2230a_100000210961_100000183359 [0,0,0,0,0,0|3,0,1]=4 221 B11R0.40 CCOCCCNCC(=O)NC 2230a_100000693194_100012232248 [0,0,0,0,0,0|3,0,1]=4 222 B11R0.40 CCOCCCNCC(=O)NC 34a_100000210961_100000183359 [0,0,0,0,0,0|3,0,1]=4 223 B11R0.40 CCOCCCNCC(=O)OC 2230a_100000210961_100000747449 [0,0,0,0,0,0|2,0,1]=3 224 B11R0.40 CCOCCCNCC(=O)OC 34a_100000210961_100000747449 [0,0,0,0,0,0|2,0,1]=3 225 B11R0.40 CCOCCCOCC(=O)CC 34a_100000725409_100012232248 [0,0,0,0,0,0|3,0,1]=4 226 B11R0.40 CCOCCCOCC(=O)CC 7a_100000757476_100000747405 [0,0,0,0,0,0|3,0,1]=4 227 B11R0.40 CCOCCCOCC(=O)NC 34a_100000750040_100012232248 [0,0,0,0,0,0|3,0,1]=4 228 B11R0.40 CCOCCCOCC(=O)NC 34a_100000757476_100000183359 [0,0,0,0,0,0|3,0,1]=4 229 B11R0.40 CCOCCCOCC(=O)NC 7a_100000757476_100000183359 [0,0,0,0,0,0|3,0,1]=4 230 B11R0.40 CCOCCCOCC(=O)OC 34a_100000757476_100000747449 [0,0,0,0,0,0|2,0,1]=3 231 B11R0.40 CCOCCCOCC(=O)OC 7a_100000757476_100000747449 [0,0,0,0,0,0|2,0,1]=3 232 B11R0.40 CCOCCCSCC(=O)CC 62a_100000747405_100012232248 [0,0,0,0,0,0|3,0,1]=4 233 B11R0.40 CCOCCCSCC(=O)CC 62a_100012232248_100000747405 [0,0,0,0,0,0|3,0,1]=4 234 B11R0.40 CCOCCCSCC(=O)NC 62a_100000183359_100012232248 [0,0,0,0,0,0|3,0,1]=4 235 B11R0.40 CCOCCCSCC(=O)NC 62a_100012232248_100000183359 [0,0,0,0,0,0|3,0,1]=4 236 B11R0.40 CCOCCCSCC(=O)OC 62a_100000747449_100012232248 [0,0,0,0,0,0|2,0,1]=3 237 B11R0.40 CCOCCCSCC(=O)OC 62a_100012232248_100000747449 [0,0,0,0,0,0|2,0,1]=3 238 B11R0.40 CCOCCNCCC(=O)OC 2230a_102516460346_100000204255 [0,0,0,0,0,0|2,0,2]=4 239 B11R0.40 CCOCCNCCC(=O)OC 34a_102516460346_100000742370 [0,0,0,0,0,0|2,0,2]=4 240 B11R0.40 CCOCCNN=CC(=O)OC 4a_100000732670_200011823558 [0,0,0,0,0,0|3,0,1]=4 241 B11R0.40 CCOCCOCCC(=O)OC 34a_100000210136_100000742370 [0,0,0,0,0,0|2,0,2]=4 242 B11R0.40 CCOCCOCCC(=O)OC 7a_100000210136_100000204255 [0,0,0,0,0,0|2,0,2]=4 243 B11R0.40 CCOCCSCCC(=O)OC 62a_100000204255_100011215890 [0,0,0,0,0,0|2,0,2]=4 244 B11R0.40 CCOCCSCCC(=O)OC 62a_100000210147_100000204255 [0,0,0,0,0,0|2,0,2]=4 245 B11R0.40 CCOCCSCOC(=O)OC 62a_100000210147_100000139417 [0,0,0,0,0,0|3,0,1]=4 246 B11R0.40 CCOCSC/C=C/C(=O)OC 62a_100000739092_100000742655 [0,0,0,0,0,0|2,0,2]=4 247 B11R0.40 CCOCSC/C=C/C(=O)OC 62a_100000742655_100000739092 [0,0,0,0,0,0|2,0,2]=4 248 B11R0.40 CCOCSCCCC(=O)OC 62a_100000739092_100011218270 [0,0,0,0,0,0|2,0,2]=4 249 B11R0.40 CCOCSCCCC(=O)OC 62a_100011218270_100000739092 [0,0,0,0,0,0|2,0,2]=4 250 B11R0.40 CCSCCCCCC(=O)OC 62a_100000210202_100009816466 [0,0,0,0,0,0|1,0,2]=3 251 B11R0.40 CCSCCCCCC(=O)OC 62a_100009816466_100000210202 [0,0,0,0,0,0|1,0,2]=3 252 B11R0.40 CCSCCCOCC(=O)CC 7a_100011216438_100000747405 [0,0,0,0,0,0|3,0,1]=4 253 B11R0.40 CCSCCCOCC(=O)NC 34a_100011216438_100000183359 [0,0,0,0,0,0|3,0,1]=4 254 B11R0.40 CCSCCCOCC(=O)NC 7a_100011216438_100000183359 [0,0,0,0,0,0|3,0,1]=4 255 B11R0.40 CCSCCCOCC(=O)OC 34a_100011216438_100000747449 [0,0,0,0,0,0|2,0,1]=3 256 B11R0.40 CCSCCCOCC(=O)OC 7a_100011216438_100000747449 [0,0,0,0,0,0|2,0,1]=3 257 B11R0.40 CCSCCNCCC(=O)OC 2230a_100000106463_100000204255 [0,0,0,0,0,0|2,0,2]=4 258 B11R0.40 CCSCCOCCC(=O)OC 34a_100000212035_100000742370 [0,0,0,0,0,0|2,0,2]=4 259 B11R0.40 CCSCCOCCC(=O)OC 7a_100000212035_100000204255 [0,0,0,0,0,0|2,0,2]=4 260 B11R0.40 CCSCCSCCC(=O)OC 62a_100000204255_100000757381 [0,0,0,0,0,0|2,0,2]=4 261 B11R0.40 CCSCCSCCC(=O)OC 62a_100000757381_100000204255 [0,0,0,0,0,0|2,0,2]=4 262 B11R0.40 CCSCCSCOC(=O)OC 62a_100000757381_100000139417 [0,0,0,0,0,0|3,0,1]=4 263 B11R0.40 CNC(=O)CCCCCCCO 240690a_100102657272_100011219782 [0,0,0,0,0,0|2,0,2]=4 264 B11R0.40 CNC(=O)CNCCCCCF 2230a_100000693194_100000729378 [0,0,0,0,0,0|3,0,1]=4 265 B11R0.40 CNC(=O)CNCCCCCO 2230a_100000693194_100000746330 [0,0,0,0,0,0|3,0,1]=4 266 B11R0.40 CNC(=O)CNCCCCCO 2230a_100000762737_100000183359 [0,0,0,0,0,0|3,0,1]=4 267 B11R0.40 CNC(=O)CNCCCCCO 34a_100000762737_100000183359 [0,0,0,0,0,0|3,0,1]=4 268 B11R0.40 CNC(=O)CNCCCCOC 2230a_100000693194_100000730899 [0,0,0,0,0,0|3,0,1]=4 269 B11R0.40 CNC(=O)COCCCCCBr 34a_100000746331_100000183359 [0,0,0,0,0,0|3,0,1]=4 270 B11R0.40 CNC(=O)COCCCCCBr 7a_100000746331_100000183359 [0,0,0,0,0,0|3,0,1]=4 271 B11R0.40 CNC(=O)COCCCCCCl 34a_100000746330_100000183359 [0,0,0,0,0,0|3,0,1]=4 272 B11R0.40 CNC(=O)COCCCCCCl 7a_100000746330_100000183359 [0,0,0,0,0,0|3,0,1]=4 273 B11R0.40 CNC(=O)COCCCCCF 34a_100000750040_100000729378 [0,0,0,0,0,0|3,0,1]=4 274 B11R0.40 CNC(=O)COCCCCCI 34a_200012148887_100000183359 [0,0,0,0,0,0|3,0,1]=4 275 B11R0.40 CNC(=O)COCCCCCI 7a_200012148887_100000183359 [0,0,0,0,0,0|3,0,1]=4 276 B11R0.40 CNC(=O)COCCCCCN 34a_100000762737_100000183359 [0,0,0,0,0,0|3,0,1]=4 277 B11R0.40 CNC(=O)COCCCCCO 34a_100000750040_100000746330 [0,0,0,0,0,0|3,0,1]=4 278 B11R0.40 CNC(=O)COCCCCOC 34a_100000740925_100000183359 [0,0,0,0,0,0|3,0,1]=4 279 B11R0.40 CNC(=O)COCCCCOC 34a_100000750040_100000755781 [0,0,0,0,0,0|3,0,1]=4 280 B11R0.40 CNC(=O)COCCCCSC 34a_100011217163_100000183359 [0,0,0,0,0,0|3,0,1]=4 281 B11R0.40 CNC(=O)COCCCCSC 7a_100011217163_100000183359 [0,0,0,0,0,0|3,0,1]=4 282 B11R0.40 CNC(=O)CSCCCCCF 62a_100000183359_100000729378 [0,0,0,0,0,0|3,0,1]=4 283 B11R0.40 CNC(=O)CSCCCCCF 62a_100000729378_100000183359 [0,0,0,0,0,0|3,0,1]=4 284 B11R0.40 CNC(=O)CSCCCCCO 62a_100000183359_100000746330 [0,0,0,0,0,0|3,0,1]=4 285 B11R0.40 CNC(=O)CSCCCCCO 62a_100000746330_100000183359 [0,0,0,0,0,0|3,0,1]=4 286 B11R0.40 CNC(=O)CSCCCCOC 62a_100000183359_100000730899 [0,0,0,0,0,0|3,0,1]=4 287 B11R0.40 CNC(=O)CSCCCCOC 62a_100000730899_100000183359 [0,0,0,0,0,0|3,0,1]=4 288 B11R0.40 CNC(=O)NCCCCCCO 2708a_100102657272_100000686447 [0,0,0,0,0,0|3,0,1]=4 289 B11R0.40 CNC(=O)NCCCCCCO 273464a_100000686447_100102657272 [0,0,0,0,0,0|3,0,1]=4 290 B11R0.40 CNC(=O)NCCCCCCO 273464a_100102657272_100000686447 [0,0,0,0,0,0|3,0,1]=4 291 B11R0.40 CNC(=O)NCCCCCCO 512a_100000686447_100102657272 [0,0,0,0,0,0|3,0,1]=4 292 B11R0.40 CNC(=O)NCCCCCCO 512a_106832991638_100000686447 [0,0,0,0,0,0|3,0,1]=4 293 B11R0.40 CNC(=O)NCCCCCOC 2708a_100000747528_106832991635 [0,0,0,0,0,0|3,0,1]=4 294 B11R0.40 CNC(=O)NCCCCCOC 2708a_100102657272_100000747528 [0,0,0,0,0,0|3,0,1]=4 295 B11R0.40 CNC(=O)NCCCCCOC 273464a_100000747528_100102657272 [0,0,0,0,0,0|3,0,1]=4 296 B11R0.40 CNC(=O)NCCCCCOC 273464a_100102657272_100000747528 [0,0,0,0,0,0|3,0,1]=4 297 B11R0.40 CNC(=O)NCCCCCOC 512a_100000747528_100102657272 [0,0,0,0,0,0|3,0,1]=4 298 B11R0.40 CNC(=O)NCCCCCOC 512a_106832991638_100000747528 [0,0,0,0,0,0|3,0,1]=4 299 B11R0.40 CNCCCCCCC(=O)OC 2230a_106832991635_100009815986 [0,0,0,0,0,0|1,0,2]=3 300 B11R0.40 CNCCCCCCC(=O)OC 34a_100102657272_100009815986 [0,0,0,0,0,0|1,0,2]=3 301 B11R0.40 CNCCCCCCC(=O)OC 7a_106832991635_100009815986 [0,0,0,0,0,0|1,0,2]=3 302 B11R0.40 CNCCCOCCC(=O)OC 34a_100000213112_100000742370 [0,0,0,0,0,0|2,0,2]=4 303 B11R0.40 COC(=O)/C=C/CNCCCF 2230a_100015189416_100000742655 [0,0,0,0,0,0|2,0,2]=4 304 B11R0.40 COC(=O)/C=C/CNCCCF 34a_100015189416_100000742655 [0,0,0,0,0,0|2,0,2]=4 305 B11R0.40 COC(=O)/C=C/CNCCSC 2230a_100020590264_100000742655 [0,0,0,0,0,0|2,0,2]=4 306 B11R0.40 COC(=O)/C=C/COCCCBr 34a_100011217188_100000742655 [0,0,0,0,0,0|2,0,2]=4 307 B11R0.40 COC(=O)/C=C/COCCCCl 34a_100000230001_100000742655 [0,0,0,0,0,0|2,0,2]=4 308 B11R0.40 COC(=O)/C=C/COCCCF 34a_100000759539_100000742655 [0,0,0,0,0,0|2,0,2]=4 309 B11R0.40 COC(=O)/C=C/COCCCN 34a_100000182051_100000742655 [0,0,0,0,0,0|2,0,2]=4 310 B11R0.40 COC(=O)/C=C/COCCSC 34a_100000230434_100000742655 [0,0,0,0,0,0|2,0,2]=4 311 B11R0.40 COC(=O)/C=C/COCCSC 7a_100000230434_100000742655 [0,0,0,0,0,0|2,0,2]=4 312 B11R0.40 COC(=O)/C=C/CSCCCF 62a_100000742655_100011934791 [0,0,0,0,0,0|2,0,2]=4 313 B11R0.40 COC(=O)/C=C/CSCCCF 62a_100011934791_100000742655 [0,0,0,0,0,0|2,0,2]=4 314 B11R0.40 COC(=O)/C=C/CSCCCO 62a_100000742655_100011215043 [0,0,0,0,0,0|2,0,2]=4 315 B11R0.40 COC(=O)/C=C/CSCCCO 62a_100011215043_100000742655 [0,0,0,0,0,0|2,0,2]=4 316 B11R0.40 COC(=O)/C=C/CSCCSC 62a_100000212216_100000742655 [0,0,0,0,0,0|2,0,2]=4 317 B11R0.40 COC(=O)/C=C/CSCCSC 62a_100000742655_100000751147 [0,0,0,0,0,0|2,0,2]=4 318 B11R0.40 COC(=O)CCCCCCO[13CH3] 34a_100009863599_200025704644 [0,0,0,0,0,0|1,0,2]=3 319 B11R0.40 COC(=O)CCCCCCO[13CH3] 7a_100009863599_200025704644 [0,0,0,0,0,0|1,0,2]=3 320 B11R0.40 COC(=O)CCCCCCSC 62a_100009815986_200000210301 [0,0,0,0,0,0|1,0,2]=3 321 B11R0.40 COC(=O)CCCCCCSC 62a_200000210301_100009815986 [0,0,0,0,0,0|1,0,2]=3 322 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_100009815986_200025704644 [0,0,0,0,0,0|1,0,2]=3 323 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_200025704644_100009815986 [0,0,0,0,0,0|1,0,2]=3 324 B11R0.40 COC(=O)CCCCCOCF 34a_100000074720_100015361967 [0,0,0,0,0,0|2,0,2]=4 325 B11R0.40 COC(=O)CCCCCOCF 7a_100000074720_100015361967 [0,0,0,0,0,0|2,0,2]=4 326 B11R0.40 COC(=O)CCCCCSCF 62a_100009816466_100015361967 [0,0,0,0,0,0|2,0,2]=4 327 B11R0.40 COC(=O)CCCCCSCF 62a_100015361967_100009816466 [0,0,0,0,0,0|2,0,2]=4 328 B11R0.40 COC(=O)CCCCNCCF 34a_100000724931_100000204269 [0,0,0,0,0,0|2,0,2]=4 329 B11R0.40 COC(=O)CCCCNCCO 2230a_100016997473_100000204269 [0,0,0,0,0,0|2,0,2]=4 330 B11R0.40 COC(=O)CCCCNCCO 34a_100016990907_100000204269 [0,0,0,0,0,0|2,0,2]=4 331 B11R0.40 COC(=O)CCCCOCCBr 34a_100000211926_100000204269 [0,0,0,0,0,0|2,0,2]=4 332 B11R0.40 COC(=O)CCCCOCCF 34a_100000059025_100011217306 [0,0,0,0,0,0|2,0,2]=4 333 B11R0.40 COC(=O)CCCCOCCF 7a_100000059025_100011217306 [0,0,0,0,0,0|2,0,2]=4 334 B11R0.40 COC(=O)CCCCOCCN 34a_100000210304_100000204269 [0,0,0,0,0,0|2,0,2]=4 335 B11R0.40 COC(=O)CCCCOCCO 34a_100000059025_100000211926 [0,0,0,0,0,0|2,0,2]=4 336 B11R0.40 COC(=O)CCCCOCCO 7a_100000059025_100000211926 [0,0,0,0,0,0|2,0,2]=4 337 B11R0.40 COC(=O)CCCCOCSC 34a_100000059025_100011218213 [0,0,0,0,0,0|2,0,2]=4 338 B11R0.40 COC(=O)CCCCSCCF 62a_100000204269_100011217306 [0,0,0,0,0,0|2,0,2]=4 339 B11R0.40 COC(=O)CCCCSCCF 62a_100011217306_100000204269 [0,0,0,0,0,0|2,0,2]=4 340 B11R0.40 COC(=O)CCCCSCCO 62a_100000204269_100000211926 [0,0,0,0,0,0|2,0,2]=4 341 B11R0.40 COC(=O)CCCCSCCO 62a_100000211926_100000204269 [0,0,0,0,0,0|2,0,2]=4 342 B11R0.40 COC(=O)CCCCSCSC 62a_100000204269_100011218213 [0,0,0,0,0,0|2,0,2]=4 343 B11R0.40 COC(=O)CCCCSCSC 62a_100011218213_100000204269 [0,0,0,0,0,0|2,0,2]=4 344 B11R0.40 COC(=O)CCCNCCCF 2230a_100015189416_100011218270 [0,0,0,0,0,0|2,0,2]=4 345 B11R0.40 COC(=O)CCCNCCCF 34a_100015189416_100000742333 [0,0,0,0,0,0|2,0,2]=4 346 B11R0.40 COC(=O)CCCNCCSC 2230a_100020590264_100011218270 [0,0,0,0,0,0|2,0,2]=4 347 B11R0.40 COC(=O)CCCOCCCBr 34a_100011217188_100000742333 [0,0,0,0,0,0|2,0,2]=4 348 B11R0.40 COC(=O)CCCOCCCCl 34a_100000230001_100000742333 [0,0,0,0,0,0|2,0,2]=4 349 B11R0.40 COC(=O)CCCOCCCF 34a_100000759539_100000742333 [0,0,0,0,0,0|2,0,2]=4 350 B11R0.40 COC(=O)CCCOCCCN 34a_100000182051_100000742333 [0,0,0,0,0,0|2,0,2]=4 351 B11R0.40 COC(=O)CCCOCCSC 34a_100000230434_100000742333 [0,0,0,0,0,0|2,0,2]=4 352 B11R0.40 COC(=O)CCCOCCSC 7a_100000230434_100011218270 [0,0,0,0,0,0|2,0,2]=4 353 B11R0.40 COC(=O)CCCSCCCF 62a_100011218270_100011934791 [0,0,0,0,0,0|2,0,2]=4 354 B11R0.40 COC(=O)CCCSCCCF 62a_100011934791_100011218270 [0,0,0,0,0,0|2,0,2]=4 355 B11R0.40 COC(=O)CCCSCCCO 62a_100011215043_100011218270 [0,0,0,0,0,0|2,0,2]=4 356 B11R0.40 COC(=O)CCCSCCCO 62a_100011218270_100011215043 [0,0,0,0,0,0|2,0,2]=4 357 B11R0.40 COC(=O)CCCSCCSC 62a_100000212216_100011218270 [0,0,0,0,0,0|2,0,2]=4 358 B11R0.40 COC(=O)CCCSCCSC 62a_100011218270_100000751147 [0,0,0,0,0,0|2,0,2]=4 359 B11R0.40 COC(=O)CCNCCCCO 2230a_100000750430_100000204255 [0,0,0,0,0,0|2,0,2]=4 360 B11R0.40 COC(=O)CCNCCCCO 34a_100000750430_100000742370 [0,0,0,0,0,0|2,0,2]=4 361 B11R0.40 COC(=O)CCNCCCSC 2230a_100000749238_100000204255 [0,0,0,0,0,0|2,0,2]=4 362 B11R0.40 COC(=O)CCOCCCCBr 34a_100011216708_100000742370 [0,0,0,0,0,0|2,0,2]=4 363 B11R0.40 COC(=O)CCOCCCCCl 34a_100000210776_100000742370 [0,0,0,0,0,0|2,0,2]=4 364 B11R0.40 COC(=O)CCOCCCCCl 7a_100000210776_100000204255 [0,0,0,0,0,0|2,0,2]=4 365 B11R0.40 COC(=O)CCOCCCCF 34a_100011995726_100000742370 [0,0,0,0,0,0|2,0,2]=4 366 B11R0.40 COC(=O)CCOCCCCF 7a_100011995726_100000204255 [0,0,0,0,0,0|2,0,2]=4 367 B11R0.40 COC(=O)CCOCCCCI 34a_200012148704_100000742370 [0,0,0,0,0,0|2,0,2]=4 368 B11R0.40 COC(=O)CCOCCCCN 34a_100000750430_100000742370 [0,0,0,0,0,0|2,0,2]=4 369 B11R0.40 COC(=O)CCOCCCSC 34a_100000690336_100000742370 [0,0,0,0,0,0|2,0,2]=4 370 B11R0.40 COC(=O)CCOCCCSC 7a_100000690336_100000204255 [0,0,0,0,0,0|2,0,2]=4 371 B11R0.40 COC(=O)CCSCCCCF 62a_100000204255_100000729493 [0,0,0,0,0,0|2,0,2]=4 372 B11R0.40 COC(=O)CCSCCCCF 62a_100000729493_100000204255 [0,0,0,0,0,0|2,0,2]=4 373 B11R0.40 COC(=O)CCSCCCCO 62a_100000204255_100000210776 [0,0,0,0,0,0|2,0,2]=4 374 B11R0.40 COC(=O)CCSCCCCO 62a_100000210776_100000204255 [0,0,0,0,0,0|2,0,2]=4 375 B11R0.40 COC(=O)CNCCCCCO 2230a_100000762737_100000747449 [0,0,0,0,0,0|2,0,1]=3 376 B11R0.40 COC(=O)CNCCCCCO 34a_100000762737_100000747449 [0,0,0,0,0,0|2,0,1]=3 377 B11R0.40 COC(=O)CNCCOCCO 2230a_100000211614_100000747449 [0,0,0,0,0,0|3,0,1]=4 378 B11R0.40 COC(=O)CNCCOCCO 34a_100000211614_100000747449 [0,0,0,0,0,0|3,0,1]=4 379 B11R0.40 COC(=O)CNCCSCCO 2230a_100011219999_100000747449 [0,0,0,0,0,0|3,0,1]=4 380 B11R0.40 COC(=O)COCCCCCBr 34a_100000746331_100000747449 [0,0,0,0,0,0|2,0,1]=3 381 B11R0.40 COC(=O)COCCCCCBr 7a_100000746331_100000747449 [0,0,0,0,0,0|2,0,1]=3 382 B11R0.40 COC(=O)COCCCCCCl 34a_100000746330_100000747449 [0,0,0,0,0,0|2,0,1]=3 383 B11R0.40 COC(=O)COCCCCCCl 7a_100000746330_100000747449 [0,0,0,0,0,0|2,0,1]=3 384 B11R0.40 COC(=O)COCCCCCI 34a_200012148887_100000747449 [0,0,0,0,0,0|2,0,1]=3 385 B11R0.40 COC(=O)COCCCCCI 7a_200012148887_100000747449 [0,0,0,0,0,0|2,0,1]=3 386 B11R0.40 COC(=O)COCCCCCN 34a_100000762737_100000747449 [0,0,0,0,0,0|2,0,1]=3 387 B11R0.40 COC(=O)COCCCCSC 34a_100011217163_100000747449 [0,0,0,0,0,0|2,0,1]=3 388 B11R0.40 COC(=O)COCCCCSC 7a_100011217163_100000747449 [0,0,0,0,0,0|2,0,1]=3 389 B11R0.40 COC(=O)COCCNCCF 34a_100000724931_100000090808 [0,0,0,0,0,0|3,0,1]=4 390 B11R0.40 COC(=O)COCCNCCO 2230a_100016997473_100000090808 [0,0,0,0,0,0|3,0,1]=4 391 B11R0.40 COC(=O)COCCNCCO 34a_100016990907_100000090808 [0,0,0,0,0,0|3,0,1]=4 392 B11R0.40 COC(=O)COCCOCCBr 34a_100000211926_100000090808 [0,0,0,0,0,0|3,0,1]=4 393 B11R0.40 COC(=O)COCCOCCBr 34a_100000692535_100000747449 [0,0,0,0,0,0|3,0,1]=4 394 B11R0.40 COC(=O)COCCOCCBr 7a_100000692535_100000747449 [0,0,0,0,0,0|3,0,1]=4 395 B11R0.40 COC(=O)COCCOCCCl 34a_100011215305_100000747449 [0,0,0,0,0,0|3,0,1]=4 396 B11R0.40 COC(=O)COCCOCCCl 7a_100011215305_100000747449 [0,0,0,0,0,0|3,0,1]=4 397 B11R0.40 COC(=O)COCCOCCF 34a_200015357709_100000747449 [0,0,0,0,0,0|3,0,1]=4 398 B11R0.40 COC(=O)COCCOCCF 7a_200015357709_100000747449 [0,0,0,0,0,0|3,0,1]=4 399 B11R0.40 COC(=O)COCCOCCI 34a_100012149058_100000747449 [0,0,0,0,0,0|3,0,1]=4 400 B11R0.40 COC(=O)COCCOCCI 7a_100012149058_100000747449 [0,0,0,0,0,0|3,0,1]=4 401 B11R0.40 COC(=O)COCCOCCN 34a_100000210304_100000090808 [0,0,0,0,0,0|3,0,1]=4 402 B11R0.40 COC(=O)COCCOCCN 34a_100000211614_100000747449 [0,0,0,0,0,0|3,0,1]=4 403 B11R0.40 COC(=O)COCCSCCF 62a_100000090808_100011217306 [0,0,0,0,0,0|3,0,1]=4 404 B11R0.40 COC(=O)COCCSCCF 62a_100011217306_100000090808 [0,0,0,0,0,0|3,0,1]=4 405 B11R0.40 COC(=O)COCCSCCO 62a_100000090808_100000211926 [0,0,0,0,0,0|3,0,1]=4 406 B11R0.40 COC(=O)COCCSCCO 62a_100000211926_100000090808 [0,0,0,0,0,0|3,0,1]=4 407 B11R0.40 COC(=O)COCCSCSC 62a_100000090808_100011218213 [0,0,0,0,0,0|3,0,1]=4 408 B11R0.40 COC(=O)COCCSCSC 62a_100011218213_100000090808 [0,0,0,0,0,0|3,0,1]=4 409 B11R0.40 COC(=O)CSCCCCC#N 62a_100000747449_100000211819 [0,0,0,0,0,0|2,0,2]=4 410 B11R0.40 COC(=O)CSCCCCC#N 62a_100011219923_100000747449 [0,0,0,0,0,0|2,0,2]=4 411 B11R0.40 COC(=O)CSCCCCC=O 62a_100000139335_100000747449 [0,0,0,0,0,0|2,0,2]=4 412 B11R0.40 COC(=O)CSCCCCC=O 62a_100000747449_100000139335 [0,0,0,0,0,0|2,0,2]=4 413 B11R0.40 COC(=O)CSCCCCCF 62a_100000729378_100000747449 [0,0,0,0,0,0|2,0,1]=3 414 B11R0.40 COC(=O)CSCCCCCF 62a_100000747449_100000729378 [0,0,0,0,0,0|2,0,1]=3 415 B11R0.40 COC(=O)CSCCCCCO 62a_100000746330_100000747449 [0,0,0,0,0,0|2,0,1]=3 416 B11R0.40 COC(=O)CSCCCCCO 62a_100000747449_100000746330 [0,0,0,0,0,0|2,0,1]=3 417 B11R0.40 COC(=O)CSCCOCCO 62a_100000747449_100011215305 [0,0,0,0,0,0|3,0,1]=4 418 B11R0.40 COC(=O)CSCCOCCO 62a_100011215305_100000747449 [0,0,0,0,0,0|3,0,1]=4 419 B11R0.40 COC(=O)NCCOCCCF 34a_100000757965_100011934791 [0,0,0,0,0,0|3,0,1]=4 420 B11R0.40 COC(=O)NCCOCCCO 34a_100000757965_100000230001 [0,0,0,0,0,0|3,0,1]=4 421 B11R0.40 COC(=O)NCCOCCSC 34a_100000757965_100000212216 [0,0,0,0,0,0|3,0,1]=4 422 B11R0.40 COC(=O)OCCOCCCF 34a_100010262106_100011934791 [0,0,0,0,0,0|3,0,1]=4 423 B11R0.40 COC(=O)OCCOCCCO 34a_100010262106_100000230001 [0,0,0,0,0,0|3,0,1]=4 424 B11R0.40 COC(=O)OCCOCCSC 34a_100010262106_100000212216 [0,0,0,0,0,0|3,0,1]=4 425 B11R0.40 COC(=O)OCSCCCCF 62a_100000729493_100000139417 [0,0,0,0,0,0|3,0,1]=4 426 B11R0.40 COC(=O)OCSCCCCO 62a_100000210776_100000139417 [0,0,0,0,0,0|3,0,1]=4 427 B11R0.40 COCCCCCCC(=O)OC 34a_100009863599_200000210301 [0,0,0,0,0,0|1,0,2]=3 428 B11R0.40 COCCCCCCC(=O)OC 34a_100138415774_100009815986 [0,0,0,0,0,0|1,0,2]=3 429 B11R0.40 COCCCCCCC(=O)OC 7a_100009863599_200000210301 [0,0,0,0,0,0|1,0,2]=3 430 B11R0.40 COCCCCOCC(=O)OC 34a_100000740925_100000747449 [0,0,0,0,0,0|2,0,1]=3 431 B11R0.40 COCCCCSCC(=O)OC 62a_100000730899_100000747449 [0,0,0,0,0,0|2,0,1]=3 432 B11R0.40 COCCCCSCC(=O)OC 62a_100000747449_100000730899 [0,0,0,0,0,0|2,0,1]=3 433 B11R0.40 COCCCNCCC(=O)OC 34a_100150723488_100000742370 [0,0,0,0,0,0|2,0,2]=4 434 B11R0.40 COCCCOCCC(=O)OC 34a_100000740835_100000742370 [0,0,0,0,0,0|2,0,2]=4 435 B11R0.40 COCCCSCCC(=O)OC 62a_100000204255_100000709357 [0,0,0,0,0,0|2,0,2]=4 436 B11R0.40 COCCCSCCC(=O)OC 62a_100000709357_100000204255 [0,0,0,0,0,0|2,0,2]=4 437 B11R0.40 COCCCSCOC(=O)OC 62a_100000709357_100000139417 [0,0,0,0,0,0|3,0,1]=4 438 B11R0.40 COCCNC/C=C/C(=O)OC 2230a_100000209980_100000742655 [0,0,0,0,0,0|2,0,2]=4 439 B11R0.40 COCCNCCCC(=O)OC 2230a_100000209980_100011218270 [0,0,0,0,0,0|2,0,2]=4 440 B11R0.40 COCCOC/C=C/C(=O)OC 34a_100000210237_100000742655 [0,0,0,0,0,0|2,0,2]=4 441 B11R0.40 COCCOCCCC(=O)OC 34a_100000210237_100000742333 [0,0,0,0,0,0|2,0,2]=4 442 B11R0.40 COCCOCCNC(=O)OC 34a_100000757965_100011201679 [0,0,0,0,0,0|3,0,1]=4 443 B11R0.40 COCCOCCOC(=O)OC 34a_100010262106_100011201679 [0,0,0,0,0,0|3,0,1]=4 444 B11R0.40 COCCOCSCC(=O)OC 62a_100000231047_100000747449 [0,0,0,0,0,0|3,0,1]=4 445 B11R0.40 COCCOCSCC(=O)OC 62a_100000747449_100000231047 [0,0,0,0,0,0|3,0,1]=4 446 B11R0.40 COCCSC/C=C/C(=O)OC 62a_100000233755_100000742655 [0,0,0,0,0,0|2,0,2]=4 447 B11R0.40 COCCSC/C=C/C(=O)OC 62a_100000742655_100000233755 [0,0,0,0,0,0|2,0,2]=4 448 B11R0.40 COCCSCCCC(=O)OC 62a_100000233755_100011218270 [0,0,0,0,0,0|2,0,2]=4 449 B11R0.40 COCCSCCCC(=O)OC 62a_100011218270_100000233755 [0,0,0,0,0,0|2,0,2]=4 450 B11R0.40 COCSCCCCC(=O)OC 62a_100000204269_100000766300 [0,0,0,0,0,0|2,0,2]=4 451 B11R0.40 COCSCCCCC(=O)OC 62a_100000766300_100000204269 [0,0,0,0,0,0|2,0,2]=4 452 B11R0.40 COCSCCOCC(=O)OC 62a_100000090808_100000766300 [0,0,0,0,0,0|3,0,1]=4 453 B11R0.40 COCSCCOCC(=O)OC 62a_100000766300_100000090808 [0,0,0,0,0,0|3,0,1]=4 454 B10R0.4 C=C(C)CNCCCCCC 2230a_100000210581_100000748629 [1,0,0,0,0,0|2,0,1]=4 455 B10R0.4 C=C(C)COCCCCCC 34a_100000210245_100000210314 [1,0,0,0,0,0|2,0,1]=4 456 B10R0.4 C=C(C)COCCCCCC 34a_100000210259_100000748629 [1,0,0,0,0,0|2,0,1]=4 457 B10R0.4 C=C(C)COCCCCCC 7a_100000210259_100000748629 [1,0,0,0,0,0|2,0,1]=4 458 B10R0.4 C=C(C)CSCCCCCC 62a_100000210314_100000211660 [1,0,0,0,0,0|2,0,1]=4 459 B10R0.4 C=C(C)CSCCCCCC 62a_100000748629_100000210757 [1,0,0,0,0,0|2,0,1]=4 460 B10R0.4 CC(=O)CCCCCCCO 1458a_100000070787_100000760002 [1,0,0,0,0,0|1,0,2]=4 461 B10R0.4 CC(=O)CCCCCCCO 1458a_100011219782_200000210301 [1,0,0,0,0,0|1,0,2]=4 462 B10R0.4 CC(=O)COCCCCCF 34a_100000211253_100000729378 [1,0,0,0,0,0|2,0,1]=4 463 B10R0.4 CC(=O)COCCCCCO 34a_100000211253_100000746330 [1,0,0,0,0,0|2,0,1]=4 464 B10R0.4 CC(=O)NCCCCCCO 240690a_100000686447_100015343762 [1,0,0,0,0,0|2,0,1]=4 465 B10R0.4 CC(=O)NCCCCCCO 527a_100000686447_100103153847 [1,0,0,0,0,0|2,0,1]=4 466 B10R0.4 CC(=O)NCCCCCN[13CH3] 2230a_200012022750_200025704644 [1,0,0,0,0,0|2,0,1]=4 467 B10R0.4 CC(=O)NCCCCCN[13CH3] 34a_200012022750_200025704644 [1,0,0,0,0,0|2,0,1]=4 468 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_100000033007_200025704644 [1,0,0,0,0,0|2,0,1]=4 469 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_200025704644_100000033007 [1,0,0,0,0,0|2,0,1]=4 470 B10R0.4 CCCCC/C=C/CC(=O)C 1458a_100020675968_200000210301 [1,0,0,0,0,0|0,0,3]=4 471 B10R0.4 CCCCC/C=C/CC(=O)[13CH3] 1458a_100020675968_200025704644 [1,0,0,0,0,0|0,0,3]=4 472 B10R0.4 CCCCCC#CCC(=O)C 1458a_100000070787_100009816472 [1,0,0,0,0,0|0,0,2]=3 473 B10R0.4 CCCCCC=NNC(=O)C 4a_100000189765_100000737632 [1,0,0,0,0,0|2,0,1]=4 474 B10R0.4 CCCCCCC=CC(=O)C 1458a_200015324643_200000210301 [1,0,0,0,0,0|0,0,2]=3 475 B10R0.4 CCCCCCC=CC(=O)[13CH3] 1458a_200015324643_200025704644 [1,0,0,0,0,0|0,0,2]=3 476 B10R0.4 CCCCCCCCC(=O)C 1458a_100000070787_100000210759 [1,0,0,0,0,0|0,0,2]=3 477 B10R0.4 CCCCCCCCC(=O)C 1458a_100000210188_200000210301 [1,0,0,0,0,0|0,0,2]=3 478 B10R0.4 CCCCCCCCC(=O)[13CH3] 1458a_100000210188_200025704644 [1,0,0,0,0,0|0,0,2]=3 479 B10R0.4 CCCCCCCNC(=O)C 11a_100000229938_100015343762 [1,0,0,0,0,0|1,0,1]=3 480 B10R0.4 CCCCCCCNC(=O)C 1626a_100000229938_100015343762 [1,0,0,0,0,0|1,0,1]=3 481 B10R0.4 CCCCCCCNC(=O)C 240690a_100000229938_100015343762 [1,0,0,0,0,0|1,0,1]=3 482 B10R0.4 CCCCCCCNC(=O)C 527a_100000229938_100103153847 [1,0,0,0,0,0|1,0,1]=3 483 B10R0.4 CCCCCCNCC(=O)N 2230a_100000210581_100000747473 [1,0,0,0,0,0|2,0,1]=4 484 B10R0.4 CCCCCCNCC(=O)N 2230a_100000711301_100000210314 [1,0,0,0,0,0|2,0,1]=4 485 B10R0.4 CCCCCCNCC(=O)O 269956a_100016091260_100000210757 [1,0,0,0,0,0|1,0,1]=3 486 B10R0.4 CCCCCCOCC(=O)C 34a_100000211253_100000210314 [1,0,0,0,0,0|1,0,1]=3 487 B10R0.4 CCCCCCOCC(=O)N 34a_100000210259_100000187820 [1,0,0,0,0,0|2,0,1]=4 488 B10R0.4 CCCCCCOCC(=O)N 7a_100000210259_100000187820 [1,0,0,0,0,0|2,0,1]=4 489 B10R0.4 CCCCCCOCC(=O)[O-] 34a_100000210259_100020667443 [1,0,0,0,0,0|1,0,2]=4 490 B10R0.4 CCCCCCSCC(=O)N 62a_100000210314_100000747473 [1,0,0,0,0,0|2,0,1]=4 491 B10R0.4 CCCCCCSCC(=O)N 62a_100000747473_100000210757 [1,0,0,0,0,0|2,0,1]=4 492 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100000210314_100020667443 [1,0,0,0,0,0|1,0,2]=4 493 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100020667443_100000210757 [1,0,0,0,0,0|1,0,2]=4 494 B10R0.4 CCCCCNOCC(=O)O 269956a_100000106656_100000210326 [1,0,0,0,0,0|2,0,1]=4 495 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [1,0,0,0,0,0|1,0,2]=4 496 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [1,0,0,0,0,0|1,0,2]=4 497 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [1,0,0,0,0,0|1,0,2]=4 498 B10R0.4 CCCCCOCOC(=O)C 34a_100000210253_100009813279 [1,0,0,0,0,0|2,0,1]=4 499 B10R0.4 CCCCCSCCC(=O)C 62a_100000053229_100000210326 [1,0,0,0,0,0|1,0,2]=4 500 B10R0.4 CCCCCSCCC(=O)C 62a_100000210326_100000053229 [1,0,0,0,0,0|1,0,2]=4 501 B10R0.4 CCCCCSCOC(=O)C 62a_100000076356_100000210326 [1,0,0,0,0,0|2,0,1]=4 502 B10R0.4 CCCCCSCOC(=O)C 62a_100000210326_100000076356 [1,0,0,0,0,0|2,0,1]=4 503 B10R0.4 CCCCNCCCC(=O)C 7a_106832991798_100011215641 [1,0,0,0,0,0|1,0,2]=4 504 B10R0.4 CCCCNCCNC(=O)C 2230a_100000102301_100000189650 [1,0,0,0,0,0|2,0,1]=4 505 B10R0.4 CCCCNCCNC(=O)C 2230a_100000209853_100000210211 [1,0,0,0,0,0|2,0,1]=4 506 B10R0.4 CCCCNCCNC(=O)C 7a_106832991798_100000189650 [1,0,0,0,0,0|2,0,1]=4 507 B10R0.4 CCCCNCCOC(=O)C 7a_106832991798_100009814007 [1,0,0,0,0,0|2,0,1]=4 508 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [1,0,0,0,0,0|1,0,2]=4 509 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [1,0,0,0,0,0|1,0,2]=4 510 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [1,0,0,0,0,0|1,0,2]=4 511 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [1,0,0,0,0,0|1,0,2]=4 512 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [1,0,0,0,0,0|2,0,1]=4 513 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [1,0,0,0,0,0|2,0,1]=4 514 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [1,0,0,0,0,0|2,0,1]=4 515 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [1,0,0,0,0,0|2,0,1]=4 516 B10R0.4 CCCCOCNCC(=O)O 269956a_100016091260_100011995733 [1,0,0,0,0,0|2,0,1]=4 517 B10R0.4 CCCCOCOCC(=O)C 34a_100000211253_100011995733 [1,0,0,0,0,0|2,0,1]=4 518 B10R0.4 CCCCSCCCC(=O)C 62a_100000210211_100011215641 [1,0,0,0,0,0|1,0,2]=4 519 B10R0.4 CCCCSCCCC(=O)C 62a_100011215641_100000210210 [1,0,0,0,0,0|1,0,2]=4 520 B10R0.4 CCCCSCCNC(=O)C 11a_100025743550_100015343762 [1,0,0,0,0,0|2,0,1]=4 521 B10R0.4 CCCCSCCNC(=O)C 1626a_100025743550_100015343762 [1,0,0,0,0,0|2,0,1]=4 522 B10R0.4 CCCCSCCNC(=O)C 240690a_100025743550_100015343762 [1,0,0,0,0,0|2,0,1]=4 523 B10R0.4 CCCCSCCNC(=O)C 527a_100025743550_100103153847 [1,0,0,0,0,0|2,0,1]=4 524 B10R0.4 CCCCSCCNC(=O)C 62a_100000189650_100000210210 [1,0,0,0,0,0|2,0,1]=4 525 B10R0.4 CCCCSCCNC(=O)C 62a_100000210211_100000189650 [1,0,0,0,0,0|2,0,1]=4 526 B10R0.4 CCCCSCCOC(=O)C 62a_100000210211_100009814007 [1,0,0,0,0,0|2,0,1]=4 527 B10R0.4 CCCCSCCOC(=O)C 62a_100009814007_100000210210 [1,0,0,0,0,0|2,0,1]=4 528 B10R0.4 CCCNCCCNC(=O)C 34a_100000736810_100000210303 [1,0,0,0,0,0|2,0,1]=4 529 B10R0.4 CCCNCCOCC(=O)O 269956a_100000700818_100000210207 [1,0,0,0,0,0|2,0,1]=4 530 B10R0.4 CCCOCCCCC(=O)C 34a_100000210258_100009817362 [1,0,0,0,0,0|1,0,2]=4 531 B10R0.4 CCCOCCCNC(=O)C 1626a_100011217757_100015343762 [1,0,0,0,0,0|2,0,1]=4 532 B10R0.4 CCCOCCCNC(=O)C 240690a_100011217757_100015343762 [1,0,0,0,0,0|2,0,1]=4 533 B10R0.4 CCCOCCCNC(=O)C 34a_100000752032_100000210303 [1,0,0,0,0,0|2,0,1]=4 534 B10R0.4 CCCOCCCNC(=O)C 527a_100011217757_100103153847 [1,0,0,0,0,0|2,0,1]=4 535 B10R0.4 CCCOCCCOC(=O)C 34a_100000210258_100000042594 [1,0,0,0,0,0|2,0,1]=4 536 B10R0.4 CCCOCCCSC(=O)C 34a_100000210258_100000038929 [1,0,0,0,0,0|2,0,1]=4 537 B10R0.4 CCCOCCNCC(=O)O 269956a_100016091260_100011215938 [1,0,0,0,0,0|2,0,1]=4 538 B10R0.4 CCCOCCOCC(=O)C 34a_100000211253_100011215938 [1,0,0,0,0,0|2,0,1]=4 539 B10R0.4 CCCSCCCCC(=O)C 62a_100000210303_100000735457 [1,0,0,0,0,0|1,0,2]=4 540 B10R0.4 CCCSCCCCC(=O)C 62a_100000735457_100000210303 [1,0,0,0,0,0|1,0,2]=4 541 B10R0.4 CCCSCCCOC(=O)C 62a_100000042594_100000210303 [1,0,0,0,0,0|2,0,1]=4 542 B10R0.4 CCCSCCCOC(=O)C 62a_100000210303_100000042594 [1,0,0,0,0,0|2,0,1]=4 543 B10R0.4 CCCSCCCSC(=O)C 62a_100000038929_100000210303 [1,0,0,0,0,0|2,0,1]=4 544 B10R0.4 CCCSCCCSC(=O)C 62a_100000210303_100000038929 [1,0,0,0,0,0|2,0,1]=4 545 B10R0.4 CCNCCCCNC(=O)C 2230a_200011368371_100000210202 [1,0,0,0,0,0|2,0,1]=4 546 B10R0.4 CCNCCCCNC(=O)C 34a_200011368371_100000210202 [1,0,0,0,0,0|2,0,1]=4 547 B10R0.4 CCNCCCCSC(=O)C 2230a_100015525214_200010402107 [1,0,0,0,0,0|2,0,1]=4 548 B10R0.4 CCOCCCCOC(=O)C 34a_100000073216_100000210202 [1,0,0,0,0,0|2,0,1]=4 549 B10R0.4 CCOCCCCOC(=O)C 34a_100121572206_100000033659 [1,0,0,0,0,0|2,0,1]=4 550 B10R0.4 CCOCCCCOC(=O)C 7a_100000073216_100000210202 [1,0,0,0,0,0|2,0,1]=4 551 B10R0.4 CCOCCCCSC(=O)C 34a_100121572206_200010402107 [1,0,0,0,0,0|2,0,1]=4 552 B10R0.4 CCOCCCNCC(=O)O 269956a_100016091260_100012232248 [1,0,0,0,0,0|2,0,1]=4 553 B10R0.4 CCOCCCOCC(=O)C 34a_100000211253_100012232248 [1,0,0,0,0,0|2,0,1]=4 554 B10R0.4 CCSCCCCOC(=O)C 62a_100000033659_100000210202 [1,0,0,0,0,0|2,0,1]=4 555 B10R0.4 CCSCCCCOC(=O)C 62a_100000210202_100000033659 [1,0,0,0,0,0|2,0,1]=4 556 B10R0.4 CCSCCCCSC(=O)C 62a_100000210202_200010402107 [1,0,0,0,0,0|2,0,1]=4 557 B10R0.4 CCSCCCCSC(=O)C 62a_200010402107_100000210202 [1,0,0,0,0,0|2,0,1]=4 558 B10R0.4 CNCCCCCNC(=O)C 2230a_200012022750_200000210301 [1,0,0,0,0,0|2,0,1]=4 559 B10R0.4 CNCCCCCNC(=O)C 34a_200012022750_200000210301 [1,0,0,0,0,0|2,0,1]=4 560 B10R0.4 CNCCCCCOC(=O)C 2230a_106832991635_100009813381 [1,0,0,0,0,0|2,0,1]=4 561 B10R0.4 CNCCCCCOC(=O)C 34a_100102657272_100000033007 [1,0,0,0,0,0|2,0,1]=4 562 B10R0.4 CNCCCCCOC(=O)C 7a_106832991635_100000033007 [1,0,0,0,0,0|2,0,1]=4 563 B10R0.4 COCCCCCCC(=O)C 1458a_100000070787_100011998445 [1,0,0,0,0,0|1,0,2]=4 564 B10R0.4 COCCCCCNC(=O)C 11a_100000747528_100015343762 [1,0,0,0,0,0|2,0,1]=4 565 B10R0.4 COCCCCCNC(=O)C 1626a_100000747528_100015343762 [1,0,0,0,0,0|2,0,1]=4 566 B10R0.4 COCCCCCNC(=O)C 240690a_100000747528_100015343762 [1,0,0,0,0,0|2,0,1]=4 567 B10R0.4 COCCCCCNC(=O)C 527a_100000747528_100103153847 [1,0,0,0,0,0|2,0,1]=4 568 B10R0.4 COCCCCCOC(=O)C 34a_100138415774_100000033007 [1,0,0,0,0,0|2,0,1]=4 569 B10R0.4 COCCCCNCC(=O)O 269956a_100016091260_100000730899 [1,0,0,0,0,0|2,0,1]=4 570 B10R0.4 COCCCCOCC(=O)C 34a_100000211253_100000755781 [1,0,0,0,0,0|2,0,1]=4 571 B10R0.4 CSCCCCCOC(=O)C 62a_100000033007_200000210301 [1,0,0,0,0,0|2,0,1]=4 572 B10R0.4 CSCCCCCOC(=O)C 62a_200000210301_100000033007 [1,0,0,0,0,0|2,0,1]=4 573 B10R0.4 O=C(O)CNCCCCCF 269956a_100016091260_100000729378 [1,0,0,0,0,0|2,0,1]=4 574 B10R0.4 O=C(O)CNCCCCCO 269956a_100016091260_100000746330 [1,0,0,0,0,0|2,0,1]=4 575 B10R0.4 [13CH3]C(=O)CCCCCCCO 1458a_100011219782_200025704644 [1,0,0,0,0,0|1,0,2]=4 576 B10R0.71 C/C=C/COCCCCCC 34a_100000210259_100102629194 [1,0,0,0,0,0|2,0,1]=4 577 B10R0.71 C/C=C/COCCCCCC 34a_100016270725_100000210314 [1,0,0,0,0,0|2,0,1]=4 578 B10R0.71 C/C=C/COCCCCCC 7a_100000210259_100102629194 [1,0,0,0,0,0|2,0,1]=4 579 B10R0.71 C/C=C/CSCCCCCC 62a_100000210314_100102629194 [1,0,0,0,0,0|2,0,1]=4 580 B10R0.71 C/C=C/CSCCCCCC 62a_100102629194_100000210757 [1,0,0,0,0,0|2,0,1]=4 581 B10R0.71 CC=CCNCCCCCC 2230a_100000210581_100000070051 [1,0,0,0,0,0|2,0,1]=4 582 B10R0.71 CC=CCOCCCCCC 34a_100000210259_100000070051 [1,0,0,0,0,0|2,0,1]=4 583 B10R0.71 CC=CCOCCCCCC 7a_100000210259_100000070051 [1,0,0,0,0,0|2,0,1]=4 584 B10R0.71 CC=CCSCCCCCC 62a_100000070051_100000210757 [1,0,0,0,0,0|2,0,1]=4 585 B10R0.71 CC=CCSCCCCCC 62a_100000210314_100000070051 [1,0,0,0,0,0|2,0,1]=4 586 B10R0.71 CCCC#CCCOCCC 34a_100000042726_100000210303 [1,0,0,0,0,0|2,0,1]=4 587 B10R0.71 CCCC#CCCOCCC 7a_100000042726_100000210303 [1,0,0,0,0,0|2,0,1]=4 588 B10R0.71 CCCC#CCOCCCC 34a_100000034806_100000210210 [1,0,0,0,0,0|2,0,1]=4 589 B10R0.71 CCCC#CCOCCCC 7a_100000034806_100000210211 [1,0,0,0,0,0|2,0,1]=4 590 B10R0.71 CCCCCC#CCCOC 34a_200000042877_200000210301 [1,0,0,0,0,0|0,0,3]=4 591 B10R0.71 CCCCCC#CCCOC 7a_200000042877_200000210301 [1,0,0,0,0,0|0,0,3]=4 592 B10R0.71 CCCCCC#CCCO[13CH3] 34a_200000042877_200025704644 [1,0,0,0,0,0|0,0,3]=4 593 B10R0.71 CCCCCC#CCCO[13CH3] 7a_200000042877_200025704644 [1,0,0,0,0,0|0,0,3]=4 594 B10R0.71 CCCCCC/C=C/COC 34a_200016276170_200000210301 [1,0,0,0,0,0|0,0,3]=4 595 B10R0.71 CCCCCC/C=C/COC 7a_200016276170_200000210301 [1,0,0,0,0,0|0,0,3]=4 596 B10R0.71 CCCCCC/C=C/CO[13CH3] 34a_200016276170_200025704644 [1,0,0,0,0,0|0,0,3]=4 597 B10R0.71 CCCCCC/C=C/CO[13CH3] 7a_200016276170_200025704644 [1,0,0,0,0,0|0,0,3]=4 598 B10R0.71 CCCCCCC#CCOC 34a_200000037284_200000210301 [1,0,0,0,0,0|0,0,1]=2 599 B10R0.71 CCCCCCC#CCOC 7a_200000037284_200000210301 [1,0,0,0,0,0|0,0,1]=2 600 B10R0.71 CCCCCCC#CCO[13CH3] 34a_200000037284_200025704644 [1,0,0,0,0,0|0,0,1]=2 601 B10R0.71 CCCCCCC#CCO[13CH3] 7a_200000037284_200025704644 [1,0,0,0,0,0|0,0,1]=2 602 B10R0.71 CCCCCCCCCOC 34a_100000210712_200000210301 [1,0,0,0,0,0|0,0,3]=4 603 B10R0.71 CCCCCCCCCOC 34a_100138415774_100011214924 [1,0,0,0,0,0|0,0,3]=4 604 B10R0.71 CCCCCCCCCOC 7a_100000210712_200000210301 [1,0,0,0,0,0|0,0,3]=4 605 B10R0.71 CCCCCCCCCO[13CH3] 34a_100000210712_200025704644 [1,0,0,0,0,0|0,0,3]=4 606 B10R0.71 CCCCCCCCCO[13CH3] 7a_100000210712_200025704644 [1,0,0,0,0,0|0,0,3]=4 607 B10R0.71 CCCCCCCNCOC 2230a_100000229938_100000766300 [1,0,0,0,0,0|1,0,2]=4 608 B10R0.71 CCCCCCCSCOC 62a_100000210614_100000766300 [1,0,0,0,0,0|1,0,2]=4 609 B10R0.71 CCCCCCCSCOC 62a_100000766300_100000210316 [1,0,0,0,0,0|1,0,2]=4 610 B10R0.71 CCCCCCNCCOC 2230a_100000209980_100000210314 [1,0,0,0,0,0|1,0,2]=4 611 B10R0.71 CCCCCCNCCOC 2230a_100000210581_100011201679 [1,0,0,0,0,0|1,0,2]=4 612 B10R0.71 CCCCCCOCCOC 34a_100000210237_100000210314 [1,0,0,0,0,0|1,0,2]=4 613 B10R0.71 CCCCCCOCCOC 34a_100000210259_100011201679 [1,0,0,0,0,0|1,0,2]=4 614 B10R0.71 CCCCCCOCCOC 34a_100000691444_200000210301 [1,0,0,0,0,0|1,0,2]=4 615 B10R0.71 CCCCCCOCCOC 7a_100000210259_100000233755 [1,0,0,0,0,0|1,0,2]=4 616 B10R0.71 CCCCCCOCCOC 7a_100000691444_200000210301 [1,0,0,0,0,0|1,0,2]=4 617 B10R0.71 CCCCCCOCCO[13CH3] 34a_100000691444_200025704644 [1,0,0,0,0,0|1,0,2]=4 618 B10R0.71 CCCCCCOCCO[13CH3] 7a_100000691444_200025704644 [1,0,0,0,0,0|1,0,2]=4 619 B10R0.71 CCCCCCSCCOC 62a_100000210314_100000233755 [1,0,0,0,0,0|1,0,2]=4 620 B10R0.71 CCCCCCSCCOC 62a_100000233755_100000210757 [1,0,0,0,0,0|1,0,2]=4 621 B10R0.74 C#CC(=O)CCCCCCC 1458a_100000211873_100000210614 [1,0,0,0,0,0|1,0,2]=4 622 B10R0.74 C=CC(=O)CCCCCCC 1458a_100000185746_100000210614 [1,0,0,0,0,0|1,0,2]=4 623 B10R0.74 C=CC(=O)NCCCCCC 1626a_100000210581_100000185746 [1,0,0,0,0,0|2,0,1]=4 624 B10R0.74 C=CC(=O)NCCCCCC 240690a_100000210581_200121576911 [1,0,0,0,0,0|2,0,1]=4 625 B10R0.74 CCC(=O)CCCCCCF 1458a_100000210414_100015922095 [1,0,0,0,0,0|2,0,1]=4 626 B10R0.74 CCC(=O)CCCCCCO 1458a_100000210414_100000766143 [1,0,0,0,0,0|2,0,1]=4 627 B10R0.74 CCC(=O)CCCCCCO 1458a_100011996774_100000210202 [1,0,0,0,0,0|2,0,1]=4 628 B10R0.74 CCC(=O)CCCCCOC 1458a_100011935119_100000210202 [1,0,0,0,0,0|2,0,1]=4 629 B10R0.74 CCC(=O)NCCCCCO 240690a_100000762737_100000210414 [1,0,0,0,0,0|3,0,0]=4 630 B10R0.74 CCCCCC#CC(=O)CC 1458a_100011215388_100000210202 [1,0,0,0,0,0|1,0,0]=2 631 B10R0.74 CCCCCC#CC(=O)CF 1458a_100011215388_100015361967 [1,0,0,0,0,0|2,0,0]=3 632 B10R0.74 CCCCCC#CC(=O)NC 240690a_100102657272_100011215388 [1,0,0,0,0,0|1,0,0]=2 633 B10R0.74 CCCCCC=CC(=O)CC 1458a_100016263427_100000210202 [1,0,0,0,0,0|1,0,2]=4 634 B10R0.74 CCCCCC=CC(=O)NC 11a_106832991635_100016263427 [1,0,0,0,0,0|1,0,2]=4 635 B10R0.74 CCCCCC=CC(=O)NC 1626a_100102657272_100016263427 [1,0,0,0,0,0|1,0,2]=4 636 B10R0.74 CCCCCC=CC(=O)NC 240690a_100102657272_100016263427 [1,0,0,0,0,0|1,0,2]=4 637 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [1,0,0,0,0,0|1,0,1]=3 638 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [1,0,0,0,0,0|1,0,1]=3 639 B10R0.74 CCCCCCCC(=O)CF 1458a_100000211969_100015361967 [1,0,0,0,0,0|2,0,1]=4 640 B10R0.74 CCCCCCCC(=O)CO 1458a_100000210174_100000210614 [1,0,0,0,0,0|2,0,1]=4 641 B10R0.74 CCCCCCCC(=O)NC 11a_106832991635_100000211969 [1,0,0,0,0,0|1,0,1]=3 642 B10R0.74 CCCCCCCC(=O)NC 1626a_100102657272_100000211969 [1,0,0,0,0,0|1,0,1]=3 643 B10R0.74 CCCCCCCC(=O)NC 240690a_100102657272_100000211969 [1,0,0,0,0,0|1,0,1]=3 644 B10R0.74 CCCCCCCC(=O)NC 527a_100102657272_100000211969 [1,0,0,0,0,0|1,0,1]=3 645 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [1,0,0,0,0,0|1,0,2]=4 646 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [1,0,0,0,0,0|1,0,2]=4 647 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [1,0,0,0,0,0|1,0,2]=4 648 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [1,0,0,0,0,0|1,0,2]=4 649 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [1,0,0,0,0,0|1,0,2]=4 650 B10R0.74 CCCCCCNC(=O)CC 11a_100000210581_100000210414 [1,0,0,0,0,0|2,0,0]=3 651 B10R0.74 CCCCCCNC(=O)CC 1626a_100000210581_100000210414 [1,0,0,0,0,0|2,0,0]=3 652 B10R0.74 CCCCCCNC(=O)CC 240690a_100000210581_100000210414 [1,0,0,0,0,0|2,0,0]=3 653 B10R0.74 CCCCCCNC(=O)CC 527a_100000210581_100000210414 [1,0,0,0,0,0|2,0,0]=3 654 B10R0.74 CCCCCCNC(=O)CO 240690a_100000210581_100000210174 [1,0,0,0,0,0|3,0,0]=4 655 B10R0.74 CCCCCCNC(=O)CO 527a_100000210581_100000210174 [1,0,0,0,0,0|3,0,0]=4 656 B10R0.74 CCCCCCNC(=O)NC 2708a_100000210581_106832991635 [1,0,0,0,0,0|2,0,0]=3 657 B10R0.74 CCCCCCNC(=O)NC 2708a_100102657272_100000210581 [1,0,0,0,0,0|2,0,0]=3 658 B10R0.74 CCCCCCNC(=O)NC 273464a_100000210581_100102657272 [1,0,0,0,0,0|2,0,0]=3 659 B10R0.74 CCCCCCNC(=O)NC 273464a_100102657272_100000210581 [1,0,0,0,0,0|2,0,0]=3 660 B10R0.74 CCCCCCNC(=O)NC 512a_100000210581_100102657272 [1,0,0,0,0,0|2,0,0]=3 661 B10R0.74 CCCCCCNC(=O)NC 512a_106832991638_100000210581 [1,0,0,0,0,0|2,0,0]=3 662 B10R0.74 CCCCCCSC(C)OC 62a_100000210314_100009879195 [1,0,0,0,0,0|2,0,1]=4 663 B10R0.74 CCCCCCSC(C)OC 62a_100009879195_100000210757 [1,0,0,0,0,0|2,0,1]=4 664 B10R0.74 CCCCCNCC(=O)NC 2230a_100000209983_100000183359 [1,0,0,0,0,0|2,0,1]=4 665 B10R0.74 CCCCCNCC(=O)NC 2230a_100000693194_100000210326 [1,0,0,0,0,0|2,0,1]=4 666 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [1,0,0,0,0,0|1,0,1]=3 667 B10R0.74 CCCCCNNC(=O)CC 22a_100000694160_100000210414 [1,0,0,0,0,0|3,0,0]=4 668 B10R0.74 CCCCCNNC(=O)NC 273464a_100102657272_100000694160 [1,0,0,0,0,0|3,0,0]=4 669 B10R0.74 CCCCCNNC(=O)NC 512a_100000694160_100102657272 [1,0,0,0,0,0|3,0,0]=4 670 B10R0.74 CCCCCNNC(=O)NC 512a_106832991638_100000694160 [1,0,0,0,0,0|3,0,0]=4 671 B10R0.74 CCCCCOCC(=O)CC 34a_100000725409_100000718602 [1,0,0,0,0,0|2,0,1]=4 672 B10R0.74 CCCCCOCC(=O)CC 7a_100000210253_100000747405 [1,0,0,0,0,0|2,0,1]=4 673 B10R0.74 CCCCCOCC(=O)NC 34a_100000210253_100000183359 [1,0,0,0,0,0|2,0,1]=4 674 B10R0.74 CCCCCOCC(=O)NC 34a_100000750040_100000718602 [1,0,0,0,0,0|2,0,1]=4 675 B10R0.74 CCCCCOCC(=O)NC 7a_100000210253_100000183359 [1,0,0,0,0,0|2,0,1]=4 676 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [1,0,0,0,0,0|1,0,1]=3 677 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [1,0,0,0,0,0|1,0,1]=3 678 B10R0.74 CCCCCSCC(=O)CC 62a_100000210326_100000747405 [1,0,0,0,0,0|2,0,1]=4 679 B10R0.74 CCCCCSCC(=O)CC 62a_100000747405_100000210326 [1,0,0,0,0,0|2,0,1]=4 680 B10R0.74 CCCCCSCC(=O)NC 62a_100000183359_100000210326 [1,0,0,0,0,0|2,0,1]=4 681 B10R0.74 CCCCCSCC(=O)NC 62a_100000210326_100000183359 [1,0,0,0,0,0|2,0,1]=4 682 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [1,0,0,0,0,0|1,0,1]=3 683 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [1,0,0,0,0,0|1,0,1]=3 684 B10R0.74 CCCCNCCC(=O)NC 2230a_100000102301_100000737683 [1,0,0,0,0,0|2,0,1]=4 685 B10R0.74 CCCCNCCC(=O)NC 2230a_100000738227_100000210211 [1,0,0,0,0,0|2,0,1]=4 686 B10R0.74 CCCCNCCC(=O)NC 34a_100000738227_100000210210 [1,0,0,0,0,0|2,0,1]=4 687 B10R0.74 CCCCNCCC(=O)NC 7a_106832991798_100000737683 [1,0,0,0,0,0|2,0,1]=4 688 B10R0.74 CCCCNCCC(=O)OC 2230a_100000102301_100000204255 [1,0,0,0,0,0|1,0,1]=3 689 B10R0.74 CCCCNCCC(=O)OC 7a_106832991798_100000204255 [1,0,0,0,0,0|1,0,1]=3 690 B10R0.74 CCCCNN=CC(=O)OC 4a_100025702795_200011823558 [1,0,0,0,0,0|2,0,1]=4 691 B10R0.74 CCCCOCCC(=O)CC 1458a_100000210414_100000743108 [1,0,0,0,0,0|2,0,1]=4 692 B10R0.74 CCCCOCCC(=O)NC 34a_100000210227_100012179268 [1,0,0,0,0,0|2,0,1]=4 693 B10R0.74 CCCCOCCC(=O)NC 34a_100000754576_100000210210 [1,0,0,0,0,0|2,0,1]=4 694 B10R0.74 CCCCOCCC(=O)NC 7a_100000210227_100000737683 [1,0,0,0,0,0|2,0,1]=4 695 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [1,0,0,0,0,0|1,0,1]=3 696 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [1,0,0,0,0,0|1,0,1]=3 697 B10R0.74 CCCCSCCC(=O)NC 62a_100000210211_100000737683 [1,0,0,0,0,0|2,0,1]=4 698 B10R0.74 CCCCSCCC(=O)NC 62a_100000737683_100000210210 [1,0,0,0,0,0|2,0,1]=4 699 B10R0.74 CCCCSCCC(=O)OC 62a_100000204255_100000210210 [1,0,0,0,0,0|1,0,1]=3 700 B10R0.74 CCCCSCCC(=O)OC 62a_100000210211_100000204255 [1,0,0,0,0,0|1,0,1]=3 701 B10R0.74 CCCCSCOC(=O)OC 62a_100000210211_100000139417 [1,0,0,0,0,0|2,0,0]=3 702 B10R0.74 CCCNCCCC(=O)NC 2230a_100000740002_100000210303 [1,0,0,0,0,0|2,0,1]=4 703 B10R0.74 CCCNCCCC(=O)NC 34a_100000740002_100000210303 [1,0,0,0,0,0|2,0,1]=4 704 B10R0.74 CCCNCCNC(=O)CC 34a_100132302217_100000210303 [1,0,0,0,0,0|3,0,0]=4 705 B10R0.74 CCCNCCNC(=O)NC 34a_100015205895_100000210303 [1,0,0,0,0,0|3,0,0]=4 706 B10R0.74 CCCOC/C=C/C(=O)OC 34a_100000210258_100000742655 [1,0,0,0,0,0|1,0,2]=4 707 B10R0.74 CCCOCCCC(=O)NC 34a_100000210258_100000741757 [1,0,0,0,0,0|2,0,1]=4 708 B10R0.74 CCCOCCCC(=O)OC 34a_100000210258_100000742333 [1,0,0,0,0,0|1,0,1]=3 709 B10R0.74 CCCOCCNC(=O)CC 1626a_100161115042_100000210414 [1,0,0,0,0,0|3,0,0]=4 710 B10R0.74 CCCOCCNC(=O)CC 240690a_100161115042_100000210414 [1,0,0,0,0,0|3,0,0]=4 711 B10R0.74 CCCOCCNC(=O)CC 34a_200000158885_100000210303 [1,0,0,0,0,0|3,0,0]=4 712 B10R0.74 CCCOCCNC(=O)CC 527a_100161115042_100000210414 [1,0,0,0,0,0|3,0,0]=4 713 B10R0.74 CCCOCCNC(=O)CC 7a_200000158885_100000210303 [1,0,0,0,0,0|3,0,0]=4 714 B10R0.74 CCCOCCNC(=O)NC 2708a_100102657272_100161115042 [1,0,0,0,0,0|3,0,0]=4 715 B10R0.74 CCCOCCNC(=O)NC 2708a_100161115042_106832991635 [1,0,0,0,0,0|3,0,0]=4 716 B10R0.74 CCCOCCNC(=O)NC 273464a_100102657272_100161115042 [1,0,0,0,0,0|3,0,0]=4 717 B10R0.74 CCCOCCNC(=O)NC 273464a_100161115042_100102657272 [1,0,0,0,0,0|3,0,0]=4 718 B10R0.74 CCCOCCNC(=O)NC 512a_100161115042_100102657272 [1,0,0,0,0,0|3,0,0]=4 719 B10R0.74 CCCOCCNC(=O)NC 512a_106832991638_100161115042 [1,0,0,0,0,0|3,0,0]=4 720 B10R0.74 CCCOCCNC(=O)OC 34a_100000757965_100000210303 [1,0,0,0,0,0|2,0,0]=3 721 B10R0.74 CCCOCCOC(=O)CC 7a_200000031056_100000210303 [1,0,0,0,0,0|3,0,0]=4 722 B10R0.74 CCCOCCOC(=O)NC 34a_100000210258_200011997002 [1,0,0,0,0,0|3,0,0]=4 723 B10R0.74 CCCOCCOC(=O)OC 34a_100010262106_100000210303 [1,0,0,0,0,0|2,0,0]=3 724 B10R0.74 CCCSC/C=C/C(=O)OC 62a_100000210303_100000742655 [1,0,0,0,0,0|1,0,2]=4 725 B10R0.74 CCCSC/C=C/C(=O)OC 62a_100000742655_100000210303 [1,0,0,0,0,0|1,0,2]=4 726 B10R0.74 CCCSCCCC(=O)NC 62a_100000210303_100000741757 [1,0,0,0,0,0|2,0,1]=4 727 B10R0.74 CCCSCCCC(=O)NC 62a_100000741757_100000210303 [1,0,0,0,0,0|2,0,1]=4 728 B10R0.74 CCCSCCCC(=O)OC 62a_100000210303_100011218270 [1,0,0,0,0,0|1,0,1]=3 729 B10R0.74 CCCSCCCC(=O)OC 62a_100011218270_100000210303 [1,0,0,0,0,0|1,0,1]=3 730 B10R0.74 CCCSCCNC(=O)CC 11a_100020603323_100000210414 [1,0,0,0,0,0|3,0,0]=4 731 B10R0.74 CCCSCCNC(=O)CC 240690a_100020603323_100000210414 [1,0,0,0,0,0|3,0,0]=4 732 B10R0.74 CCCSCCNC(=O)CC 527a_100020603323_100000210414 [1,0,0,0,0,0|3,0,0]=4 733 B10R0.74 CCCSCCNC(=O)NC 2708a_100020603323_106832991635 [1,0,0,0,0,0|3,0,0]=4 734 B10R0.74 CCCSCCNC(=O)NC 2708a_100102657272_100020603323 [1,0,0,0,0,0|3,0,0]=4 735 B10R0.74 CCCSCCNC(=O)NC 273464a_100020603323_100102657272 [1,0,0,0,0,0|3,0,0]=4 736 B10R0.74 CCCSCCNC(=O)NC 273464a_100102657272_100020603323 [1,0,0,0,0,0|3,0,0]=4 737 B10R0.74 CCCSCCNC(=O)NC 512a_100020603323_100102657272 [1,0,0,0,0,0|3,0,0]=4 738 B10R0.74 CCCSCCNC(=O)NC 512a_106832991638_100020603323 [1,0,0,0,0,0|3,0,0]=4 739 B10R0.74 CCCSCCOC(=O)NC 62a_100000210303_200011997002 [1,0,0,0,0,0|3,0,0]=4 740 B10R0.74 CCCSCCOC(=O)NC 62a_200011997002_100000210303 [1,0,0,0,0,0|3,0,0]=4 741 B10R0.74 CCNCCCCC(=O)OC 2230a_100015525214_100000204269 [1,0,0,0,0,0|1,0,1]=3 742 B10R0.74 CCNCCOCC(=O)OC 2230a_100015525214_100000090808 [1,0,0,0,0,0|2,0,1]=4 743 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [1,0,0,0,0,0|1,0,1]=3 744 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [1,0,0,0,0,0|1,0,1]=3 745 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [1,0,0,0,0,0|1,0,1]=3 746 B10R0.74 CCOCCCNC(=O)CC 11a_100000210961_100000210414 [1,0,0,0,0,0|3,0,0]=4 747 B10R0.74 CCOCCCNC(=O)CC 1626a_100000210961_100000210414 [1,0,0,0,0,0|3,0,0]=4 748 B10R0.74 CCOCCCNC(=O)CC 240690a_100000210961_100000210414 [1,0,0,0,0,0|3,0,0]=4 749 B10R0.74 CCOCCCNC(=O)CC 527a_100000210961_100000210414 [1,0,0,0,0,0|3,0,0]=4 750 B10R0.74 CCOCCCNC(=O)NC 2708a_100000210961_106832991635 [1,0,0,0,0,0|3,0,0]=4 751 B10R0.74 CCOCCCNC(=O)NC 2708a_100102657272_100000210961 [1,0,0,0,0,0|3,0,0]=4 752 B10R0.74 CCOCCCNC(=O)NC 273464a_100000210961_100102657272 [1,0,0,0,0,0|3,0,0]=4 753 B10R0.74 CCOCCCNC(=O)NC 273464a_100102657272_100000210961 [1,0,0,0,0,0|3,0,0]=4 754 B10R0.74 CCOCCCNC(=O)NC 512a_100000210961_100102657272 [1,0,0,0,0,0|3,0,0]=4 755 B10R0.74 CCOCCCNC(=O)NC 512a_106832991638_100000210961 [1,0,0,0,0,0|3,0,0]=4 756 B10R0.74 CCOCCNCC(=O)OC 2230a_102516460346_100000747449 [1,0,0,0,0,0|2,0,1]=4 757 B10R0.74 CCOCCNCC(=O)OC 34a_102516460346_100000747449 [1,0,0,0,0,0|2,0,1]=4 758 B10R0.74 CCOCCOCC(=O)OC 34a_100000210136_100000747449 [1,0,0,0,0,0|2,0,1]=4 759 B10R0.74 CCOCCOCC(=O)OC 34a_100121572206_100000090808 [1,0,0,0,0,0|2,0,1]=4 760 B10R0.74 CCOCCOCC(=O)OC 7a_100000210136_100000747449 [1,0,0,0,0,0|2,0,1]=4 761 B10R0.74 CCOCCSCC(=O)OC 62a_100000210147_100000747449 [1,0,0,0,0,0|2,0,1]=4 762 B10R0.74 CCOCCSCC(=O)OC 62a_100000747449_100011215890 [1,0,0,0,0,0|2,0,1]=4 763 B10R0.74 CCOCSCCC(=O)OC 62a_100000204255_100000739092 [1,0,0,0,0,0|2,0,1]=4 764 B10R0.74 CCOCSCCC(=O)OC 62a_100000739092_100000204255 [1,0,0,0,0,0|2,0,1]=4 765 B10R0.74 CCOCSCOC(=O)OC 62a_100000739092_100000139417 [1,0,0,0,0,0|3,0,0]=4 766 B10R0.74 CCSCCCCC(=O)OC 62a_100000204269_100000210202 [1,0,0,0,0,0|1,0,1]=3 767 B10R0.74 CCSCCCCC(=O)OC 62a_100000210202_100000204269 [1,0,0,0,0,0|1,0,1]=3 768 B10R0.74 CCSCCNCC(=O)OC 2230a_100000106463_100000747449 [1,0,0,0,0,0|2,0,1]=4 769 B10R0.74 CCSCCOCC(=O)OC 34a_100000212035_100000747449 [1,0,0,0,0,0|2,0,1]=4 770 B10R0.74 CCSCCOCC(=O)OC 62a_100000090808_100000210202 [1,0,0,0,0,0|2,0,1]=4 771 B10R0.74 CCSCCOCC(=O)OC 62a_100000210202_100000090808 [1,0,0,0,0,0|2,0,1]=4 772 B10R0.74 CCSCCOCC(=O)OC 7a_100000212035_100000747449 [1,0,0,0,0,0|2,0,1]=4 773 B10R0.74 CCSCCSCC(=O)OC 62a_100000747449_100000757381 [1,0,0,0,0,0|2,0,1]=4 774 B10R0.74 CCSCCSCC(=O)OC 62a_100000757381_100000747449 [1,0,0,0,0,0|2,0,1]=4 775 B10R0.74 CNC(=O)CCCCCCO 240690a_100102657272_100011996774 [1,0,0,0,0,0|2,0,1]=4 776 B10R0.74 CNC(=O)CCCCCOC 11a_106832991635_100011935119 [1,0,0,0,0,0|2,0,1]=4 777 B10R0.74 CNC(=O)CCCCCOC 1626a_100102657272_100011935119 [1,0,0,0,0,0|2,0,1]=4 778 B10R0.74 CNC(=O)CCCCCOC 240690a_100102657272_100011935119 [1,0,0,0,0,0|2,0,1]=4 779 B10R0.74 CNC(=O)CCCCCOC 527a_100102657272_100011935119 [1,0,0,0,0,0|2,0,1]=4 780 B10R0.74 CNC(=O)NCCCCCO 2708a_100102657272_100000762737 [1,0,0,0,0,0|3,0,0]=4 781 B10R0.74 CNC(=O)NCCCCCO 273464a_100000762737_100102657272 [1,0,0,0,0,0|3,0,0]=4 782 B10R0.74 CNC(=O)NCCCCCO 273464a_100102657272_100000762737 [1,0,0,0,0,0|3,0,0]=4 783 B10R0.74 CNC(=O)NCCCCCO 512a_100000762737_100102657272 [1,0,0,0,0,0|3,0,0]=4 784 B10R0.74 CNC(=O)NCCCCCO 512a_106832991638_100000762737 [1,0,0,0,0,0|3,0,0]=4 785 B10R0.74 CNCCCCCC(=O)OC 2230a_106832991635_100009816466 [1,0,0,0,0,0|1,0,1]=3 786 B10R0.74 CNCCCCCC(=O)OC 34a_100102657272_100009816466 [1,0,0,0,0,0|1,0,1]=3 787 B10R0.74 CNCCCCCC(=O)OC 7a_106832991635_100009816466 [1,0,0,0,0,0|1,0,1]=3 788 B10R0.74 CNCCCOCC(=O)OC 34a_100000213112_100000747449 [1,0,0,0,0,0|2,0,1]=4 789 B10R0.74 COC(=O)CCCCCO[13CH3] 34a_100000074720_200025704644 [1,0,0,0,0,0|1,0,1]=3 790 B10R0.74 COC(=O)CCCCCO[13CH3] 7a_100000074720_200025704644 [1,0,0,0,0,0|1,0,1]=3 791 B10R0.74 COC(=O)CCCCCSC 62a_100009816466_200000210301 [1,0,0,0,0,0|1,0,1]=3 792 B10R0.74 COC(=O)CCCCCSC 62a_200000210301_100009816466 [1,0,0,0,0,0|1,0,1]=3 793 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_100009816466_200025704644 [1,0,0,0,0,0|1,0,1]=3 794 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_200025704644_100009816466 [1,0,0,0,0,0|1,0,1]=3 795 B10R0.74 COC(=O)CCCCOCF 34a_100000059025_100015361967 [1,0,0,0,0,0|2,0,1]=4 796 B10R0.74 COC(=O)CCCCOCF 7a_100000059025_100015361967 [1,0,0,0,0,0|2,0,1]=4 797 B10R0.74 COC(=O)CCCCSCF 62a_100000204269_100015361967 [1,0,0,0,0,0|2,0,1]=4 798 B10R0.74 COC(=O)CCCCSCF 62a_100015361967_100000204269 [1,0,0,0,0,0|2,0,1]=4 799 B10R0.74 COC(=O)CCCNCCF 34a_100000724931_100000742333 [1,0,0,0,0,0|2,0,1]=4 800 B10R0.74 COC(=O)CCCNCCO 2230a_100016997473_100011218270 [1,0,0,0,0,0|2,0,1]=4 801 B10R0.74 COC(=O)CCCNCCO 34a_100016990907_100000742333 [1,0,0,0,0,0|2,0,1]=4 802 B10R0.74 COC(=O)CCCOCCBr 34a_100000211926_100000742333 [1,0,0,0,0,0|2,0,1]=4 803 B10R0.74 COC(=O)CCCOCCN 34a_100000210304_100000742333 [1,0,0,0,0,0|2,0,1]=4 804 B10R0.74 COC(=O)CCCSCCF 62a_100011217306_100011218270 [1,0,0,0,0,0|2,0,1]=4 805 B10R0.74 COC(=O)CCCSCCF 62a_100011218270_100011217306 [1,0,0,0,0,0|2,0,1]=4 806 B10R0.74 COC(=O)CCCSCCO 62a_100000211926_100011218270 [1,0,0,0,0,0|2,0,1]=4 807 B10R0.74 COC(=O)CCCSCCO 62a_100011218270_100000211926 [1,0,0,0,0,0|2,0,1]=4 808 B10R0.74 COC(=O)CCCSCSC 62a_100011218213_100011218270 [1,0,0,0,0,0|2,0,1]=4 809 B10R0.74 COC(=O)CCCSCSC 62a_100011218270_100011218213 [1,0,0,0,0,0|2,0,1]=4 810 B10R0.74 COC(=O)CCNCCCF 2230a_100015189416_100000204255 [1,0,0,0,0,0|2,0,1]=4 811 B10R0.74 COC(=O)CCNCCCF 34a_100015189416_100000742370 [1,0,0,0,0,0|2,0,1]=4 812 B10R0.74 COC(=O)CCNCCSC 2230a_100020590264_100000204255 [1,0,0,0,0,0|2,0,1]=4 813 B10R0.74 COC(=O)CCOCCCBr 34a_100011217188_100000742370 [1,0,0,0,0,0|2,0,1]=4 814 B10R0.74 COC(=O)CCOCCCCl 34a_100000230001_100000742370 [1,0,0,0,0,0|2,0,1]=4 815 B10R0.74 COC(=O)CCOCCCF 34a_100000759539_100000742370 [1,0,0,0,0,0|2,0,1]=4 816 B10R0.74 COC(=O)CCOCCCN 34a_100000182051_100000742370 [1,0,0,0,0,0|2,0,1]=4 817 B10R0.74 COC(=O)CCOCCSC 34a_100000230434_100000742370 [1,0,0,0,0,0|2,0,1]=4 818 B10R0.74 COC(=O)CCOCCSC 7a_100000230434_100000204255 [1,0,0,0,0,0|2,0,1]=4 819 B10R0.74 COC(=O)CCSCCCF 62a_100000204255_100011934791 [1,0,0,0,0,0|2,0,1]=4 820 B10R0.74 COC(=O)CCSCCCF 62a_100011934791_100000204255 [1,0,0,0,0,0|2,0,1]=4 821 B10R0.74 COC(=O)CCSCCCO 62a_100000204255_100011215043 [1,0,0,0,0,0|2,0,1]=4 822 B10R0.74 COC(=O)CCSCCCO 62a_100011215043_100000204255 [1,0,0,0,0,0|2,0,1]=4 823 B10R0.74 COC(=O)CCSCCSC 62a_100000204255_100000751147 [1,0,0,0,0,0|2,0,1]=4 824 B10R0.74 COC(=O)CCSCCSC 62a_100000212216_100000204255 [1,0,0,0,0,0|2,0,1]=4 825 B10R0.74 COC(=O)CNCCCCO 2230a_100000750430_100000747449 [1,0,0,0,0,0|2,0,1]=4 826 B10R0.74 COC(=O)CNCCCCO 34a_100000750430_100000747449 [1,0,0,0,0,0|2,0,1]=4 827 B10R0.74 COC(=O)CNCCCSC 2230a_100000749238_100000747449 [1,0,0,0,0,0|2,0,1]=4 828 B10R0.74 COC(=O)COCCCCBr 34a_100011216708_100000747449 [1,0,0,0,0,0|2,0,1]=4 829 B10R0.74 COC(=O)COCCCCCl 34a_100000210776_100000747449 [1,0,0,0,0,0|2,0,1]=4 830 B10R0.74 COC(=O)COCCCCCl 7a_100000210776_100000747449 [1,0,0,0,0,0|2,0,1]=4 831 B10R0.74 COC(=O)COCCCCF 34a_100011995726_100000747449 [1,0,0,0,0,0|2,0,1]=4 832 B10R0.74 COC(=O)COCCCCF 7a_100011995726_100000747449 [1,0,0,0,0,0|2,0,1]=4 833 B10R0.74 COC(=O)COCCCCI 34a_200012148704_100000747449 [1,0,0,0,0,0|2,0,1]=4 834 B10R0.74 COC(=O)COCCCCN 34a_100000750430_100000747449 [1,0,0,0,0,0|2,0,1]=4 835 B10R0.74 COC(=O)COCCCSC 34a_100000690336_100000747449 [1,0,0,0,0,0|2,0,1]=4 836 B10R0.74 COC(=O)COCCCSC 7a_100000690336_100000747449 [1,0,0,0,0,0|2,0,1]=4 837 B10R0.74 COC(=O)CSCCCCF 62a_100000729493_100000747449 [1,0,0,0,0,0|2,0,1]=4 838 B10R0.74 COC(=O)CSCCCCF 62a_100000747449_100000729493 [1,0,0,0,0,0|2,0,1]=4 839 B10R0.74 COC(=O)CSCCCCO 62a_100000210776_100000747449 [1,0,0,0,0,0|2,0,1]=4 840 B10R0.74 COC(=O)CSCCCCO 62a_100000747449_100000210776 [1,0,0,0,0,0|2,0,1]=4 841 B10R0.74 COC(=O)NCCOCCF 34a_100000757965_100011217306 [1,0,0,0,0,0|3,0,0]=4 842 B10R0.74 COC(=O)NCCOCCO 34a_100000757965_100000211926 [1,0,0,0,0,0|3,0,0]=4 843 B10R0.74 COC(=O)NCCOCSC 34a_100000757965_100011218213 [1,0,0,0,0,0|3,0,0]=4 844 B10R0.74 COC(=O)OCCOCCF 34a_100010262106_100011217306 [1,0,0,0,0,0|3,0,0]=4 845 B10R0.74 COC(=O)OCCOCCO 34a_100010262106_100000211926 [1,0,0,0,0,0|3,0,0]=4 846 B10R0.74 COC(=O)OCCOCSC 34a_100010262106_100011218213 [1,0,0,0,0,0|3,0,0]=4 847 B10R0.74 COC(=O)OCSCCCF 62a_100011934791_100000139417 [1,0,0,0,0,0|3,0,0]=4 848 B10R0.74 COC(=O)OCSCCCO 62a_100011215043_100000139417 [1,0,0,0,0,0|3,0,0]=4 849 B10R0.74 COC(=O)OCSCCSC 62a_100000212216_100000139417 [1,0,0,0,0,0|3,0,0]=4 850 B10R0.74 COCCCCCC(=O)OC 34a_100000074720_200000210301 [1,0,0,0,0,0|1,0,1]=3 851 B10R0.74 COCCCCCC(=O)OC 34a_100138415774_100009816466 [1,0,0,0,0,0|1,0,1]=3 852 B10R0.74 COCCCCCC(=O)OC 7a_100000074720_200000210301 [1,0,0,0,0,0|1,0,1]=3 853 B10R0.74 COCCCNCC(=O)OC 34a_100150723488_100000747449 [1,0,0,0,0,0|2,0,1]=4 854 B10R0.74 COCCCOCC(=O)OC 34a_100000740835_100000747449 [1,0,0,0,0,0|2,0,1]=4 855 B10R0.74 COCCCSCC(=O)OC 62a_100000709357_100000747449 [1,0,0,0,0,0|2,0,1]=4 856 B10R0.74 COCCCSCC(=O)OC 62a_100000747449_100000709357 [1,0,0,0,0,0|2,0,1]=4 857 B10R0.74 COCCNCCC(=O)OC 2230a_100000209980_100000204255 [1,0,0,0,0,0|2,0,1]=4 858 B10R0.74 COCCOCCC(=O)OC 34a_100000210237_100000742370 [1,0,0,0,0,0|2,0,1]=4 859 B10R0.74 COCCSCCC(=O)OC 62a_100000204255_100000233755 [1,0,0,0,0,0|2,0,1]=4 860 B10R0.74 COCCSCCC(=O)OC 62a_100000233755_100000204255 [1,0,0,0,0,0|2,0,1]=4 861 B10R0.74 COCCSCOC(=O)OC 62a_100000233755_100000139417 [1,0,0,0,0,0|3,0,0]=4 862 B10R0.74 COCSCCCC(=O)OC 62a_100000766300_100011218270 [1,0,0,0,0,0|2,0,1]=4 863 B10R0.74 COCSCCCC(=O)OC 62a_100011218270_100000766300 [1,0,0,0,0,0|2,0,1]=4 864 B12R0.1 C=COC(=O)CNCCCCCC 2230a_100000210581_100000036128 [0,1,0,0,0,0|1,0,2]=4 865 B12R0.1 C=COC(=O)COCCCCCC 34a_100000210259_100000036128 [0,1,0,0,0,0|1,0,2]=4 866 B12R0.1 C=COC(=O)CSCCCCCC 62a_100000036128_100000210757 [0,1,0,0,0,0|1,0,2]=4 867 B12R0.1 C=COC(=O)CSCCCCCC 62a_100000210314_100000036128 [0,1,0,0,0,0|1,0,2]=4 868 B12R0.1 CC#CC(=O)CC#CCCCCC 1458a_100000763181_100009816472 [0,1,0,0,0,0|1,0,2]=4 869 B12R0.1 CC#CC(=O)CCCCCCCC 1458a_100000763181_100000210759 [0,1,0,0,0,0|1,0,2]=4 870 B12R0.1 CC=CC(=O)CC#CCCCCC 1458a_100000210699_100009816472 [0,1,0,0,0,0|1,0,2]=4 871 B12R0.1 CC=CC(=O)CCCCCCCC 1458a_100000210699_100000210759 [0,1,0,0,0,0|1,0,2]=4 872 B12R0.1 CC=CC(=O)NCCCCCCC 11a_100000229938_100000210699 [0,1,0,0,0,0|2,0,1]=4 873 B12R0.1 CC=CC(=O)NCCCCCCC 1626a_100000229938_100000210699 [0,1,0,0,0,0|2,0,1]=4 874 B12R0.1 CC=CC(=O)NCCCCCCC 240690a_100000229938_100000210699 [0,1,0,0,0,0|2,0,1]=4 875 B12R0.1 CCCCCC#CCC(=O)CCC 1458a_100000211992_100009816472 [0,1,0,0,0,0|1,0,2]=4 876 B12R0.1 CCCCCC#CCC(=O)CCO 1458a_100011216618_100009816472 [0,1,0,0,0,0|1,0,2]=4 877 B12R0.1 CCCCCC#CCC(=O)COC 1458a_100000210968_100009816472 [0,1,0,0,0,0|0,0,2]=3 878 B12R0.1 CCCCCC#CCC(=O)CSC 1458a_100000184570_100009816472 [0,1,0,0,0,0|0,1,2]=4 879 B12R0.1 CCCCCC=NNC(=O)COC 4a_100000216845_100000737632 [0,1,0,0,0,0|2,0,1]=4 880 B12R0.1 CCCCCCC=CC(=O)CCC 1458a_200015324643_100000210303 [0,1,0,0,0,0|1,0,2]=4 881 B12R0.1 CCCCCCC=CC(=O)CCF 1458a_200015324643_100011217306 [0,1,0,0,0,0|1,0,2]=4 882 B12R0.1 CCCCCCC=CC(=O)CCO 1458a_200015324643_100000211926 [0,1,0,0,0,0|1,0,2]=4 883 B12R0.1 CCCCCCC=CC(=O)NCC 11a_100015525214_200015324643 [0,1,0,0,0,0|1,0,2]=4 884 B12R0.1 CCCCCCC=CC(=O)NCC 240690a_100015525214_200015324643 [0,1,0,0,0,0|1,0,2]=4 885 B12R0.1 CCCCCCC=CC(=O)NNC 22a_100016993582_200015324643 [0,1,0,0,0,0|1,0,2]=4 886 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000210188_100000210303 [0,1,0,0,0,0|1,0,2]=4 887 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000211992_100000210759 [0,1,0,0,0,0|1,0,2]=4 888 B12R0.1 CCCCCCCCC(=O)CCF 1458a_100000210188_100011217306 [0,1,0,0,0,0|1,0,2]=4 889 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100000210188_100000211926 [0,1,0,0,0,0|1,0,2]=4 890 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100011216618_100000210759 [0,1,0,0,0,0|1,0,2]=4 891 B12R0.1 CCCCCCCCC(=O)COC 1458a_100000210968_100000210759 [0,1,0,0,0,0|0,0,2]=3 892 B12R0.1 CCCCCCCCC(=O)CSC 1458a_100000184570_100000210759 [0,1,0,0,0,0|0,1,2]=4 893 B12R0.1 CCCCCCCCC(=O)NCC 11a_100015525214_100000210188 [0,1,0,0,0,0|1,0,2]=4 894 B12R0.1 CCCCCCCCC(=O)NCC 240690a_100015525214_100000210188 [0,1,0,0,0,0|1,0,2]=4 895 B12R0.1 CCCCCCCCC(=O)NCC 527a_100015525214_100000210188 [0,1,0,0,0,0|1,0,2]=4 896 B12R0.1 CCCCCCCCC(=O)NNC 22a_100016993582_100000210188 [0,1,0,0,0,0|1,0,2]=4 897 B12R0.1 CCCCCCCNC(=O)CCC 11a_100000229938_100000211992 [0,1,0,0,0,0|2,0,1]=4 898 B12R0.1 CCCCCCCNC(=O)CCC 1626a_100000229938_100000211992 [0,1,0,0,0,0|2,0,1]=4 899 B12R0.1 CCCCCCCNC(=O)CCC 240690a_100000229938_100000211992 [0,1,0,0,0,0|2,0,1]=4 900 B12R0.1 CCCCCCCNC(=O)CCC 527a_100000229938_100000211992 [0,1,0,0,0,0|2,0,1]=4 901 B12R0.1 CCCCCCCNC(=O)CCO 240690a_100000229938_100011216618 [0,1,0,0,0,0|2,0,1]=4 902 B12R0.1 CCCCCCCNC(=O)COC 11a_100000229938_100000210968 [0,1,0,0,0,0|1,0,1]=3 903 B12R0.1 CCCCCCCNC(=O)COC 1626a_100000229938_100000210968 [0,1,0,0,0,0|1,0,1]=3 904 B12R0.1 CCCCCCCNC(=O)COC 240690a_100000229938_100000210968 [0,1,0,0,0,0|1,0,1]=3 905 B12R0.1 CCCCCCCNC(=O)COC 527a_100000229938_100000210968 [0,1,0,0,0,0|1,0,1]=3 906 B12R0.1 CCCCCCCNC(=O)CSC 11a_100000229938_100000184570 [0,1,0,0,0,0|1,1,1]=4 907 B12R0.1 CCCCCCCNC(=O)CSC 1626a_100000229938_100000184570 [0,1,0,0,0,0|1,1,1]=4 908 B12R0.1 CCCCCCCNC(=O)CSC 240690a_100000229938_100000184570 [0,1,0,0,0,0|1,1,1]=4 909 B12R0.1 CCCCCCCNC(=O)CSC 527a_100000229938_100000184570 [0,1,0,0,0,0|1,1,1]=4 910 B12R0.1 CCCCCCCNC(=O)NCC 2708a_100000229938_100015525214 [0,1,0,0,0,0|2,0,1]=4 911 B12R0.1 CCCCCCCNC(=O)NCC 2708a_100015525214_100000229938 [0,1,0,0,0,0|2,0,1]=4 912 B12R0.1 CCCCCCCNC(=O)NCC 273464a_100000229938_100015525214 [0,1,0,0,0,0|2,0,1]=4 913 B12R0.1 CCCCCCCNC(=O)NCC 273464a_100015525214_100000229938 [0,1,0,0,0,0|2,0,1]=4 914 B12R0.1 CCCCCCCNC(=O)NCC 512a_100000229938_100015525214 [0,1,0,0,0,0|2,0,1]=4 915 B12R0.1 CCCCCCCNC(=O)NCC 512a_100015525214_100000229938 [0,1,0,0,0,0|2,0,1]=4 916 B12R0.1 CCCCCCCNC(=O)NNC 273464a_100000229938_100016993582 [0,1,0,0,0,0|2,0,1]=4 917 B12R0.1 CCCCCCCNC(=O)NNC 512a_100000229938_100016993582 [0,1,0,0,0,0|2,0,1]=4 918 B12R0.1 CCCCCCCNC(=O)NNC 512a_100016993582_100000229938 [0,1,0,0,0,0|2,0,1]=4 919 B12R0.1 CCCCCCNCC(=O)CCC 2230a_100000210581_100000747444 [0,1,0,0,0,0|2,0,1]=4 920 B12R0.1 CCCCCCNCC(=O)NCC 2230a_100000210581_100000183381 [0,1,0,0,0,0|2,0,1]=4 921 B12R0.1 CCCCCCNCC(=O)NCC 2230a_100016988866_100000210314 [0,1,0,0,0,0|2,0,1]=4 922 B12R0.1 CCCCCCNCC(=O)NCO 2230a_100000210581_100000185155 [0,1,0,0,0,0|2,0,1]=4 923 B12R0.1 CCCCCCNCC(=O)OCC 2230a_100000210581_100000188475 [0,1,0,0,0,0|1,0,1]=3 924 B12R0.1 CCCCCCOCC(=O)CCC 7a_100000210259_100000747444 [0,1,0,0,0,0|2,0,1]=4 925 B12R0.1 CCCCCCOCC(=O)NCC 34a_100000210259_100000183381 [0,1,0,0,0,0|2,0,1]=4 926 B12R0.1 CCCCCCOCC(=O)NCC 7a_100000210259_100000183381 [0,1,0,0,0,0|2,0,1]=4 927 B12R0.1 CCCCCCOCC(=O)NCO 34a_100000210259_100000185155 [0,1,0,0,0,0|2,0,1]=4 928 B12R0.1 CCCCCCOCC(=O)NCO 7a_100000210259_100000185155 [0,1,0,0,0,0|2,0,1]=4 929 B12R0.1 CCCCCCOCC(=O)OCC 34a_100000210259_100000188475 [0,1,0,0,0,0|1,0,1]=3 930 B12R0.1 CCCCCCOCC(=O)OCC 7a_100000210259_100000188475 [0,1,0,0,0,0|1,0,1]=3 931 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000210314_100000747444 [0,1,0,0,0,0|2,0,1]=4 932 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000747444_100000210757 [0,1,0,0,0,0|2,0,1]=4 933 B12R0.1 CCCCCCSCC(=O)NCC 62a_100000183381_100000210757 [0,1,0,0,0,0|2,0,1]=4 934 B12R0.1 CCCCCCSCC(=O)NCC 62a_100000210314_100000183381 [0,1,0,0,0,0|2,0,1]=4 935 B12R0.1 CCCCCCSCC(=O)NCO 62a_100000185155_100000210757 [0,1,0,0,0,0|2,0,1]=4 936 B12R0.1 CCCCCCSCC(=O)NCO 62a_100000210314_100000185155 [0,1,0,0,0,0|2,0,1]=4 937 B12R0.1 CCCCCCSCC(=O)OCC 62a_100000188475_100000210757 [0,1,0,0,0,0|1,0,1]=3 938 B12R0.1 CCCCCCSCC(=O)OCC 62a_100000210314_100000188475 [0,1,0,0,0,0|1,0,1]=3 939 B12R0.1 CCCCCNCCC(=O)OCC 2230a_100000209983_100011206558 [0,1,0,0,0,0|1,0,2]=4 940 B12R0.1 CCCCCNN=CC(=O)OCC 4a_100000694160_100000742314 [0,1,0,0,0,0|2,0,1]=4 941 B12R0.1 CCCCCOCCC(=O)OCC 34a_100000210253_100000765890 [0,1,0,0,0,0|1,0,2]=4 942 B12R0.1 CCCCCOCCC(=O)OCC 7a_100000210253_100011206558 [0,1,0,0,0,0|1,0,2]=4 943 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000210326_100000765890 [0,1,0,0,0,0|1,0,2]=4 944 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000765890_100000210326 [0,1,0,0,0,0|1,0,2]=4 945 B12R0.1 CCCCCSCOC(=O)OCC 62a_100000210326_100000075025 [0,1,0,0,0,0|2,0,1]=4 946 B12R0.1 CCCCNC/C=C/C(=O)OCC 2230a_100000102301_100016267167 [0,1,0,0,0,0|1,0,2]=4 947 B12R0.1 CCCCNC/C=C/C(=O)OCC 7a_106832991798_100016267167 [0,1,0,0,0,0|1,0,2]=4 948 B12R0.1 CCCCNCCCC(=O)OCC 2230a_100000102301_100009991533 [0,1,0,0,0,0|1,0,2]=4 949 B12R0.1 CCCCNCCCC(=O)OCC 7a_106832991798_100011215271 [0,1,0,0,0,0|1,0,2]=4 950 B12R0.1 CCCCNCCNC(=O)OCC 7a_106832991798_200011445536 [0,1,0,0,0,0|2,0,1]=4 951 B12R0.1 CCCCOC/C=C/C(=O)OCC 34a_100000210227_100016267167 [0,1,0,0,0,0|1,0,2]=4 952 B12R0.1 CCCCOC/C=C/C(=O)OCC 7a_100000210227_100016267167 [0,1,0,0,0,0|1,0,2]=4 953 B12R0.1 CCCCOCCCC(=O)OCC 34a_100000210227_100009991533 [0,1,0,0,0,0|1,0,2]=4 954 B12R0.1 CCCCOCCCC(=O)OCC 7a_100000210227_100011215271 [0,1,0,0,0,0|1,0,2]=4 955 B12R0.1 CCCCOCCCC(=O)OCC 7a_100012001163_100000210211 [0,1,0,0,0,0|1,0,2]=4 956 B12R0.1 CCCCOCCNC(=O)OCC 34a_100000158857_100000210210 [0,1,0,0,0,0|2,0,1]=4 957 B12R0.1 CCCCOCCNC(=O)OCC 7a_100000210227_200011445536 [0,1,0,0,0,0|2,0,1]=4 958 B12R0.1 CCCCOCSCC(=O)OCC 62a_100000188475_100011995733 [0,1,0,0,0,0|2,0,1]=4 959 B12R0.1 CCCCOCSCC(=O)OCC 62a_100011995733_100000188475 [0,1,0,0,0,0|2,0,1]=4 960 B12R0.1 CCCCSC/C=C/C(=O)OCC 62a_100000210211_100016267167 [0,1,0,0,0,0|1,0,2]=4 961 B12R0.1 CCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210210 [0,1,0,0,0,0|1,0,2]=4 962 B12R0.1 CCCCSCCCC(=O)OCC 62a_100000210211_100009991533 [0,1,0,0,0,0|1,0,2]=4 963 B12R0.1 CCCCSCCCC(=O)OCC 62a_100009991533_100000210210 [0,1,0,0,0,0|1,0,2]=4 964 B12R0.1 CCCCSCCNC(=O)COC 11a_100025743550_100000210968 [0,1,0,0,0,0|2,0,1]=4 965 B12R0.1 CCCCSCCNC(=O)COC 1626a_100025743550_100000210968 [0,1,0,0,0,0|2,0,1]=4 966 B12R0.1 CCCCSCCNC(=O)COC 240690a_100025743550_100000210968 [0,1,0,0,0,0|2,0,1]=4 967 B12R0.1 CCCCSCCNC(=O)COC 527a_100025743550_100000210968 [0,1,0,0,0,0|2,0,1]=4 968 B12R0.1 CCCCSCCNC(=O)OCC 62a_100000210211_200011445536 [0,1,0,0,0,0|2,0,1]=4 969 B12R0.1 CCCOCCCCC(=O)OCC 34a_100000210258_100000750268 [0,1,0,0,0,0|1,0,2]=4 970 B12R0.1 CCCOCCCNC(=O)COC 1626a_100011217757_100000210968 [0,1,0,0,0,0|2,0,1]=4 971 B12R0.1 CCCOCCCNC(=O)COC 240690a_100011217757_100000210968 [0,1,0,0,0,0|2,0,1]=4 972 B12R0.1 CCCOCCCNC(=O)COC 527a_100011217757_100000210968 [0,1,0,0,0,0|2,0,1]=4 973 B12R0.1 CCCOCCNCC(=O)OCC 2230a_100161115042_100000188475 [0,1,0,0,0,0|2,0,1]=4 974 B12R0.1 CCCOCCNCC(=O)OCC 34a_100161115042_100000188475 [0,1,0,0,0,0|2,0,1]=4 975 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000210258_100000088970 [0,1,0,0,0,0|2,0,1]=4 976 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000752267_100000188475 [0,1,0,0,0,0|2,0,1]=4 977 B12R0.1 CCCOCCOCC(=O)OCC 7a_100000752267_100000188475 [0,1,0,0,0,0|2,0,1]=4 978 B12R0.1 CCCOCCSCC(=O)OCC 62a_100000188475_100011215938 [0,1,0,0,0,0|2,0,1]=4 979 B12R0.1 CCCOCCSCC(=O)OCC 62a_100011215938_100000188475 [0,1,0,0,0,0|2,0,1]=4 980 B12R0.1 CCCOCCSCC(=O)OCC 7a_200000230590_100000210303 [0,1,0,0,0,0|2,0,1]=4 981 B12R0.1 CCCSCCCCC(=O)OCC 62a_100000210303_100000750268 [0,1,0,0,0,0|1,0,2]=4 982 B12R0.1 CCCSCCCCC(=O)OCC 62a_100000750268_100000210303 [0,1,0,0,0,0|1,0,2]=4 983 B12R0.1 CCCSCCNCC(=O)OCC 2230a_100020603323_100000188475 [0,1,0,0,0,0|2,0,1]=4 984 B12R0.1 CCCSCCOCC(=O)OCC 34a_200000230433_100000188475 [0,1,0,0,0,0|2,0,1]=4 985 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000088970_100000210303 [0,1,0,0,0,0|2,0,1]=4 986 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000210303_100000088970 [0,1,0,0,0,0|2,0,1]=4 987 B12R0.1 CCCSCCOCC(=O)OCC 7a_200000230433_100000188475 [0,1,0,0,0,0|2,0,1]=4 988 B12R0.1 CCNCCCCCC(=O)OCC 2230a_100015525214_100000755133 [0,1,0,0,0,0|1,0,2]=4 989 B12R0.1 CCNCCCOCC(=O)OCC 2230a_100015525214_100009893628 [0,1,0,0,0,0|2,0,1]=4 990 B12R0.1 CCOC(=O)CCCCCCNC 2230a_106832991635_100009814379 [0,1,0,0,0,0|1,0,2]=4 991 B12R0.1 CCOC(=O)CCCCCCNC 34a_100102657272_100009814379 [0,1,0,0,0,0|1,0,2]=4 992 B12R0.1 CCOC(=O)CCCCCCNC 7a_106832991635_100009814379 [0,1,0,0,0,0|1,0,2]=4 993 B12R0.1 CCOC(=O)CCCCCCOC 34a_100138415774_100009814379 [0,1,0,0,0,0|1,0,2]=4 994 B12R0.1 CCOC(=O)CCCCCCSC 62a_200000210301_100009814379 [0,1,0,0,0,0|1,0,2]=4 995 B12R0.1 CCOC(=O)CCCCCCS[13CH3] 62a_200025704644_100009814379 [0,1,0,0,0,0|1,0,2]=4 996 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000210202_100000755133 [0,1,0,0,0,0|1,0,2]=4 997 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000755133_100000210202 [0,1,0,0,0,0|1,0,2]=4 998 B12R0.1 CCOC(=O)CNCCCCCO 2230a_100000762737_100000188475 [0,1,0,0,0,0|2,0,1]=4 999 B12R0.1 CCOC(=O)CNCCCCCO 34a_100000762737_100000188475 [0,1,0,0,0,0|2,0,1]=4 1000 B12R0.1 CCOC(=O)COCCCCCBr 34a_100000746331_100000188475 [0,1,0,0,0,0|2,0,1]=4 1001 B12R0.1 CCOC(=O)COCCCCCBr 7a_100000746331_100000188475 [0,1,0,0,0,0|2,0,1]=4 1002 B12R0.1 CCOC(=O)COCCCCCCl 34a_100000746330_100000188475 [0,1,0,0,0,0|2,0,1]=4 1003 B12R0.1 CCOC(=O)COCCCCCCl 7a_100000746330_100000188475 [0,1,0,0,0,0|2,0,1]=4 1004 B12R0.1 CCOC(=O)COCCCCCI 34a_200012148887_100000188475 [0,1,0,0,0,0|2,0,1]=4 1005 B12R0.1 CCOC(=O)COCCCCCI 7a_200012148887_100000188475 [0,1,0,0,0,0|2,0,1]=4 1006 B12R0.1 CCOC(=O)COCCCCCN 34a_100000762737_100000188475 [0,1,0,0,0,0|2,0,1]=4 1007 B12R0.1 CCOC(=O)COCCCCOC 34a_100000740925_100000188475 [0,1,0,0,0,0|2,0,1]=4 1008 B12R0.1 CCOC(=O)COCCCCSC 34a_100011217163_100000188475 [0,1,0,0,0,0|2,0,1]=4 1009 B12R0.1 CCOC(=O)COCCCCSC 7a_100011217163_100000188475 [0,1,0,0,0,0|2,0,1]=4 1010 B12R0.1 CCOC(=O)COCCCSCC 34a_100011216438_100000188475 [0,1,0,0,0,0|2,0,1]=4 1011 B12R0.1 CCOC(=O)COCCCSCC 62a_100000210202_100009893628 [0,1,0,0,0,0|2,0,1]=4 1012 B12R0.1 CCOC(=O)COCCCSCC 62a_100009893628_100000210202 [0,1,0,0,0,0|2,0,1]=4 1013 B12R0.1 CCOC(=O)COCCCSCC 7a_100011216438_100000188475 [0,1,0,0,0,0|2,0,1]=4 1014 B12R0.1 CCOC(=O)CSCCCCCF 62a_100000188475_100000729378 [0,1,0,0,0,0|2,0,1]=4 1015 B12R0.1 CCOC(=O)CSCCCCCF 62a_100000729378_100000188475 [0,1,0,0,0,0|2,0,1]=4 1016 B12R0.1 CCOC(=O)CSCCCCCO 62a_100000188475_100000746330 [0,1,0,0,0,0|2,0,1]=4 1017 B12R0.1 CCOC(=O)CSCCCCCO 62a_100000746330_100000188475 [0,1,0,0,0,0|2,0,1]=4 1018 B12R0.1 CCOC(=O)CSCCCCOC 62a_100000188475_100000730899 [0,1,0,0,0,0|2,0,1]=4 1019 B12R0.1 CCOC(=O)CSCCCCOC 62a_100000730899_100000188475 [0,1,0,0,0,0|2,0,1]=4 1020 B12R0.1 CCOCCCCCC(=O)OCC 34a_100121572206_100000755133 [0,1,0,0,0,0|1,0,2]=4 1021 B12R0.1 CCOCCCCCC(=O)OCC 7a_100011214988_100000210202 [0,1,0,0,0,0|1,0,2]=4 1022 B12R0.1 CCOCCCNCC(=O)OCC 2230a_100000210961_100000188475 [0,1,0,0,0,0|2,0,1]=4 1023 B12R0.1 CCOCCCNCC(=O)OCC 34a_100000210961_100000188475 [0,1,0,0,0,0|2,0,1]=4 1024 B12R0.1 CCOCCCOCC(=O)OCC 34a_100000757476_100000188475 [0,1,0,0,0,0|2,0,1]=4 1025 B12R0.1 CCOCCCOCC(=O)OCC 34a_100121572206_100009893628 [0,1,0,0,0,0|2,0,1]=4 1026 B12R0.1 CCOCCCOCC(=O)OCC 7a_100000757476_100000188475 [0,1,0,0,0,0|2,0,1]=4 1027 B12R0.1 CCOCCCSCC(=O)OCC 62a_100000188475_100012232248 [0,1,0,0,0,0|2,0,1]=4 1028 B12R0.1 CCOCCCSCC(=O)OCC 62a_100012232248_100000188475 [0,1,0,0,0,0|2,0,1]=4 1029 B12R0.1 COCC(=O)CCCCCCCO 1458a_100000210968_100000760002 [0,1,0,0,0,0|1,0,2]=4 1030 B12R0.1 COCC(=O)NCCCCCCO 240690a_100000686447_100000210968 [0,1,0,0,0,0|2,0,1]=4 1031 B12R0.1 COCC(=O)NCCCCCCO 527a_100000686447_100000210968 [0,1,0,0,0,0|2,0,1]=4 1032 B12R0.1 COCCCCCCC(=O)COC 1458a_100000210968_100011998445 [0,1,0,0,0,0|1,0,2]=4 1033 B12R0.1 COCCCCCNC(=O)COC 11a_100000747528_100000210968 [0,1,0,0,0,0|2,0,1]=4 1034 B12R0.1 COCCCCCNC(=O)COC 1626a_100000747528_100000210968 [0,1,0,0,0,0|2,0,1]=4 1035 B12R0.1 COCCCCCNC(=O)COC 240690a_100000747528_100000210968 [0,1,0,0,0,0|2,0,1]=4 1036 B12R0.1 COCCCCCNC(=O)COC 527a_100000747528_100000210968 [0,1,0,0,0,0|2,0,1]=4 1037 B12R0.49 C=C(COCCCCC)C(=O)OC 34a_100000210253_100009813391 [0,1,0,0,0,0|1,0,2]=4 1038 B12R0.49 C=C(CSCCCCC)C(=O)OC 62a_100000210326_100009813391 [0,1,0,0,0,0|1,0,2]=4 1039 B12R0.49 C=C(CSCCCCC)C(=O)OC 62a_100009813391_100000210326 [0,1,0,0,0,0|1,0,2]=4 1040 B12R0.49 CCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210614 [0,1,0,0,0,0|1,0,2]=4 1041 B12R0.49 CCCCCCCC(C)C(=O)CC 1458a_100000210414_200011218727 [0,1,0,0,0,0|1,0,2]=4 1042 B12R0.49 CCCCCCCN(C)C(=O)CC 11a_100000228206_100000210414 [0,1,0,0,0,0|2,0,1]=4 1043 B12R0.49 CCCCCCCN(C)C(=O)CC 1626a_100000228206_100000210414 [0,1,0,0,0,0|2,0,1]=4 1044 B12R0.49 CCCCCCCN(C)C(=O)CC 240690a_100000228206_100000210414 [0,1,0,0,0,0|2,0,1]=4 1045 B12R0.49 CCCCCCCN(C)C(=O)CC 527a_100000228206_100000210414 [0,1,0,0,0,0|2,0,1]=4 1046 B12R0.49 CCCCCCCN(C)C(=O)NC 2708a_100102657272_100000228206 [0,1,0,0,0,0|2,0,1]=4 1047 B12R0.49 CCCCCCCN(C)C(=O)NC 273464a_100102657272_100000228206 [0,1,0,0,0,0|2,0,1]=4 1048 B12R0.49 CCCCCCNC(=O)C(=O)NC 1626a_100000210581_100011218921 [0,1,0,0,0,0|2,0,1]=4 1049 B12R0.49 CCCCCCNC(=O)C(=O)NC 240690a_100000210581_100011218921 [0,1,0,0,0,0|2,0,1]=4 1050 B12R0.49 CCCCCCNC(=O)C(=O)NC 527a_100000210581_100011218921 [0,1,0,0,0,0|2,0,1]=4 1051 B12R0.49 CCCCCCNC(=O)C(=O)OC 11a_100000210581_100000024059 [0,1,0,0,0,0|1,0,1]=3 1052 B12R0.49 CCCCCCNC(=O)C(=O)OC 1626a_100000210581_100000024059 [0,1,0,0,0,0|1,0,1]=3 1053 B12R0.49 CCCCCCNC(=O)C(=O)OC 240690a_100000210581_100000024059 [0,1,0,0,0,0|1,0,1]=3 1054 B12R0.49 CCCCCCNC(=O)C(=O)OC 527a_100000210581_100000024059 [0,1,0,0,0,0|1,0,1]=3 1055 B12R0.49 CCCCCCNC(C)C(=O)CC 2230a_100000210581_100000742827 [0,1,0,0,0,0|2,0,1]=4 1056 B12R0.49 CCCCCCNC(C)C(=O)NC 2230a_100000210581_100000731044 [0,1,0,0,0,0|2,0,1]=4 1057 B12R0.49 CCCCCCNC(C)C(=O)OC 2230a_100000210581_100000211248 [0,1,0,0,0,0|1,0,1]=3 1058 B12R0.49 CCCCCCNC(F)C(=O)NC 2230a_100000210581_100009813575 [0,1,0,0,0,0|2,0,1]=4 1059 B12R0.49 CCCCCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210314 [0,1,0,0,0,0|2,0,1]=4 1060 B12R0.49 CCCCCCN[C@H](C)C(=O)NC 34a_100000684985_100000210314 [0,1,0,0,0,0|2,0,1]=4 1061 B12R0.49 CCCCCCOC(C)C(=O)CC 7a_100000210259_100000742827 [0,1,0,0,0,0|2,0,1]=4 1062 B12R0.49 CCCCCCOC(C)C(=O)NC 34a_100000210259_100000731044 [0,1,0,0,0,0|2,0,1]=4 1063 B12R0.49 CCCCCCOC(C)C(=O)NC 7a_100000210259_100000209862 [0,1,0,0,0,0|2,0,1]=4 1064 B12R0.49 CCCCCCOC(C)C(=O)OC 34a_100000210259_100000211248 [0,1,0,0,0,0|1,0,1]=3 1065 B12R0.49 CCCCCCOC(C)C(=O)OC 34a_100011215400_100000210314 [0,1,0,0,0,0|1,0,1]=3 1066 B12R0.49 CCCCCCOC(C)C(=O)OC 7a_100000210259_100000211248 [0,1,0,0,0,0|1,0,1]=3 1067 B12R0.49 CCCCCCOC(F)C(=O)NC 34a_100000210259_100009813575 [0,1,0,0,0,0|2,0,1]=4 1068 B12R0.49 CCCCCCOC(F)C(=O)NC 7a_100000210259_100009813575 [0,1,0,0,0,0|2,0,1]=4 1069 B12R0.49 CCCCCCSC(C)C(=O)CC 62a_100000210314_100000742827 [0,1,0,0,0,0|2,0,1]=4 1070 B12R0.49 CCCCCCSC(C)C(=O)CC 62a_100000742827_100000210757 [0,1,0,0,0,0|2,0,1]=4 1071 B12R0.49 CCCCCCSC(C)C(=O)NC 62a_100000209862_100000210757 [0,1,0,0,0,0|2,0,1]=4 1072 B12R0.49 CCCCCCSC(C)C(=O)NC 62a_100000210314_100000731044 [0,1,0,0,0,0|2,0,1]=4 1073 B12R0.49 CCCCCCSC(C)C(=O)OC 62a_100000210314_100000211248 [0,1,0,0,0,0|1,0,1]=3 1074 B12R0.49 CCCCCCSC(C)C(=O)OC 62a_100000211248_100000210757 [0,1,0,0,0,0|1,0,1]=3 1075 B12R0.49 CCCCCCSC(F)C(=O)NC 62a_100000210314_100009813575 [0,1,0,0,0,0|2,0,1]=4 1076 B12R0.49 CCCCCCSC(F)C(=O)NC 62a_100009813575_100000210757 [0,1,0,0,0,0|2,0,1]=4 1077 B12R0.49 CCCCCNN=C(C)C(=O)OC 4a_100000694160_100000211753 [0,1,0,0,0,0|2,0,1]=4 1078 B12R0.49 CCCCCOCC(=O)C(=O)OC 34a_100000210253_100011610305 [0,1,0,0,0,0|1,0,2]=4 1079 B12R0.49 CCCCCOCC(C)C(=O)OC 34a_100000210253_100000698445 [0,1,0,0,0,0|1,0,2]=4 1080 B12R0.49 CCCCCOCC(C)C(=O)OC 34a_100000749362_100000718602 [0,1,0,0,0,0|1,0,2]=4 1081 B12R0.49 CCCCCOCC(C)C(=O)OC 7a_100000749362_100000210326 [0,1,0,0,0,0|1,0,2]=4 1082 B12R0.49 CCCCCOCC(F)C(=O)OC 34a_200009849844_100000718602 [0,1,0,0,0,0|1,0,2]=4 1083 B12R0.49 CCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000718602 [0,1,0,0,0,0|1,0,2]=4 1084 B12R0.49 CCCCCSCC(=O)C(=O)OC 62a_100000210326_100011610305 [0,1,0,0,0,0|1,0,2]=4 1085 B12R0.49 CCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210326 [0,1,0,0,0,0|1,0,2]=4 1086 B12R0.49 CCCCCSCC(C)C(=O)OC 62a_100000210326_100000698445 [0,1,0,0,0,0|1,0,2]=4 1087 B12R0.49 CCCCCSCC(C)C(=O)OC 62a_100000698445_100000210326 [0,1,0,0,0,0|1,0,2]=4 1088 B12R0.49 CCCCNCCC(C)C(=O)OC 2230a_100000102301_100000034942 [0,1,0,0,0,0|1,0,2]=4 1089 B12R0.49 CCCCNCCC(C)C(=O)OC 7a_106832991798_100000034942 [0,1,0,0,0,0|1,0,2]=4 1090 B12R0.49 CCCCOCCC(C)C(=O)OC 34a_100000210227_100000034942 [0,1,0,0,0,0|1,0,2]=4 1091 B12R0.49 CCCCOCCC(C)C(=O)OC 7a_100000210227_100000034942 [0,1,0,0,0,0|1,0,2]=4 1092 B12R0.49 CCCCOCOC(C)C(=O)OC 34a_100011215400_100011995733 [0,1,0,0,0,0|2,0,1]=4 1093 B12R0.49 CCCCOCSC(C)C(=O)OC 62a_100000211248_100011995733 [0,1,0,0,0,0|2,0,1]=4 1094 B12R0.49 CCCCOCSC(C)C(=O)OC 62a_100011995733_100000211248 [0,1,0,0,0,0|2,0,1]=4 1095 B12R0.49 CCCCSCCC(C)C(=O)OC 62a_100000034942_100000210210 [0,1,0,0,0,0|1,0,2]=4 1096 B12R0.49 CCCCSCCC(C)C(=O)OC 62a_100000210211_100000034942 [0,1,0,0,0,0|1,0,2]=4 1097 B12R0.49 CCCOCCNC(=O)C(=O)OC 1626a_100161115042_100000024059 [0,1,0,0,0,0|2,0,1]=4 1098 B12R0.49 CCCOCCNC(=O)C(=O)OC 240690a_100161115042_100000024059 [0,1,0,0,0,0|2,0,1]=4 1099 B12R0.49 CCCOCCNC(=O)C(=O)OC 527a_100161115042_100000024059 [0,1,0,0,0,0|2,0,1]=4 1100 B12R0.49 CCCOCCNC(C)C(=O)OC 2230a_100161115042_100000211248 [0,1,0,0,0,0|2,0,1]=4 1101 B12R0.49 CCCOCCNC(C)C(=O)OC 34a_100161115042_100000211248 [0,1,0,0,0,0|2,0,1]=4 1102 B12R0.49 CCCOCCOC(C)C(=O)OC 34a_100000752267_100000211248 [0,1,0,0,0,0|2,0,1]=4 1103 B12R0.49 CCCOCCOC(C)C(=O)OC 34a_100011215400_100011215938 [0,1,0,0,0,0|2,0,1]=4 1104 B12R0.49 CCCOCCOC(C)C(=O)OC 7a_100000752267_100000211248 [0,1,0,0,0,0|2,0,1]=4 1105 B12R0.49 CCCOCCSC(C)C(=O)OC 62a_100000211248_100011215938 [0,1,0,0,0,0|2,0,1]=4 1106 B12R0.49 CCCOCCSC(C)C(=O)OC 62a_100011215938_100000211248 [0,1,0,0,0,0|2,0,1]=4 1107 B12R0.49 CCCSCCNC(=O)C(=O)OC 11a_100020603323_100000024059 [0,1,0,0,0,0|2,0,1]=4 1108 B12R0.49 CCCSCCNC(=O)C(=O)OC 240690a_100020603323_100000024059 [0,1,0,0,0,0|2,0,1]=4 1109 B12R0.49 CCCSCCNC(=O)C(=O)OC 527a_100020603323_100000024059 [0,1,0,0,0,0|2,0,1]=4 1110 B12R0.49 CCCSCCNC(C)C(=O)OC 2230a_100020603323_100000211248 [0,1,0,0,0,0|2,0,1]=4 1111 B12R0.49 CCCSCCOC(C)C(=O)OC 34a_200000230433_100000211248 [0,1,0,0,0,0|2,0,1]=4 1112 B12R0.49 CCCSCCOC(C)C(=O)OC 7a_200000230433_100000211248 [0,1,0,0,0,0|2,0,1]=4 1113 B12R0.49 CCOCCCNC(=O)C(=O)OC 11a_100000210961_100000024059 [0,1,0,0,0,0|2,0,1]=4 1114 B12R0.49 CCOCCCNC(=O)C(=O)OC 1626a_100000210961_100000024059 [0,1,0,0,0,0|2,0,1]=4 1115 B12R0.49 CCOCCCNC(=O)C(=O)OC 240690a_100000210961_100000024059 [0,1,0,0,0,0|2,0,1]=4 1116 B12R0.49 CCOCCCNC(=O)C(=O)OC 527a_100000210961_100000024059 [0,1,0,0,0,0|2,0,1]=4 1117 B12R0.49 CCOCCCNC(C)C(=O)OC 2230a_100000210961_100000211248 [0,1,0,0,0,0|2,0,1]=4 1118 B12R0.49 CCOCCCNC(C)C(=O)OC 34a_100000210961_100000211248 [0,1,0,0,0,0|2,0,1]=4 1119 B12R0.49 CCOCCCOC(C)C(=O)OC 34a_100000757476_100000211248 [0,1,0,0,0,0|2,0,1]=4 1120 B12R0.49 CCOCCCOC(C)C(=O)OC 34a_100011215400_100012232248 [0,1,0,0,0,0|2,0,1]=4 1121 B12R0.49 CCOCCCOC(C)C(=O)OC 7a_100000757476_100000211248 [0,1,0,0,0,0|2,0,1]=4 1122 B12R0.49 CCOCCCSC(C)C(=O)OC 62a_100000211248_100012232248 [0,1,0,0,0,0|2,0,1]=4 1123 B12R0.49 CCOCCCSC(C)C(=O)OC 62a_100012232248_100000211248 [0,1,0,0,0,0|2,0,1]=4 1124 B12R0.49 CCSCCCOC(C)C(=O)OC 34a_100011216438_100000211248 [0,1,0,0,0,0|2,0,1]=4 1125 B12R0.49 CCSCCCOC(C)C(=O)OC 7a_100011216438_100000211248 [0,1,0,0,0,0|2,0,1]=4 1126 B12R0.49 COC(=O)C(=O)NCCCCCO 240690a_100000762737_100000024059 [0,1,0,0,0,0|2,0,1]=4 1127 B12R0.49 COC(=O)C(C)NCCCCCO 2230a_100000762737_100000211248 [0,1,0,0,0,0|2,0,1]=4 1128 B12R0.49 COC(=O)C(C)NCCCCCO 34a_100000762737_100000211248 [0,1,0,0,0,0|2,0,1]=4 1129 B12R0.49 COC(=O)C(C)OCCCCCBr 34a_100000746331_100000211248 [0,1,0,0,0,0|2,0,1]=4 1130 B12R0.49 COC(=O)C(C)OCCCCCBr 7a_100000746331_100000211248 [0,1,0,0,0,0|2,0,1]=4 1131 B12R0.49 COC(=O)C(C)OCCCCCCl 34a_100000746330_100000211248 [0,1,0,0,0,0|2,0,1]=4 1132 B12R0.49 COC(=O)C(C)OCCCCCCl 7a_100000746330_100000211248 [0,1,0,0,0,0|2,0,1]=4 1133 B12R0.49 COC(=O)C(C)OCCCCCF 34a_100011215400_100000729378 [0,1,0,0,0,0|2,0,1]=4 1134 B12R0.49 COC(=O)C(C)OCCCCCI 34a_200012148887_100000211248 [0,1,0,0,0,0|2,0,1]=4 1135 B12R0.49 COC(=O)C(C)OCCCCCI 7a_200012148887_100000211248 [0,1,0,0,0,0|2,0,1]=4 1136 B12R0.49 COC(=O)C(C)OCCCCCN 34a_100000762737_100000211248 [0,1,0,0,0,0|2,0,1]=4 1137 B12R0.49 COC(=O)C(C)OCCCCCO 34a_100011215400_100000746330 [0,1,0,0,0,0|2,0,1]=4 1138 B12R0.49 COC(=O)C(C)OCCCCSC 34a_100011217163_100000211248 [0,1,0,0,0,0|2,0,1]=4 1139 B12R0.49 COC(=O)C(C)OCCCCSC 7a_100011217163_100000211248 [0,1,0,0,0,0|2,0,1]=4 1140 B12R0.49 COC(=O)C(C)SCCCCCF 62a_100000211248_100000729378 [0,1,0,0,0,0|2,0,1]=4 1141 B12R0.49 COC(=O)C(C)SCCCCCF 62a_100000729378_100000211248 [0,1,0,0,0,0|2,0,1]=4 1142 B12R0.49 COC(=O)C(C)SCCCCCO 62a_100000211248_100000746330 [0,1,0,0,0,0|2,0,1]=4 1143 B12R0.49 COC(=O)C(C)SCCCCCO 62a_100000746330_100000211248 [0,1,0,0,0,0|2,0,1]=4 1144 B12R0.49 COCCCCOC(C)C(=O)OC 34a_100000740925_100000211248 [0,1,0,0,0,0|2,0,1]=4 1145 B12R0.49 COCCCCOC(C)C(=O)OC 34a_100011215400_100000755781 [0,1,0,0,0,0|2,0,1]=4 1146 B12R0.49 COCCCCSC(C)C(=O)OC 62a_100000211248_100000730899 [0,1,0,0,0,0|2,0,1]=4 1147 B12R0.49 COCCCCSC(C)C(=O)OC 62a_100000730899_100000211248 [0,1,0,0,0,0|2,0,1]=4 1148 B12R0.102 CCCCC(=O)CCCC(=O)OC 1458a_100000210183_100011218270 [0,1,0,0,0,0|0,0,3]=4 1149 B12R0.102 CCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210211 [0,1,0,0,0,0|0,0,3]=4 1150 B12R0.102 CCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210211 [0,1,0,0,0,0|1,0,2]=4 1151 B12R0.102 CCCCC(C)COCC(=O)CC 7a_100011995851_100000747405 [0,1,0,0,0,0|2,0,1]=4 1152 B12R0.102 CCCCC(C)COCC(=O)NC 34a_100011995851_100000183359 [0,1,0,0,0,0|2,0,1]=4 1153 B12R0.102 CCCCC(C)COCC(=O)NC 7a_100011995851_100000183359 [0,1,0,0,0,0|2,0,1]=4 1154 B12R0.102 CCCCC(C)COCC(=O)OC 34a_100011995851_100000747449 [0,1,0,0,0,0|1,0,1]=3 1155 B12R0.102 CCCCC(C)COCC(=O)OC 7a_100011995851_100000747449 [0,1,0,0,0,0|1,0,1]=3 1156 B12R0.102 CCCCC(C)NCCC(=O)OC 2230a_100000126638_100000204255 [0,1,0,0,0,0|1,0,2]=4 1157 B12R0.102 CCCCC(C)OCCC(=O)OC 34a_100000687866_100000742370 [0,1,0,0,0,0|1,0,2]=4 1158 B12R0.102 CCCCC(C)OCCC(=O)OC 7a_100000687866_100000204255 [0,1,0,0,0,0|1,0,2]=4 1159 B12R0.102 CCCCC(C)SCCC(=O)OC 62a_100000204255_200011215066 [0,1,0,0,0,0|1,0,2]=4 1160 B12R0.102 CCCCC(C)SCCC(=O)OC 62a_200011215066_100000204255 [0,1,0,0,0,0|1,0,2]=4 1161 B12R0.102 CCCCC(C)SCOC(=O)OC 62a_200011215066_100000139417 [0,1,0,0,0,0|2,0,1]=4 1162 B12R0.102 CCCCN(C)C/C=C/C(=O)OC 2230a_100000207549_100000742655 [0,1,0,0,0,0|1,0,2]=4 1163 B12R0.102 CCCCN(C)C/C=C/C(=O)OC 269982a_100000207549_100000742655 [0,1,0,0,0,0|1,0,2]=4 1164 B12R0.102 CCCCN(C)CCCC(=O)OC 2230a_100000207549_100011218270 [0,1,0,0,0,0|1,0,2]=4 1165 B12R0.102 CCCCN(C)CCCC(=O)OC 269982a_100000207549_100011218270 [0,1,0,0,0,0|1,0,2]=4 1166 B12R0.102 CCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210211 [0,1,0,0,0,0|1,0,2]=4 1167 B12R0.102 CCCC[C@H](N)COCC(=O)NC 34a_100011934283_100000183359 [0,1,0,0,0,0|2,0,1]=4 1168 B12R0.102 CCCC[C@H](N)COCC(=O)OC 34a_100011934283_100000747449 [0,1,0,0,0,0|1,0,1]=3 1169 B12R0.102 CCCOC(C)CNCC(=O)OC 2230a_100015185124_100000747449 [0,1,0,0,0,0|2,0,1]=4 1170 B12R0.102 CCCOC(C)CNCC(=O)OC 34a_100015185124_100000747449 [0,1,0,0,0,0|2,0,1]=4 1171 B12R0.102 CCOCC(O)CNCC(=O)OC 2230a_102515437182_100000747449 [0,1,0,0,0,0|2,0,1]=4 1172 B12R0.102 CCOCC(O)CNCC(=O)OC 34a_102515437182_100000747449 [0,1,0,0,0,0|2,0,1]=4 1173 B12R0.102 COC(=O)CNC[C@H](C)CCCO 2230a_100160569302_100000747449 [0,1,0,0,0,0|2,0,1]=4 1174 B12R0.102 COC(=O)CNC[C@H](C)CCCO 34a_100160569302_100000747449 [0,1,0,0,0,0|2,0,1]=4 1175 B12R0.102 COC(=O)COC[C@@H](N)CCSC 34a_100011827619_100000747449 [0,1,0,0,0,0|2,0,1]=4 1176 B12R0.113 CCCCCCC(=O)CC(=O)CC 1458a_100102632555_100000747405 [0,1,0,0,0,0|1,0,2]=4 1177 B12R0.113 CCCCCCC(=O)CC(=O)NC 1458a_100102632555_100000183359 [0,1,0,0,0,0|1,0,2]=4 1178 B12R0.113 CCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210757 [0,1,0,0,0,0|0,0,2]=3 1179 B12R0.113 CCCCCCC(=O)CC(=O)OC 1458a_100102632555_100000747449 [0,1,0,0,0,0|0,0,2]=3 1180 B12R0.113 CCCCCCC(C)NC(=O)CC 11a_100000210919_100000210414 [0,1,0,0,0,0|2,0,1]=4 1181 B12R0.113 CCCCCCC(C)NC(=O)CC 1626a_100000210919_100000210414 [0,1,0,0,0,0|2,0,1]=4 1182 B12R0.113 CCCCCCC(C)NC(=O)CC 240690a_100000210919_100000210414 [0,1,0,0,0,0|2,0,1]=4 1183 B12R0.113 CCCCCCC(C)NC(=O)CC 527a_100000210919_100000210414 [0,1,0,0,0,0|2,0,1]=4 1184 B12R0.113 CCCCCCC(C)NC(=O)NC 2708a_100000210919_106832991635 [0,1,0,0,0,0|2,0,1]=4 1185 B12R0.113 CCCCCCC(C)NC(=O)NC 2708a_100102657272_100000210919 [0,1,0,0,0,0|2,0,1]=4 1186 B12R0.113 CCCCCCC(C)NC(=O)NC 273464a_100000210919_100102657272 [0,1,0,0,0,0|2,0,1]=4 1187 B12R0.113 CCCCCCC(C)NC(=O)NC 273464a_100102657272_100000210919 [0,1,0,0,0,0|2,0,1]=4 1188 B12R0.113 CCCCCCC(C)NC(=O)NC 512a_100000210919_100102657272 [0,1,0,0,0,0|2,0,1]=4 1189 B12R0.113 CCCCCCC(C)NC(=O)NC 512a_106832991638_100000210919 [0,1,0,0,0,0|2,0,1]=4 1190 B12R0.113 CCCCCCN(C)CC(=O)CC 269982a_106256046315_100000747405 [0,1,0,0,0,0|2,0,1]=4 1191 B12R0.113 CCCCCCN(C)CC(=O)NC 2230a_100000189611_100000210314 [0,1,0,0,0,0|2,0,1]=4 1192 B12R0.113 CCCCCCN(C)CC(=O)NC 2230a_106256046315_100000183359 [0,1,0,0,0,0|2,0,1]=4 1193 B12R0.113 CCCCCCN(C)CC(=O)NC 269982a_106256046315_100000183359 [0,1,0,0,0,0|2,0,1]=4 1194 B12R0.113 CCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210314 [0,1,0,0,0,0|1,0,1]=3 1195 B12R0.113 CCCCCCN(C)CC(=O)OC 2230a_106256046315_100000747449 [0,1,0,0,0,0|1,0,1]=3 1196 B12R0.113 CCCCCCN(C)CC(=O)OC 269982a_106256046315_100000747449 [0,1,0,0,0,0|1,0,1]=3 1197 B12R0.113 CCCCCNC(=O)CC(=O)OC 240690a_100000209983_100000211351 [0,1,0,0,0,0|1,0,2]=4 1198 B12R0.113 CCCCCNC(C)CC(=O)OC 2230a_100000209983_100009817358 [0,1,0,0,0,0|1,0,2]=4 1199 B12R0.113 CCCCCOC(C)CC(=O)OC 34a_100000210253_100009817358 [0,1,0,0,0,0|1,0,2]=4 1200 B12R0.113 CCCCCOC(C)CC(=O)OC 7a_100000210253_100009817358 [0,1,0,0,0,0|1,0,2]=4 1201 B12R0.113 CCCCCSC(C)CC(=O)OC 62a_100000210326_100009817358 [0,1,0,0,0,0|1,0,2]=4 1202 B12R0.113 CCCCCSC(C)CC(=O)OC 62a_100009817358_100000210326 [0,1,0,0,0,0|1,0,2]=4 1203 B12R0.113 CCCCNC[C@H](O)CC(=O)OC 7a_106832991798_100000754131 [0,1,0,0,0,0|1,0,2]=4 1204 B12R0.113 CCCCOCC(=O)CC(=O)OC 1458a_100000211351_100011995733 [0,1,0,0,0,0|1,0,2]=4 1205 B12R0.113 CCCCOCC(=O)CC(=O)OC 1458a_100000757543_100000747449 [0,1,0,0,0,0|1,0,2]=4 1206 B12R0.113 CCCCOCN(C)CC(=O)OC 2230a_100000198492_100011995733 [0,1,0,0,0,0|2,0,1]=4 1207 B12R0.113 CCCCOC[C@H](O)CC(=O)OC 34a_100000210227_100000754131 [0,1,0,0,0,0|1,0,2]=4 1208 B12R0.113 CCCCOC[C@H](O)CC(=O)OC 7a_100000210227_100000754131 [0,1,0,0,0,0|1,0,2]=4 1209 B12R0.113 CCCCSCC(=O)CC(=O)OC 1458a_100000191162_100000747449 [0,1,0,0,0,0|1,0,2]=4 1210 B12R0.113 CCCCSCC(=O)CC(=O)OC 62a_100000210211_100000210525 [0,1,0,0,0,0|1,0,2]=4 1211 B12R0.113 CCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210210 [0,1,0,0,0,0|1,0,2]=4 1212 B12R0.113 CCCCSCC(=O)NC(=O)OC 62a_100000210211_100000010850 [0,1,0,0,0,0|2,0,1]=4 1213 B12R0.113 CCCCSC[C@H](O)CC(=O)OC 62a_100000210211_100000754131 [0,1,0,0,0,0|1,0,2]=4 1214 B12R0.113 CCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210210 [0,1,0,0,0,0|1,0,2]=4 1215 B12R0.113 CCCOCCC(=O)CC(=O)OC 1458a_100000211351_100011215938 [0,1,0,0,0,0|1,0,2]=4 1216 B12R0.113 CCCOCCN(C)CC(=O)OC 2230a_100000198492_100011215938 [0,1,0,0,0,0|2,0,1]=4 1217 B12R0.113 CCOCCCC(=O)CC(=O)OC 1458a_100000211351_100012232248 [0,1,0,0,0,0|1,0,2]=4 1218 B12R0.113 CCOCCCN(C)CC(=O)OC 2230a_100000198492_100012232248 [0,1,0,0,0,0|2,0,1]=4 1219 B12R0.113 COC(=O)CC(=O)CCCCCF 1458a_100000211351_100000729378 [0,1,0,0,0,0|1,0,2]=4 1220 B12R0.113 COC(=O)CC(=O)CCCCCO 1458a_100000211351_100000746330 [0,1,0,0,0,0|1,0,2]=4 1221 B12R0.113 COC(=O)CC(=O)CCCCCO 1458a_100102619762_100000747449 [0,1,0,0,0,0|1,0,2]=4 1222 B12R0.113 COC(=O)CN(C)CCCCCF 2230a_100000198492_100000729378 [0,1,0,0,0,0|2,0,1]=4 1223 B12R0.113 COC(=O)CN(C)CCCCCO 2230a_100000198492_100000746330 [0,1,0,0,0,0|2,0,1]=4 1224 B12R0.113 COC(=O)CN(C)CCCCCO 2230a_100000722520_100000747449 [0,1,0,0,0,0|2,0,1]=4 1225 B12R0.113 COC(=O)CN(C)CCCCCO 269982a_100000722520_100000747449 [0,1,0,0,0,0|2,0,1]=4 1226 B12R0.113 COCCCCC(=O)CC(=O)OC 1458a_100000211351_100000755781 [0,1,0,0,0,0|1,0,2]=4 1227 B12R0.113 COCCCCN(C)CC(=O)OC 2230a_100000198492_100000730899 [0,1,0,0,0,0|2,0,1]=4 1228 B12R0.142 CCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210326 [0,1,0,0,0,0|0,0,3]=4 1229 B12R0.142 CCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210326 [0,1,0,0,0,0|1,0,2]=4 1230 B12R0.142 CCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000212188 [0,1,0,0,0,0|1,0,2]=4 1231 B12R0.142 CCCCCC(C)CCC(=O)CC 1458a_100000034243_100000210202 [0,1,0,0,0,0|1,0,2]=4 1232 B12R0.142 CCCCCC(C)CCC(=O)NC 11a_106832991635_100000034243 [0,1,0,0,0,0|1,0,2]=4 1233 B12R0.142 CCCCCC(C)CCC(=O)NC 1626a_100102657272_100000034243 [0,1,0,0,0,0|1,0,2]=4 1234 B12R0.142 CCCCCC(C)CCC(=O)NC 240690a_100102657272_100000034243 [0,1,0,0,0,0|1,0,2]=4 1235 B12R0.142 CCCCCC(C)CCC(=O)NC 527a_100102657272_100000034243 [0,1,0,0,0,0|1,0,2]=4 1236 B12R0.142 CCCCCC(C)NCC(=O)NC 2230a_100000211957_100000183359 [0,1,0,0,0,0|2,0,1]=4 1237 B12R0.142 CCCCCC(C)NCC(=O)NC 2230a_100000693194_200011218191 [0,1,0,0,0,0|2,0,1]=4 1238 B12R0.142 CCCCCC(C)NCC(=O)NC 270004a_100000693194_100000211708 [0,1,0,0,0,0|2,0,1]=4 1239 B12R0.142 CCCCCC(C)NCC(=O)OC 2230a_100000211957_100000747449 [0,1,0,0,0,0|1,0,1]=3 1240 B12R0.142 CCCCCC(C)OCC(=O)CC 34a_100000725409_200011218191 [0,1,0,0,0,0|2,0,1]=4 1241 B12R0.142 CCCCCC(C)OCC(=O)CC 7a_100011215632_100000747405 [0,1,0,0,0,0|2,0,1]=4 1242 B12R0.142 CCCCCC(C)OCC(=O)NC 34a_100000750040_200011218191 [0,1,0,0,0,0|2,0,1]=4 1243 B12R0.142 CCCCCC(C)OCC(=O)NC 34a_100011215632_100000183359 [0,1,0,0,0,0|2,0,1]=4 1244 B12R0.142 CCCCCC(C)OCC(=O)NC 7a_100011215632_100000183359 [0,1,0,0,0,0|2,0,1]=4 1245 B12R0.142 CCCCCC(C)OCC(=O)OC 34a_100011215632_100000747449 [0,1,0,0,0,0|1,0,1]=3 1246 B12R0.142 CCCCCC(C)OCC(=O)OC 7a_100011215632_100000747449 [0,1,0,0,0,0|1,0,1]=3 1247 B12R0.142 CCCCCC(C)SCC(=O)CC 62a_100000747405_200011218191 [0,1,0,0,0,0|2,0,1]=4 1248 B12R0.142 CCCCCC(C)SCC(=O)CC 62a_200011218191_100000747405 [0,1,0,0,0,0|2,0,1]=4 1249 B12R0.142 CCCCCC(C)SCC(=O)NC 62a_100000183359_200011218191 [0,1,0,0,0,0|2,0,1]=4 1250 B12R0.142 CCCCCC(C)SCC(=O)NC 62a_200011218191_100000183359 [0,1,0,0,0,0|2,0,1]=4 1251 B12R0.142 CCCCCC(C)SCC(=O)OC 62a_100000747449_200011218191 [0,1,0,0,0,0|1,0,1]=3 1252 B12R0.142 CCCCCC(C)SCC(=O)OC 62a_200011218191_100000747449 [0,1,0,0,0,0|1,0,1]=3 1253 B12R0.142 CCCCCN(C)CCC(=O)OC 2230a_100000223495_100000204255 [0,1,0,0,0,0|1,0,2]=4 1254 B12R0.142 CCCCCN(C)CCC(=O)OC 269982a_100000223495_100000204255 [0,1,0,0,0,0|1,0,2]=4 1255 B12R0.142 CCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210215 [0,1,0,0,0,0|1,0,2]=4 1256 B12R0.142 COCCCC(C)OCC(=O)OC 34a_200011539412_100000747449 [0,1,0,0,0,0|2,0,1]=4 1257 B12R0.142 COCCCC(C)OCC(=O)OC 7a_200011539412_100000747449 [0,1,0,0,0,0|2,0,1]=4 1258 B12R0.183 CCC(=O)CCCCCC(=O)OC 1458a_100000210414_100009816466 [0,1,0,0,0,0|0,0,3]=4 1259 B12R0.183 CCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210202 [0,1,0,0,0,0|0,0,3]=4 1260 B12R0.183 CCC(=O)COCCCC(C)CC 7a_100011216074_100000747405 [0,1,0,0,0,0|2,0,1]=4 1261 B12R0.183 CCC(C)CCCOCC(=O)NC 7a_100011216074_100000183359 [0,1,0,0,0,0|2,0,1]=4 1262 B12R0.183 CCC(C)CCCOCC(=O)OC 7a_100011216074_100000747449 [0,1,0,0,0,0|1,0,1]=3 1263 B12R0.183 CCC(C)CCNCCC(=O)OC 2230a_100020591266_100000204255 [0,1,0,0,0,0|1,0,2]=4 1264 B12R0.183 CCC(C)CCOCCC(=O)OC 7a_100011215188_100000204255 [0,1,0,0,0,0|1,0,2]=4 1265 B12R0.183 CCC(C)CNC/C=C/C(=O)OC 2230a_100020588543_100000742655 [0,1,0,0,0,0|1,0,2]=4 1266 B12R0.183 CCC(C)CNCCCC(=O)OC 2230a_100020588543_100011218270 [0,1,0,0,0,0|1,0,2]=4 1267 B12R0.183 CCC(C)COCCNC(=O)OC 34a_100000757965_100000748023 [0,1,0,0,0,0|2,0,1]=4 1268 B12R0.183 CCC(C)COCCOC(=O)OC 34a_100010262106_100000748023 [0,1,0,0,0,0|2,0,1]=4 1269 B12R0.183 CCC(C)CSC/C=C/C(=O)OC 62a_100000742655_100000748023 [0,1,0,0,0,0|1,0,2]=4 1270 B12R0.183 CCC(C)CSC/C=C/C(=O)OC 62a_100000748023_100000742655 [0,1,0,0,0,0|1,0,2]=4 1271 B12R0.183 CCC(C)CSCCCC(=O)OC 62a_100000748023_100011218270 [0,1,0,0,0,0|1,0,2]=4 1272 B12R0.183 CCC(C)CSCCCC(=O)OC 62a_100011218270_100000748023 [0,1,0,0,0,0|1,0,2]=4 1273 B12R0.183 CCC(C)NCCCCC(=O)OC 2230a_100000209981_100000204269 [0,1,0,0,0,0|1,0,2]=4 1274 B12R0.183 CCC(C)NCCOCC(=O)OC 2230a_100000209981_100000090808 [0,1,0,0,0,0|2,0,1]=4 1275 B12R0.183 CCC(C)OCCCCC(=O)OC 34a_100000059025_100011215416 [0,1,0,0,0,0|1,0,2]=4 1276 B12R0.183 CCC(C)OCCCCC(=O)OC 7a_100000059025_100000758301 [0,1,0,0,0,0|1,0,2]=4 1277 B12R0.183 CCC(C)OCCCCC(=O)OC 7a_100000210228_100000204269 [0,1,0,0,0,0|1,0,2]=4 1278 B12R0.183 CCC(C)OCCOCC(=O)OC 7a_100000210228_100000090808 [0,1,0,0,0,0|2,0,1]=4 1279 B12R0.183 CCC(C)SCCCCC(=O)OC 62a_100000204269_100000758301 [0,1,0,0,0,0|1,0,2]=4 1280 B12R0.183 CCC(C)SCCCCC(=O)OC 62a_100000758301_100000204269 [0,1,0,0,0,0|1,0,2]=4 1281 B12R0.183 CCC(C)SCCOCC(=O)OC 62a_100000090808_100000758301 [0,1,0,0,0,0|2,0,1]=4 1282 B12R0.183 CCC(C)SCCOCC(=O)OC 62a_100000758301_100000090808 [0,1,0,0,0,0|2,0,1]=4 1283 B12R0.183 CCC(O)CNC/C=C/C(=O)OC 2230a_100011218483_100000742655 [0,1,0,0,0,0|1,0,2]=4 1284 B12R0.183 CCC(O)CNCCCC(=O)OC 2230a_100011218483_100011218270 [0,1,0,0,0,0|1,0,2]=4 1285 B12R0.183 CCC(O)COCCNC(=O)OC 34a_100000757965_100011218378 [0,1,0,0,0,0|2,0,1]=4 1286 B12R0.183 CCC(O)COCCOC(=O)OC 34a_100010262106_100011218378 [0,1,0,0,0,0|2,0,1]=4 1287 B12R0.183 CCC(O)CSC/C=C/C(=O)OC 62a_100000742655_100011218378 [0,1,0,0,0,0|1,0,2]=4 1288 B12R0.183 CCC(O)CSC/C=C/C(=O)OC 62a_100011218378_100000742655 [0,1,0,0,0,0|1,0,2]=4 1289 B12R0.183 CCC(O)CSCCCC(=O)OC 62a_100011218270_100011218378 [0,1,0,0,0,0|1,0,2]=4 1290 B12R0.183 CCC(O)CSCCCC(=O)OC 62a_100011218378_100011218270 [0,1,0,0,0,0|1,0,2]=4 1291 B12R0.183 CCN(C)CCCCCC(=O)OC 2230a_100000225621_100009816466 [0,1,0,0,0,0|1,0,2]=4 1292 B12R0.183 CCN(C)CCCCCC(=O)OC 269982a_100000225621_100009816466 [0,1,0,0,0,0|1,0,2]=4 1293 B12R0.183 CCN(C)CCCSCC(=O)OC 62a_100000747449_100015186262 [0,1,0,0,0,0|2,0,1]=4 1294 B12R0.183 CC[C@H](C)COC/C=C/C(=O)OC 7a_100009816381_100000742655 [0,1,0,0,0,0|1,0,2]=4 1295 B12R0.183 CC[C@H](C)COCCCC(=O)OC 7a_100009816381_100011218270 [0,1,0,0,0,0|1,0,2]=4 1296 B12R0.183 CC[C@H](C)COCCNC(=O)OC 34a_100000757965_100009816398 [0,1,0,0,0,0|2,0,1]=4 1297 B12R0.183 CC[C@H](C)COCCOC(=O)OC 34a_100010262106_100009816398 [0,1,0,0,0,0|2,0,1]=4 1298 B12R0.183 CC[C@H](C)CSC/C=C/C(=O)OC 62a_100000742655_100009816398 [0,1,0,0,0,0|1,0,2]=4 1299 B12R0.183 CC[C@H](C)CSC/C=C/C(=O)OC 62a_100009816398_100000742655 [0,1,0,0,0,0|1,0,2]=4 1300 B12R0.183 CC[C@H](C)CSCCCC(=O)OC 62a_100009816398_100011218270 [0,1,0,0,0,0|1,0,2]=4 1301 B12R0.183 CC[C@H](C)CSCCCC(=O)OC 62a_100011218270_100009816398 [0,1,0,0,0,0|1,0,2]=4 1302 B12R0.183 COC(=O)COCCC[C@@H](C)CN 34a_100160569302_100000747449 [0,1,0,0,0,0|2,0,1]=4 1303 B12R0.184 CCC(=O)CCCCCCC(C)C 1458a_100000040743_100000210202 [0,1,0,0,0,0|1,0,2]=4 1304 B12R0.184 CCC(=O)COCCCCC(C)C 34a_100000725409_100011216152 [0,1,0,0,0,0|2,0,1]=4 1305 B12R0.184 CCC(=O)COCCCCC(C)C 7a_100011214890_100000747405 [0,1,0,0,0,0|2,0,1]=4 1306 B12R0.184 CCC(=O)CSCCCCC(C)C 62a_100000747405_100011216152 [0,1,0,0,0,0|2,0,1]=4 1307 B12R0.184 CCC(=O)CSCCCCC(C)C 62a_100011216152_100000747405 [0,1,0,0,0,0|2,0,1]=4 1308 B12R0.184 CCC(=O)NCCCCCC(C)C 1626a_100011290863_100000210414 [0,1,0,0,0,0|2,0,1]=4 1309 B12R0.184 CCC(=O)NCCCCCC(C)C 240690a_100011290863_100000210414 [0,1,0,0,0,0|2,0,1]=4 1310 B12R0.184 CCC(=O)NCCCCCC(C)C 527a_100011290863_100000210414 [0,1,0,0,0,0|2,0,1]=4 1311 B12R0.184 CNC(=O)CCCCCCC(C)C 11a_106832991635_100000040743 [0,1,0,0,0,0|1,0,2]=4 1312 B12R0.184 CNC(=O)CCCCCCC(C)C 1626a_100102657272_100000040743 [0,1,0,0,0,0|1,0,2]=4 1313 B12R0.184 CNC(=O)CCCCCCC(C)C 240690a_100102657272_100000040743 [0,1,0,0,0,0|1,0,2]=4 1314 B12R0.184 CNC(=O)CCCCCCC(C)C 527a_100102657272_100000040743 [0,1,0,0,0,0|1,0,2]=4 1315 B12R0.184 CNC(=O)CNCCCCC(C)C 2230a_100000693194_100011216152 [0,1,0,0,0,0|2,0,1]=4 1316 B12R0.184 CNC(=O)COCCCCC(C)C 34a_100000750040_100011216152 [0,1,0,0,0,0|2,0,1]=4 1317 B12R0.184 CNC(=O)COCCCCC(C)C 34a_100011214890_100000183359 [0,1,0,0,0,0|2,0,1]=4 1318 B12R0.184 CNC(=O)COCCCCC(C)C 7a_100011214890_100000183359 [0,1,0,0,0,0|2,0,1]=4 1319 B12R0.184 CNC(=O)CSCCCCC(C)C 62a_100000183359_100011216152 [0,1,0,0,0,0|2,0,1]=4 1320 B12R0.184 CNC(=O)CSCCCCC(C)C 62a_100011216152_100000183359 [0,1,0,0,0,0|2,0,1]=4 1321 B12R0.184 CNC(=O)NCCCCCC(C)C 2708a_100011290863_106832991635 [0,1,0,0,0,0|2,0,1]=4 1322 B12R0.184 CNC(=O)NCCCCCC(C)C 2708a_100102657272_100011290863 [0,1,0,0,0,0|2,0,1]=4 1323 B12R0.184 CNC(=O)NCCCCCC(C)C 273464a_100011290863_100102657272 [0,1,0,0,0,0|2,0,1]=4 1324 B12R0.184 CNC(=O)NCCCCCC(C)C 273464a_100102657272_100011290863 [0,1,0,0,0,0|2,0,1]=4 1325 B12R0.184 CNC(=O)NCCCCCC(C)C 512a_100011290863_100102657272 [0,1,0,0,0,0|2,0,1]=4 1326 B12R0.184 CNC(=O)NCCCCCC(C)C 512a_106832991638_100011290863 [0,1,0,0,0,0|2,0,1]=4 1327 B12R0.184 COC(=O)/C=C/CNCCC(C)O 2230a_200000755665_100000742655 [0,1,0,0,0,0|1,0,2]=4 1328 B12R0.184 COC(=O)/C=C/COCCC(C)Br 34a_100009893172_100000742655 [0,1,0,0,0,0|1,0,2]=4 1329 B12R0.184 COC(=O)/C=C/COCCC(C)C 34a_100000210254_100000742655 [0,1,0,0,0,0|1,0,2]=4 1330 B12R0.184 COC(=O)/C=C/COCCC(C)C 7a_100000210254_100000742655 [0,1,0,0,0,0|1,0,2]=4 1331 B12R0.184 COC(=O)/C=C/COCC[C@@H](C)N 34a_100000706166_100000742655 [0,1,0,0,0,0|1,0,2]=4 1332 B12R0.184 COC(=O)/C=C/CSCCC(C)C 62a_100000210312_100000742655 [0,1,0,0,0,0|1,0,2]=4 1333 B12R0.184 COC(=O)/C=C/CSCCC(C)C 62a_100000742655_100000210312 [0,1,0,0,0,0|1,0,2]=4 1334 B12R0.184 COC(=O)/C=C/CSCCC(C)O 62a_100000742655_100012276601 [0,1,0,0,0,0|1,0,2]=4 1335 B12R0.184 COC(=O)/C=C/CSCCC(C)O 62a_100012276601_100000742655 [0,1,0,0,0,0|1,0,2]=4 1336 B12R0.184 COC(=O)CCCCCCC(=O)C 1458a_100000036694_200000210301 [0,1,0,0,0,0|0,0,3]=4 1337 B12R0.184 COC(=O)CCCCCCC(=O)C 1458a_100000070787_100009815986 [0,1,0,0,0,0|0,0,3]=4 1338 B12R0.184 COC(=O)CCCCCCC(=O)[13CH3] 1458a_100000036694_200025704644 [0,1,0,0,0,0|0,0,3]=4 1339 B12R0.184 COC(=O)CCCCCCN(C)C 2230a_100102631434_100009815986 [0,1,0,0,0,0|1,0,2]=4 1340 B12R0.184 COC(=O)CCCCCCN(C)C 269982a_100102631434_100009815986 [0,1,0,0,0,0|1,0,2]=4 1341 B12R0.184 COC(=O)CCCCCNC(C)C 2230a_100138425928_100009816466 [0,1,0,0,0,0|1,0,2]=4 1342 B12R0.184 COC(=O)CCCCCNC(C)C 34a_100138425928_100009816466 [0,1,0,0,0,0|1,0,2]=4 1343 B12R0.184 COC(=O)CCCCCOC(C)C 34a_100000074720_100000210206 [0,1,0,0,0,0|1,0,2]=4 1344 B12R0.184 COC(=O)CCCCCOC(C)C 34a_100000212225_100009816466 [0,1,0,0,0,0|1,0,2]=4 1345 B12R0.184 COC(=O)CCCCCOC(C)C 7a_100000074720_100000210206 [0,1,0,0,0,0|1,0,2]=4 1346 B12R0.184 COC(=O)CCCCCSC(C)C 62a_100000210206_100009816466 [0,1,0,0,0,0|1,0,2]=4 1347 B12R0.184 COC(=O)CCCCCSC(C)C 62a_100009816466_100000210206 [0,1,0,0,0,0|1,0,2]=4 1348 B12R0.184 COC(=O)CCCCNCC(C)C 2230a_100000210953_100000204269 [0,1,0,0,0,0|1,0,2]=4 1349 B12R0.184 COC(=O)CCCCNCC(C)C 34a_100000210953_100000204269 [0,1,0,0,0,0|1,0,2]=4 1350 B12R0.184 COC(=O)CCCCNCC(C)O 2230a_100000210904_100000204269 [0,1,0,0,0,0|1,0,2]=4 1351 B12R0.184 COC(=O)CCCCNCC(C)O 34a_100000210904_100000204269 [0,1,0,0,0,0|1,0,2]=4 1352 B12R0.184 COC(=O)CCCCOCC(C)Br 34a_100012180447_100000204269 [0,1,0,0,0,0|1,0,2]=4 1353 B12R0.184 COC(=O)CCCCOCC(C)C 34a_100000059025_100000210624 [0,1,0,0,0,0|1,0,2]=4 1354 B12R0.184 COC(=O)CCCCOCC(C)C 34a_100000210257_100000204269 [0,1,0,0,0,0|1,0,2]=4 1355 B12R0.184 COC(=O)CCCCOCC(C)C 7a_100000059025_100000210760 [0,1,0,0,0,0|1,0,2]=4 1356 B12R0.184 COC(=O)CCCCOCC(C)F 34a_100015925927_100000204269 [0,1,0,0,0,0|1,0,2]=4 1357 B12R0.184 COC(=O)CCCCOCC(C)O 34a_100000059025_100011218427 [0,1,0,0,0,0|1,0,2]=4 1358 B12R0.184 COC(=O)CCCCOCC(C)O 7a_100000059025_100011218427 [0,1,0,0,0,0|1,0,2]=4 1359 B12R0.184 COC(=O)CCCCOC[C@@H](C)Cl 34a_100016084084_100000204269 [0,1,0,0,0,0|1,0,2]=4 1360 B12R0.184 COC(=O)CCCCOC[C@@H](C)N 34a_100000737577_100000204269 [0,1,0,0,0,0|1,0,2]=4 1361 B12R0.184 COC(=O)CCCCOC[C@@H](C)O 34a_100000059025_100009817552 [0,1,0,0,0,0|1,0,2]=4 1362 B12R0.184 COC(=O)CCCCOC[C@@H](C)O 7a_100000059025_100009817552 [0,1,0,0,0,0|1,0,2]=4 1363 B12R0.184 COC(=O)CCCCSCC(C)C 62a_100000204269_100000210760 [0,1,0,0,0,0|1,0,2]=4 1364 B12R0.184 COC(=O)CCCCSCC(C)C 62a_100000210624_100000204269 [0,1,0,0,0,0|1,0,2]=4 1365 B12R0.184 COC(=O)CCCCSCC(C)O 62a_100000204269_100011218427 [0,1,0,0,0,0|1,0,2]=4 1366 B12R0.184 COC(=O)CCCCSCC(C)O 62a_100011218427_100000204269 [0,1,0,0,0,0|1,0,2]=4 1367 B12R0.184 COC(=O)CCCCSC[C@@H](C)O 62a_100000204269_100009817552 [0,1,0,0,0,0|1,0,2]=4 1368 B12R0.184 COC(=O)CCCCSC[C@@H](C)O 62a_100009817552_100000204269 [0,1,0,0,0,0|1,0,2]=4 1369 B12R0.184 COC(=O)CCCNCCC(C)O 2230a_200000755665_100011218270 [0,1,0,0,0,0|1,0,2]=4 1370 B12R0.184 COC(=O)CCCOCCC(C)Br 34a_100009893172_100000742333 [0,1,0,0,0,0|1,0,2]=4 1371 B12R0.184 COC(=O)CCCOCCC(C)C 34a_100000210254_100000742333 [0,1,0,0,0,0|1,0,2]=4 1372 B12R0.184 COC(=O)CCCOCCC(C)C 7a_100000210254_100011218270 [0,1,0,0,0,0|1,0,2]=4 1373 B12R0.184 COC(=O)CCCOCC[C@@H](C)N 34a_100000706166_100000742333 [0,1,0,0,0,0|1,0,2]=4 1374 B12R0.184 COC(=O)CCCSCCC(C)C 62a_100000210312_100011218270 [0,1,0,0,0,0|1,0,2]=4 1375 B12R0.184 COC(=O)CCCSCCC(C)C 62a_100011218270_100000210312 [0,1,0,0,0,0|1,0,2]=4 1376 B12R0.184 COC(=O)CCCSCCC(C)O 62a_100011218270_100012276601 [0,1,0,0,0,0|1,0,2]=4 1377 B12R0.184 COC(=O)CCCSCCC(C)O 62a_100012276601_100011218270 [0,1,0,0,0,0|1,0,2]=4 1378 B12R0.184 COC(=O)CCNCCCC(C)C 2230a_200000737386_100000204255 [0,1,0,0,0,0|1,0,2]=4 1379 B12R0.184 COC(=O)CCNCCCC(C)C 34a_200000737386_100000742370 [0,1,0,0,0,0|1,0,2]=4 1380 B12R0.184 COC(=O)CCOCCCC(C)C 34a_100000210774_100000742370 [0,1,0,0,0,0|1,0,2]=4 1381 B12R0.184 COC(=O)CCOCCCC(C)C 7a_100000210774_100000204255 [0,1,0,0,0,0|1,0,2]=4 1382 B12R0.184 COC(=O)CCSCCCC(C)C 62a_100000204255_100011214892 [0,1,0,0,0,0|1,0,2]=4 1383 B12R0.184 COC(=O)CCSCCCC(C)C 62a_100011214892_100000204255 [0,1,0,0,0,0|1,0,2]=4 1384 B12R0.184 COC(=O)CCSCCCC(C)O 62a_100000204255_200000718107 [0,1,0,0,0,0|1,0,2]=4 1385 B12R0.184 COC(=O)CCSCCCC(C)O 62a_200000718107_100000204255 [0,1,0,0,0,0|1,0,2]=4 1386 B12R0.184 COC(=O)CNCCCOC(C)C 2230a_100000737246_100000747449 [0,1,0,0,0,0|2,0,1]=4 1387 B12R0.184 COC(=O)CNCCCOC(C)C 34a_100000737246_100000747449 [0,1,0,0,0,0|2,0,1]=4 1388 B12R0.184 COC(=O)COCCCCC(C)C 34a_100011214890_100000747449 [0,1,0,0,0,0|1,0,1]=3 1389 B12R0.184 COC(=O)COCCCCC(C)C 7a_100011214890_100000747449 [0,1,0,0,0,0|1,0,1]=3 1390 B12R0.184 COC(=O)COCCCNC(C)C 34a_100000182298_100000747449 [0,1,0,0,0,0|2,0,1]=4 1391 B12R0.184 COC(=O)COCCNCC(C)C 2230a_100000210953_100000090808 [0,1,0,0,0,0|2,0,1]=4 1392 B12R0.184 COC(=O)COCCNCC(C)C 34a_100000210953_100000090808 [0,1,0,0,0,0|2,0,1]=4 1393 B12R0.184 COC(=O)COCCNCC(C)C 34a_100015185251_100000747449 [0,1,0,0,0,0|2,0,1]=4 1394 B12R0.184 COC(=O)COCCNCC(C)O 2230a_100000210904_100000090808 [0,1,0,0,0,0|2,0,1]=4 1395 B12R0.184 COC(=O)COCCNCC(C)O 34a_100000210904_100000090808 [0,1,0,0,0,0|2,0,1]=4 1396 B12R0.184 COC(=O)COCCOCC(C)Br 34a_100012180447_100000090808 [0,1,0,0,0,0|2,0,1]=4 1397 B12R0.184 COC(=O)COCCOCC(C)C 34a_100000210257_100000090808 [0,1,0,0,0,0|2,0,1]=4 1398 B12R0.184 COC(=O)COCCOCC(C)C 34a_100000703358_100000747449 [0,1,0,0,0,0|2,0,1]=4 1399 B12R0.184 COC(=O)COCCOCC(C)C 7a_100000703358_100000747449 [0,1,0,0,0,0|2,0,1]=4 1400 B12R0.184 COC(=O)COCCOCC(C)F 34a_100015925927_100000090808 [0,1,0,0,0,0|2,0,1]=4 1401 B12R0.184 COC(=O)COCCOC[C@@H](C)Cl 34a_100016084084_100000090808 [0,1,0,0,0,0|2,0,1]=4 1402 B12R0.184 COC(=O)COCCOC[C@@H](C)N 34a_100000737577_100000090808 [0,1,0,0,0,0|2,0,1]=4 1403 B12R0.184 COC(=O)COCCSCC(C)C 34a_200000230437_100000747449 [0,1,0,0,0,0|2,0,1]=4 1404 B12R0.184 COC(=O)COCCSCC(C)C 62a_100000090808_100000210760 [0,1,0,0,0,0|2,0,1]=4 1405 B12R0.184 COC(=O)COCCSCC(C)C 62a_100000210624_100000090808 [0,1,0,0,0,0|2,0,1]=4 1406 B12R0.184 COC(=O)COCCSCC(C)C 7a_200000230437_100000747449 [0,1,0,0,0,0|2,0,1]=4 1407 B12R0.184 COC(=O)COCCSCC(C)O 62a_100000090808_100011218427 [0,1,0,0,0,0|2,0,1]=4 1408 B12R0.184 COC(=O)COCCSCC(C)O 62a_100011218427_100000090808 [0,1,0,0,0,0|2,0,1]=4 1409 B12R0.184 COC(=O)COCCSC[C@@H](C)O 62a_100000090808_100009817552 [0,1,0,0,0,0|2,0,1]=4 1410 B12R0.184 COC(=O)COCCSC[C@@H](C)O 62a_100009817552_100000090808 [0,1,0,0,0,0|2,0,1]=4 1411 B12R0.184 COC(=O)CSCCCCC(=O)C 62a_100000735457_100000747449 [0,1,0,0,0,0|1,0,2]=4 1412 B12R0.184 COC(=O)CSCCCCC(=O)C 62a_100000747449_100000735457 [0,1,0,0,0,0|1,0,2]=4 1413 B12R0.184 COC(=O)CSCCCCC(C)C 62a_100000747449_100011216152 [0,1,0,0,0,0|1,0,1]=3 1414 B12R0.184 COC(=O)CSCCCCC(C)C 62a_100011216152_100000747449 [0,1,0,0,0,0|1,0,1]=3 1415 B12R0.184 COC(=O)CSCCCCN(C)C 62a_100000747449_100000690147 [0,1,0,0,0,0|2,0,1]=4 1416 B12R0.184 COC(=O)NCCOCCC(C)C 34a_100000757965_100000210312 [0,1,0,0,0,0|2,0,1]=4 1417 B12R0.184 COC(=O)NCCOCCC(C)O 34a_100000757965_100012276601 [0,1,0,0,0,0|2,0,1]=4 1418 B12R0.184 COC(=O)OCCOCCC(C)C 34a_100010262106_100000210312 [0,1,0,0,0,0|2,0,1]=4 1419 B12R0.184 COC(=O)OCCOCCC(C)O 34a_100010262106_100012276601 [0,1,0,0,0,0|2,0,1]=4 1420 B12R0.184 COC(=O)OCSCCCC(C)C 62a_100011214892_100000139417 [0,1,0,0,0,0|2,0,1]=4 1421 B12R0.184 COC(=O)OCSCCCC(C)O 62a_200000718107_100000139417 [0,1,0,0,0,0|2,0,1]=4 1422 B12R0.248 C#CCCCCCOCC(=O)OC 34a_100000766912_100000747449 [0,1,0,0,0,0|1,0,2]=4 1423 B12R0.248 C#CCCCCCOCC(=O)OC 7a_100000766912_100000747449 [0,1,0,0,0,0|1,0,2]=4 1424 B12R0.248 C#CCCCCCSCC(=O)OC 62a_100000747449_100012094781 [0,1,0,0,0,0|1,0,2]=4 1425 B12R0.248 C#CCCCCCSCC(=O)OC 62a_100012094781_100000747449 [0,1,0,0,0,0|1,0,2]=4 1426 B12R0.248 C=CCCCCCOCC(=O)OC 34a_100011216702_100000747449 [0,1,0,0,0,0|1,0,2]=4 1427 B12R0.248 C=CCCCCCOCC(=O)OC 7a_100011216702_100000747449 [0,1,0,0,0,0|1,0,2]=4 1428 B12R0.248 C=CCCCCCSCC(=O)OC 62a_100000700193_100000747449 [0,1,0,0,0,0|1,0,2]=4 1429 B12R0.248 C=CCCCCCSCC(=O)OC 62a_100000747449_100000700193 [0,1,0,0,0,0|1,0,2]=4 1430 B12R0.248 CC/C=C/CCCOCC(=O)OC 34a_100016287902_100000747449 [0,1,0,0,0,0|1,0,2]=4 1431 B12R0.248 CC/C=C/CCCOCC(=O)OC 7a_100016287902_100000747449 [0,1,0,0,0,0|1,0,2]=4 1432 B12R0.248 CCC(=O)CCCCCCCCO 1458a_100000210414_100000033203 [0,1,0,0,0,0|1,0,2]=4 1433 B12R0.248 CCC(=O)COCCCCCCBr 7a_100011215345_100000747405 [0,1,0,0,0,0|2,0,1]=4 1434 B12R0.248 CCC(=O)COCCCCCCCl 7a_100000766143_100000747405 [0,1,0,0,0,0|2,0,1]=4 1435 B12R0.248 CCC(=O)COCCCCCCF 34a_100000725409_100015922095 [0,1,0,0,0,0|2,0,1]=4 1436 B12R0.248 CCC(=O)COCCCCCCF 7a_100000732779_100000747405 [0,1,0,0,0,0|2,0,1]=4 1437 B12R0.248 CCC(=O)COCCCCCCO 34a_100000725409_100000766143 [0,1,0,0,0,0|2,0,1]=4 1438 B12R0.248 CCC(=O)CSCCCCCCF 62a_100000747405_100015922095 [0,1,0,0,0,0|2,0,1]=4 1439 B12R0.248 CCC(=O)CSCCCCCCF 62a_100015922095_100000747405 [0,1,0,0,0,0|2,0,1]=4 1440 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000747405_100000766143 [0,1,0,0,0,0|2,0,1]=4 1441 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000766143_100000747405 [0,1,0,0,0,0|2,0,1]=4 1442 B12R0.248 CCC(=O)NCCCCCCCO 240690a_100011996573_100000210414 [0,1,0,0,0,0|2,0,1]=4 1443 B12R0.248 CCCC#CCCOCC(=O)OC 34a_100000042726_100000747449 [0,1,0,0,0,0|1,0,2]=4 1444 B12R0.248 CCCC#CCCOCC(=O)OC 7a_100000042726_100000747449 [0,1,0,0,0,0|1,0,2]=4 1445 B12R0.248 CCCC/C=C/COCC(=O)OC 34a_200016272032_100000747449 [0,1,0,0,0,0|1,0,2]=4 1446 B12R0.248 CCCC/C=C/COCC(=O)OC 7a_200016272032_100000747449 [0,1,0,0,0,0|1,0,2]=4 1447 B12R0.248 CCCCC#CCOCC(=O)OC 34a_200000034558_100000747449 [0,1,0,0,0,0|1,0,2]=4 1448 B12R0.248 CCCCC#CCOCC(=O)OC 7a_200000034558_100000747449 [0,1,0,0,0,0|1,0,2]=4 1449 B12R0.248 CCCCCC/C=C/CC(=O)CC 1458a_100020681715_100000210202 [0,1,0,0,0,0|1,0,2]=4 1450 B12R0.248 CCCCCC/C=C/CC(=O)NC 11a_106832991635_100020681715 [0,1,0,0,0,0|1,0,2]=4 1451 B12R0.248 CCCCCC/C=C/CC(=O)NC 1626a_100102657272_100020681715 [0,1,0,0,0,0|1,0,2]=4 1452 B12R0.248 CCCCCC/C=C/CC(=O)NC 240690a_100102657272_100020681715 [0,1,0,0,0,0|1,0,2]=4 1453 B12R0.248 CCCCCCC=NNC(=O)CC 4a_100000183195_100000234349 [0,1,0,0,0,0|2,0,1]=4 1454 B12R0.248 CCCCCCCC=CC(=O)CC 1458a_200015332781_100000210202 [0,1,0,0,0,0|1,0,2]=4 1455 B12R0.248 CCCCCCCC=CC(=O)NC 11a_106832991635_200015332781 [0,1,0,0,0,0|1,0,2]=4 1456 B12R0.248 CCCCCCCC=CC(=O)NC 1626a_100102657272_200015332781 [0,1,0,0,0,0|1,0,2]=4 1457 B12R0.248 CCCCCCCC=CC(=O)NC 240690a_100102657272_200015332781 [0,1,0,0,0,0|1,0,2]=4 1458 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210414_100000210670 [0,1,0,0,0,0|1,0,2]=4 1459 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210558_100000210202 [0,1,0,0,0,0|1,0,2]=4 1460 B12R0.248 CCCCCCCCCC(=O)NC 11a_106832991635_100000210558 [0,1,0,0,0,0|1,0,2]=4 1461 B12R0.248 CCCCCCCCCC(=O)NC 1626a_100102657272_100000210558 [0,1,0,0,0,0|1,0,2]=4 1462 B12R0.248 CCCCCCCCCC(=O)NC 240690a_100102657272_100000210558 [0,1,0,0,0,0|1,0,2]=4 1463 B12R0.248 CCCCCCCCCC(=O)NC 527a_100102657272_100000210558 [0,1,0,0,0,0|1,0,2]=4 1464 B12R0.248 CCCCCCCCNC(=O)CC 11a_100000229939_100000210414 [0,1,0,0,0,0|1,0,2]=4 1465 B12R0.248 CCCCCCCCNC(=O)CC 1626a_100000229939_100000210414 [0,1,0,0,0,0|1,0,2]=4 1466 B12R0.248 CCCCCCCCNC(=O)CC 240690a_100000229939_100000210414 [0,1,0,0,0,0|1,0,2]=4 1467 B12R0.248 CCCCCCCCNC(=O)CC 527a_100000229939_100000210414 [0,1,0,0,0,0|1,0,2]=4 1468 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100000229939_106832991635 [0,1,0,0,0,0|1,0,2]=4 1469 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100102657272_100000229939 [0,1,0,0,0,0|1,0,2]=4 1470 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100000229939_100102657272 [0,1,0,0,0,0|1,0,2]=4 1471 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100102657272_100000229939 [0,1,0,0,0,0|1,0,2]=4 1472 B12R0.248 CCCCCCCCNC(=O)NC 512a_100000229939_100102657272 [0,1,0,0,0,0|1,0,2]=4 1473 B12R0.248 CCCCCCCCNC(=O)NC 512a_106832991638_100000229939 [0,1,0,0,0,0|1,0,2]=4 1474 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000229938_100000183359 [0,1,0,0,0,0|1,0,2]=4 1475 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000693194_100000210681 [0,1,0,0,0,0|1,0,2]=4 1476 B12R0.248 CCCCCCCNCC(=O)OC 2230a_100000229938_100000747449 [0,1,0,0,0,0|0,0,2]=3 1477 B12R0.248 CCCCCCCOCC(=O)CC 34a_100000725409_100000210614 [0,1,0,0,0,0|1,0,2]=4 1478 B12R0.248 CCCCCCCOCC(=O)CC 7a_100000210272_100000747405 [0,1,0,0,0,0|1,0,2]=4 1479 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000210272_100000183359 [0,1,0,0,0,0|1,0,2]=4 1480 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000750040_100000210614 [0,1,0,0,0,0|1,0,2]=4 1481 B12R0.248 CCCCCCCOCC(=O)NC 7a_100000210272_100000183359 [0,1,0,0,0,0|1,0,2]=4 1482 B12R0.248 CCCCCCCOCC(=O)OC 34a_100000210272_100000747449 [0,1,0,0,0,0|0,0,2]=3 1483 B12R0.248 CCCCCCCOCC(=O)OC 7a_100000210272_100000747449 [0,1,0,0,0,0|0,0,2]=3 1484 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000210614_100000747405 [0,1,0,0,0,0|1,0,2]=4 1485 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000747405_100000210316 [0,1,0,0,0,0|1,0,2]=4 1486 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000183359_100000210316 [0,1,0,0,0,0|1,0,2]=4 1487 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000210614_100000183359 [0,1,0,0,0,0|1,0,2]=4 1488 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000210614_100000747449 [0,1,0,0,0,0|0,0,2]=3 1489 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000747449_100000210316 [0,1,0,0,0,0|0,0,2]=3 1490 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000210581_100000737683 [0,1,0,0,0,0|1,0,2]=4 1491 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000738227_100000210314 [0,1,0,0,0,0|1,0,2]=4 1492 B12R0.248 CCCCCCNCCC(=O)NC 34a_100000738227_100000210314 [0,1,0,0,0,0|1,0,2]=4 1493 B12R0.248 CCCCCCNCCC(=O)OC 2230a_100000210581_100000204255 [0,1,0,0,0,0|0,0,2]=3 1494 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000210259_100012179268 [0,1,0,0,0,0|1,0,2]=4 1495 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000754576_100000210314 [0,1,0,0,0,0|1,0,2]=4 1496 B12R0.248 CCCCCCOCCC(=O)NC 7a_100000210259_100000737683 [0,1,0,0,0,0|1,0,2]=4 1497 B12R0.248 CCCCCCOCCC(=O)OC 34a_100000210259_100000742370 [0,1,0,0,0,0|0,0,2]=3 1498 B12R0.248 CCCCCCOCCC(=O)OC 7a_100000210259_100000204255 [0,1,0,0,0,0|0,0,2]=3 1499 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000210314_100000737683 [0,1,0,0,0,0|1,0,2]=4 1500 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000737683_100000210757 [0,1,0,0,0,0|1,0,2]=4 1501 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000204255_100000210757 [0,1,0,0,0,0|0,0,2]=3 1502 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000210314_100000204255 [0,1,0,0,0,0|0,0,2]=3 1503 B12R0.248 CCCCCCSCOC(=O)OC 62a_100000210314_100000139417 [0,1,0,0,0,0|1,0,1]=3 1504 B12R0.248 CCCCCNC/C=C/C(=O)OC 2230a_100000209983_100000742655 [0,1,0,0,0,0|0,0,2]=3 1505 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000209983_100000741757 [0,1,0,0,0,0|1,0,2]=4 1506 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000740002_100000210326 [0,1,0,0,0,0|1,0,2]=4 1507 B12R0.248 CCCCCNCCCC(=O)NC 34a_100000740002_100000718602 [0,1,0,0,0,0|1,0,2]=4 1508 B12R0.248 CCCCCNCCCC(=O)OC 2230a_100000209983_100011218270 [0,1,0,0,0,0|0,0,2]=3 1509 B12R0.248 CCCCCNCCNC(=O)CC 34a_100132302217_100000718602 [0,1,0,0,0,0|2,0,1]=4 1510 B12R0.248 CCCCCNCCNC(=O)NC 34a_100015205895_100000718602 [0,1,0,0,0,0|2,0,1]=4 1511 B12R0.248 CCCCCNN=CCC(=O)OC 4a_100000694160_200011552997 [0,1,0,0,0,0|1,0,2]=4 1512 B12R0.248 CCCCCOC/C=C/C(=O)OC 34a_100000210253_100000742655 [0,1,0,0,0,0|0,0,2]=3 1513 B12R0.248 CCCCCOC/C=C/C(=O)OC 7a_100000210253_100000742655 [0,1,0,0,0,0|0,0,2]=3 1514 B12R0.248 CCCCCOCCCC(=O)NC 34a_100000210253_100000741757 [0,1,0,0,0,0|1,0,2]=4 1515 B12R0.248 CCCCCOCCCC(=O)NC 7a_100000210253_100000741757 [0,1,0,0,0,0|1,0,2]=4 1516 B12R0.248 CCCCCOCCCC(=O)OC 34a_100000210253_100000742333 [0,1,0,0,0,0|0,0,2]=3 1517 B12R0.248 CCCCCOCCCC(=O)OC 7a_100000210253_100011218270 [0,1,0,0,0,0|0,0,2]=3 1518 B12R0.248 CCCCCOCCNC(=O)CC 34a_200000158885_100000718602 [0,1,0,0,0,0|2,0,1]=4 1519 B12R0.248 CCCCCOCCNC(=O)CC 7a_200000158885_100000210326 [0,1,0,0,0,0|2,0,1]=4 1520 B12R0.248 CCCCCOCCNC(=O)OC 34a_100000757965_100000718602 [0,1,0,0,0,0|1,0,1]=3 1521 B12R0.248 CCCCCOCCOC(=O)CC 7a_200000031056_100000210326 [0,1,0,0,0,0|2,0,1]=4 1522 B12R0.248 CCCCCOCCOC(=O)NC 34a_100000210253_200011997002 [0,1,0,0,0,0|2,0,1]=4 1523 B12R0.248 CCCCCOCCOC(=O)NC 7a_100000210253_200011997002 [0,1,0,0,0,0|2,0,1]=4 1524 B12R0.248 CCCCCOCCOC(=O)OC 34a_100010262106_100000718602 [0,1,0,0,0,0|1,0,1]=3 1525 B12R0.248 CCCCCSC/C=C/C(=O)OC 62a_100000210326_100000742655 [0,1,0,0,0,0|0,0,2]=3 1526 B12R0.248 CCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210326 [0,1,0,0,0,0|0,0,2]=3 1527 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000210326_100000741757 [0,1,0,0,0,0|1,0,2]=4 1528 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000741757_100000210326 [0,1,0,0,0,0|1,0,2]=4 1529 B12R0.248 CCCCCSCCCC(=O)OC 62a_100000210326_100011218270 [0,1,0,0,0,0|0,0,2]=3 1530 B12R0.248 CCCCCSCCCC(=O)OC 62a_100011218270_100000210326 [0,1,0,0,0,0|0,0,2]=3 1531 B12R0.248 CCCCCSCCOC(=O)NC 62a_100000210326_200011997002 [0,1,0,0,0,0|2,0,1]=4 1532 B12R0.248 CCCCCSCCOC(=O)NC 62a_200011997002_100000210326 [0,1,0,0,0,0|2,0,1]=4 1533 B12R0.248 CCCCNCCCCC(=O)OC 2230a_100000102301_100000204269 [0,1,0,0,0,0|0,0,2]=3 1534 B12R0.248 CCCCNCCCCC(=O)OC 7a_106832991798_100000204269 [0,1,0,0,0,0|0,0,2]=3 1535 B12R0.248 CCCCNCCOCC(=O)OC 2230a_100000102301_100000090808 [0,1,0,0,0,0|1,0,1]=3 1536 B12R0.248 CCCCNCCOCC(=O)OC 7a_106832991798_100000090808 [0,1,0,0,0,0|1,0,1]=3 1537 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000059025_100000210210 [0,1,0,0,0,0|0,0,2]=3 1538 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000210227_100000204269 [0,1,0,0,0,0|0,0,2]=3 1539 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000059025_100000210211 [0,1,0,0,0,0|0,0,2]=3 1540 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000210227_100000204269 [0,1,0,0,0,0|0,0,2]=3 1541 B12R0.248 CCCCOCCCNC(=O)CC 1626a_200000211371_100000210414 [0,1,0,0,0,0|2,0,1]=4 1542 B12R0.248 CCCCOCCCNC(=O)CC 240690a_200000211371_100000210414 [0,1,0,0,0,0|2,0,1]=4 1543 B12R0.248 CCCCOCCCNC(=O)CC 527a_200000211371_100000210414 [0,1,0,0,0,0|2,0,1]=4 1544 B12R0.248 CCCCOCCCNC(=O)NC 2708a_100102657272_200000211371 [0,1,0,0,0,0|2,0,1]=4 1545 B12R0.248 CCCCOCCCNC(=O)NC 2708a_200000211371_106832991635 [0,1,0,0,0,0|2,0,1]=4 1546 B12R0.248 CCCCOCCCNC(=O)NC 273464a_100102657272_200000211371 [0,1,0,0,0,0|2,0,1]=4 1547 B12R0.248 CCCCOCCCNC(=O)NC 273464a_200000211371_100102657272 [0,1,0,0,0,0|2,0,1]=4 1548 B12R0.248 CCCCOCCCNC(=O)NC 512a_106832991638_200000211371 [0,1,0,0,0,0|2,0,1]=4 1549 B12R0.248 CCCCOCCCNC(=O)NC 512a_200000211371_100102657272 [0,1,0,0,0,0|2,0,1]=4 1550 B12R0.248 CCCCOCCNCC(=O)NC 2230a_100000693194_100000743108 [0,1,0,0,0,0|2,0,1]=4 1551 B12R0.248 CCCCOCCOCC(=O)CC 1458a_100011216887_100000210202 [0,1,0,0,0,0|2,0,1]=4 1552 B12R0.248 CCCCOCCOCC(=O)CC 34a_100000725409_100000743108 [0,1,0,0,0,0|2,0,1]=4 1553 B12R0.248 CCCCOCCOCC(=O)CC 7a_100000210238_100000747405 [0,1,0,0,0,0|2,0,1]=4 1554 B12R0.248 CCCCOCCOCC(=O)NC 11a_106832991635_100011216887 [0,1,0,0,0,0|2,0,1]=4 1555 B12R0.248 CCCCOCCOCC(=O)NC 1626a_100102657272_100011216887 [0,1,0,0,0,0|2,0,1]=4 1556 B12R0.248 CCCCOCCOCC(=O)NC 240690a_100102657272_100011216887 [0,1,0,0,0,0|2,0,1]=4 1557 B12R0.248 CCCCOCCOCC(=O)NC 34a_100000210238_100000183359 [0,1,0,0,0,0|2,0,1]=4 1558 B12R0.248 CCCCOCCOCC(=O)NC 34a_100000750040_100000743108 [0,1,0,0,0,0|2,0,1]=4 1559 B12R0.248 CCCCOCCOCC(=O)NC 527a_100102657272_100011216887 [0,1,0,0,0,0|2,0,1]=4 1560 B12R0.248 CCCCOCCOCC(=O)NC 7a_100000210238_100000183359 [0,1,0,0,0,0|2,0,1]=4 1561 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210227_100000090808 [0,1,0,0,0,0|1,0,1]=3 1562 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210238_100000747449 [0,1,0,0,0,0|1,0,1]=3 1563 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210227_100000090808 [0,1,0,0,0,0|1,0,1]=3 1564 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210238_100000747449 [0,1,0,0,0,0|1,0,1]=3 1565 B12R0.248 CCCCOCCSCC(=O)CC 62a_100000743108_100000747405 [0,1,0,0,0,0|2,0,1]=4 1566 B12R0.248 CCCCOCCSCC(=O)CC 62a_100000747405_100000743108 [0,1,0,0,0,0|2,0,1]=4 1567 B12R0.248 CCCCOCCSCC(=O)NC 62a_100000183359_100000743108 [0,1,0,0,0,0|2,0,1]=4 1568 B12R0.248 CCCCOCCSCC(=O)NC 62a_100000743108_100000183359 [0,1,0,0,0,0|2,0,1]=4 1569 B12R0.248 CCCCOCCSCC(=O)OC 62a_100000743108_100000747449 [0,1,0,0,0,0|1,0,1]=3 1570 B12R0.248 CCCCOCCSCC(=O)OC 62a_100000747449_100000743108 [0,1,0,0,0,0|1,0,1]=3 1571 B12R0.248 CCCCOCSCCC(=O)OC 62a_100000204255_100011995733 [0,1,0,0,0,0|1,0,2]=4 1572 B12R0.248 CCCCOCSCCC(=O)OC 62a_100011995733_100000204255 [0,1,0,0,0,0|1,0,2]=4 1573 B12R0.248 CCCCOCSCOC(=O)OC 62a_100011995733_100000139417 [0,1,0,0,0,0|2,0,1]=4 1574 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000204269_100000210210 [0,1,0,0,0,0|0,0,2]=3 1575 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000210211_100000204269 [0,1,0,0,0,0|0,0,2]=3 1576 B12R0.248 CCCCSCCNCC(=O)NC 2230a_100025743550_100000183359 [0,1,0,0,0,0|2,0,1]=4 1577 B12R0.248 CCCCSCCNCC(=O)OC 2230a_100025743550_100000747449 [0,1,0,0,0,0|1,0,1]=3 1578 B12R0.248 CCCCSCCOCC(=O)CC 7a_200000230436_100000747405 [0,1,0,0,0,0|2,0,1]=4 1579 B12R0.248 CCCCSCCOCC(=O)NC 34a_200000230436_100000183359 [0,1,0,0,0,0|2,0,1]=4 1580 B12R0.248 CCCCSCCOCC(=O)NC 7a_200000230436_100000183359 [0,1,0,0,0,0|2,0,1]=4 1581 B12R0.248 CCCCSCCOCC(=O)OC 34a_200000230436_100000747449 [0,1,0,0,0,0|1,0,1]=3 1582 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000090808_100000210210 [0,1,0,0,0,0|1,0,1]=3 1583 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000210211_100000090808 [0,1,0,0,0,0|1,0,1]=3 1584 B12R0.248 CCCCSCCOCC(=O)OC 7a_200000230436_100000747449 [0,1,0,0,0,0|1,0,1]=3 1585 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000074720_100000210303 [0,1,0,0,0,0|0,0,2]=3 1586 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000210258_100009816466 [0,1,0,0,0,0|0,0,2]=3 1587 B12R0.248 CCCOCCCCCC(=O)OC 7a_100000074720_100000210303 [0,1,0,0,0,0|0,0,2]=3 1588 B12R0.248 CCCOCCCNCC(=O)NC 2230a_100011217757_100000183359 [0,1,0,0,0,0|2,0,1]=4 1589 B12R0.248 CCCOCCCNCC(=O)NC 34a_100011217757_100000183359 [0,1,0,0,0,0|2,0,1]=4 1590 B12R0.248 CCCOCCCNCC(=O)OC 2230a_100011217757_100000747449 [0,1,0,0,0,0|1,0,1]=3 1591 B12R0.248 CCCOCCCNCC(=O)OC 34a_100011217757_100000747449 [0,1,0,0,0,0|1,0,1]=3 1592 B12R0.248 CCCOCCNCCC(=O)OC 2230a_100161115042_100000204255 [0,1,0,0,0,0|1,0,2]=4 1593 B12R0.248 CCCOCCNCCC(=O)OC 34a_100161115042_100000742370 [0,1,0,0,0,0|1,0,2]=4 1594 B12R0.248 CCCOCCOCCC(=O)OC 34a_100000752267_100000742370 [0,1,0,0,0,0|1,0,2]=4 1595 B12R0.248 CCCOCCOCCC(=O)OC 7a_100000752267_100000204255 [0,1,0,0,0,0|1,0,2]=4 1596 B12R0.248 CCCOCCSCCC(=O)OC 62a_100000204255_100011215938 [0,1,0,0,0,0|1,0,2]=4 1597 B12R0.248 CCCOCCSCCC(=O)OC 62a_100011215938_100000204255 [0,1,0,0,0,0|1,0,2]=4 1598 B12R0.248 CCCOCCSCOC(=O)OC 62a_100011215938_100000139417 [0,1,0,0,0,0|2,0,1]=4 1599 B12R0.248 CCCSCCCCCC(=O)OC 62a_100000210303_100009816466 [0,1,0,0,0,0|0,0,2]=3 1600 B12R0.248 CCCSCCCCCC(=O)OC 62a_100009816466_100000210303 [0,1,0,0,0,0|0,0,2]=3 1601 B12R0.248 CCCSCCNCCC(=O)OC 2230a_100020603323_100000204255 [0,1,0,0,0,0|1,0,2]=4 1602 B12R0.248 CCCSCCOCCC(=O)OC 34a_200000230433_100000742370 [0,1,0,0,0,0|1,0,2]=4 1603 B12R0.248 CCCSCCOCCC(=O)OC 7a_200000230433_100000204255 [0,1,0,0,0,0|1,0,2]=4 1604 B12R0.248 CCNCCCCCCC(=O)OC 2230a_100015525214_100009815986 [0,1,0,0,0,0|0,0,2]=3 1605 B12R0.248 CCOCCCCCCC(=O)OC 34a_100009863599_100000210202 [0,1,0,0,0,0|0,0,2]=3 1606 B12R0.248 CCOCCCCCCC(=O)OC 34a_100121572206_100009815986 [0,1,0,0,0,0|0,0,2]=3 1607 B12R0.248 CCOCCCCCCC(=O)OC 7a_100009863599_100000210202 [0,1,0,0,0,0|0,0,2]=3 1608 B12R0.248 CCOCCCNCCC(=O)OC 2230a_100000210961_100000204255 [0,1,0,0,0,0|1,0,2]=4 1609 B12R0.248 CCOCCCNCCC(=O)OC 34a_100000210961_100000742370 [0,1,0,0,0,0|1,0,2]=4 1610 B12R0.248 CCOCCCOCCC(=O)OC 34a_100000757476_100000742370 [0,1,0,0,0,0|1,0,2]=4 1611 B12R0.248 CCOCCCOCCC(=O)OC 7a_100000757476_100000204255 [0,1,0,0,0,0|1,0,2]=4 1612 B12R0.248 CCOCCCSCCC(=O)OC 62a_100000204255_100012232248 [0,1,0,0,0,0|1,0,2]=4 1613 B12R0.248 CCOCCCSCCC(=O)OC 62a_100012232248_100000204255 [0,1,0,0,0,0|1,0,2]=4 1614 B12R0.248 CCOCCCSCOC(=O)OC 62a_100012232248_100000139417 [0,1,0,0,0,0|2,0,1]=4 1615 B12R0.248 CCOCCNC/C=C/C(=O)OC 2230a_102516460346_100000742655 [0,1,0,0,0,0|1,0,2]=4 1616 B12R0.248 CCOCCNC/C=C/C(=O)OC 34a_102516460346_100000742655 [0,1,0,0,0,0|1,0,2]=4 1617 B12R0.248 CCOCCNCCCC(=O)OC 2230a_102516460346_100011218270 [0,1,0,0,0,0|1,0,2]=4 1618 B12R0.248 CCOCCNCCCC(=O)OC 34a_102516460346_100000742333 [0,1,0,0,0,0|1,0,2]=4 1619 B12R0.248 CCOCCOC/C=C/C(=O)OC 34a_100000210136_100000742655 [0,1,0,0,0,0|1,0,2]=4 1620 B12R0.248 CCOCCOC/C=C/C(=O)OC 7a_100000210136_100000742655 [0,1,0,0,0,0|1,0,2]=4 1621 B12R0.248 CCOCCOCCCC(=O)OC 34a_100000210136_100000742333 [0,1,0,0,0,0|1,0,2]=4 1622 B12R0.248 CCOCCOCCCC(=O)OC 7a_100000210136_100011218270 [0,1,0,0,0,0|1,0,2]=4 1623 B12R0.248 CCOCCOCCNC(=O)OC 34a_100000757965_100000210147 [0,1,0,0,0,0|2,0,1]=4 1624 B12R0.248 CCOCCOCCOC(=O)OC 34a_100010262106_100000210147 [0,1,0,0,0,0|2,0,1]=4 1625 B12R0.248 CCOCCSC/C=C/C(=O)OC 62a_100000210147_100000742655 [0,1,0,0,0,0|1,0,2]=4 1626 B12R0.248 CCOCCSC/C=C/C(=O)OC 62a_100000742655_100011215890 [0,1,0,0,0,0|1,0,2]=4 1627 B12R0.248 CCOCCSCCCC(=O)OC 62a_100000210147_100011218270 [0,1,0,0,0,0|1,0,2]=4 1628 B12R0.248 CCOCCSCCCC(=O)OC 62a_100011218270_100011215890 [0,1,0,0,0,0|1,0,2]=4 1629 B12R0.248 CCOCSCCCCC(=O)OC 62a_100000204269_100000739092 [0,1,0,0,0,0|1,0,2]=4 1630 B12R0.248 CCOCSCCCCC(=O)OC 62a_100000739092_100000204269 [0,1,0,0,0,0|1,0,2]=4 1631 B12R0.248 CCOCSCCOCC(=O)OC 62a_100000090808_100000739092 [0,1,0,0,0,0|2,0,1]=4 1632 B12R0.248 CCOCSCCOCC(=O)OC 62a_100000739092_100000090808 [0,1,0,0,0,0|2,0,1]=4 1633 B12R0.248 CCSCCCCCCC(=O)OC 62a_100000210202_100009815986 [0,1,0,0,0,0|0,0,2]=3 1634 B12R0.248 CCSCCCCCCC(=O)OC 62a_100009815986_100000210202 [0,1,0,0,0,0|0,0,2]=3 1635 B12R0.248 CCSCCCOCCC(=O)OC 34a_100011216438_100000742370 [0,1,0,0,0,0|1,0,2]=4 1636 B12R0.248 CCSCCCOCCC(=O)OC 7a_100011216438_100000204255 [0,1,0,0,0,0|1,0,2]=4 1637 B12R0.248 CCSCCNC/C=C/C(=O)OC 2230a_100000106463_100000742655 [0,1,0,0,0,0|1,0,2]=4 1638 B12R0.248 CCSCCNCCCC(=O)OC 2230a_100000106463_100011218270 [0,1,0,0,0,0|1,0,2]=4 1639 B12R0.248 CCSCCOC/C=C/C(=O)OC 34a_100000212035_100000742655 [0,1,0,0,0,0|1,0,2]=4 1640 B12R0.248 CCSCCOC/C=C/C(=O)OC 7a_100000212035_100000742655 [0,1,0,0,0,0|1,0,2]=4 1641 B12R0.248 CCSCCOCCCC(=O)OC 34a_100000212035_100000742333 [0,1,0,0,0,0|1,0,2]=4 1642 B12R0.248 CCSCCOCCCC(=O)OC 7a_100000212035_100011218270 [0,1,0,0,0,0|1,0,2]=4 1643 B12R0.248 CCSCCOCCNC(=O)OC 34a_100000757965_100000757381 [0,1,0,0,0,0|2,0,1]=4 1644 B12R0.248 CCSCCOCCOC(=O)OC 34a_100010262106_100000757381 [0,1,0,0,0,0|2,0,1]=4 1645 B12R0.248 CCSCCSC/C=C/C(=O)OC 62a_100000742655_100000757381 [0,1,0,0,0,0|1,0,2]=4 1646 B12R0.248 CCSCCSC/C=C/C(=O)OC 62a_100000757381_100000742655 [0,1,0,0,0,0|1,0,2]=4 1647 B12R0.248 CCSCCSCCCC(=O)OC 62a_100000757381_100011218270 [0,1,0,0,0,0|1,0,2]=4 1648 B12R0.248 CCSCCSCCCC(=O)OC 62a_100011218270_100000757381 [0,1,0,0,0,0|1,0,2]=4 1649 B12R0.248 CNC(=O)CCCCCCCCO 240690a_100102657272_100000015970 [0,1,0,0,0,0|1,0,2]=4 1650 B12R0.248 CNC(=O)CNCCCCCCF 2230a_100000693194_100015922095 [0,1,0,0,0,0|2,0,1]=4 1651 B12R0.248 CNC(=O)CNCCCCCCO 2230a_100000686447_100000183359 [0,1,0,0,0,0|2,0,1]=4 1652 B12R0.248 CNC(=O)CNCCCCCCO 2230a_100000693194_100000766143 [0,1,0,0,0,0|2,0,1]=4 1653 B12R0.248 CNC(=O)CNCCCCCCO 34a_100000686447_100000183359 [0,1,0,0,0,0|2,0,1]=4 1654 B12R0.248 CNC(=O)CNCCCCCOC 2230a_100000747528_100000183359 [0,1,0,0,0,0|2,0,1]=4 1655 B12R0.248 CNC(=O)CNCCCCCOC 34a_100000747528_100000183359 [0,1,0,0,0,0|2,0,1]=4 1656 B12R0.248 CNC(=O)COCCCCCCBr 34a_100011215345_100000183359 [0,1,0,0,0,0|2,0,1]=4 1657 B12R0.248 CNC(=O)COCCCCCCBr 7a_100011215345_100000183359 [0,1,0,0,0,0|2,0,1]=4 1658 B12R0.248 CNC(=O)COCCCCCCCl 34a_100000766143_100000183359 [0,1,0,0,0,0|2,0,1]=4 1659 B12R0.248 CNC(=O)COCCCCCCCl 7a_100000766143_100000183359 [0,1,0,0,0,0|2,0,1]=4 1660 B12R0.248 CNC(=O)COCCCCCCF 34a_100000732779_100000183359 [0,1,0,0,0,0|2,0,1]=4 1661 B12R0.248 CNC(=O)COCCCCCCF 34a_100000750040_100015922095 [0,1,0,0,0,0|2,0,1]=4 1662 B12R0.248 CNC(=O)COCCCCCCF 7a_100000732779_100000183359 [0,1,0,0,0,0|2,0,1]=4 1663 B12R0.248 CNC(=O)COCCCCCCN 34a_100000686447_100000183359 [0,1,0,0,0,0|2,0,1]=4 1664 B12R0.248 CNC(=O)COCCCCCCO 34a_100000750040_100000766143 [0,1,0,0,0,0|2,0,1]=4 1665 B12R0.248 CNC(=O)CSCCCCCCF 62a_100000183359_100015922095 [0,1,0,0,0,0|2,0,1]=4 1666 B12R0.248 CNC(=O)CSCCCCCCF 62a_100015922095_100000183359 [0,1,0,0,0,0|2,0,1]=4 1667 B12R0.248 CNC(=O)CSCCCCCCO 62a_100000183359_100000766143 [0,1,0,0,0,0|2,0,1]=4 1668 B12R0.248 CNC(=O)CSCCCCCCO 62a_100000766143_100000183359 [0,1,0,0,0,0|2,0,1]=4 1669 B12R0.248 CNC(=O)NCCCCCCCO 2708a_100011996573_106832991635 [0,1,0,0,0,0|2,0,1]=4 1670 B12R0.248 CNC(=O)NCCCCCCCO 2708a_100102657272_100011996573 [0,1,0,0,0,0|2,0,1]=4 1671 B12R0.248 CNC(=O)NCCCCCCCO 273464a_100011996573_100102657272 [0,1,0,0,0,0|2,0,1]=4 1672 B12R0.248 CNC(=O)NCCCCCCCO 273464a_100102657272_100011996573 [0,1,0,0,0,0|2,0,1]=4 1673 B12R0.248 CNC(=O)NCCCCCCCO 512a_100011996573_100102657272 [0,1,0,0,0,0|2,0,1]=4 1674 B12R0.248 CNC(=O)NCCCCCCCO 512a_106832991638_100011996573 [0,1,0,0,0,0|2,0,1]=4 1675 B12R0.248 CNCCCCCCCC(=O)OC 2230a_106832991635_100010004213 [0,1,0,0,0,0|0,0,2]=3 1676 B12R0.248 CNCCCCCCCC(=O)OC 34a_100102657272_100010004213 [0,1,0,0,0,0|0,0,2]=3 1677 B12R0.248 CNCCCCCCCC(=O)OC 7a_106832991635_100010004213 [0,1,0,0,0,0|0,0,2]=3 1678 B12R0.248 CNCCCCCOCC(=O)NC 34a_100000722520_100000183359 [0,1,0,0,0,0|2,0,1]=4 1679 B12R0.248 CNCCCCCOCC(=O)OC 34a_100000722520_100000747449 [0,1,0,0,0,0|1,0,1]=3 1680 B12R0.248 CNCCCOC/C=C/C(=O)OC 34a_100000213112_100000742655 [0,1,0,0,0,0|1,0,2]=4 1681 B12R0.248 CNCCCOCCCC(=O)OC 34a_100000213112_100000742333 [0,1,0,0,0,0|1,0,2]=4 1682 B12R0.248 CNCCOCCOCC(=O)OC 34a_100000228057_100000747449 [0,1,0,0,0,0|2,0,1]=4 1683 B12R0.248 COC(=O)/C=C/CNCCCCO 2230a_100000750430_100000742655 [0,1,0,0,0,0|1,0,2]=4 1684 B12R0.248 COC(=O)/C=C/CNCCCCO 34a_100000750430_100000742655 [0,1,0,0,0,0|1,0,2]=4 1685 B12R0.248 COC(=O)/C=C/CNCCCSC 2230a_100000749238_100000742655 [0,1,0,0,0,0|1,0,2]=4 1686 B12R0.248 COC(=O)/C=C/COCCCCBr 34a_100011216708_100000742655 [0,1,0,0,0,0|1,0,2]=4 1687 B12R0.248 COC(=O)/C=C/COCCCCCl 34a_100000210776_100000742655 [0,1,0,0,0,0|1,0,2]=4 1688 B12R0.248 COC(=O)/C=C/COCCCCCl 7a_100000210776_100000742655 [0,1,0,0,0,0|1,0,2]=4 1689 B12R0.248 COC(=O)/C=C/COCCCCF 34a_100011995726_100000742655 [0,1,0,0,0,0|1,0,2]=4 1690 B12R0.248 COC(=O)/C=C/COCCCCF 7a_100011995726_100000742655 [0,1,0,0,0,0|1,0,2]=4 1691 B12R0.248 COC(=O)/C=C/COCCCCI 34a_200012148704_100000742655 [0,1,0,0,0,0|1,0,2]=4 1692 B12R0.248 COC(=O)/C=C/COCCCCN 34a_100000750430_100000742655 [0,1,0,0,0,0|1,0,2]=4 1693 B12R0.248 COC(=O)/C=C/COCCCSC 34a_100000690336_100000742655 [0,1,0,0,0,0|1,0,2]=4 1694 B12R0.248 COC(=O)/C=C/COCCCSC 7a_100000690336_100000742655 [0,1,0,0,0,0|1,0,2]=4 1695 B12R0.248 COC(=O)/C=C/CSCCCCF 62a_100000729493_100000742655 [0,1,0,0,0,0|1,0,2]=4 1696 B12R0.248 COC(=O)/C=C/CSCCCCF 62a_100000742655_100000729493 [0,1,0,0,0,0|1,0,2]=4 1697 B12R0.248 COC(=O)/C=C/CSCCCCO 62a_100000210776_100000742655 [0,1,0,0,0,0|1,0,2]=4 1698 B12R0.248 COC(=O)/C=C/CSCCCCO 62a_100000742655_100000210776 [0,1,0,0,0,0|1,0,2]=4 1699 B12R0.248 COC(=O)CCCCCCCO[13CH3] 34a_100011022521_200025704644 [0,1,0,0,0,0|0,0,2]=3 1700 B12R0.248 COC(=O)CCCCCCCO[13CH3] 7a_100011022521_200025704644 [0,1,0,0,0,0|0,0,2]=3 1701 B12R0.248 COC(=O)CCCCCCCSC 62a_100010004213_200000210301 [0,1,0,0,0,0|0,0,2]=3 1702 B12R0.248 COC(=O)CCCCCCCSC 62a_200000210301_100010004213 [0,1,0,0,0,0|0,0,2]=3 1703 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_100010004213_200025704644 [0,1,0,0,0,0|0,0,2]=3 1704 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_200025704644_100010004213 [0,1,0,0,0,0|0,0,2]=3 1705 B12R0.248 COC(=O)CCCCCCOCF 34a_100009863599_100015361967 [0,1,0,0,0,0|1,0,2]=4 1706 B12R0.248 COC(=O)CCCCCCOCF 7a_100009863599_100015361967 [0,1,0,0,0,0|1,0,2]=4 1707 B12R0.248 COC(=O)CCCCCCSCF 62a_100009815986_100015361967 [0,1,0,0,0,0|1,0,2]=4 1708 B12R0.248 COC(=O)CCCCCCSCF 62a_100015361967_100009815986 [0,1,0,0,0,0|1,0,2]=4 1709 B12R0.248 COC(=O)CCCCCNCCF 34a_100000724931_100009816466 [0,1,0,0,0,0|1,0,2]=4 1710 B12R0.248 COC(=O)CCCCCNCCO 2230a_100016997473_100009816466 [0,1,0,0,0,0|1,0,2]=4 1711 B12R0.248 COC(=O)CCCCCNCCO 34a_100016990907_100009816466 [0,1,0,0,0,0|1,0,2]=4 1712 B12R0.248 COC(=O)CCCCCOCCBr 34a_100000211926_100009816466 [0,1,0,0,0,0|1,0,2]=4 1713 B12R0.248 COC(=O)CCCCCOCCF 34a_100000074720_100011217306 [0,1,0,0,0,0|1,0,2]=4 1714 B12R0.248 COC(=O)CCCCCOCCF 7a_100000074720_100011217306 [0,1,0,0,0,0|1,0,2]=4 1715 B12R0.248 COC(=O)CCCCCOCCN 34a_100000210304_100009816466 [0,1,0,0,0,0|1,0,2]=4 1716 B12R0.248 COC(=O)CCCCCOCCO 34a_100000074720_100000211926 [0,1,0,0,0,0|1,0,2]=4 1717 B12R0.248 COC(=O)CCCCCOCCO 7a_100000074720_100000211926 [0,1,0,0,0,0|1,0,2]=4 1718 B12R0.248 COC(=O)CCCCCOCSC 34a_100000074720_100011218213 [0,1,0,0,0,0|1,0,2]=4 1719 B12R0.248 COC(=O)CCCCCSCCF 62a_100009816466_100011217306 [0,1,0,0,0,0|1,0,2]=4 1720 B12R0.248 COC(=O)CCCCCSCCF 62a_100011217306_100009816466 [0,1,0,0,0,0|1,0,2]=4 1721 B12R0.248 COC(=O)CCCCCSCCO 62a_100000211926_100009816466 [0,1,0,0,0,0|1,0,2]=4 1722 B12R0.248 COC(=O)CCCCCSCCO 62a_100009816466_100000211926 [0,1,0,0,0,0|1,0,2]=4 1723 B12R0.248 COC(=O)CCCCCSCSC 62a_100009816466_100011218213 [0,1,0,0,0,0|1,0,2]=4 1724 B12R0.248 COC(=O)CCCCCSCSC 62a_100011218213_100009816466 [0,1,0,0,0,0|1,0,2]=4 1725 B12R0.248 COC(=O)CCCCNCCCF 2230a_100015189416_100000204269 [0,1,0,0,0,0|1,0,2]=4 1726 B12R0.248 COC(=O)CCCCNCCCF 34a_100015189416_100000204269 [0,1,0,0,0,0|1,0,2]=4 1727 B12R0.248 COC(=O)CCCCNCCSC 2230a_100020590264_100000204269 [0,1,0,0,0,0|1,0,2]=4 1728 B12R0.248 COC(=O)CCCCOCCCBr 34a_100011217188_100000204269 [0,1,0,0,0,0|1,0,2]=4 1729 B12R0.248 COC(=O)CCCCOCCCCl 34a_100000230001_100000204269 [0,1,0,0,0,0|1,0,2]=4 1730 B12R0.248 COC(=O)CCCCOCCCF 34a_100000059025_100011934791 [0,1,0,0,0,0|1,0,2]=4 1731 B12R0.248 COC(=O)CCCCOCCCF 34a_100000759539_100000204269 [0,1,0,0,0,0|1,0,2]=4 1732 B12R0.248 COC(=O)CCCCOCCCF 7a_100000059025_100011934791 [0,1,0,0,0,0|1,0,2]=4 1733 B12R0.248 COC(=O)CCCCOCCCN 34a_100000182051_100000204269 [0,1,0,0,0,0|1,0,2]=4 1734 B12R0.248 COC(=O)CCCCOCCCO 34a_100000059025_100000230001 [0,1,0,0,0,0|1,0,2]=4 1735 B12R0.248 COC(=O)CCCCOCCCO 7a_100000059025_100011215043 [0,1,0,0,0,0|1,0,2]=4 1736 B12R0.248 COC(=O)CCCCOCCSC 34a_100000059025_100000212216 [0,1,0,0,0,0|1,0,2]=4 1737 B12R0.248 COC(=O)CCCCOCCSC 34a_100000230434_100000204269 [0,1,0,0,0,0|1,0,2]=4 1738 B12R0.248 COC(=O)CCCCOCCSC 7a_100000059025_100000212216 [0,1,0,0,0,0|1,0,2]=4 1739 B12R0.248 COC(=O)CCCCOCCSC 7a_100000230434_100000204269 [0,1,0,0,0,0|1,0,2]=4 1740 B12R0.248 COC(=O)CCCCSCCCF 62a_100000204269_100011934791 [0,1,0,0,0,0|1,0,2]=4 1741 B12R0.248 COC(=O)CCCCSCCCF 62a_100011934791_100000204269 [0,1,0,0,0,0|1,0,2]=4 1742 B12R0.248 COC(=O)CCCCSCCCO 62a_100000204269_100011215043 [0,1,0,0,0,0|1,0,2]=4 1743 B12R0.248 COC(=O)CCCCSCCCO 62a_100011215043_100000204269 [0,1,0,0,0,0|1,0,2]=4 1744 B12R0.248 COC(=O)CCCCSCCSC 62a_100000204269_100000751147 [0,1,0,0,0,0|1,0,2]=4 1745 B12R0.248 COC(=O)CCCCSCCSC 62a_100000212216_100000204269 [0,1,0,0,0,0|1,0,2]=4 1746 B12R0.248 COC(=O)CCCNCCCCO 2230a_100000750430_100011218270 [0,1,0,0,0,0|1,0,2]=4 1747 B12R0.248 COC(=O)CCCNCCCCO 34a_100000750430_100000742333 [0,1,0,0,0,0|1,0,2]=4 1748 B12R0.248 COC(=O)CCCNCCCSC 2230a_100000749238_100011218270 [0,1,0,0,0,0|1,0,2]=4 1749 B12R0.248 COC(=O)CCCOCCCCBr 34a_100011216708_100000742333 [0,1,0,0,0,0|1,0,2]=4 1750 B12R0.248 COC(=O)CCCOCCCCCl 34a_100000210776_100000742333 [0,1,0,0,0,0|1,0,2]=4 1751 B12R0.248 COC(=O)CCCOCCCCCl 7a_100000210776_100011218270 [0,1,0,0,0,0|1,0,2]=4 1752 B12R0.248 COC(=O)CCCOCCCCF 34a_100011995726_100000742333 [0,1,0,0,0,0|1,0,2]=4 1753 B12R0.248 COC(=O)CCCOCCCCF 7a_100011995726_100011218270 [0,1,0,0,0,0|1,0,2]=4 1754 B12R0.248 COC(=O)CCCOCCCCI 34a_200012148704_100000742333 [0,1,0,0,0,0|1,0,2]=4 1755 B12R0.248 COC(=O)CCCOCCCCN 34a_100000750430_100000742333 [0,1,0,0,0,0|1,0,2]=4 1756 B12R0.248 COC(=O)CCCOCCCSC 34a_100000690336_100000742333 [0,1,0,0,0,0|1,0,2]=4 1757 B12R0.248 COC(=O)CCCOCCCSC 7a_100000690336_100011218270 [0,1,0,0,0,0|1,0,2]=4 1758 B12R0.248 COC(=O)CCCSCCCCF 62a_100000729493_100011218270 [0,1,0,0,0,0|1,0,2]=4 1759 B12R0.248 COC(=O)CCCSCCCCF 62a_100011218270_100000729493 [0,1,0,0,0,0|1,0,2]=4 1760 B12R0.248 COC(=O)CCCSCCCCO 62a_100000210776_100011218270 [0,1,0,0,0,0|1,0,2]=4 1761 B12R0.248 COC(=O)CCCSCCCCO 62a_100011218270_100000210776 [0,1,0,0,0,0|1,0,2]=4 1762 B12R0.248 COC(=O)CCNCCCCCO 2230a_100000762737_100000204255 [0,1,0,0,0,0|1,0,2]=4 1763 B12R0.248 COC(=O)CCNCCCCCO 34a_100000762737_100000742370 [0,1,0,0,0,0|1,0,2]=4 1764 B12R0.248 COC(=O)CCOCCCCCBr 34a_100000746331_100000742370 [0,1,0,0,0,0|1,0,2]=4 1765 B12R0.248 COC(=O)CCOCCCCCBr 7a_100000746331_100000204255 [0,1,0,0,0,0|1,0,2]=4 1766 B12R0.248 COC(=O)CCOCCCCCCl 34a_100000746330_100000742370 [0,1,0,0,0,0|1,0,2]=4 1767 B12R0.248 COC(=O)CCOCCCCCCl 7a_100000746330_100000204255 [0,1,0,0,0,0|1,0,2]=4 1768 B12R0.248 COC(=O)CCOCCCCCI 34a_200012148887_100000742370 [0,1,0,0,0,0|1,0,2]=4 1769 B12R0.248 COC(=O)CCOCCCCCI 7a_200012148887_100000204255 [0,1,0,0,0,0|1,0,2]=4 1770 B12R0.248 COC(=O)CCOCCCCCN 34a_100000762737_100000742370 [0,1,0,0,0,0|1,0,2]=4 1771 B12R0.248 COC(=O)CCOCCCCSC 34a_100011217163_100000742370 [0,1,0,0,0,0|1,0,2]=4 1772 B12R0.248 COC(=O)CCOCCCCSC 7a_100011217163_100000204255 [0,1,0,0,0,0|1,0,2]=4 1773 B12R0.248 COC(=O)CCSCCCCCF 62a_100000204255_100000729378 [0,1,0,0,0,0|1,0,2]=4 1774 B12R0.248 COC(=O)CCSCCCCCF 62a_100000729378_100000204255 [0,1,0,0,0,0|1,0,2]=4 1775 B12R0.248 COC(=O)CCSCCCCCO 62a_100000204255_100000746330 [0,1,0,0,0,0|1,0,2]=4 1776 B12R0.248 COC(=O)CCSCCCCCO 62a_100000746330_100000204255 [0,1,0,0,0,0|1,0,2]=4 1777 B12R0.248 COC(=O)CNCCCCCCO 2230a_100000686447_100000747449 [0,1,0,0,0,0|1,0,1]=3 1778 B12R0.248 COC(=O)CNCCCCCCO 34a_100000686447_100000747449 [0,1,0,0,0,0|1,0,1]=3 1779 B12R0.248 COC(=O)COCCCCCCBr 34a_100011215345_100000747449 [0,1,0,0,0,0|1,0,1]=3 1780 B12R0.248 COC(=O)COCCCCCCBr 7a_100011215345_100000747449 [0,1,0,0,0,0|1,0,1]=3 1781 B12R0.248 COC(=O)COCCCCCCCl 34a_100000766143_100000747449 [0,1,0,0,0,0|1,0,1]=3 1782 B12R0.248 COC(=O)COCCCCCCCl 7a_100000766143_100000747449 [0,1,0,0,0,0|1,0,1]=3 1783 B12R0.248 COC(=O)COCCCCCCF 34a_100000732779_100000747449 [0,1,0,0,0,0|1,0,1]=3 1784 B12R0.248 COC(=O)COCCCCCCF 7a_100000732779_100000747449 [0,1,0,0,0,0|1,0,1]=3 1785 B12R0.248 COC(=O)COCCCCCCN 34a_100000686447_100000747449 [0,1,0,0,0,0|1,0,1]=3 1786 B12R0.248 COC(=O)COCCNCCCF 2230a_100015189416_100000090808 [0,1,0,0,0,0|2,0,1]=4 1787 B12R0.248 COC(=O)COCCNCCCF 34a_100015189416_100000090808 [0,1,0,0,0,0|2,0,1]=4 1788 B12R0.248 COC(=O)COCCNCCSC 2230a_100020590264_100000090808 [0,1,0,0,0,0|2,0,1]=4 1789 B12R0.248 COC(=O)COCCOCCCBr 34a_100011217188_100000090808 [0,1,0,0,0,0|2,0,1]=4 1790 B12R0.248 COC(=O)COCCOCCCCl 34a_100000230001_100000090808 [0,1,0,0,0,0|2,0,1]=4 1791 B12R0.248 COC(=O)COCCOCCCF 34a_100000759539_100000090808 [0,1,0,0,0,0|2,0,1]=4 1792 B12R0.248 COC(=O)COCCOCCCN 34a_100000182051_100000090808 [0,1,0,0,0,0|2,0,1]=4 1793 B12R0.248 COC(=O)COCCOCCO[13CH3] 34a_100011023656_200025704644 [0,1,0,0,0,0|2,0,1]=4 1794 B12R0.248 COC(=O)COCCOCCO[13CH3] 7a_100011023656_200025704644 [0,1,0,0,0,0|2,0,1]=4 1795 B12R0.248 COC(=O)COCCOCCSC 34a_100000230434_100000090808 [0,1,0,0,0,0|2,0,1]=4 1796 B12R0.248 COC(=O)COCCOCCSC 7a_100000230434_100000090808 [0,1,0,0,0,0|2,0,1]=4 1797 B12R0.248 COC(=O)COCCSCCCF 62a_100000090808_100011934791 [0,1,0,0,0,0|2,0,1]=4 1798 B12R0.248 COC(=O)COCCSCCCF 62a_100011934791_100000090808 [0,1,0,0,0,0|2,0,1]=4 1799 B12R0.248 COC(=O)COCCSCCCO 62a_100000090808_100011215043 [0,1,0,0,0,0|2,0,1]=4 1800 B12R0.248 COC(=O)COCCSCCCO 62a_100011215043_100000090808 [0,1,0,0,0,0|2,0,1]=4 1801 B12R0.248 COC(=O)COCCSCCSC 62a_100000090808_100000751147 [0,1,0,0,0,0|2,0,1]=4 1802 B12R0.248 COC(=O)COCCSCCSC 62a_100000212216_100000090808 [0,1,0,0,0,0|2,0,1]=4 1803 B12R0.248 COC(=O)CSCCCCCC#N 62a_100000747449_100009813376 [0,1,0,0,0,0|1,0,2]=4 1804 B12R0.248 COC(=O)CSCCCCCC#N 62a_100009813376_100000747449 [0,1,0,0,0,0|1,0,2]=4 1805 B12R0.248 COC(=O)CSCCCCCC=O 62a_100000139337_100000747449 [0,1,0,0,0,0|1,0,2]=4 1806 B12R0.248 COC(=O)CSCCCCCC=O 62a_100000747449_100000139337 [0,1,0,0,0,0|1,0,2]=4 1807 B12R0.248 COC(=O)CSCCCCCCF 62a_100000747449_100015922095 [0,1,0,0,0,0|1,0,1]=3 1808 B12R0.248 COC(=O)CSCCCCCCF 62a_100015922095_100000747449 [0,1,0,0,0,0|1,0,1]=3 1809 B12R0.248 COC(=O)CSCCCCCCO 62a_100000747449_100000766143 [0,1,0,0,0,0|1,0,1]=3 1810 B12R0.248 COC(=O)CSCCCCCCO 62a_100000766143_100000747449 [0,1,0,0,0,0|1,0,1]=3 1811 B12R0.248 COC(=O)NCCOCCCCF 34a_100000757965_100000729493 [0,1,0,0,0,0|2,0,1]=4 1812 B12R0.248 COC(=O)NCCOCCCCO 34a_100000757965_100011216708 [0,1,0,0,0,0|2,0,1]=4 1813 B12R0.248 COC(=O)OCCOCCCCF 34a_100010262106_100000729493 [0,1,0,0,0,0|2,0,1]=4 1814 B12R0.248 COC(=O)OCCOCCCCO 34a_100010262106_100011216708 [0,1,0,0,0,0|2,0,1]=4 1815 B12R0.248 COC(=O)OCSCCCCCF 62a_100000729378_100000139417 [0,1,0,0,0,0|2,0,1]=4 1816 B12R0.248 COC(=O)OCSCCCCCO 62a_100000746330_100000139417 [0,1,0,0,0,0|2,0,1]=4 1817 B12R0.248 COCCCCCCCC(=O)OC 34a_100011022521_200000210301 [0,1,0,0,0,0|0,0,2]=3 1818 B12R0.248 COCCCCCCCC(=O)OC 34a_100138415774_100010004213 [0,1,0,0,0,0|0,0,2]=3 1819 B12R0.248 COCCCCCCCC(=O)OC 7a_100011022521_200000210301 [0,1,0,0,0,0|0,0,2]=3 1820 B12R0.248 COCCCCCNCC(=O)OC 2230a_100000747528_100000747449 [0,1,0,0,0,0|1,0,1]=3 1821 B12R0.248 COCCCCCNCC(=O)OC 34a_100000747528_100000747449 [0,1,0,0,0,0|1,0,1]=3 1822 B12R0.248 COCCCCOCCC(=O)OC 34a_100000740925_100000742370 [0,1,0,0,0,0|1,0,2]=4 1823 B12R0.248 COCCCCSCCC(=O)OC 62a_100000204255_100000730899 [0,1,0,0,0,0|1,0,2]=4 1824 B12R0.248 COCCCCSCCC(=O)OC 62a_100000730899_100000204255 [0,1,0,0,0,0|1,0,2]=4 1825 B12R0.248 COCCCCSCOC(=O)OC 62a_100000730899_100000139417 [0,1,0,0,0,0|2,0,1]=4 1826 B12R0.248 COCCCNC/C=C/C(=O)OC 34a_100150723488_100000742655 [0,1,0,0,0,0|1,0,2]=4 1827 B12R0.248 COCCCNCCCC(=O)OC 34a_100150723488_100000742333 [0,1,0,0,0,0|1,0,2]=4 1828 B12R0.248 COCCCOC/C=C/C(=O)OC 34a_100000740835_100000742655 [0,1,0,0,0,0|1,0,2]=4 1829 B12R0.248 COCCCOCCCC(=O)OC 34a_100000740835_100000742333 [0,1,0,0,0,0|1,0,2]=4 1830 B12R0.248 COCCCOCCNC(=O)OC 34a_100000757965_100000740836 [0,1,0,0,0,0|2,0,1]=4 1831 B12R0.248 COCCCOCCOC(=O)OC 34a_100010262106_100000740836 [0,1,0,0,0,0|2,0,1]=4 1832 B12R0.248 COCCCSC/C=C/C(=O)OC 62a_100000709357_100000742655 [0,1,0,0,0,0|1,0,2]=4 1833 B12R0.248 COCCCSC/C=C/C(=O)OC 62a_100000742655_100000709357 [0,1,0,0,0,0|1,0,2]=4 1834 B12R0.248 COCCCSCCCC(=O)OC 62a_100000709357_100011218270 [0,1,0,0,0,0|1,0,2]=4 1835 B12R0.248 COCCCSCCCC(=O)OC 62a_100011218270_100000709357 [0,1,0,0,0,0|1,0,2]=4 1836 B12R0.248 COCCNCCCCC(=O)OC 2230a_100000209980_100000204269 [0,1,0,0,0,0|1,0,2]=4 1837 B12R0.248 COCCNCCOCC(=O)OC 2230a_100000209980_100000090808 [0,1,0,0,0,0|2,0,1]=4 1838 B12R0.248 COCCOCCCCC(=O)OC 34a_100000059025_100011201679 [0,1,0,0,0,0|1,0,2]=4 1839 B12R0.248 COCCOCCCCC(=O)OC 34a_100000210237_100000204269 [0,1,0,0,0,0|1,0,2]=4 1840 B12R0.248 COCCOCCCCC(=O)OC 7a_100000059025_100000233755 [0,1,0,0,0,0|1,0,2]=4 1841 B12R0.248 COCCOCCNCC(=O)OC 2230a_100000745349_100000747449 [0,1,0,0,0,0|2,0,1]=4 1842 B12R0.248 COCCOCCNCC(=O)OC 34a_100000745349_100000747449 [0,1,0,0,0,0|2,0,1]=4 1843 B12R0.248 COCCOCCOCC(=O)OC 34a_100000210237_100000090808 [0,1,0,0,0,0|2,0,1]=4 1844 B12R0.248 COCCOCCOCC(=O)OC 34a_100011023656_200000210301 [0,1,0,0,0,0|2,0,1]=4 1845 B12R0.248 COCCOCCOCC(=O)OC 34a_100011215163_100000747449 [0,1,0,0,0,0|2,0,1]=4 1846 B12R0.248 COCCOCCOCC(=O)OC 7a_100011023656_200000210301 [0,1,0,0,0,0|2,0,1]=4 1847 B12R0.248 COCCOCCOCC(=O)OC 7a_100011215163_100000747449 [0,1,0,0,0,0|2,0,1]=4 1848 B12R0.248 COCCOCCSCC(=O)OC 62a_100000695917_100000747449 [0,1,0,0,0,0|2,0,1]=4 1849 B12R0.248 COCCOCCSCC(=O)OC 62a_100000747449_100000695917 [0,1,0,0,0,0|2,0,1]=4 1850 B12R0.248 COCCSCCCCC(=O)OC 62a_100000204269_100000233755 [0,1,0,0,0,0|1,0,2]=4 1851 B12R0.248 COCCSCCCCC(=O)OC 62a_100000233755_100000204269 [0,1,0,0,0,0|1,0,2]=4 1852 B12R0.248 COCCSCCOCC(=O)OC 62a_100000090808_100000233755 [0,1,0,0,0,0|2,0,1]=4 1853 B12R0.248 COCCSCCOCC(=O)OC 62a_100000233755_100000090808 [0,1,0,0,0,0|2,0,1]=4 1854 B12R0.248 COCSCCCCCC(=O)OC 62a_100000766300_100009816466 [0,1,0,0,0,0|1,0,2]=4 1855 B12R0.248 COCSCCCCCC(=O)OC 62a_100009816466_100000766300 [0,1,0,0,0,0|1,0,2]=4 1856 B12R0.251 C=C(C)C(=O)CC#CCCCCC 1458a_100000185857_100009816472 [0,1,0,0,0,0|1,0,2]=4 1857 B12R0.251 C=C(C)C(=O)CCCCCCCC 1458a_100000185857_100000210759 [0,1,0,0,0,0|1,0,2]=4 1858 B12R0.251 C=C(C)C(=O)NCCCCCCC 11a_100000229938_100000185857 [0,1,0,0,0,0|2,0,1]=4 1859 B12R0.251 C=C(C)C(=O)NCCCCCCC 1626a_100000229938_100000185857 [0,1,0,0,0,0|2,0,1]=4 1860 B12R0.251 CCCCCC#CCC(=O)C(C)C 1458a_100000210198_100009816472 [0,1,0,0,0,0|1,0,2]=4 1861 B12R0.251 CCCCCC#CCC(=O)C(C)F 1458a_100000062450_100009816472 [0,1,0,0,0,0|1,0,2]=4 1862 B12R0.251 CCCCCC#CCC(=O)[C@@H](C)O 1458a_100000717761_100009816472 [0,1,0,0,0,0|1,0,2]=4 1863 B12R0.251 CCCCCC#CCC(=O)[C@H](C)O 1458a_217856618621_100009816472 [0,1,0,0,0,0|1,0,2]=4 1864 B12R0.251 CCCCCCC=CC(=O)C(C)C 1458a_200015324643_100000210206 [0,1,0,0,0,0|1,0,2]=4 1865 B12R0.251 CCCCCCC=CC(=O)N(C)C 11a_100102631434_200015324643 [0,1,0,0,0,0|1,0,2]=4 1866 B12R0.251 CCCCCCC=CC(=O)N(C)C 1626a_100102631434_200015324643 [0,1,0,0,0,0|1,0,2]=4 1867 B12R0.251 CCCCCCC=CC(=O)N(C)C 240690a_100102631434_200015324643 [0,1,0,0,0,0|1,0,2]=4 1868 B12R0.251 CCCCCCCCC(=O)C(C)C 1458a_100000210188_100000210206 [0,1,0,0,0,0|1,0,2]=4 1869 B12R0.251 CCCCCCCCC(=O)C(C)C 1458a_100000210198_100000210759 [0,1,0,0,0,0|1,0,2]=4 1870 B12R0.251 CCCCCCCCC(=O)C(C)F 1458a_100000062450_100000210759 [0,1,0,0,0,0|1,0,2]=4 1871 B12R0.251 CCCCCCCCC(=O)N(C)C 11a_100102631434_100000210188 [0,1,0,0,0,0|1,0,2]=4 1872 B12R0.251 CCCCCCCCC(=O)N(C)C 1626a_100102631434_100000210188 [0,1,0,0,0,0|1,0,2]=4 1873 B12R0.251 CCCCCCCCC(=O)N(C)C 240690a_100102631434_100000210188 [0,1,0,0,0,0|1,0,2]=4 1874 B12R0.251 CCCCCCCCC(=O)N(C)C 527a_100102631434_100000210188 [0,1,0,0,0,0|1,0,2]=4 1875 B12R0.251 CCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210759 [0,1,0,0,0,0|1,0,2]=4 1876 B12R0.251 CCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210759 [0,1,0,0,0,0|1,0,2]=4 1877 B12R0.251 CCCCCCCNC(=O)C(C)C 11a_100000229938_100000210198 [0,1,0,0,0,0|2,0,1]=4 1878 B12R0.251 CCCCCCCNC(=O)C(C)C 1626a_100000229938_100000210198 [0,1,0,0,0,0|2,0,1]=4 1879 B12R0.251 CCCCCCCNC(=O)C(C)C 240690a_100000229938_100000210198 [0,1,0,0,0,0|2,0,1]=4 1880 B12R0.251 CCCCCCCNC(=O)C(C)C 527a_100000229938_100000210198 [0,1,0,0,0,0|2,0,1]=4 1881 B12R0.251 CCCCCCCNC(=O)C(C)F 11a_100000229938_100000062450 [0,1,0,0,0,0|2,0,1]=4 1882 B12R0.251 CCCCCCCNC(=O)C(C)F 1626a_100000229938_100000062450 [0,1,0,0,0,0|2,0,1]=4 1883 B12R0.251 CCCCCCCNC(=O)C(C)F 240690a_100000229938_100000062450 [0,1,0,0,0,0|2,0,1]=4 1884 B12R0.251 CCCCCCCNC(=O)C(C)F 527a_100000229938_100000062450 [0,1,0,0,0,0|2,0,1]=4 1885 B12R0.251 CCCCCCCNC(=O)N(C)C 2708a_100000229938_100102631434 [0,1,0,0,0,0|2,0,1]=4 1886 B12R0.251 CCCCCCCNC(=O)[C@@H](C)O 240690a_100000229938_100000717761 [0,1,0,0,0,0|2,0,1]=4 1887 B12R0.251 CCCCCCCNC(=O)[C@H](C)O 1626a_100000229938_217856618621 [0,1,0,0,0,0|2,0,1]=4 1888 B12R0.251 CCCCCCCNC(=O)[C@H](C)O 240690a_100000229938_217856618621 [0,1,0,0,0,0|2,0,1]=4 1889 B12R0.251 CCCCCCNCC(=O)C(C)C 2230a_100000210581_100000753385 [0,1,0,0,0,0|2,0,1]=4 1890 B12R0.251 CCCCCCNCC(=O)N(C)C 2230a_100000210581_100000185267 [0,1,0,0,0,0|2,0,1]=4 1891 B12R0.251 CCCCCCNCC(=O)N(C)C 2230a_100015183351_100000210314 [0,1,0,0,0,0|2,0,1]=4 1892 B12R0.251 CCCCCCOCC(=O)C(=O)C 34a_100000210259_100011261029 [0,1,0,0,0,0|2,0,1]=4 1893 B12R0.251 CCCCCCOCC(=O)C(C)C 34a_100000210259_100000753385 [0,1,0,0,0,0|2,0,1]=4 1894 B12R0.251 CCCCCCOCC(=O)C(C)C 7a_100000210259_100000753385 [0,1,0,0,0,0|2,0,1]=4 1895 B12R0.251 CCCCCCOCC(=O)N(C)C 34a_100000210259_100000692301 [0,1,0,0,0,0|2,0,1]=4 1896 B12R0.251 CCCCCCOCC(=O)N(C)C 7a_100000210259_100000692301 [0,1,0,0,0,0|2,0,1]=4 1897 B12R0.251 CCCCCCSCC(=O)C(=O)C 62a_100000210314_100011261029 [0,1,0,0,0,0|2,0,1]=4 1898 B12R0.251 CCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210757 [0,1,0,0,0,0|2,0,1]=4 1899 B12R0.251 CCCCCCSCC(=O)C(C)C 62a_100000210314_100000753385 [0,1,0,0,0,0|2,0,1]=4 1900 B12R0.251 CCCCCCSCC(=O)C(C)C 62a_100000753385_100000210757 [0,1,0,0,0,0|2,0,1]=4 1901 B12R0.251 CCCCCCSCC(=O)N(C)C 62a_100000210314_100000692301 [0,1,0,0,0,0|2,0,1]=4 1902 B12R0.251 CCCCCCSCC(=O)N(C)C 62a_100000692301_100000210757 [0,1,0,0,0,0|2,0,1]=4 1903 B12R0.276 CCCC(=O)CCCCC(=O)OC 1458a_100000211992_100000204269 [0,1,0,0,0,0|0,0,3]=4 1904 B12R0.276 CCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210303 [0,1,0,0,0,0|0,0,3]=4 1905 B12R0.276 CCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210303 [0,1,0,0,0,0|1,0,2]=4 1906 B12R0.276 CCCC(=O)CCOCC(=O)OC 1458a_100000211992_100000090808 [0,1,0,0,0,0|1,0,2]=4 1907 B12R0.276 CCCC(C)CCOCC(=O)CC 7a_100011217855_100000747405 [0,1,0,0,0,0|2,0,1]=4 1908 B12R0.276 CCCC(C)CCOCC(=O)NC 34a_100011217855_100000183359 [0,1,0,0,0,0|2,0,1]=4 1909 B12R0.276 CCCC(C)CCOCC(=O)NC 7a_100011217855_100000183359 [0,1,0,0,0,0|2,0,1]=4 1910 B12R0.276 CCCC(C)CCOCC(=O)OC 34a_100011217855_100000747449 [0,1,0,0,0,0|1,0,1]=3 1911 B12R0.276 CCCC(C)CCOCC(=O)OC 7a_100011217855_100000747449 [0,1,0,0,0,0|1,0,1]=3 1912 B12R0.276 CCCC(C)COCCC(=O)OC 34a_100000688023_100000742370 [0,1,0,0,0,0|1,0,2]=4 1913 B12R0.276 CCCC(C)COCCC(=O)OC 7a_100000688023_100000204255 [0,1,0,0,0,0|1,0,2]=4 1914 B12R0.276 CCCC(C)CSCCC(=O)OC 62a_100000204255_100011216630 [0,1,0,0,0,0|1,0,2]=4 1915 B12R0.276 CCCC(C)CSCCC(=O)OC 62a_100011216630_100000204255 [0,1,0,0,0,0|1,0,2]=4 1916 B12R0.276 CCCC(C)CSCOC(=O)OC 62a_100011216630_100000139417 [0,1,0,0,0,0|2,0,1]=4 1917 B12R0.276 CCCC(C)NC/C=C/C(=O)OC 2230a_100000741246_100000742655 [0,1,0,0,0,0|1,0,2]=4 1918 B12R0.276 CCCC(C)NCCCC(=O)OC 2230a_100000741246_100011218270 [0,1,0,0,0,0|1,0,2]=4 1919 B12R0.276 CCCC(C)OC/C=C/C(=O)OC 34a_100000764384_100000742655 [0,1,0,0,0,0|1,0,2]=4 1920 B12R0.276 CCCC(C)OC/C=C/C(=O)OC 7a_100000764384_100000742655 [0,1,0,0,0,0|1,0,2]=4 1921 B12R0.276 CCCC(C)OCCCC(=O)OC 34a_100000764384_100000742333 [0,1,0,0,0,0|1,0,2]=4 1922 B12R0.276 CCCC(C)OCCCC(=O)OC 7a_100000764384_100011218270 [0,1,0,0,0,0|1,0,2]=4 1923 B12R0.276 CCCC(C)OCCNC(=O)OC 34a_100000757965_100000766640 [0,1,0,0,0,0|2,0,1]=4 1924 B12R0.276 CCCC(C)OCCOC(=O)OC 34a_100010262106_100000766640 [0,1,0,0,0,0|2,0,1]=4 1925 B12R0.276 CCCC(C)SC/C=C/C(=O)OC 62a_100000742655_100000766640 [0,1,0,0,0,0|1,0,2]=4 1926 B12R0.276 CCCC(C)SC/C=C/C(=O)OC 62a_100000766640_100000742655 [0,1,0,0,0,0|1,0,2]=4 1927 B12R0.276 CCCC(C)SCCCC(=O)OC 62a_100000766640_100011218270 [0,1,0,0,0,0|1,0,2]=4 1928 B12R0.276 CCCC(C)SCCCC(=O)OC 62a_100011218270_100000766640 [0,1,0,0,0,0|1,0,2]=4 1929 B12R0.276 CCCN(C)CCCCC(=O)OC 2230a_100000747261_100000204269 [0,1,0,0,0,0|1,0,2]=4 1930 B12R0.276 CCCN(C)CCCCC(=O)OC 269982a_100000747261_100000204269 [0,1,0,0,0,0|1,0,2]=4 1931 B12R0.276 CCCN(C)CCOCC(=O)OC 2230a_100000747261_100000090808 [0,1,0,0,0,0|2,0,1]=4 1932 B12R0.276 CCC[C@H](N)CCOCC(=O)NC 34a_100015193777_100000183359 [0,1,0,0,0,0|2,0,1]=4 1933 B12R0.276 CCC[C@H](N)CCOCC(=O)OC 34a_100015193777_100000747449 [0,1,0,0,0,0|1,0,1]=3 1934 B12R0.276 CCC[C@H](N)COCCC(=O)OC 34a_100000732646_100000742370 [0,1,0,0,0,0|1,0,2]=4 1935 B12R1.7 CCCCCCN1CNC(=O)C1 2230a_200000708111_100000210314 [0,0,0,1,0,0|2,0,1]=4 1936 B12R1.7 CCCCCOC1COC(=O)O1 34a_100000210253_100000032252 [0,0,0,1,0,0|2,0,1]=4 1937 B12R1.7 CCCCCSC1COC(=O)O1 62a_100000210326_100000032252 [0,0,0,1,0,0|2,0,1]=4 1938 B12R1.7 CCCCNC[C@H]1COC(=O)N1 2230a_100000102301_100015307671 [0,0,0,1,0,0|2,0,1]=4 1939 B12R1.7 CCCCNC[C@H]1COC(=O)N1 7a_106832991798_100015307671 [0,0,0,1,0,0|2,0,1]=4 1940 B12R1.7 CCCCOCC1=CC(=O)OC1 34a_100000210227_100000716558 [0,0,0,1,0,0|1,0,2]=4 1941 B12R1.7 CCCCOCC1COC(=O)O1 34a_100000210227_100000073702 [0,0,0,1,0,0|2,0,1]=4 1942 B12R1.7 CCCCOC[C@H]1COC(=O)N1 34a_100000210227_100015307671 [0,0,0,1,0,0|2,0,1]=4 1943 B12R1.7 CCCCOC[C@H]1COC(=O)N1 7a_100000210227_100015307671 [0,0,0,1,0,0|2,0,1]=4 1944 B12R1.7 CCCCSCC1=CC(=O)OC1 62a_100000210211_100000716558 [0,0,0,1,0,0|1,0,2]=4 1945 B12R1.7 CCCCSCC1=CC(=O)OC1 62a_100000716558_100000210210 [0,0,0,1,0,0|1,0,2]=4 1946 B12R1.7 CCCCSCC1COC(=O)O1 62a_100000073702_100000210210 [0,0,0,1,0,0|2,0,1]=4 1947 B12R1.7 CCCCSCC1COC(=O)O1 62a_100000210211_100000073702 [0,0,0,1,0,0|2,0,1]=4 1948 B12R1.7 CCCCSC[C@H]1COC(=O)N1 62a_100000210211_100015307671 [0,0,0,1,0,0|2,0,1]=4 1949 B12R1.7 CCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210210 [0,0,0,1,0,0|2,0,1]=4 1950 B12R1.27 CCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210202 [0,0,0,1,0,0|1,0,2]=4 1951 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000210414_100011273959 [0,0,0,1,0,0|1,0,2]=4 1952 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000211375_100000210202 [0,0,0,1,0,0|1,0,2]=4 1953 B12R1.27 CCC(=O)COC1CCCCC1 1458a_100000210414_100011935260 [0,0,0,1,0,0|2,0,1]=4 1954 B12R1.27 CCC(=O)COC1CCCCC1 1458a_100011223303_100000210202 [0,0,0,1,0,0|2,0,1]=4 1955 B12R1.27 CCC(=O)COC1CCCCC1 34a_100000725409_100000210327 [0,0,0,1,0,0|2,0,1]=4 1956 B12R1.27 CCC(=O)COC1CCCCC1 7a_100000210231_100000747405 [0,0,0,1,0,0|2,0,1]=4 1957 B12R1.27 CCC(=O)CSC1CCCCC1 62a_100000210327_100000747405 [0,0,0,1,0,0|2,0,1]=4 1958 B12R1.27 CCC(=O)CSC1CCCCC1 62a_100000747405_100000210327 [0,0,0,1,0,0|2,0,1]=4 1959 B12R1.27 CCC(=O)NCC1CCCCC1 11a_100000210473_100000210414 [0,0,0,1,0,0|2,0,1]=4 1960 B12R1.27 CCC(=O)NCC1CCCCC1 1626a_100000210473_100000210414 [0,0,0,1,0,0|2,0,1]=4 1961 B12R1.27 CCC(=O)NCC1CCCCC1 240690a_100000210473_100000210414 [0,0,0,1,0,0|2,0,1]=4 1962 B12R1.27 CCC(=O)NCC1CCCCC1 527a_100000210473_100000210414 [0,0,0,1,0,0|2,0,1]=4 1963 B12R1.27 CCC(=O)NNC1CCCCC1 22a_100000709804_100000210414 [0,0,0,1,0,0|3,0,0]=4 1964 B12R1.27 CNC(=O)C=CC1CCCCC1 11a_106832991635_100102566626 [0,0,0,1,0,0|1,0,2]=4 1965 B12R1.27 CNC(=O)C=CC1CCCCC1 1626a_100102657272_100102566626 [0,0,0,1,0,0|1,0,2]=4 1966 B12R1.27 CNC(=O)C=CC1CCCCC1 240690a_100102657272_100102566626 [0,0,0,1,0,0|1,0,2]=4 1967 B12R1.27 CNC(=O)CCC1CCCCC1 11a_106832991635_100000211375 [0,0,0,1,0,0|1,0,2]=4 1968 B12R1.27 CNC(=O)CCC1CCCCC1 1626a_100102657272_100000211375 [0,0,0,1,0,0|1,0,2]=4 1969 B12R1.27 CNC(=O)CCC1CCCCC1 240690a_100102657272_100000211375 [0,0,0,1,0,0|1,0,2]=4 1970 B12R1.27 CNC(=O)CCC1CCCCC1 527a_100102657272_100000211375 [0,0,0,1,0,0|1,0,2]=4 1971 B12R1.27 CNC(=O)CNC1CCCCC1 2230a_100000182618_100000183359 [0,0,0,1,0,0|2,0,1]=4 1972 B12R1.27 CNC(=O)CNC1CCCCC1 270004a_100000693194_100000210434 [0,0,0,1,0,0|2,0,1]=4 1973 B12R1.27 CNC(=O)CNC1CCCCC1 34a_100000182618_100000183359 [0,0,0,1,0,0|2,0,1]=4 1974 B12R1.27 CNC(=O)COC1CCCCC1 11a_106832991635_100011223303 [0,0,0,1,0,0|2,0,1]=4 1975 B12R1.27 CNC(=O)COC1CCCCC1 1626a_100102657272_100011223303 [0,0,0,1,0,0|2,0,1]=4 1976 B12R1.27 CNC(=O)COC1CCCCC1 240690a_100102657272_100011223303 [0,0,0,1,0,0|2,0,1]=4 1977 B12R1.27 CNC(=O)COC1CCCCC1 34a_100000210231_100000183359 [0,0,0,1,0,0|2,0,1]=4 1978 B12R1.27 CNC(=O)COC1CCCCC1 34a_100000750040_100000210327 [0,0,0,1,0,0|2,0,1]=4 1979 B12R1.27 CNC(=O)COC1CCCCC1 527a_100102657272_100011223303 [0,0,0,1,0,0|2,0,1]=4 1980 B12R1.27 CNC(=O)COC1CCCCC1 7a_100000210231_100000183359 [0,0,0,1,0,0|2,0,1]=4 1981 B12R1.27 CNC(=O)CSC1CCCCC1 62a_100000183359_100000210327 [0,0,0,1,0,0|2,0,1]=4 1982 B12R1.27 CNC(=O)CSC1CCCCC1 62a_100000210327_100000183359 [0,0,0,1,0,0|2,0,1]=4 1983 B12R1.27 CNC(=O)NCC1CCCCC1 2708a_100000210473_106832991635 [0,0,0,1,0,0|2,0,1]=4 1984 B12R1.27 CNC(=O)NCC1CCCCC1 2708a_100102657272_100000210473 [0,0,0,1,0,0|2,0,1]=4 1985 B12R1.27 CNC(=O)NCC1CCCCC1 273464a_100000210473_100102657272 [0,0,0,1,0,0|2,0,1]=4 1986 B12R1.27 CNC(=O)NCC1CCCCC1 273464a_100102657272_100000210473 [0,0,0,1,0,0|2,0,1]=4 1987 B12R1.27 CNC(=O)NCC1CCCCC1 512a_106832991638_100000210473 [0,0,0,1,0,0|2,0,1]=4 1988 B12R1.27 CNC(=O)NNC1CCCCC1 273464a_100102657272_100000709804 [0,0,0,1,0,0|3,0,0]=4 1989 B12R1.27 COC(=O)CNC1CCCCC1 2230a_100000182618_100000747449 [0,0,0,1,0,0|1,0,1]=3 1990 B12R1.27 COC(=O)CNC1CCCCC1 34a_100000182618_100000747449 [0,0,0,1,0,0|1,0,1]=3 1991 B12R1.27 COC(=O)CNC1CCCOC1 2230a_100000719290_100000747449 [0,0,0,1,0,0|2,0,1]=4 1992 B12R1.27 COC(=O)CNC1CCCOC1 34a_100000719290_100000747449 [0,0,0,1,0,0|2,0,1]=4 1993 B12R1.27 COC(=O)CNC1CCOCC1 2230a_100000741149_100000747449 [0,0,0,1,0,0|2,0,1]=4 1994 B12R1.27 COC(=O)CNC1CCOCC1 34a_100000741149_100000747449 [0,0,0,1,0,0|2,0,1]=4 1995 B12R1.27 COC(=O)CNC1CCSCC1 2230a_100000748639_100000747449 [0,0,0,1,0,0|2,0,1]=4 1996 B12R1.27 COC(=O)CNC1CCSCC1 34a_100000748639_100000747449 [0,0,0,1,0,0|2,0,1]=4 1997 B12R1.27 COC(=O)COC1CCCCC1 34a_100000210231_100000747449 [0,0,0,1,0,0|1,0,1]=3 1998 B12R1.27 COC(=O)COC1CCCCC1 7a_100000210231_100000747449 [0,0,0,1,0,0|1,0,1]=3 1999 B12R1.27 COC(=O)COC1CCCCO1 34a_100000033831_100000747449 [0,0,0,1,0,0|2,0,1]=4 2000 B12R1.27 COC(=O)COC1CCCOC1 34a_100000754041_100000747449 [0,0,0,1,0,0|2,0,1]=4 2001 B12R1.27 COC(=O)COC1CCCSC1 7a_100015962668_100000747449 [0,0,0,1,0,0|2,0,1]=4 2002 B12R1.27 COC(=O)COC1CCOCC1 34a_100000744328_100000747449 [0,0,0,1,0,0|2,0,1]=4 2003 B12R1.27 COC(=O)COC1CCSCC1 34a_100000731022_100000747449 [0,0,0,1,0,0|2,0,1]=4 2004 B12R1.27 COC(=O)COC1CCSCC1 7a_100000731022_100000747449 [0,0,0,1,0,0|2,0,1]=4 2005 B12R1.27 COC(=O)CSC1CCCCC1 62a_100000210327_100000747449 [0,0,0,1,0,0|1,0,1]=3 2006 B12R1.27 COC(=O)CSC1CCCCC1 62a_100000747449_100000210327 [0,0,0,1,0,0|1,0,1]=3 2007 B12R1.27 COC(=O)CSC1CCCOC1 62a_100000747449_100000693364 [0,0,0,1,0,0|2,0,1]=4 2008 B12R1.27 COC(=O)CSC1CCOCC1 62a_100000747449_100011324220 [0,0,0,1,0,0|2,0,1]=4 2009 B12R1.27 COC(=O)CSC1CCSCC1 62a_100000747449_100000069128 [0,0,0,1,0,0|2,0,1]=4 2010 B12R1.77 CCC(=O)N1CCCCC1CC 11a_100000210034_100000210414 [0,0,0,1,0,0|2,0,1]=4 2011 B12R1.77 CCC(=O)N1CCCCC1CC 1626a_100000210034_100000210414 [0,0,0,1,0,0|2,0,1]=4 2012 B12R1.77 CCC(=O)N1CCCCC1CC 240690a_100000210034_100000210414 [0,0,0,1,0,0|2,0,1]=4 2013 B12R1.77 CCC(=O)N1CCCCC1CC 527a_100000210034_100000210414 [0,0,0,1,0,0|2,0,1]=4 2014 B12R1.77 CCC1CCCCN1C(=O)NC 2708a_100102657272_100000210034 [0,0,0,1,0,0|2,0,1]=4 2015 B12R1.77 CCC1CCCCN1C(=O)NC 273464a_100102657272_100000210034 [0,0,0,1,0,0|2,0,1]=4 2016 B12R1.77 CCN1CCCCC1C(=O)OC 2230a_100000734855_100000210202 [0,0,0,1,0,0|1,0,2]=4 2017 B12R1.77 CCN1CCCCC1C(=O)OC 269982a_100000734855_100000204670 [0,0,0,1,0,0|1,0,2]=4 2018 B12R1.77 CCN1CCCCC1C(=O)OC 34a_100000734855_100000210202 [0,0,0,1,0,0|1,0,2]=4 2019 B12R1.77 COC(=O)[C@@H]1CCCC[C@@H]1OC 34a_100015709673_200000210301 [0,0,0,1,0,0|1,0,2]=4 2020 B12R1.77 COC(=O)[C@@H]1CCCC[C@@H]1OC 7a_100015709673_200000210301 [0,0,0,1,0,0|1,0,2]=4 2021 B12R1.77 COC(=O)[C@@H]1CCCC[C@@H]1O[13CH3] 34a_100015709673_200025704644 [0,0,0,1,0,0|1,0,2]=4 2022 B12R1.77 COC(=O)[C@@H]1CCCC[C@@H]1O[13CH3] 7a_100015709673_200025704644 [0,0,0,1,0,0|1,0,2]=4 2023 B12R1.82 CCC(=O)CN1CCCC1CC 269982a_100000754278_100000747405 [0,0,0,1,0,0|2,0,1]=4 2024 B12R1.82 CCC1CCCN1CC(=O)NC 2230a_100000754278_100000183359 [0,0,0,1,0,0|2,0,1]=4 2025 B12R1.82 CCC1CCCN1CC(=O)NC 269982a_100000754278_100000183359 [0,0,0,1,0,0|2,0,1]=4 2026 B12R1.82 CCC1CCCN1CC(=O)NC 34a_100000754278_100000183359 [0,0,0,1,0,0|2,0,1]=4 2027 B12R1.82 CCC1CCCN1CC(=O)OC 2230a_100000754278_100000747449 [0,0,0,1,0,0|1,0,1]=3 2028 B12R1.82 CCC1CCCN1CC(=O)OC 269982a_100000754278_100000747449 [0,0,0,1,0,0|1,0,1]=3 2029 B12R1.82 CCC1CCCN1CC(=O)OC 34a_100000754278_100000747449 [0,0,0,1,0,0|1,0,1]=3 2030 B12R1.82 CCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210202 [0,0,0,1,0,0|1,0,2]=4 2031 B12R1.82 CCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000204670 [0,0,0,1,0,0|1,0,2]=4 2032 B12R1.82 CCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210202 [0,0,0,1,0,0|1,0,2]=4 2033 B12R1.82 COC(=O)CN1CCC[C@@H]1CO 2230a_100000745186_100000747449 [0,0,0,1,0,0|2,0,1]=4 2034 B12R1.82 COC(=O)CN1CCC[C@@H]1CO 269982a_100000745186_100000747449 [0,0,0,1,0,0|2,0,1]=4 2035 B12R1.82 COC(=O)CN1CCC[C@@H]1CO 34a_100000745186_100000747449 [0,0,0,1,0,0|2,0,1]=4 2036 B12R1.163 COCC1CCN1CC(=O)OC 2230a_100015195929_100000747449 [0,0,0,1,0,0|2,0,1]=4 2037 B12R1.163 COCC1CCN1CC(=O)OC 269982a_100015195929_100000747449 [0,0,0,1,0,0|2,0,1]=4 2038 B12R1.163 COCC1CCN1CC(=O)OC 34a_100015195929_100000747449 [0,0,0,1,0,0|2,0,1]=4 2039 B12R1.291 CCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210303 [0,0,0,1,0,0|1,0,2]=4 2040 B12R1.291 CCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210303 [0,0,0,1,0,0|1,0,2]=4 2041 B12R1.291 CCCN1CCSC1C(=O)OC 2230a_100015296106_100000210303 [0,0,0,1,0,0|2,0,1]=4 2042 B12R1.291 CCCN1CCSC1C(=O)OC 269982a_100015296106_100000210303 [0,0,0,1,0,0|2,0,1]=4 2043 B12R1.291 CCOC1CCCC1C(=O)OC 34a_200000081814_100000210202 [0,0,0,1,0,0|1,0,2]=4 2044 B12R1.291 CCOC1CCCC1C(=O)OC 7a_200000081814_100000210202 [0,0,0,1,0,0|1,0,2]=4 2045 B12R1.327 CCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210211 [0,0,0,1,0,0|1,0,2]=4 2046 B12R1.327 CCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210211 [0,0,0,1,0,0|1,0,2]=4 2047 B12R1.353 CCC(=O)COC1CCCC1C 7a_100011216460_100000747405 [0,0,0,1,0,0|2,0,1]=4 2048 B12R1.353 CNC(=O)CNC1CCCC1C 269862a_100000693194_100000752053 [0,0,0,1,0,0|2,0,1]=4 2049 B12R1.353 CNC(=O)COC1CCCC1C 34a_100011216460_100000183359 [0,0,0,1,0,0|2,0,1]=4 2050 B12R1.353 CNC(=O)COC1CCCC1C 7a_100011216460_100000183359 [0,0,0,1,0,0|2,0,1]=4 2051 B12R1.353 COC(=O)CCN1CCC[C@@H]1C 2230a_100020605311_100000204255 [0,0,0,1,0,0|1,0,2]=4 2052 B12R1.353 COC(=O)CCN1CCC[C@@H]1C 269982a_100020605311_100000204255 [0,0,0,1,0,0|1,0,2]=4 2053 B12R1.353 COC(=O)CCN1CCC[C@H]1C 2230a_100015189458_100000204255 [0,0,0,1,0,0|1,0,2]=4 2054 B12R1.353 COC(=O)CCN1CCC[C@H]1C 269982a_100015189458_100000204255 [0,0,0,1,0,0|1,0,2]=4 2055 B12R1.353 COC(=O)CCN1CCC[C@H]1C 34a_100015189458_100000742370 [0,0,0,1,0,0|1,0,2]=4 2056 B12R1.353 COC(=O)COC1CCCC1C 34a_100011216460_100000747449 [0,0,0,1,0,0|1,0,1]=3 2057 B12R1.353 COC(=O)COC1CCCC1C 7a_100011216460_100000747449 [0,0,0,1,0,0|1,0,1]=3 2058 B12R1.353 COC(=O)CO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000747449 [0,0,0,1,0,0|2,0,1]=4 2059 B12R1.353 COC(=O)CO[C@H]1CCC[C@@H]1N 34a_100000748460_100000747449 [0,0,0,1,0,0|2,0,1]=4 2060 B12R1.353 COC(=O)CO[C@H]1CNC[C@H]1C 34a_200015306588_100000747449 [0,0,0,1,0,0|2,0,1]=4 2061 B12R1.353 COC(=O)CS[C@@H]1CCC[C@H]1O 62a_100000747449_200016002552 [0,0,0,1,0,0|2,0,1]=4 2062 B12R1.353 COC(=O)CS[C@@H]1CCC[C@H]1O 62a_200016002552_100000747449 [0,0,0,1,0,0|2,0,1]=4 2063 B12R1.355 COC(=O)CCOCC1CC1C 34a_100000744939_100000742370 [0,0,0,1,0,0|1,0,2]=4 2064 B12R1.355 COC(=O)CCOCC1CC1C 7a_100000744939_100000204255 [0,0,0,1,0,0|1,0,2]=4 2065 B12R1.356 COC(=O)/C=C/CNC1CCC1 2230a_100000749019_100000742655 [0,0,0,1,0,0|1,0,2]=4 2066 B12R1.356 COC(=O)/C=C/CNC1CCC1 34a_100000749019_100000742655 [0,0,0,1,0,0|1,0,2]=4 2067 B12R1.356 COC(=O)/C=C/COC1CCC1 34a_100000748187_100000742655 [0,0,0,1,0,0|1,0,2]=4 2068 B12R1.356 COC(=O)/C=C/CSC1CCC1 62a_100000742655_100000749161 [0,0,0,1,0,0|1,0,2]=4 2069 B12R1.356 COC(=O)C=NNCC1CCC1 4a_200020586977_200011823558 [0,0,0,1,0,0|2,0,1]=4 2070 B12R1.356 COC(=O)CCCCN1CCC1 269982a_100000754969_100000204269 [0,0,0,1,0,0|1,0,2]=4 2071 B12R1.356 COC(=O)CCCNC1CCC1 2230a_100000749019_100011218270 [0,0,0,1,0,0|1,0,2]=4 2072 B12R1.356 COC(=O)CCCNC1CCC1 34a_100000749019_100000742333 [0,0,0,1,0,0|1,0,2]=4 2073 B12R1.356 COC(=O)CCCOC1CCC1 34a_100000748187_100000742333 [0,0,0,1,0,0|1,0,2]=4 2074 B12R1.356 COC(=O)CCCSC1CCC1 62a_100011218270_100000749161 [0,0,0,1,0,0|1,0,2]=4 2075 B12R1.356 COC(=O)CCNCC1CCC1 2230a_100000738700_100000204255 [0,0,0,1,0,0|1,0,2]=4 2076 B12R1.356 COC(=O)CCNCC1CCC1 34a_100000738700_100000742370 [0,0,0,1,0,0|1,0,2]=4 2077 B12R1.356 COC(=O)CCOCC1CCC1 34a_100000760304_100000742370 [0,0,0,1,0,0|1,0,2]=4 2078 B12R1.356 COC(=O)CCSCC1CCC1 62a_100000204255_100000763275 [0,0,0,1,0,0|1,0,2]=4 2079 B12R1.356 COC(=O)CCSCC1CCC1 62a_100000763275_100000204255 [0,0,0,1,0,0|1,0,2]=4 2080 B12R1.356 COC(=O)COCCC1COC1 34a_100009855314_100000747449 [0,0,0,1,0,0|2,0,1]=4 2081 B12R1.356 COC(=O)NCCOC1CCC1 34a_100000757965_100000749161 [0,0,0,1,0,0|2,0,1]=4 2082 B12R1.356 COC(=O)OCCOC1CCC1 34a_100010262106_100000749161 [0,0,0,1,0,0|2,0,1]=4 2083 B12R1.356 COC(=O)OCSCC1CCC1 62a_100000763275_100000139417 [0,0,0,1,0,0|2,0,1]=4 2084 B12R1.360 COC(=O)/C=C/CNCC1CC1 2230a_100000735609_100000742655 [0,0,0,1,0,0|1,0,2]=4 2085 B12R1.360 COC(=O)/C=C/CNCC1CC1 34a_100000735609_100000742655 [0,0,0,1,0,0|1,0,2]=4 2086 B12R1.360 COC(=O)/C=C/COCC1CC1 34a_100000211283_100000742655 [0,0,0,1,0,0|1,0,2]=4 2087 B12R1.360 COC(=O)/C=C/CSCC1CC1 62a_100000742655_100000742324 [0,0,0,1,0,0|1,0,2]=4 2088 B12R1.360 COC(=O)/C=C/CSCC1CC1 62a_100000756562_100000742655 [0,0,0,1,0,0|1,0,2]=4 2089 B12R1.360 COC(=O)CCCCNC1CC1 34a_100000212008_100000204269 [0,0,0,1,0,0|1,0,2]=4 2090 B12R1.360 COC(=O)CCCCOC1CC1 34a_100000059025_100000211595 [0,0,0,1,0,0|1,0,2]=4 2091 B12R1.360 COC(=O)CCCCSC1CC1 62a_100000204269_100000211595 [0,0,0,1,0,0|1,0,2]=4 2092 B12R1.360 COC(=O)CCCNCC1CC1 2230a_100000735609_100011218270 [0,0,0,1,0,0|1,0,2]=4 2093 B12R1.360 COC(=O)CCCNCC1CC1 34a_100000735609_100000742333 [0,0,0,1,0,0|1,0,2]=4 2094 B12R1.360 COC(=O)CCCOCC1CC1 34a_100000211283_100000742333 [0,0,0,1,0,0|1,0,2]=4 2095 B12R1.360 COC(=O)CCCSCC1CC1 62a_100000756562_100011218270 [0,0,0,1,0,0|1,0,2]=4 2096 B12R1.360 COC(=O)CCCSCC1CC1 62a_100011218270_100000742324 [0,0,0,1,0,0|1,0,2]=4 2097 B12R1.360 COC(=O)CCNCCC1CC1 34a_100000764129_100000742370 [0,0,0,1,0,0|1,0,2]=4 2098 B12R1.360 COC(=O)CCOCCC1CC1 34a_100000754188_100000742370 [0,0,0,1,0,0|1,0,2]=4 2099 B12R1.360 COC(=O)CCOCCC1CC1 7a_100000754188_100000204255 [0,0,0,1,0,0|1,0,2]=4 2100 B12R1.360 COC(=O)CCSCCC1CC1 62a_100000204255_100000764125 [0,0,0,1,0,0|1,0,2]=4 2101 B12R1.360 COC(=O)CCSCCC1CC1 62a_100000764125_100000204255 [0,0,0,1,0,0|1,0,2]=4 2102 B12R1.360 COC(=O)COCCNC1CC1 34a_100000212008_100000090808 [0,0,0,1,0,0|2,0,1]=4 2103 B12R1.360 COC(=O)COCCNC1CC1 34a_100000738766_100000747449 [0,0,0,1,0,0|2,0,1]=4 2104 B12R1.360 COC(=O)COCCSC1CC1 62a_100000090808_100000211595 [0,0,0,1,0,0|2,0,1]=4 2105 B12R1.360 COC(=O)CSCCCC1CO1 62a_100000733510_100000747449 [0,0,0,1,0,0|2,0,1]=4 2106 B12R1.360 COC(=O)CSCCCC1CO1 62a_100000747449_100000733510 [0,0,0,1,0,0|2,0,1]=4 2107 B12R1.360 COC(=O)NCCOCC1CC1 34a_100000757965_100000742324 [0,0,0,1,0,0|2,0,1]=4 2108 B12R1.360 COC(=O)OCCOCC1CC1 34a_100010262106_100000742324 [0,0,0,1,0,0|2,0,1]=4 2109 B12R1.360 COC(=O)OCSCCC1CC1 62a_100000764125_100000139417 [0,0,0,1,0,0|2,0,1]=4 2110 B12R1.364 COC(=O)/C=C/CN1CCC1C 269982a_100000755817_100000742655 [0,0,0,1,0,0|1,0,2]=4 2111 B12R1.364 COC(=O)/C=C/CN1CCC1C 34a_100000755817_100000742655 [0,0,0,1,0,0|1,0,2]=4 2112 B12R1.364 COC(=O)CCCN1CCC1C 269982a_100000755817_100011218270 [0,0,0,1,0,0|1,0,2]=4 2113 B12R1.364 COC(=O)CCCN1CCC1C 34a_100000755817_100000742333 [0,0,0,1,0,0|1,0,2]=4 2114 B12R1.371 CCC(=O)CN1CCCCC1C 269982a_100000211376_100000747405 [0,0,0,1,0,0|2,0,1]=4 2115 B12R1.371 CCC(=O)NC1CCCCC1C 11a_100000211402_100000210414 [0,0,0,1,0,0|2,0,1]=4 2116 B12R1.371 CCC(=O)NC1CCCCC1C 1626a_100000211402_100000210414 [0,0,0,1,0,0|2,0,1]=4 2117 B12R1.371 CCC(=O)NC1CCCCC1C 240690a_100000211402_100000210414 [0,0,0,1,0,0|2,0,1]=4 2118 B12R1.371 CCC(=O)NC1CCCCC1C 527a_100000211402_100000210414 [0,0,0,1,0,0|2,0,1]=4 2119 B12R1.371 CNC(=O)CN1CCCCC1C 2230a_100000211376_100000183359 [0,0,0,1,0,0|2,0,1]=4 2120 B12R1.371 CNC(=O)CN1CCCCC1C 269982a_100000211376_100000183359 [0,0,0,1,0,0|2,0,1]=4 2121 B12R1.371 CNC(=O)CN1CCCCC1C 34a_100000211376_100000183359 [0,0,0,1,0,0|2,0,1]=4 2122 B12R1.371 CNC(=O)NC1CCCCC1C 2708a_100000211402_106832991635 [0,0,0,1,0,0|2,0,1]=4 2123 B12R1.371 CNC(=O)NC1CCCCC1C 2708a_100102657272_100000211402 [0,0,0,1,0,0|2,0,1]=4 2124 B12R1.371 CNC(=O)NC1CCCCC1C 273464a_100000211402_100102657272 [0,0,0,1,0,0|2,0,1]=4 2125 B12R1.371 CNC(=O)NC1CCCCC1C 273464a_100102657272_100000211402 [0,0,0,1,0,0|2,0,1]=4 2126 B12R1.371 CNC(=O)NC1CCCCC1C 512a_100000211402_100102657272 [0,0,0,1,0,0|2,0,1]=4 2127 B12R1.371 CNC(=O)NC1CCCCC1C 512a_106832991638_100000211402 [0,0,0,1,0,0|2,0,1]=4 2128 B12R1.371 COC(=O)CN1CCCCC1C 2230a_100000211376_100000747449 [0,0,0,1,0,0|1,0,1]=3 2129 B12R1.371 COC(=O)CN1CCCCC1C 269982a_100000211376_100000747449 [0,0,0,1,0,0|1,0,1]=3 2130 B12R1.371 COC(=O)CN1CCCCC1C 34a_100000211376_100000747449 [0,0,0,1,0,0|1,0,1]=3 2131 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 2230a_100009815349_100000747449 [0,0,0,1,0,0|2,0,1]=4 2132 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 269982a_100009815349_100000747449 [0,0,0,1,0,0|2,0,1]=4 2133 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 34a_100009815349_100000747449 [0,0,0,1,0,0|2,0,1]=4 2134 B12R1.383 CCCCCCOC1CCC1=O 34a_100000210259_100009892977 [0,0,0,1,0,0|2,0,1]=4 2135 B12R1.383 CCCCCCOC1CCC1=O 7a_100000210259_100009892977 [0,0,0,1,0,0|2,0,1]=4 2136 B12R1.383 CCCCCCSC1CCC1=O 62a_100000210314_100009892977 [0,0,0,1,0,0|2,0,1]=4 2137 B12R1.383 CCCCCCSC1CCC1=O 62a_100009892977_100000210757 [0,0,0,1,0,0|2,0,1]=4 2138 B12R1.477 CCC(=O)CCCC1CCCC1 1458a_100000210414_100011713738 [0,0,0,1,0,0|1,0,2]=4 2139 B12R1.477 CCC(=O)COCC1CCCC1 34a_100000725409_100000740388 [0,0,0,1,0,0|2,0,1]=4 2140 B12R1.477 CCC(=O)COCC1CCCC1 7a_100000742336_100000747405 [0,0,0,1,0,0|2,0,1]=4 2141 B12R1.477 CCC(=O)CSCC1CCCC1 62a_100000740388_100000747405 [0,0,0,1,0,0|2,0,1]=4 2142 B12R1.477 CCC(=O)CSCC1CCCC1 62a_100000747405_100000740388 [0,0,0,1,0,0|2,0,1]=4 2143 B12R1.477 CCC(=O)NCCC1CCCC1 11a_100000739158_100000210414 [0,0,0,1,0,0|2,0,1]=4 2144 B12R1.477 CCC(=O)NCCC1CCCC1 1626a_100000739158_100000210414 [0,0,0,1,0,0|2,0,1]=4 2145 B12R1.477 CCC(=O)NCCC1CCCC1 240690a_100000739158_100000210414 [0,0,0,1,0,0|2,0,1]=4 2146 B12R1.477 CCC(=O)NCCC1CCCC1 527a_100000739158_100000210414 [0,0,0,1,0,0|2,0,1]=4 2147 B12R1.477 CNC(=O)CNCC1CCCC1 2230a_100000693194_100000740388 [0,0,0,1,0,0|2,0,1]=4 2148 B12R1.477 CNC(=O)CNCC1CCCC1 2230a_100000737975_100000183359 [0,0,0,1,0,0|2,0,1]=4 2149 B12R1.477 CNC(=O)CNCC1CCCC1 269862a_100000693194_100000746403 [0,0,0,1,0,0|2,0,1]=4 2150 B12R1.477 CNC(=O)CNCC1CCCC1 34a_100000737975_100000183359 [0,0,0,1,0,0|2,0,1]=4 2151 B12R1.477 CNC(=O)COCC1CCCC1 34a_100000742336_100000183359 [0,0,0,1,0,0|2,0,1]=4 2152 B12R1.477 CNC(=O)COCC1CCCC1 34a_100000750040_100000740388 [0,0,0,1,0,0|2,0,1]=4 2153 B12R1.477 CNC(=O)COCC1CCCC1 7a_100000742336_100000183359 [0,0,0,1,0,0|2,0,1]=4 2154 B12R1.477 CNC(=O)CSCC1CCCC1 62a_100000183359_100000740388 [0,0,0,1,0,0|2,0,1]=4 2155 B12R1.477 CNC(=O)CSCC1CCCC1 62a_100000740388_100000183359 [0,0,0,1,0,0|2,0,1]=4 2156 B12R1.477 CNC(=O)NCCC1CCCC1 2708a_100000739158_106832991635 [0,0,0,1,0,0|2,0,1]=4 2157 B12R1.477 CNC(=O)NCCC1CCCC1 2708a_100102657272_100000739158 [0,0,0,1,0,0|2,0,1]=4 2158 B12R1.477 CNC(=O)NCCC1CCCC1 273464a_100000739158_100102657272 [0,0,0,1,0,0|2,0,1]=4 2159 B12R1.477 CNC(=O)NCCC1CCCC1 273464a_100102657272_100000739158 [0,0,0,1,0,0|2,0,1]=4 2160 B12R1.477 CNC(=O)NCCC1CCCC1 512a_100000739158_100102657272 [0,0,0,1,0,0|2,0,1]=4 2161 B12R1.477 CNC(=O)NCCC1CCCC1 512a_106832991638_100000739158 [0,0,0,1,0,0|2,0,1]=4 2162 B12R1.477 COC(=O)/C=C/CN1CCCC1 2230a_100000188435_100000742655 [0,0,0,1,0,0|1,0,2]=4 2163 B12R1.477 COC(=O)/C=C/CN1CCCC1 269982a_100000188435_100000742655 [0,0,0,1,0,0|1,0,2]=4 2164 B12R1.477 COC(=O)C=NNC1CCCC1 4a_100000737850_200011823558 [0,0,0,1,0,0|2,0,1]=4 2165 B12R1.477 COC(=O)CCCN1CCCC1 2230a_100000188435_100011218270 [0,0,0,1,0,0|1,0,2]=4 2166 B12R1.477 COC(=O)CCCN1CCCC1 269982a_100000188435_100011218270 [0,0,0,1,0,0|1,0,2]=4 2167 B12R1.477 COC(=O)CCNC1CCCC1 2230a_100000211070_100000204255 [0,0,0,1,0,0|1,0,2]=4 2168 B12R1.477 COC(=O)CCNC1CCCC1 34a_100000211070_100000742370 [0,0,0,1,0,0|1,0,2]=4 2169 B12R1.477 COC(=O)CCOC1CCCC1 34a_100000210269_100000742370 [0,0,0,1,0,0|1,0,2]=4 2170 B12R1.477 COC(=O)CCOC1CCCC1 7a_100000210269_100000204255 [0,0,0,1,0,0|1,0,2]=4 2171 B12R1.477 COC(=O)CCSC1CCCC1 62a_100000204255_100000179811 [0,0,0,1,0,0|1,0,2]=4 2172 B12R1.477 COC(=O)CCSC1CCCC1 62a_100011217020_100000204255 [0,0,0,1,0,0|1,0,2]=4 2173 B12R1.477 COC(=O)CNCC1CCCC1 2230a_100000737975_100000747449 [0,0,0,1,0,0|1,0,1]=3 2174 B12R1.477 COC(=O)CNCC1CCCC1 34a_100000737975_100000747449 [0,0,0,1,0,0|1,0,1]=3 2175 B12R1.477 COC(=O)CNCC1CCOC1 2230a_100000737293_100000747449 [0,0,0,1,0,0|2,0,1]=4 2176 B12R1.477 COC(=O)CNCC1CCOC1 34a_100000737293_100000747449 [0,0,0,1,0,0|2,0,1]=4 2177 B12R1.477 COC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000747449 [0,0,0,1,0,0|2,0,1]=4 2178 B12R1.477 COC(=O)CNC[C@@H]1CCCO1 34a_100020590478_100000747449 [0,0,0,1,0,0|2,0,1]=4 2179 B12R1.477 COC(=O)COCC1CCCC1 34a_100000742336_100000747449 [0,0,0,1,0,0|1,0,1]=3 2180 B12R1.477 COC(=O)COCC1CCCC1 7a_100000742336_100000747449 [0,0,0,1,0,0|1,0,1]=3 2181 B12R1.477 COC(=O)COCC1CCCO1 34a_100000210270_100000747449 [0,0,0,1,0,0|2,0,1]=4 2182 B12R1.477 COC(=O)COCC1CCCO1 7a_100000210270_100000747449 [0,0,0,1,0,0|2,0,1]=4 2183 B12R1.477 COC(=O)COCC1CCNC1 34a_100000748654_100000747449 [0,0,0,1,0,0|2,0,1]=4 2184 B12R1.477 COC(=O)COCC1CCOC1 34a_100000740260_100000747449 [0,0,0,1,0,0|2,0,1]=4 2185 B12R1.477 COC(=O)COC[C@H]1CCCN1 34a_100000745186_100000747449 [0,0,0,1,0,0|2,0,1]=4 2186 B12R1.477 COC(=O)CSCC1CCCC1 62a_100000740388_100000747449 [0,0,0,1,0,0|1,0,1]=3 2187 B12R1.477 COC(=O)CSCC1CCCC1 62a_100000747449_100000740388 [0,0,0,1,0,0|1,0,1]=3 2188 B12R1.477 COC(=O)CSCC1CCCO1 62a_100000203698_100000747449 [0,0,0,1,0,0|2,0,1]=4 2189 B12R1.477 COC(=O)CSCC1CCCO1 62a_100000747449_100000203698 [0,0,0,1,0,0|2,0,1]=4 2190 B12R1.477 COC(=O)CSCC1CCOC1 62a_100000702531_100000747449 [0,0,0,1,0,0|2,0,1]=4 2191 B12R1.477 COC(=O)CSCC1CCOC1 62a_100000747449_100000702531 [0,0,0,1,0,0|2,0,1]=4 2192 B12R1.477 COC(=O)OCSC1CCCC1 62a_100011217020_100000139417 [0,0,0,1,0,0|2,0,1]=4 2193 B12R1.1412 CCCCCN1CC1C(=O)OC 2230a_200009830135_100000210326 [0,0,0,1,0,0|1,0,2]=4 2194 B12R1.1659 CCC(=O)N1CCCCCCC1 11a_100000211400_100000210414 [0,0,0,1,0,0|2,0,1]=4 2195 B12R1.1659 CCC(=O)N1CCCCCCC1 1626a_100000211400_100000210414 [0,0,0,1,0,0|2,0,1]=4 2196 B12R1.1659 CCC(=O)N1CCCCCCC1 240690a_100000211400_100000210414 [0,0,0,1,0,0|2,0,1]=4 2197 B12R1.1659 CCC(=O)N1CCCCCCC1 527a_100000211400_100000210414 [0,0,0,1,0,0|2,0,1]=4 2198 B12R1.1659 CNC(=O)N1CCCCCCC1 2708a_100102657272_100000211400 [0,0,0,1,0,0|2,0,1]=4 2199 B12R1.1659 CNC(=O)N1CCCCCCC1 273464a_100102657272_100000211400 [0,0,0,1,0,0|2,0,1]=4 2200 B12R1.1748 CCC(=O)C=C1CCCCCC1 1458a_100011240665_100000210202 [0,0,0,1,0,0|1,0,2]=4 2201 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000210414_200000696569 [0,0,0,1,0,0|1,0,2]=4 2202 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000685095_100000210202 [0,0,0,1,0,0|1,0,2]=4 2203 B12R1.1748 CCC(=O)CN1CCCCCC1 1458a_100000740298_100000210202 [0,0,0,1,0,0|2,0,1]=4 2204 B12R1.1748 CCC(=O)CN1CCCCCC1 269982a_100000185865_100000747405 [0,0,0,1,0,0|2,0,1]=4 2205 B12R1.1748 CCC(=O)NC1CCCCCC1 11a_100000210984_100000210414 [0,0,0,1,0,0|2,0,1]=4 2206 B12R1.1748 CCC(=O)NC1CCCCCC1 1626a_100000210984_100000210414 [0,0,0,1,0,0|2,0,1]=4 2207 B12R1.1748 CCC(=O)NC1CCCCCC1 240690a_100000210984_100000210414 [0,0,0,1,0,0|2,0,1]=4 2208 B12R1.1748 CCC(=O)NC1CCCCCC1 527a_100000210984_100000210414 [0,0,0,1,0,0|2,0,1]=4 2209 B12R1.1748 CNC(=O)C=C1CCCCCC1 11a_106832991635_100011240665 [0,0,0,1,0,0|1,0,2]=4 2210 B12R1.1748 CNC(=O)C=C1CCCCCC1 1626a_100102657272_100011240665 [0,0,0,1,0,0|1,0,2]=4 2211 B12R1.1748 CNC(=O)C=C1CCCCCC1 240690a_100102657272_100011240665 [0,0,0,1,0,0|1,0,2]=4 2212 B12R1.1748 CNC(=O)CC1CCCCCC1 11a_106832991635_100000685095 [0,0,0,1,0,0|1,0,2]=4 2213 B12R1.1748 CNC(=O)CC1CCCCCC1 1626a_100102657272_100000685095 [0,0,0,1,0,0|1,0,2]=4 2214 B12R1.1748 CNC(=O)CC1CCCCCC1 240690a_100102657272_100000685095 [0,0,0,1,0,0|1,0,2]=4 2215 B12R1.1748 CNC(=O)CC1CCCCCC1 527a_100102657272_100000685095 [0,0,0,1,0,0|1,0,2]=4 2216 B12R1.1748 CNC(=O)CN1CCCCCC1 11a_106832991635_100000740298 [0,0,0,1,0,0|2,0,1]=4 2217 B12R1.1748 CNC(=O)CN1CCCCCC1 2230a_100000185865_100000183359 [0,0,0,1,0,0|2,0,1]=4 2218 B12R1.1748 CNC(=O)CN1CCCCCC1 240690a_100102657272_100000740298 [0,0,0,1,0,0|2,0,1]=4 2219 B12R1.1748 CNC(=O)CN1CCCCCC1 269982a_100000185865_100000183359 [0,0,0,1,0,0|2,0,1]=4 2220 B12R1.1748 CNC(=O)CN1CCCCCC1 34a_100000185865_100000183359 [0,0,0,1,0,0|2,0,1]=4 2221 B12R1.1748 CNC(=O)CN1CCCCCC1 527a_100102657272_100000740298 [0,0,0,1,0,0|2,0,1]=4 2222 B12R1.1748 CNC(=O)NC1CCCCCC1 2708a_100000210984_106832991635 [0,0,0,1,0,0|2,0,1]=4 2223 B12R1.1748 CNC(=O)NC1CCCCCC1 2708a_100102657272_100000210984 [0,0,0,1,0,0|2,0,1]=4 2224 B12R1.1748 CNC(=O)NC1CCCCCC1 273464a_100000210984_100102657272 [0,0,0,1,0,0|2,0,1]=4 2225 B12R1.1748 CNC(=O)NC1CCCCCC1 273464a_100102657272_100000210984 [0,0,0,1,0,0|2,0,1]=4 2226 B12R1.1748 CNC(=O)NC1CCCCCC1 512a_106832991638_100000210984 [0,0,0,1,0,0|2,0,1]=4 2227 B12R1.1748 COC(=O)CN1CCCCCC1 2230a_100000185865_100000747449 [0,0,0,1,0,0|1,0,1]=3 2228 B12R1.1748 COC(=O)CN1CCCCCC1 269982a_100000185865_100000747449 [0,0,0,1,0,0|1,0,1]=3 2229 B12R1.1748 COC(=O)CN1CCCCCC1 34a_100000185865_100000747449 [0,0,0,1,0,0|1,0,1]=3 2230 B12R1.1748 COC(=O)CN1CCCOCC1 2230a_100000685342_100000747449 [0,0,0,1,0,0|2,0,1]=4 2231 B12R1.1748 COC(=O)CN1CCCOCC1 269982a_100000685342_100000747449 [0,0,0,1,0,0|2,0,1]=4 2232 B12R1.1748 COC(=O)CN1CCCOCC1 34a_100000685342_100000747449 [0,0,0,1,0,0|2,0,1]=4 2233 B9R0.2 CC(=O)CCCCCCF 1458a_100000070787_100015922095 [2,0,0,0,0,0|1,0,1]=4 2234 B9R0.2 CC(=O)CCCCCCO 1458a_100000070787_100000766143 [2,0,0,0,0,0|1,0,1]=4 2235 B9R0.2 CC(=O)CCCCCCO 1458a_100011996774_200000210301 [2,0,0,0,0,0|1,0,1]=4 2236 B9R0.2 CC(=O)NCCCCCO 240690a_100000762737_100015343762 [2,0,0,0,0,0|2,0,0]=4 2237 B9R0.2 CC(=O)NCCCCN[13CH3] 2230a_200011368371_200025704644 [2,0,0,0,0,0|2,0,0]=4 2238 B9R0.2 CC(=O)NCCCCN[13CH3] 34a_200011368371_200025704644 [2,0,0,0,0,0|2,0,0]=4 2239 B9R0.2 CC(=O)OCCCCO[13CH3] 34a_100000073216_200025704644 [2,0,0,0,0,0|2,0,0]=4 2240 B9R0.2 CC(=O)OCCCCO[13CH3] 7a_100000073216_200025704644 [2,0,0,0,0,0|2,0,0]=4 2241 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_100000033659_200025704644 [2,0,0,0,0,0|2,0,0]=4 2242 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_200025704644_100000033659 [2,0,0,0,0,0|2,0,0]=4 2243 B9R0.2 CC(=O)SCCCCS[13CH3] 62a_200010402107_200025704644 [2,0,0,0,0,0|2,0,0]=4 2244 B9R0.2 CC(=O)SCCCCS[13CH3] 62a_200025704644_200010402107 [2,0,0,0,0,0|2,0,0]=4 2245 B9R0.2 CCCCCC#CC(=O)C 1458a_100011215388_200000210301 [2,0,0,0,0,0|0,0,0]=2 2246 B9R0.2 CCCCCC#CC(=O)[13CH3] 1458a_100011215388_200025704644 [2,0,0,0,0,0|0,0,0]=2 2247 B9R0.2 CCCCCC=CC(=O)C 1458a_100016263427_200000210301 [2,0,0,0,0,0|0,0,2]=4 2248 B9R0.2 CCCCCC=CC(=O)[13CH3] 1458a_100016263427_200025704644 [2,0,0,0,0,0|0,0,2]=4 2249 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [2,0,0,0,0,0|0,0,1]=3 2250 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [2,0,0,0,0,0|0,0,1]=3 2251 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [2,0,0,0,0,0|0,0,1]=3 2252 B9R0.2 CCCCCCNC(=O)C 11a_100000210581_100015343762 [2,0,0,0,0,0|1,0,0]=3 2253 B9R0.2 CCCCCCNC(=O)C 1626a_100000210581_100015343762 [2,0,0,0,0,0|1,0,0]=3 2254 B9R0.2 CCCCCCNC(=O)C 240690a_100000210581_100015343762 [2,0,0,0,0,0|1,0,0]=3 2255 B9R0.2 CCCCCCNC(=O)C 527a_100000210581_100103153847 [2,0,0,0,0,0|1,0,0]=3 2256 B9R0.2 CCCCCNCC(=O)O 269956a_100016091260_100000210326 [2,0,0,0,0,0|1,0,1]=4 2257 B9R0.2 CCCCCNNC(=O)C 22a_100000694160_100000070787 [2,0,0,0,0,0|2,0,0]=4 2258 B9R0.2 CCCCCOCC(=O)C 34a_100000211253_100000718602 [2,0,0,0,0,0|1,0,1]=4 2259 B9R0.2 CCCCNCCC(=O)C 7a_106832991798_100000053229 [2,0,0,0,0,0|1,0,1]=4 2260 B9R0.2 CCCCOCCC(=O)C 1458a_100000070787_100000743108 [2,0,0,0,0,0|1,0,1]=4 2261 B9R0.2 CCCCOCCC(=O)C 34a_100000759926_100000210210 [2,0,0,0,0,0|1,0,1]=4 2262 B9R0.2 CCCCOCCC(=O)C 7a_100000210227_100000053229 [2,0,0,0,0,0|1,0,1]=4 2263 B9R0.2 CCCCOCCC(=O)C 7a_100000759926_100000210211 [2,0,0,0,0,0|1,0,1]=4 2264 B9R0.2 CCCCOCOC(=O)C 34a_100000210227_100009813279 [2,0,0,0,0,0|2,0,0]=4 2265 B9R0.2 CCCCSCCC(=O)C 62a_100000053229_100000210210 [2,0,0,0,0,0|1,0,1]=4 2266 B9R0.2 CCCCSCCC(=O)C 62a_100000210211_100000053229 [2,0,0,0,0,0|1,0,1]=4 2267 B9R0.2 CCCCSCOC(=O)C 62a_100000076356_100000210210 [2,0,0,0,0,0|2,0,0]=4 2268 B9R0.2 CCCCSCOC(=O)C 62a_100000210211_100000076356 [2,0,0,0,0,0|2,0,0]=4 2269 B9R0.2 CCCNCCNC(=O)C 2230a_100000209853_100000210303 [2,0,0,0,0,0|2,0,0]=4 2270 B9R0.2 CCCOCCCC(=O)C 34a_100000210258_100000685027 [2,0,0,0,0,0|1,0,1]=4 2271 B9R0.2 CCCOCCCC(=O)C 34a_100000759063_100000210303 [2,0,0,0,0,0|1,0,1]=4 2272 B9R0.2 CCCOCCCC(=O)C 7a_100000759063_100000210303 [2,0,0,0,0,0|1,0,1]=4 2273 B9R0.2 CCCOCCNC(=O)C 1626a_100161115042_100015343762 [2,0,0,0,0,0|2,0,0]=4 2274 B9R0.2 CCCOCCNC(=O)C 240690a_100161115042_100015343762 [2,0,0,0,0,0|2,0,0]=4 2275 B9R0.2 CCCOCCNC(=O)C 34a_100000158858_100000210303 [2,0,0,0,0,0|2,0,0]=4 2276 B9R0.2 CCCOCCNC(=O)C 527a_100161115042_100103153847 [2,0,0,0,0,0|2,0,0]=4 2277 B9R0.2 CCCOCCOC(=O)C 34a_100000210258_100009814007 [2,0,0,0,0,0|2,0,0]=4 2278 B9R0.2 CCCSCCCC(=O)C 62a_100000210303_100011215641 [2,0,0,0,0,0|1,0,1]=4 2279 B9R0.2 CCCSCCCC(=O)C 62a_100011215641_100000210303 [2,0,0,0,0,0|1,0,1]=4 2280 B9R0.2 CCCSCCNC(=O)C 11a_100020603323_100015343762 [2,0,0,0,0,0|2,0,0]=4 2281 B9R0.2 CCCSCCNC(=O)C 240690a_100020603323_100015343762 [2,0,0,0,0,0|2,0,0]=4 2282 B9R0.2 CCCSCCNC(=O)C 527a_100020603323_100103153847 [2,0,0,0,0,0|2,0,0]=4 2283 B9R0.2 CCCSCCNC(=O)C 62a_100000189650_100000210303 [2,0,0,0,0,0|2,0,0]=4 2284 B9R0.2 CCCSCCNC(=O)C 62a_100000210303_100000189650 [2,0,0,0,0,0|2,0,0]=4 2285 B9R0.2 CCCSCCOC(=O)C 62a_100000210303_100009814007 [2,0,0,0,0,0|2,0,0]=4 2286 B9R0.2 CCCSCCOC(=O)C 62a_100009814007_100000210303 [2,0,0,0,0,0|2,0,0]=4 2287 B9R0.2 CCNCCCNC(=O)C 34a_100000736810_100000210202 [2,0,0,0,0,0|2,0,0]=4 2288 B9R0.2 CCNCCCSC(=O)C 2230a_100015525214_100000038929 [2,0,0,0,0,0|2,0,0]=4 2289 B9R0.2 CCOCCCCC(=O)C 34a_100121572206_100009817362 [2,0,0,0,0,0|1,0,1]=4 2290 B9R0.2 CCOCCCNC(=O)C 11a_100000210961_100015343762 [2,0,0,0,0,0|2,0,0]=4 2291 B9R0.2 CCOCCCNC(=O)C 1626a_100000210961_100015343762 [2,0,0,0,0,0|2,0,0]=4 2292 B9R0.2 CCOCCCNC(=O)C 240690a_100000210961_100015343762 [2,0,0,0,0,0|2,0,0]=4 2293 B9R0.2 CCOCCCNC(=O)C 34a_100000752032_100000210202 [2,0,0,0,0,0|2,0,0]=4 2294 B9R0.2 CCOCCCNC(=O)C 527a_100000210961_100103153847 [2,0,0,0,0,0|2,0,0]=4 2295 B9R0.2 CCOCCCOC(=O)C 34a_100121572206_100000042594 [2,0,0,0,0,0|2,0,0]=4 2296 B9R0.2 CCOCCCSC(=O)C 34a_100121572206_100000038929 [2,0,0,0,0,0|2,0,0]=4 2297 B9R0.2 CCSCCCCC(=O)C 62a_100000210202_100000735457 [2,0,0,0,0,0|1,0,1]=4 2298 B9R0.2 CCSCCCCC(=O)C 62a_100000735457_100000210202 [2,0,0,0,0,0|1,0,1]=4 2299 B9R0.2 CCSCCCOC(=O)C 62a_100000042594_100000210202 [2,0,0,0,0,0|2,0,0]=4 2300 B9R0.2 CCSCCCOC(=O)C 62a_100000210202_100000042594 [2,0,0,0,0,0|2,0,0]=4 2301 B9R0.2 CCSCCCSC(=O)C 62a_100000038929_100000210202 [2,0,0,0,0,0|2,0,0]=4 2302 B9R0.2 CCSCCCSC(=O)C 62a_100000210202_100000038929 [2,0,0,0,0,0|2,0,0]=4 2303 B9R0.2 CNCCCCNC(=O)C 2230a_200011368371_200000210301 [2,0,0,0,0,0|2,0,0]=4 2304 B9R0.2 CNCCCCNC(=O)C 34a_200011368371_200000210301 [2,0,0,0,0,0|2,0,0]=4 2305 B9R0.2 CNCCCCOC(=O)C 34a_100102657272_100000033659 [2,0,0,0,0,0|2,0,0]=4 2306 B9R0.2 CNCCCCOC(=O)C 7a_106832991635_100000033659 [2,0,0,0,0,0|2,0,0]=4 2307 B9R0.2 CNCCCCSC(=O)C 2230a_106832991635_200010402107 [2,0,0,0,0,0|2,0,0]=4 2308 B9R0.2 CNCCCCSC(=O)C 34a_100102657272_200010402107 [2,0,0,0,0,0|2,0,0]=4 2309 B9R0.2 CNCCCCSC(=O)C 7a_106832991635_200010402107 [2,0,0,0,0,0|2,0,0]=4 2310 B9R0.2 COCCCCCC(=O)C 1458a_100011935119_200000210301 [2,0,0,0,0,0|1,0,1]=4 2311 B9R0.2 COCCCCCC(=O)[13CH3] 1458a_100011935119_200025704644 [2,0,0,0,0,0|1,0,1]=4 2312 B9R0.2 COCCCCOC(=O)C 34a_100000073216_200000210301 [2,0,0,0,0,0|2,0,0]=4 2313 B9R0.2 COCCCCOC(=O)C 34a_100138415774_100000033659 [2,0,0,0,0,0|2,0,0]=4 2314 B9R0.2 COCCCCOC(=O)C 7a_100000073216_200000210301 [2,0,0,0,0,0|2,0,0]=4 2315 B9R0.2 COCCCCSC(=O)C 34a_100138415774_200010402107 [2,0,0,0,0,0|2,0,0]=4 2316 B9R0.2 CSCCCCOC(=O)C 62a_100000033659_200000210301 [2,0,0,0,0,0|2,0,0]=4 2317 B9R0.2 CSCCCCOC(=O)C 62a_200000210301_100000033659 [2,0,0,0,0,0|2,0,0]=4 2318 B9R0.2 CSCCCCSC(=O)C 62a_200000210301_200010402107 [2,0,0,0,0,0|2,0,0]=4 2319 B9R0.2 CSCCCCSC(=O)C 62a_200010402107_200000210301 [2,0,0,0,0,0|2,0,0]=4 2320 B9R0.2 [13CH3]C(=O)CCCCCCO 1458a_100011996774_200025704644 [2,0,0,0,0,0|1,0,1]=4 2321 B9R0.45 CCC#CCCOCCC 34a_100000036655_100000210303 [2,0,0,0,0,0|1,0,1]=4 2322 B9R0.45 CCC#CCCOCCC 7a_100000036655_100000210303 [2,0,0,0,0,0|1,0,1]=4 2323 B9R0.45 CCC#CCNCCCC 2230a_100000102301_100009813939 [2,0,0,0,0,0|1,0,1]=4 2324 B9R0.45 CCC#CCNCCCC 7a_106832991798_100009813939 [2,0,0,0,0,0|1,0,1]=4 2325 B9R0.45 CCC#CCOCCCC 34a_100000032950_100000210210 [2,0,0,0,0,0|1,0,1]=4 2326 B9R0.45 CCC#CCOCCCC 34a_100000210227_100009813939 [2,0,0,0,0,0|1,0,1]=4 2327 B9R0.45 CCC#CCOCCCC 7a_100000210227_100009813939 [2,0,0,0,0,0|1,0,1]=4 2328 B9R0.45 CCC#CCSCCCC 62a_100000210211_100009813939 [2,0,0,0,0,0|1,0,1]=4 2329 B9R0.45 CCC#CCSCCCC 62a_100009813939_100000210210 [2,0,0,0,0,0|1,0,1]=4 2330 B9R0.45 CCCCCC#CCNC 2230a_106832991635_100009816472 [2,0,0,0,0,0|1,0,1]=4 2331 B9R0.45 CCCCCC#CCNC 34a_100102657272_100009816472 [2,0,0,0,0,0|1,0,1]=4 2332 B9R0.45 CCCCCC#CCNC 7a_106832991635_100009816472 [2,0,0,0,0,0|1,0,1]=4 2333 B9R0.45 CCCCCC#CCOC 34a_100138415774_100009816472 [2,0,0,0,0,0|0,0,1]=3 2334 B9R0.45 CCCCCC#CCOC 34a_200000033628_200000210301 [2,0,0,0,0,0|0,0,1]=3 2335 B9R0.45 CCCCCC#CCOC 7a_200000033628_200000210301 [2,0,0,0,0,0|0,0,1]=3 2336 B9R0.45 CCCCCC#CCO[13CH3] 34a_200000033628_200025704644 [2,0,0,0,0,0|0,0,1]=3 2337 B9R0.45 CCCCCC#CCO[13CH3] 7a_200000033628_200025704644 [2,0,0,0,0,0|0,0,1]=3 2338 B9R0.45 CCCCCC#CCSC 62a_100009816472_200000210301 [2,0,0,0,0,0|0,1,1]=4 2339 B9R0.45 CCCCCC#CCSC 62a_200000210301_100009816472 [2,0,0,0,0,0|0,1,1]=4 2340 B9R0.45 CCCCCC#CCS[13CH3] 62a_100009816472_200025704644 [2,0,0,0,0,0|0,1,1]=4 2341 B9R0.45 CCCCCC#CCS[13CH3] 62a_200025704644_100009816472 [2,0,0,0,0,0|0,1,1]=4 2342 B9R0.45 CCCCCCCCOC 34a_100000210232_200000210301 [2,0,0,0,0,0|0,0,2]=4 2343 B9R0.45 CCCCCCCCOC 34a_100138415774_100000210759 [2,0,0,0,0,0|0,0,2]=4 2344 B9R0.45 CCCCCCCCOC 7a_100000210232_200000210301 [2,0,0,0,0,0|0,0,2]=4 2345 B9R0.45 CCCCCCCCO[13CH3] 34a_100000210232_200025704644 [2,0,0,0,0,0|0,0,2]=4 2346 B9R0.45 CCCCCCCCO[13CH3] 7a_100000210232_200025704644 [2,0,0,0,0,0|0,0,2]=4 2347 B9R0.45 CCCCCCNCC=O 2230a_100000210581_200015260668 [2,0,0,0,0,0|1,0,1]=4 2348 B9R0.45 CCCCCCNCOC 2230a_100000210581_100000766300 [2,0,0,0,0,0|1,0,1]=4 2349 B9R0.45 CCCCCCOCC=O 34a_100000210259_200009817547 [2,0,0,0,0,0|1,0,1]=4 2350 B9R0.45 CCCCCCOCC=O 7a_100000210259_200015260668 [2,0,0,0,0,0|1,0,1]=4 2351 B9R0.45 CCCCCCSCC=O 62a_100000210314_200015260668 [2,0,0,0,0,0|1,0,1]=4 2352 B9R0.45 CCCCCCSCC=O 62a_200015260668_100000210757 [2,0,0,0,0,0|1,0,1]=4 2353 B9R0.45 CCCCCCSCOC 62a_100000210314_100000766300 [2,0,0,0,0,0|1,0,1]=4 2354 B9R0.45 CCCCCCSCOC 62a_100000766300_100000210757 [2,0,0,0,0,0|1,0,1]=4 2355 B9R0.45 CCCCNCC#CCO 2230a_100000102301_200000047223 [2,0,0,0,0,0|1,0,1]=4 2356 B9R0.45 CCCCNCC#CCO 7a_106832991798_200000047223 [2,0,0,0,0,0|1,0,1]=4 2357 B9R0.45 CCCCOCC#CCO 34a_100000210227_200000047223 [2,0,0,0,0,0|1,0,1]=4 2358 B9R0.45 CCCCOCC#CCO 7a_100000210227_200000047223 [2,0,0,0,0,0|1,0,1]=4 2359 B9R0.45 CCCCSCC#CCO 62a_100000210211_200000047223 [2,0,0,0,0,0|1,0,1]=4 2360 B9R0.45 CCCCSCC#CCO 62a_200000047223_100000210210 [2,0,0,0,0,0|1,0,1]=4 2361 B9R0.46 C#CC(=O)CCCCCC 1458a_100000211873_100000210757 [2,0,0,0,0,0|1,0,1]=4 2362 B9R0.46 C=CC(=O)CCCCCC 1458a_100000185746_100000210757 [2,0,0,0,0,0|1,0,1]=4 2363 B9R0.46 CCC(=O)CCCCCF 1458a_100000210414_100000729378 [2,0,0,0,0,0|2,0,0]=4 2364 B9R0.46 CCC(=O)CCCCCO 1458a_100000210414_100000746330 [2,0,0,0,0,0|2,0,0]=4 2365 B9R0.46 CCC(=O)CCCCCO 1458a_100102619762_100000210202 [2,0,0,0,0,0|2,0,0]=4 2366 B9R0.46 CCC(=O)CCCCOC 1458a_100000210414_100000755781 [2,0,0,0,0,0|2,0,0]=4 2367 B9R0.46 CCCCCCC(=O)CC 1458a_100000210414_100000210757 [2,0,0,0,0,0|1,0,0]=3 2368 B9R0.46 CCCCCCC(=O)CC 1458a_100102632555_100000210202 [2,0,0,0,0,0|1,0,0]=3 2369 B9R0.46 CCCCCCC(=O)CF 1458a_100102632555_100015361967 [2,0,0,0,0,0|2,0,0]=4 2370 B9R0.46 CCCCCCC(=O)CO 1458a_100000210174_100000210757 [2,0,0,0,0,0|2,0,0]=4 2371 B9R0.46 CCCCCCC(=O)NC 11a_106832991635_100102632555 [2,0,0,0,0,0|1,0,0]=3 2372 B9R0.46 CCCCCCC(=O)NC 1626a_100102657272_100102632555 [2,0,0,0,0,0|1,0,0]=3 2373 B9R0.46 CCCCCCC(=O)NC 240690a_100102657272_100102632555 [2,0,0,0,0,0|1,0,0]=3 2374 B9R0.46 CCCCCCC(=O)NC 527a_100102657272_100102632555 [2,0,0,0,0,0|1,0,0]=3 2375 B9R0.46 CCCCCCC(C)OC 34a_100000210265_200000210301 [2,0,0,0,0,0|1,0,1]=4 2376 B9R0.46 CCCCCCC(C)OC 34a_100138415774_100011215978 [2,0,0,0,0,0|1,0,1]=4 2377 B9R0.46 CCCCCCC(C)OC 7a_100000210265_200000210301 [2,0,0,0,0,0|1,0,1]=4 2378 B9R0.46 CCCCCCC(C)O[13CH3] 34a_100000210265_200025704644 [2,0,0,0,0,0|1,0,1]=4 2379 B9R0.46 CCCCCCC(C)O[13CH3] 7a_100000210265_200025704644 [2,0,0,0,0,0|1,0,1]=4 2380 B9R0.46 CCCCCNC(=O)CC 11a_100000209983_100000210414 [2,0,0,0,0,0|2,0,0]=4 2381 B9R0.46 CCCCCNC(=O)CC 1626a_100000209983_100000210414 [2,0,0,0,0,0|2,0,0]=4 2382 B9R0.46 CCCCCNC(=O)CC 240690a_100000209983_100000210414 [2,0,0,0,0,0|2,0,0]=4 2383 B9R0.46 CCCCCNC(=O)CC 527a_100000209983_100000210414 [2,0,0,0,0,0|2,0,0]=4 2384 B9R0.46 CCCCCNC(=O)NC 2708a_100000209983_106832991635 [2,0,0,0,0,0|2,0,0]=4 2385 B9R0.46 CCCCCNC(=O)NC 2708a_100102657272_100000209983 [2,0,0,0,0,0|2,0,0]=4 2386 B9R0.46 CCCCCNC(=O)NC 273464a_100000209983_100102657272 [2,0,0,0,0,0|2,0,0]=4 2387 B9R0.46 CCCCCNC(=O)NC 273464a_100102657272_100000209983 [2,0,0,0,0,0|2,0,0]=4 2388 B9R0.46 CCCCCNC(=O)NC 512a_100000209983_100102657272 [2,0,0,0,0,0|2,0,0]=4 2389 B9R0.46 CCCCCNC(=O)NC 512a_106832991638_100000209983 [2,0,0,0,0,0|2,0,0]=4 2390 B9R0.46 CCCCNCC(=O)CC 7a_106832991798_100000747405 [2,0,0,0,0,0|2,0,0]=4 2391 B9R0.46 CCCCNCC(=O)NC 2230a_100000102301_100000183359 [2,0,0,0,0,0|2,0,0]=4 2392 B9R0.46 CCCCNCC(=O)NC 2230a_100000693194_100000210211 [2,0,0,0,0,0|2,0,0]=4 2393 B9R0.46 CCCCNCC(=O)NC 7a_106832991798_100000183359 [2,0,0,0,0,0|2,0,0]=4 2394 B9R0.46 CCCCNCC(=O)OC 2230a_100000102301_100000747449 [2,0,0,0,0,0|1,0,0]=3 2395 B9R0.46 CCCCNCC(=O)OC 7a_106832991798_100000747449 [2,0,0,0,0,0|1,0,0]=3 2396 B9R0.46 CCCCOCC(=O)CC 1458a_100000210414_100011995733 [2,0,0,0,0,0|2,0,0]=4 2397 B9R0.46 CCCCOCC(=O)CC 1458a_100000757543_100000210202 [2,0,0,0,0,0|2,0,0]=4 2398 B9R0.46 CCCCOCC(=O)CC 34a_100000725409_100000210210 [2,0,0,0,0,0|2,0,0]=4 2399 B9R0.46 CCCCOCC(=O)CC 7a_100000210227_100000747405 [2,0,0,0,0,0|2,0,0]=4 2400 B9R0.46 CCCCOCC(=O)NC 11a_106832991635_100000757543 [2,0,0,0,0,0|2,0,0]=4 2401 B9R0.46 CCCCOCC(=O)NC 1626a_100102657272_100000757543 [2,0,0,0,0,0|2,0,0]=4 2402 B9R0.46 CCCCOCC(=O)NC 240690a_100102657272_100000757543 [2,0,0,0,0,0|2,0,0]=4 2403 B9R0.46 CCCCOCC(=O)NC 34a_100000210227_100000183359 [2,0,0,0,0,0|2,0,0]=4 2404 B9R0.46 CCCCOCC(=O)NC 34a_100000750040_100000210210 [2,0,0,0,0,0|2,0,0]=4 2405 B9R0.46 CCCCOCC(=O)NC 527a_100102657272_100000757543 [2,0,0,0,0,0|2,0,0]=4 2406 B9R0.46 CCCCOCC(=O)NC 7a_100000210227_100000183359 [2,0,0,0,0,0|2,0,0]=4 2407 B9R0.46 CCCCOCC(=O)OC 34a_100000210227_100000747449 [2,0,0,0,0,0|1,0,0]=3 2408 B9R0.46 CCCCOCC(=O)OC 7a_100000210227_100000747449 [2,0,0,0,0,0|1,0,0]=3 2409 B9R0.46 CCCCSCC(=O)CC 1458a_100000191162_100000210202 [2,0,0,0,0,0|2,0,0]=4 2410 B9R0.46 CCCCSCC(=O)CC 62a_100000210211_100000747405 [2,0,0,0,0,0|2,0,0]=4 2411 B9R0.46 CCCCSCC(=O)CC 62a_100000747405_100000210210 [2,0,0,0,0,0|2,0,0]=4 2412 B9R0.46 CCCCSCC(=O)NC 11a_106832991635_100000191162 [2,0,0,0,0,0|2,0,0]=4 2413 B9R0.46 CCCCSCC(=O)NC 1626a_100102657272_100000191162 [2,0,0,0,0,0|2,0,0]=4 2414 B9R0.46 CCCCSCC(=O)NC 240690a_100102657272_100000191162 [2,0,0,0,0,0|2,0,0]=4 2415 B9R0.46 CCCCSCC(=O)NC 527a_100102657272_100000191162 [2,0,0,0,0,0|2,0,0]=4 2416 B9R0.46 CCCCSCC(=O)NC 62a_100000183359_100000210210 [2,0,0,0,0,0|2,0,0]=4 2417 B9R0.46 CCCCSCC(=O)NC 62a_100000210211_100000183359 [2,0,0,0,0,0|2,0,0]=4 2418 B9R0.46 CCCCSCC(=O)OC 62a_100000210211_100000747449 [2,0,0,0,0,0|1,0,0]=3 2419 B9R0.46 CCCCSCC(=O)OC 62a_100000747449_100000210210 [2,0,0,0,0,0|1,0,0]=3 2420 B9R0.46 CCCNCCC(=O)NC 2230a_100000738227_100000210303 [2,0,0,0,0,0|2,0,0]=4 2421 B9R0.46 CCCNCCC(=O)NC 34a_100000738227_100000210303 [2,0,0,0,0,0|2,0,0]=4 2422 B9R0.46 CCCOCCC(=O)CC 1458a_100000210414_100011215938 [2,0,0,0,0,0|2,0,0]=4 2423 B9R0.46 CCCOCCC(=O)NC 34a_100000210258_100012179268 [2,0,0,0,0,0|2,0,0]=4 2424 B9R0.46 CCCOCCC(=O)NC 34a_100000754576_100000210303 [2,0,0,0,0,0|2,0,0]=4 2425 B9R0.46 CCCOCCC(=O)OC 34a_100000210258_100000742370 [2,0,0,0,0,0|1,0,0]=3 2426 B9R0.46 CCCSCCC(=O)NC 62a_100000210303_100000737683 [2,0,0,0,0,0|2,0,0]=4 2427 B9R0.46 CCCSCCC(=O)NC 62a_100000737683_100000210303 [2,0,0,0,0,0|2,0,0]=4 2428 B9R0.46 CCCSCCC(=O)OC 62a_100000204255_100000210303 [2,0,0,0,0,0|1,0,0]=3 2429 B9R0.46 CCCSCCC(=O)OC 62a_100000210303_100000204255 [2,0,0,0,0,0|1,0,0]=3 2430 B9R0.46 CCCSCOC(=O)OC 62a_100000210303_100000139417 [2,0,0,0,0,0|2,0,0]=4 2431 B9R0.46 CCNCCCC(=O)NC 2230a_100000740002_100000210202 [2,0,0,0,0,0|2,0,0]=4 2432 B9R0.46 CCNCCCC(=O)NC 2230a_100015525214_100000741757 [2,0,0,0,0,0|2,0,0]=4 2433 B9R0.46 CCNCCCC(=O)NC 34a_100000740002_100000210202 [2,0,0,0,0,0|2,0,0]=4 2434 B9R0.46 CCNCCCC(=O)OC 2230a_100015525214_100011218270 [2,0,0,0,0,0|1,0,0]=3 2435 B9R0.46 CCOCCCC(=O)CC 1458a_100000210414_100012232248 [2,0,0,0,0,0|2,0,0]=4 2436 B9R0.46 CCOCCCC(=O)NC 34a_100121572206_100000741757 [2,0,0,0,0,0|2,0,0]=4 2437 B9R0.46 CCOCCCC(=O)OC 34a_100121572206_100000742333 [2,0,0,0,0,0|1,0,0]=3 2438 B9R0.46 CCOCCNC(=O)OC 34a_100000757965_100000210202 [2,0,0,0,0,0|2,0,0]=4 2439 B9R0.46 CCOCCOC(=O)OC 34a_100010262106_100000210202 [2,0,0,0,0,0|2,0,0]=4 2440 B9R0.46 CCOCSCC(=O)OC 62a_100000739092_100000747449 [2,0,0,0,0,0|2,0,0]=4 2441 B9R0.46 CCOCSCC(=O)OC 62a_100000747449_100000739092 [2,0,0,0,0,0|2,0,0]=4 2442 B9R0.46 CCSCCCC(=O)NC 62a_100000210202_100000741757 [2,0,0,0,0,0|2,0,0]=4 2443 B9R0.46 CCSCCCC(=O)NC 62a_100000741757_100000210202 [2,0,0,0,0,0|2,0,0]=4 2444 B9R0.46 CCSCCCC(=O)OC 62a_100000210202_100011218270 [2,0,0,0,0,0|1,0,0]=3 2445 B9R0.46 CCSCCCC(=O)OC 62a_100011218270_100000210202 [2,0,0,0,0,0|1,0,0]=3 2446 B9R0.46 CNC(=O)CCCCCO 240690a_100102657272_100102619762 [2,0,0,0,0,0|2,0,0]=4 2447 B9R0.46 CNCCCCC(=O)OC 2230a_106832991635_100000204269 [2,0,0,0,0,0|1,0,0]=3 2448 B9R0.46 CNCCCCC(=O)OC 34a_100102657272_100000204269 [2,0,0,0,0,0|1,0,0]=3 2449 B9R0.46 CNCCCCC(=O)OC 7a_106832991635_100000204269 [2,0,0,0,0,0|1,0,0]=3 2450 B9R0.46 CNCCOCC(=O)OC 2230a_106832991635_100000090808 [2,0,0,0,0,0|2,0,0]=4 2451 B9R0.46 CNCCOCC(=O)OC 34a_100102657272_100000090808 [2,0,0,0,0,0|2,0,0]=4 2452 B9R0.46 CNCCOCC(=O)OC 7a_106832991635_100000090808 [2,0,0,0,0,0|2,0,0]=4 2453 B9R0.46 COC(=O)CCCCO[13CH3] 34a_100000059025_200025704644 [2,0,0,0,0,0|1,0,0]=3 2454 B9R0.46 COC(=O)CCCCO[13CH3] 7a_100000059025_200025704644 [2,0,0,0,0,0|1,0,0]=3 2455 B9R0.46 COC(=O)CCCCSC 62a_100000204269_200000210301 [2,0,0,0,0,0|1,0,0]=3 2456 B9R0.46 COC(=O)CCCCSC 62a_200000210301_100000204269 [2,0,0,0,0,0|1,0,0]=3 2457 B9R0.46 COC(=O)CCCCS[13CH3] 62a_100000204269_200025704644 [2,0,0,0,0,0|1,0,0]=3 2458 B9R0.46 COC(=O)CCCCS[13CH3] 62a_200025704644_100000204269 [2,0,0,0,0,0|1,0,0]=3 2459 B9R0.46 COC(=O)CCCSCF 62a_100011218270_100015361967 [2,0,0,0,0,0|2,0,0]=4 2460 B9R0.46 COC(=O)CCCSCF 62a_100015361967_100011218270 [2,0,0,0,0,0|2,0,0]=4 2461 B9R0.46 COC(=O)CCNCCF 34a_100000724931_100000742370 [2,0,0,0,0,0|2,0,0]=4 2462 B9R0.46 COC(=O)CCNCCO 2230a_100016997473_100000204255 [2,0,0,0,0,0|2,0,0]=4 2463 B9R0.46 COC(=O)CCNCCO 34a_100016990907_100000742370 [2,0,0,0,0,0|2,0,0]=4 2464 B9R0.46 COC(=O)CCOCCBr 34a_100000211926_100000742370 [2,0,0,0,0,0|2,0,0]=4 2465 B9R0.46 COC(=O)CCOCCN 34a_100000210304_100000742370 [2,0,0,0,0,0|2,0,0]=4 2466 B9R0.46 COC(=O)CCSCCF 62a_100000204255_100011217306 [2,0,0,0,0,0|2,0,0]=4 2467 B9R0.46 COC(=O)CCSCCF 62a_100011217306_100000204255 [2,0,0,0,0,0|2,0,0]=4 2468 B9R0.46 COC(=O)CCSCCO 62a_100000204255_100000211926 [2,0,0,0,0,0|2,0,0]=4 2469 B9R0.46 COC(=O)CCSCCO 62a_100000211926_100000204255 [2,0,0,0,0,0|2,0,0]=4 2470 B9R0.46 COC(=O)CCSCSC 62a_100000204255_100011218213 [2,0,0,0,0,0|2,0,0]=4 2471 B9R0.46 COC(=O)CCSCSC 62a_100011218213_100000204255 [2,0,0,0,0,0|2,0,0]=4 2472 B9R0.46 COC(=O)CNCCCF 2230a_100015189416_100000747449 [2,0,0,0,0,0|2,0,0]=4 2473 B9R0.46 COC(=O)CNCCCF 34a_100015189416_100000747449 [2,0,0,0,0,0|2,0,0]=4 2474 B9R0.46 COC(=O)CNCCSC 2230a_100020590264_100000747449 [2,0,0,0,0,0|2,0,0]=4 2475 B9R0.46 COC(=O)COCCCBr 34a_100011217188_100000747449 [2,0,0,0,0,0|2,0,0]=4 2476 B9R0.46 COC(=O)COCCCCl 34a_100000230001_100000747449 [2,0,0,0,0,0|2,0,0]=4 2477 B9R0.46 COC(=O)COCCCF 34a_100000759539_100000747449 [2,0,0,0,0,0|2,0,0]=4 2478 B9R0.46 COC(=O)COCCCN 34a_100000182051_100000747449 [2,0,0,0,0,0|2,0,0]=4 2479 B9R0.46 COC(=O)COCCSC 34a_100000230434_100000747449 [2,0,0,0,0,0|2,0,0]=4 2480 B9R0.46 COC(=O)COCCSC 62a_100000090808_200000210301 [2,0,0,0,0,0|2,0,0]=4 2481 B9R0.46 COC(=O)COCCSC 62a_200000210301_100000090808 [2,0,0,0,0,0|2,0,0]=4 2482 B9R0.46 COC(=O)COCCSC 7a_100000230434_100000747449 [2,0,0,0,0,0|2,0,0]=4 2483 B9R0.46 COC(=O)COCCS[13CH3] 62a_100000090808_200025704644 [2,0,0,0,0,0|2,0,0]=4 2484 B9R0.46 COC(=O)COCCS[13CH3] 62a_200025704644_100000090808 [2,0,0,0,0,0|2,0,0]=4 2485 B9R0.46 COC(=O)CSCCCF 62a_100000747449_100011934791 [2,0,0,0,0,0|2,0,0]=4 2486 B9R0.46 COC(=O)CSCCCF 62a_100011934791_100000747449 [2,0,0,0,0,0|2,0,0]=4 2487 B9R0.46 COC(=O)CSCCCO 62a_100000747449_100011215043 [2,0,0,0,0,0|2,0,0]=4 2488 B9R0.46 COC(=O)CSCCCO 62a_100011215043_100000747449 [2,0,0,0,0,0|2,0,0]=4 2489 B9R0.46 COC(=O)CSCCSC 62a_100000212216_100000747449 [2,0,0,0,0,0|2,0,0]=4 2490 B9R0.46 COC(=O)CSCCSC 62a_100000747449_100000751147 [2,0,0,0,0,0|2,0,0]=4 2491 B9R0.46 COCCCCC(=O)OC 34a_100000059025_200000210301 [2,0,0,0,0,0|1,0,0]=3 2492 B9R0.46 COCCCCC(=O)OC 34a_100138415774_100000204269 [2,0,0,0,0,0|1,0,0]=3 2493 B9R0.46 COCCCCC(=O)OC 7a_100000059025_200000210301 [2,0,0,0,0,0|1,0,0]=3 2494 B9R0.46 COCCNCC(=O)OC 2230a_100000209980_100000747449 [2,0,0,0,0,0|2,0,0]=4 2495 B9R0.46 COCCOCC(=O)OC 34a_100000210237_100000747449 [2,0,0,0,0,0|2,0,0]=4 2496 B9R0.46 COCCOCC(=O)OC 34a_100138415774_100000090808 [2,0,0,0,0,0|2,0,0]=4 2497 B9R0.46 COCCSCC(=O)OC 62a_100000233755_100000747449 [2,0,0,0,0,0|2,0,0]=4 2498 B9R0.46 COCCSCC(=O)OC 62a_100000747449_100000233755 [2,0,0,0,0,0|2,0,0]=4 2499 B9R0.46 COCSCCC(=O)OC 62a_100000204255_100000766300 [2,0,0,0,0,0|2,0,0]=4 2500 B9R0.46 COCSCCC(=O)OC 62a_100000766300_100000204255 [2,0,0,0,0,0|2,0,0]=4 2501 B11R0.2 CCCCCCC(C)NC(=O)C 11a_100000210919_100015343762 [1,1,0,0,0,0|1,0,1]=4 2502 B11R0.2 CCCCCCC(C)NC(=O)C 1626a_100000210919_100015343762 [1,1,0,0,0,0|1,0,1]=4 2503 B11R0.2 CCCCCCC(C)NC(=O)C 240690a_100000210919_100015343762 [1,1,0,0,0,0|1,0,1]=4 2504 B11R0.2 CCCCCCC(C)NC(=O)C 527a_100000210919_100103153847 [1,1,0,0,0,0|1,0,1]=4 2505 B11R0.2 CCCCCCN(C)CC(=O)O 269956a_100000746989_100000210757 [1,1,0,0,0,0|1,0,1]=4 2506 B11R0.30 CC(=O)CCCCCCC(C)C 1458a_100000040743_200000210301 [1,1,0,0,0,0|0,0,2]=4 2507 B11R0.30 CC(=O)COCCCCC(C)C 34a_100000211253_100011216152 [1,1,0,0,0,0|1,0,1]=4 2508 B11R0.30 CC(=O)NCCCCCC(C)C 1626a_100011290863_100015343762 [1,1,0,0,0,0|1,0,1]=4 2509 B11R0.30 CC(=O)NCCCCCC(C)C 240690a_100011290863_100015343762 [1,1,0,0,0,0|1,0,1]=4 2510 B11R0.30 CC(=O)NCCCCCC(C)C 527a_100011290863_100103153847 [1,1,0,0,0,0|1,0,1]=4 2511 B11R0.30 CC(C)CCCCCCC(=O)[13CH3] 1458a_100000040743_200025704644 [1,1,0,0,0,0|0,0,2]=4 2512 B11R0.30 CC(C)CCCCNCC(=O)O 269956a_100016091260_100011216152 [1,1,0,0,0,0|1,0,1]=4 2513 B11R0.42 CCCCCCCC(C)C(=O)C 1458a_100000070787_200011218727 [1,1,0,0,0,0|0,0,2]=4 2514 B11R0.42 CCCCCCCN(C)C(=O)C 11a_100000228206_100015343762 [1,1,0,0,0,0|1,0,1]=4 2515 B11R0.42 CCCCCCCN(C)C(=O)C 1626a_100000228206_100015343762 [1,1,0,0,0,0|1,0,1]=4 2516 B11R0.42 CCCCCCCN(C)C(=O)C 240690a_100000228206_100015343762 [1,1,0,0,0,0|1,0,1]=4 2517 B11R0.42 CCCCCCCN(C)C(=O)C 527a_100000228206_100103153847 [1,1,0,0,0,0|1,0,1]=4 2518 B11R0.42 CCCCCCNC(C)C(=O)C 2230a_100000210581_100009814033 [1,1,0,0,0,0|1,0,1]=4 2519 B11R0.42 CCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210757 [1,1,0,0,0,0|1,0,1]=4 2520 B11R0.42 CCCCCCOC(C)C(=O)C 34a_100000212229_100000210314 [1,1,0,0,0,0|1,0,1]=4 2521 B11R0.42 CCCCCCOC(C)C(=O)C 7a_100000210259_100000179758 [1,1,0,0,0,0|1,0,1]=4 2522 B11R0.42 CCCCCCSC(C)C(=O)C 62a_100000210314_100009814033 [1,1,0,0,0,0|1,0,1]=4 2523 B11R0.42 CCCCCCSC(C)C(=O)C 62a_100009814033_100000210757 [1,1,0,0,0,0|1,0,1]=4 2524 B11R0.46 CCCCCC(C)CCC(=O)C 1458a_100000034243_200000210301 [1,1,0,0,0,0|0,0,2]=4 2525 B11R0.46 CCCCCC(C)CCC(=O)[13CH3] 1458a_100000034243_200025704644 [1,1,0,0,0,0|0,0,2]=4 2526 B11R0.46 CCCCCC(C)NCC(=O)O 269956a_100016091260_200011218191 [1,1,0,0,0,0|1,0,1]=4 2527 B11R0.46 CCCCCC(C)OCC(=O)C 34a_100000211253_200011218191 [1,1,0,0,0,0|1,0,1]=4 2528 B11R0.148 CC(=O)CCCCCCCCO 1458a_100000070787_100000033203 [1,1,0,0,0,0|0,0,2]=4 2529 B11R0.148 CC(=O)COCCCCCCF 34a_100000211253_100015922095 [1,1,0,0,0,0|1,0,1]=4 2530 B11R0.148 CC(=O)COCCCCCCO 34a_100000211253_100000766143 [1,1,0,0,0,0|1,0,1]=4 2531 B11R0.148 CC(=O)NCCCCCCCO 240690a_100011996573_100015343762 [1,1,0,0,0,0|1,0,1]=4 2532 B11R0.148 CC(=O)NCCCCCCN[13CH3] 2230a_200011996284_200025704644 [1,1,0,0,0,0|1,0,1]=4 2533 B11R0.148 CC(=O)NCCCCCCN[13CH3] 34a_200011996284_200025704644 [1,1,0,0,0,0|1,0,1]=4 2534 B11R0.148 CCCCCC/C=C/CC(=O)C 1458a_100020681715_200000210301 [1,1,0,0,0,0|0,0,2]=4 2535 B11R0.148 CCCCCC/C=C/CC(=O)[13CH3] 1458a_100020681715_200025704644 [1,1,0,0,0,0|0,0,2]=4 2536 B11R0.148 CCCCCCC=NNC(=O)C 4a_100000189765_100000234349 [1,1,0,0,0,0|1,0,1]=4 2537 B11R0.148 CCCCCCCC=CC(=O)C 1458a_200015332781_200000210301 [1,1,0,0,0,0|0,0,2]=4 2538 B11R0.148 CCCCCCCC=CC(=O)[13CH3] 1458a_200015332781_200025704644 [1,1,0,0,0,0|0,0,2]=4 2539 B11R0.148 CCCCCCCCCC(=O)C 1458a_100000070787_100000210670 [1,1,0,0,0,0|0,0,2]=4 2540 B11R0.148 CCCCCCCCCC(=O)C 1458a_100000210558_200000210301 [1,1,0,0,0,0|0,0,2]=4 2541 B11R0.148 CCCCCCCCCC(=O)[13CH3] 1458a_100000210558_200025704644 [1,1,0,0,0,0|0,0,2]=4 2542 B11R0.148 CCCCCCCCNC(=O)C 11a_100000229939_100015343762 [1,1,0,0,0,0|0,0,2]=4 2543 B11R0.148 CCCCCCCCNC(=O)C 1626a_100000229939_100015343762 [1,1,0,0,0,0|0,0,2]=4 2544 B11R0.148 CCCCCCCCNC(=O)C 240690a_100000229939_100015343762 [1,1,0,0,0,0|0,0,2]=4 2545 B11R0.148 CCCCCCCCNC(=O)C 527a_100000229939_100103153847 [1,1,0,0,0,0|0,0,2]=4 2546 B11R0.148 CCCCCCCNCC(=O)O 269956a_100016091260_100000210614 [1,1,0,0,0,0|0,0,2]=4 2547 B11R0.148 CCCCCCCOCC(=O)C 34a_100000211253_100000210614 [1,1,0,0,0,0|0,0,2]=4 2548 B11R0.148 CCCCCCNOCC(=O)O 269956a_100000106656_100000210757 [1,1,0,0,0,0|1,0,1]=4 2549 B11R0.148 CCCCCCOCCC(=O)C 34a_100000759926_100000210314 [1,1,0,0,0,0|0,0,2]=4 2550 B11R0.148 CCCCCCOCCC(=O)C 7a_100000210259_100000053229 [1,1,0,0,0,0|0,0,2]=4 2551 B11R0.148 CCCCCCOCCC(=O)C 7a_100000759926_100000210314 [1,1,0,0,0,0|0,0,2]=4 2552 B11R0.148 CCCCCCOCOC(=O)C 34a_100000210259_100009813279 [1,1,0,0,0,0|1,0,1]=4 2553 B11R0.148 CCCCCCSCCC(=O)C 62a_100000053229_100000210757 [1,1,0,0,0,0|0,0,2]=4 2554 B11R0.148 CCCCCCSCCC(=O)C 62a_100000210314_100000053229 [1,1,0,0,0,0|0,0,2]=4 2555 B11R0.148 CCCCCCSCOC(=O)C 62a_100000076356_100000210757 [1,1,0,0,0,0|1,0,1]=4 2556 B11R0.148 CCCCCCSCOC(=O)C 62a_100000210314_100000076356 [1,1,0,0,0,0|1,0,1]=4 2557 B11R0.148 CCCCCNCCNC(=O)C 2230a_100000209853_100000210326 [1,1,0,0,0,0|1,0,1]=4 2558 B11R0.148 CCCCCNCCNC(=O)C 2230a_100000209983_100000189650 [1,1,0,0,0,0|1,0,1]=4 2559 B11R0.148 CCCCCOCCCC(=O)C 34a_100000210253_100000685027 [1,1,0,0,0,0|0,0,2]=4 2560 B11R0.148 CCCCCOCCCC(=O)C 34a_100000759063_100000718602 [1,1,0,0,0,0|0,0,2]=4 2561 B11R0.148 CCCCCOCCCC(=O)C 7a_100000210253_100011215641 [1,1,0,0,0,0|0,0,2]=4 2562 B11R0.148 CCCCCOCCCC(=O)C 7a_100000759063_100000210326 [1,1,0,0,0,0|0,0,2]=4 2563 B11R0.148 CCCCCOCCNC(=O)C 34a_100000158858_100000718602 [1,1,0,0,0,0|1,0,1]=4 2564 B11R0.148 CCCCCOCCNC(=O)C 7a_100000210253_100000189650 [1,1,0,0,0,0|1,0,1]=4 2565 B11R0.148 CCCCCOCCOC(=O)C 34a_100000210253_100009814007 [1,1,0,0,0,0|1,0,1]=4 2566 B11R0.148 CCCCCOCCOC(=O)C 7a_100000210253_100009814007 [1,1,0,0,0,0|1,0,1]=4 2567 B11R0.148 CCCCCSCCCC(=O)C 62a_100000210326_100011215641 [1,1,0,0,0,0|0,0,2]=4 2568 B11R0.148 CCCCCSCCCC(=O)C 62a_100011215641_100000210326 [1,1,0,0,0,0|0,0,2]=4 2569 B11R0.148 CCCCCSCCNC(=O)C 62a_100000189650_100000210326 [1,1,0,0,0,0|1,0,1]=4 2570 B11R0.148 CCCCCSCCNC(=O)C 62a_100000210326_100000189650 [1,1,0,0,0,0|1,0,1]=4 2571 B11R0.148 CCCCCSCCOC(=O)C 62a_100000210326_100009814007 [1,1,0,0,0,0|1,0,1]=4 2572 B11R0.148 CCCCCSCCOC(=O)C 62a_100009814007_100000210326 [1,1,0,0,0,0|1,0,1]=4 2573 B11R0.148 CCCCNCCCCC(=O)C 7a_106832991798_100000735457 [1,1,0,0,0,0|0,0,2]=4 2574 B11R0.148 CCCCNCCCNC(=O)C 34a_100000736810_100000210210 [1,1,0,0,0,0|1,0,1]=4 2575 B11R0.148 CCCCNCCCOC(=O)C 7a_106832991798_100000042594 [1,1,0,0,0,0|1,0,1]=4 2576 B11R0.148 CCCCNCCCSC(=O)C 2230a_100000102301_100000038929 [1,1,0,0,0,0|1,0,1]=4 2577 B11R0.148 CCCCNCCCSC(=O)C 7a_106832991798_100000038929 [1,1,0,0,0,0|1,0,1]=4 2578 B11R0.148 CCCCNCCOCC(=O)O 269956a_100000700818_100000210211 [1,1,0,0,0,0|1,0,1]=4 2579 B11R0.148 CCCCOCCCCC(=O)C 34a_100000210227_100009817362 [1,1,0,0,0,0|0,0,2]=4 2580 B11R0.148 CCCCOCCCCC(=O)C 7a_100000210227_100000735457 [1,1,0,0,0,0|0,0,2]=4 2581 B11R0.148 CCCCOCCCNC(=O)C 1626a_200000211371_100015343762 [1,1,0,0,0,0|1,0,1]=4 2582 B11R0.148 CCCCOCCCNC(=O)C 240690a_200000211371_100015343762 [1,1,0,0,0,0|1,0,1]=4 2583 B11R0.148 CCCCOCCCNC(=O)C 34a_100000752032_100000210210 [1,1,0,0,0,0|1,0,1]=4 2584 B11R0.148 CCCCOCCCNC(=O)C 527a_200000211371_100103153847 [1,1,0,0,0,0|1,0,1]=4 2585 B11R0.148 CCCCOCCCOC(=O)C 34a_100000210227_100000042594 [1,1,0,0,0,0|1,0,1]=4 2586 B11R0.148 CCCCOCCCOC(=O)C 7a_100000210227_100000042594 [1,1,0,0,0,0|1,0,1]=4 2587 B11R0.148 CCCCOCCCSC(=O)C 34a_100000210227_100000038929 [1,1,0,0,0,0|1,0,1]=4 2588 B11R0.148 CCCCOCCCSC(=O)C 7a_100000210227_100000038929 [1,1,0,0,0,0|1,0,1]=4 2589 B11R0.148 CCCCOCCNCC(=O)O 269956a_100016091260_100000743108 [1,1,0,0,0,0|1,0,1]=4 2590 B11R0.148 CCCCOCCOCC(=O)C 1458a_100011216887_200000210301 [1,1,0,0,0,0|1,0,1]=4 2591 B11R0.148 CCCCOCCOCC(=O)C 34a_100000211253_100000743108 [1,1,0,0,0,0|1,0,1]=4 2592 B11R0.148 CCCCOCCOCC(=O)[13CH3] 1458a_100011216887_200025704644 [1,1,0,0,0,0|1,0,1]=4 2593 B11R0.148 CCCCSCCCCC(=O)C 62a_100000210211_100000735457 [1,1,0,0,0,0|0,0,2]=4 2594 B11R0.148 CCCCSCCCCC(=O)C 62a_100000735457_100000210210 [1,1,0,0,0,0|0,0,2]=4 2595 B11R0.148 CCCCSCCCOC(=O)C 62a_100000042594_100000210210 [1,1,0,0,0,0|1,0,1]=4 2596 B11R0.148 CCCCSCCCOC(=O)C 62a_100000210211_100000042594 [1,1,0,0,0,0|1,0,1]=4 2597 B11R0.148 CCCCSCCCSC(=O)C 62a_100000038929_100000210210 [1,1,0,0,0,0|1,0,1]=4 2598 B11R0.148 CCCCSCCCSC(=O)C 62a_100000210211_100000038929 [1,1,0,0,0,0|1,0,1]=4 2599 B11R0.148 CCCNCCCCNC(=O)C 2230a_200011368371_100000210303 [1,1,0,0,0,0|1,0,1]=4 2600 B11R0.148 CCCNCCCCNC(=O)C 34a_200011368371_100000210303 [1,1,0,0,0,0|1,0,1]=4 2601 B11R0.148 CCCOCCCCOC(=O)C 34a_100000073216_100000210303 [1,1,0,0,0,0|1,0,1]=4 2602 B11R0.148 CCCOCCCCOC(=O)C 34a_100000210258_100000033659 [1,1,0,0,0,0|1,0,1]=4 2603 B11R0.148 CCCOCCCCOC(=O)C 7a_100000073216_100000210303 [1,1,0,0,0,0|1,0,1]=4 2604 B11R0.148 CCCOCCCCSC(=O)C 34a_100000210258_200010402107 [1,1,0,0,0,0|1,0,1]=4 2605 B11R0.148 CCCSCCCCOC(=O)C 62a_100000033659_100000210303 [1,1,0,0,0,0|1,0,1]=4 2606 B11R0.148 CCCSCCCCOC(=O)C 62a_100000210303_100000033659 [1,1,0,0,0,0|1,0,1]=4 2607 B11R0.148 CCCSCCCCSC(=O)C 62a_100000210303_200010402107 [1,1,0,0,0,0|1,0,1]=4 2608 B11R0.148 CCCSCCCCSC(=O)C 62a_200010402107_100000210303 [1,1,0,0,0,0|1,0,1]=4 2609 B11R0.148 CCNCCCCCNC(=O)C 2230a_200012022750_100000210202 [1,1,0,0,0,0|1,0,1]=4 2610 B11R0.148 CCNCCCCCNC(=O)C 34a_200012022750_100000210202 [1,1,0,0,0,0|1,0,1]=4 2611 B11R0.148 CCNCCCCCOC(=O)C 2230a_100015525214_100009813381 [1,1,0,0,0,0|1,0,1]=4 2612 B11R0.148 CCOCCCCCOC(=O)C 34a_100121572206_100000033007 [1,1,0,0,0,0|1,0,1]=4 2613 B11R0.148 CCSCCCCCOC(=O)C 62a_100000033007_100000210202 [1,1,0,0,0,0|1,0,1]=4 2614 B11R0.148 CCSCCCCCOC(=O)C 62a_100000210202_100000033007 [1,1,0,0,0,0|1,0,1]=4 2615 B11R0.148 CNCCCCCCNC(=O)C 2230a_200011996284_200000210301 [1,1,0,0,0,0|1,0,1]=4 2616 B11R0.148 CNCCCCCCNC(=O)C 34a_200011996284_200000210301 [1,1,0,0,0,0|1,0,1]=4 2617 B11R0.148 O=C(O)CNCCCCCCF 269956a_100016091260_100015922095 [1,1,0,0,0,0|1,0,1]=4 2618 B11R0.148 O=C(O)CNCCCCCCO 269956a_100016091260_100000766143 [1,1,0,0,0,0|1,0,1]=4 2619 B11R0.3 CCCC#CCCOCCCC 34a_100000042726_100000210210 [1,1,0,0,0,0|1,0,1]=4 2620 B11R0.3 CCCC#CCCOCCCC 7a_100000042726_100000210211 [1,1,0,0,0,0|1,0,1]=4 2621 B11R0.3 CCCC#CCOCCCCC 34a_100000034806_100000718602 [1,1,0,0,0,0|1,0,1]=4 2622 B11R0.3 CCCC#CCOCCCCC 7a_100000034806_100000210326 [1,1,0,0,0,0|1,0,1]=4 2623 B11R0.3 CCCCCCC#CCCOC 34a_200000033163_200000210301 [1,1,0,0,0,0|0,0,1]=3 2624 B11R0.3 CCCCCCC#CCCOC 7a_200000033163_200000210301 [1,1,0,0,0,0|0,0,1]=3 2625 B11R0.3 CCCCCCC#CCCO[13CH3] 34a_200000033163_200025704644 [1,1,0,0,0,0|0,0,1]=3 2626 B11R0.3 CCCCCCC#CCCO[13CH3] 7a_200000033163_200025704644 [1,1,0,0,0,0|0,0,1]=3 2627 B11R0.3 CCCCCCC#CCOCC 34a_200000037284_100000210202 [1,1,0,0,0,0|0,0,1]=3 2628 B11R0.3 CCCCCCC#CCOCC 7a_200000037284_100000210202 [1,1,0,0,0,0|0,0,1]=3 2629 B11R0.3 CCCCCCC#CCOCF 34a_200000037284_100015361967 [1,1,0,0,0,0|0,0,1]=3 2630 B11R0.3 CCCCCCC#CCOCF 7a_200000037284_100015361967 [1,1,0,0,0,0|0,0,1]=3 2631 B11R0.3 CCCCCCCC#CCOC 34a_200000061759_200000210301 [1,1,0,0,0,0|0,0,1]=3 2632 B11R0.3 CCCCCCCC#CCOC 7a_200000061759_200000210301 [1,1,0,0,0,0|0,0,1]=3 2633 B11R0.3 CCCCCCCC#CCO[13CH3] 34a_200000061759_200025704644 [1,1,0,0,0,0|0,0,1]=3 2634 B11R0.3 CCCCCCCC#CCO[13CH3] 7a_200000061759_200025704644 [1,1,0,0,0,0|0,0,1]=3 2635 B11R0.81 CCCCCCC(=O)C=COC 1458a_100016268678_100000210757 [1,1,0,0,0,0|0,0,2]=4 2636 B11R0.70 CCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210211 [1,1,0,0,0,0|0,0,2]=4 2637 B11R0.70 CCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210211 [1,1,0,0,0,0|1,0,1]=4 2638 B11R0.70 CCCCC(C)CCC(=O)CC 1458a_100000033779_100000210202 [1,1,0,0,0,0|1,0,1]=4 2639 B11R0.70 CCCCC(C)CCC(=O)NC 11a_106832991635_100000033779 [1,1,0,0,0,0|1,0,1]=4 2640 B11R0.70 CCCCC(C)CCC(=O)NC 1626a_100102657272_100000033779 [1,1,0,0,0,0|1,0,1]=4 2641 B11R0.70 CCCCC(C)CCC(=O)NC 240690a_100102657272_100000033779 [1,1,0,0,0,0|1,0,1]=4 2642 B11R0.70 CCCCC(C)CCC(=O)NC 527a_100102657272_100000033779 [1,1,0,0,0,0|1,0,1]=4 2643 B11R0.70 CCCCC(C)NCC(=O)OC 2230a_100000126638_100000747449 [1,1,0,0,0,0|1,0,1]=4 2644 B11R0.70 CCCCC(C)OCC(=O)OC 34a_100000687866_100000747449 [1,1,0,0,0,0|1,0,1]=4 2645 B11R0.70 CCCCC(C)OCC(=O)OC 7a_100000687866_100000747449 [1,1,0,0,0,0|1,0,1]=4 2646 B11R0.70 CCCCC(C)SCC(=O)OC 62a_100000747449_200011215066 [1,1,0,0,0,0|1,0,1]=4 2647 B11R0.70 CCCCC(C)SCC(=O)OC 62a_200011215066_100000747449 [1,1,0,0,0,0|1,0,1]=4 2648 B11R0.70 CCCCN(C)CCC(=O)OC 2230a_100000207549_100000204255 [1,1,0,0,0,0|1,0,1]=4 2649 B11R0.70 CCCCN(C)CCC(=O)OC 269982a_100000207549_100000204255 [1,1,0,0,0,0|1,0,1]=4 2650 B11R0.70 CCCCN(C)CCC(=O)OC 269982a_100025711912_100000210211 [1,1,0,0,0,0|1,0,1]=4 2651 B11R0.106 CCC(=O)CCCCC(=O)OC 1458a_100000210414_100000204269 [1,1,0,0,0,0|0,0,2]=4 2652 B11R0.106 CCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210202 [1,1,0,0,0,0|0,0,2]=4 2653 B11R0.106 CCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210202 [1,1,0,0,0,0|1,0,1]=4 2654 B11R0.106 CCC(C)CCNCC(=O)OC 2230a_100020591266_100000747449 [1,1,0,0,0,0|1,0,1]=4 2655 B11R0.106 CCC(C)CCOCC(=O)OC 7a_100011215188_100000747449 [1,1,0,0,0,0|1,0,1]=4 2656 B11R0.106 CCC(C)CNCCC(=O)OC 2230a_100020588543_100000204255 [1,1,0,0,0,0|1,0,1]=4 2657 B11R0.106 CCC(C)CSCCC(=O)OC 62a_100000204255_100000748023 [1,1,0,0,0,0|1,0,1]=4 2658 B11R0.106 CCC(C)CSCCC(=O)OC 62a_100000748023_100000204255 [1,1,0,0,0,0|1,0,1]=4 2659 B11R0.106 CCC(C)CSCOC(=O)OC 62a_100000748023_100000139417 [1,1,0,0,0,0|2,0,0]=4 2660 B11R0.106 CCC(C)NCCCC(=O)OC 2230a_100000209981_100011218270 [1,1,0,0,0,0|1,0,1]=4 2661 B11R0.106 CCC(C)OCCCC(=O)OC 7a_100000210228_100011218270 [1,1,0,0,0,0|1,0,1]=4 2662 B11R0.106 CCC(C)OCCNC(=O)OC 34a_100000757965_100011215416 [1,1,0,0,0,0|2,0,0]=4 2663 B11R0.106 CCC(C)OCCOC(=O)OC 34a_100010262106_100011215416 [1,1,0,0,0,0|2,0,0]=4 2664 B11R0.106 CCC(C)SCCCC(=O)OC 62a_100000758301_100011218270 [1,1,0,0,0,0|1,0,1]=4 2665 B11R0.106 CCC(C)SCCCC(=O)OC 62a_100011218270_100000758301 [1,1,0,0,0,0|1,0,1]=4 2666 B11R0.106 CCC(O)CNCCC(=O)OC 2230a_100011218483_100000204255 [1,1,0,0,0,0|1,0,1]=4 2667 B11R0.106 CCC(O)CSCCC(=O)OC 62a_100000204255_100011218378 [1,1,0,0,0,0|1,0,1]=4 2668 B11R0.106 CCC(O)CSCCC(=O)OC 62a_100011218378_100000204255 [1,1,0,0,0,0|1,0,1]=4 2669 B11R0.106 CCC(O)CSCOC(=O)OC 62a_100011218378_100000139417 [1,1,0,0,0,0|2,0,0]=4 2670 B11R0.106 CCN(C)CCCCC(=O)OC 2230a_100000225621_100000204269 [1,1,0,0,0,0|1,0,1]=4 2671 B11R0.106 CCN(C)CCCCC(=O)OC 269982a_100000225621_100000204269 [1,1,0,0,0,0|1,0,1]=4 2672 B11R0.106 CC[C@H](C)COCCC(=O)OC 7a_100009816381_100000204255 [1,1,0,0,0,0|1,0,1]=4 2673 B11R0.106 CC[C@H](C)CSCCC(=O)OC 62a_100000204255_100009816398 [1,1,0,0,0,0|1,0,1]=4 2674 B11R0.106 CC[C@H](C)CSCCC(=O)OC 62a_100009816398_100000204255 [1,1,0,0,0,0|1,0,1]=4 2675 B11R0.106 CC[C@H](C)CSCOC(=O)OC 62a_100009816398_100000139417 [1,1,0,0,0,0|2,0,0]=4 2676 B11R0.142 C=C(COCCCC)C(=O)OC 34a_100000210227_100009813391 [1,1,0,0,0,0|1,0,1]=4 2677 B11R0.142 C=C(CSCCCC)C(=O)OC 62a_100000210211_100009813391 [1,1,0,0,0,0|1,0,1]=4 2678 B11R0.142 C=C(CSCCCC)C(=O)OC 62a_100009813391_100000210210 [1,1,0,0,0,0|1,0,1]=4 2679 B11R0.142 CCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210757 [1,1,0,0,0,0|1,0,1]=4 2680 B11R0.142 CCCCCCC(C)C(=O)CC 1458a_100000210414_100011215978 [1,1,0,0,0,0|1,0,1]=4 2681 B11R0.142 CCCCCCC(O)C(=O)CC 1458a_100011215828_100000210202 [1,1,0,0,0,0|1,0,1]=4 2682 B11R0.142 CCCCCCC(O)C(=O)NC 240690a_100102657272_100011215828 [1,1,0,0,0,0|1,0,1]=4 2683 B11R0.142 CCCCCCN(C)C(=O)CC 11a_106256046315_100000210414 [1,1,0,0,0,0|2,0,0]=4 2684 B11R0.142 CCCCCCN(C)C(=O)CC 1626a_106256046315_100000210414 [1,1,0,0,0,0|2,0,0]=4 2685 B11R0.142 CCCCCCN(C)C(=O)CC 240690a_106256046315_100000210414 [1,1,0,0,0,0|2,0,0]=4 2686 B11R0.142 CCCCCCN(C)C(=O)CC 527a_106256046315_100000210414 [1,1,0,0,0,0|2,0,0]=4 2687 B11R0.142 CCCCCCN(C)C(=O)NC 2708a_100102657272_106256046315 [1,1,0,0,0,0|2,0,0]=4 2688 B11R0.142 CCCCCCN(C)C(=O)NC 273464a_100102657272_106256046315 [1,1,0,0,0,0|2,0,0]=4 2689 B11R0.142 CCCCCNC(=O)C(=O)OC 11a_100000209983_100000024059 [1,1,0,0,0,0|1,0,1]=4 2690 B11R0.142 CCCCCNC(=O)C(=O)OC 1626a_100000209983_100000024059 [1,1,0,0,0,0|1,0,1]=4 2691 B11R0.142 CCCCCNC(=O)C(=O)OC 240690a_100000209983_100000024059 [1,1,0,0,0,0|1,0,1]=4 2692 B11R0.142 CCCCCNC(=O)C(=O)OC 527a_100000209983_100000024059 [1,1,0,0,0,0|1,0,1]=4 2693 B11R0.142 CCCCCNC(C)C(=O)OC 2230a_100000209983_100000211248 [1,1,0,0,0,0|1,0,1]=4 2694 B11R0.142 CCCCCOC(C)C(=O)OC 34a_100000210253_100000211248 [1,1,0,0,0,0|1,0,1]=4 2695 B11R0.142 CCCCCOC(C)C(=O)OC 34a_100011215400_100000718602 [1,1,0,0,0,0|1,0,1]=4 2696 B11R0.142 CCCCCOC(C)C(=O)OC 7a_100000210253_100000211248 [1,1,0,0,0,0|1,0,1]=4 2697 B11R0.142 CCCCCSC(C)C(=O)OC 62a_100000210326_100000211248 [1,1,0,0,0,0|1,0,1]=4 2698 B11R0.142 CCCCCSC(C)C(=O)OC 62a_100000211248_100000210326 [1,1,0,0,0,0|1,0,1]=4 2699 B11R0.142 CCCCOCC(=O)C(=O)OC 34a_100000210227_100011610305 [1,1,0,0,0,0|1,0,1]=4 2700 B11R0.142 CCCCOCC(C)C(=O)OC 34a_100000210227_100000698445 [1,1,0,0,0,0|1,0,1]=4 2701 B11R0.142 CCCCOCC(C)C(=O)OC 34a_100000749362_100000210210 [1,1,0,0,0,0|1,0,1]=4 2702 B11R0.142 CCCCOCC(C)C(=O)OC 7a_100000749362_100000210211 [1,1,0,0,0,0|1,0,1]=4 2703 B11R0.142 CCCCOCC(F)C(=O)OC 34a_200009849844_100000210210 [1,1,0,0,0,0|1,0,1]=4 2704 B11R0.142 CCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210210 [1,1,0,0,0,0|1,0,1]=4 2705 B11R0.142 CCCCSCC(=O)C(=O)OC 62a_100000210211_100011610305 [1,1,0,0,0,0|1,0,1]=4 2706 B11R0.142 CCCCSCC(=O)C(=O)OC 62a_100011610305_100000210210 [1,1,0,0,0,0|1,0,1]=4 2707 B11R0.142 CCCCSCC(C)C(=O)OC 62a_100000210211_100000698445 [1,1,0,0,0,0|1,0,1]=4 2708 B11R0.142 CCCCSCC(C)C(=O)OC 62a_100000698445_100000210210 [1,1,0,0,0,0|1,0,1]=4 2709 B11R0.142 CCCOCCC(C)C(=O)OC 34a_100000210258_100000034942 [1,1,0,0,0,0|1,0,1]=4 2710 B11R0.142 CCCSCCC(C)C(=O)OC 62a_100000034942_100000210303 [1,1,0,0,0,0|1,0,1]=4 2711 B11R0.142 CCCSCCC(C)C(=O)OC 62a_100000210303_100000034942 [1,1,0,0,0,0|1,0,1]=4 2712 B11R0.154 CCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210326 [1,1,0,0,0,0|0,0,2]=4 2713 B11R0.154 CCCCCC(=O)CC(=O)OC 1458a_100000212188_100000747449 [1,1,0,0,0,0|0,0,2]=4 2714 B11R0.154 CCCCCC(C)NC(=O)CC 11a_100000211957_100000210414 [1,1,0,0,0,0|2,0,0]=4 2715 B11R0.154 CCCCCC(C)NC(=O)CC 1626a_100000211957_100000210414 [1,1,0,0,0,0|2,0,0]=4 2716 B11R0.154 CCCCCC(C)NC(=O)CC 240690a_100000211957_100000210414 [1,1,0,0,0,0|2,0,0]=4 2717 B11R0.154 CCCCCC(C)NC(=O)CC 527a_100000211957_100000210414 [1,1,0,0,0,0|2,0,0]=4 2718 B11R0.154 CCCCCC(C)NC(=O)NC 2708a_100000211957_106832991635 [1,1,0,0,0,0|2,0,0]=4 2719 B11R0.154 CCCCCC(C)NC(=O)NC 2708a_100102657272_100000211957 [1,1,0,0,0,0|2,0,0]=4 2720 B11R0.154 CCCCCC(C)NC(=O)NC 273464a_100000211957_100102657272 [1,1,0,0,0,0|2,0,0]=4 2721 B11R0.154 CCCCCC(C)NC(=O)NC 273464a_100102657272_100000211957 [1,1,0,0,0,0|2,0,0]=4 2722 B11R0.154 CCCCCC(C)NC(=O)NC 512a_100000211957_100102657272 [1,1,0,0,0,0|2,0,0]=4 2723 B11R0.154 CCCCCC(C)NC(=O)NC 512a_106832991638_100000211957 [1,1,0,0,0,0|2,0,0]=4 2724 B11R0.154 CCCCCN(C)CC(=O)OC 2230a_100000198492_100000210326 [1,1,0,0,0,0|1,0,1]=4 2725 B11R0.154 CCCCCN(C)CC(=O)OC 2230a_100000223495_100000747449 [1,1,0,0,0,0|1,0,1]=4 2726 B11R0.154 CCCCCN(C)CC(=O)OC 269982a_100000223495_100000747449 [1,1,0,0,0,0|1,0,1]=4 2727 B11R0.154 CCCCNC(C)CC(=O)OC 2230a_100000102301_100009817358 [1,1,0,0,0,0|1,0,1]=4 2728 B11R0.154 CCCCNC(C)CC(=O)OC 7a_106832991798_100009817358 [1,1,0,0,0,0|1,0,1]=4 2729 B11R0.154 CCCCOC(C)CC(=O)OC 34a_100000210227_100009817358 [1,1,0,0,0,0|1,0,1]=4 2730 B11R0.154 CCCCOC(C)CC(=O)OC 7a_100000210227_100009817358 [1,1,0,0,0,0|1,0,1]=4 2731 B11R0.154 CCCCSC(C)CC(=O)OC 62a_100000210211_100009817358 [1,1,0,0,0,0|1,0,1]=4 2732 B11R0.154 CCCCSC(C)CC(=O)OC 62a_100009817358_100000210210 [1,1,0,0,0,0|1,0,1]=4 2733 B11R0.154 CCCOC[C@H](O)CC(=O)OC 34a_100000210258_100000754131 [1,1,0,0,0,0|1,0,1]=4 2734 B11R0.154 CCCSC[C@H](O)CC(=O)OC 62a_100000210303_100000754131 [1,1,0,0,0,0|1,0,1]=4 2735 B11R0.154 CCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210303 [1,1,0,0,0,0|1,0,1]=4 2736 B11R0.174 CCCC(=O)CCCC(=O)OC 1458a_100000211992_100011218270 [1,1,0,0,0,0|0,0,2]=4 2737 B11R0.174 CCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210303 [1,1,0,0,0,0|0,0,2]=4 2738 B11R0.174 CCCC(C)COCC(=O)OC 34a_100000688023_100000747449 [1,1,0,0,0,0|1,0,1]=4 2739 B11R0.174 CCCC(C)COCC(=O)OC 7a_100000688023_100000747449 [1,1,0,0,0,0|1,0,1]=4 2740 B11R0.174 CCCC(C)CSCC(=O)OC 62a_100000747449_100011216630 [1,1,0,0,0,0|1,0,1]=4 2741 B11R0.174 CCCC(C)CSCC(=O)OC 62a_100011216630_100000747449 [1,1,0,0,0,0|1,0,1]=4 2742 B11R0.174 CCCC(C)NCCC(=O)OC 2230a_100000741246_100000204255 [1,1,0,0,0,0|1,0,1]=4 2743 B11R0.174 CCCC(C)OCCC(=O)OC 34a_100000764384_100000742370 [1,1,0,0,0,0|1,0,1]=4 2744 B11R0.174 CCCC(C)OCCC(=O)OC 7a_100000764384_100000204255 [1,1,0,0,0,0|1,0,1]=4 2745 B11R0.174 CCCC(C)SCCC(=O)OC 62a_100000204255_100000766640 [1,1,0,0,0,0|1,0,1]=4 2746 B11R0.174 CCCC(C)SCCC(=O)OC 62a_100000766640_100000204255 [1,1,0,0,0,0|1,0,1]=4 2747 B11R0.174 CCCC(C)SCOC(=O)OC 62a_100000766640_100000139417 [1,1,0,0,0,0|2,0,0]=4 2748 B11R0.174 CCCN(C)CCCC(=O)OC 2230a_100000747261_100011218270 [1,1,0,0,0,0|1,0,1]=4 2749 B11R0.174 CCCN(C)CCCC(=O)OC 269982a_100000739225_100000210303 [1,1,0,0,0,0|1,0,1]=4 2750 B11R0.174 CCCN(C)CCCC(=O)OC 269982a_100000747261_100011218270 [1,1,0,0,0,0|1,0,1]=4 2751 B11R0.174 CCC[C@H](N)COCC(=O)OC 34a_100000732646_100000747449 [1,1,0,0,0,0|1,0,1]=4 2752 B13R0.2 CCCCCCC=NNC(=O)COC 4a_100000216845_100000234349 [0,2,0,0,0,0|1,0,1]=4 2753 B13R0.2 CCCCCCCCCC(=O)COC 1458a_100000210968_100000210670 [0,2,0,0,0,0|0,0,2]=4 2754 B13R0.2 CCCCCCCCNC(=O)COC 11a_100000229939_100000210968 [0,2,0,0,0,0|0,0,2]=4 2755 B13R0.2 CCCCCCCCNC(=O)COC 1626a_100000229939_100000210968 [0,2,0,0,0,0|0,0,2]=4 2756 B13R0.2 CCCCCCCCNC(=O)COC 240690a_100000229939_100000210968 [0,2,0,0,0,0|0,0,2]=4 2757 B13R0.2 CCCCCCCCNC(=O)COC 527a_100000229939_100000210968 [0,2,0,0,0,0|0,0,2]=4 2758 B13R0.2 CCCCCCCNCC(=O)OCC 2230a_100000229938_100000188475 [0,2,0,0,0,0|0,0,2]=4 2759 B13R0.2 CCCCCCCOCC(=O)OCC 34a_100000210272_100000188475 [0,2,0,0,0,0|0,0,2]=4 2760 B13R0.2 CCCCCCCOCC(=O)OCC 7a_100000210272_100000188475 [0,2,0,0,0,0|0,0,2]=4 2761 B13R0.2 CCCCCCCSCC(=O)OCC 62a_100000188475_100000210316 [0,2,0,0,0,0|0,0,2]=4 2762 B13R0.2 CCCCCCCSCC(=O)OCC 62a_100000210614_100000188475 [0,2,0,0,0,0|0,0,2]=4 2763 B13R0.2 CCCCCCNCCC(=O)OCC 2230a_100000210581_100011206558 [0,2,0,0,0,0|0,0,2]=4 2764 B13R0.2 CCCCCCOCCC(=O)OCC 34a_100000210259_100000765890 [0,2,0,0,0,0|0,0,2]=4 2765 B13R0.2 CCCCCCOCCC(=O)OCC 7a_100000210259_100011206558 [0,2,0,0,0,0|0,0,2]=4 2766 B13R0.2 CCCCCCSCCC(=O)OCC 62a_100000210314_100000765890 [0,2,0,0,0,0|0,0,2]=4 2767 B13R0.2 CCCCCCSCCC(=O)OCC 62a_100000765890_100000210757 [0,2,0,0,0,0|0,0,2]=4 2768 B13R0.2 CCCCCCSCOC(=O)OCC 62a_100000210314_100000075025 [0,2,0,0,0,0|1,0,1]=4 2769 B13R0.2 CCCCCNC/C=C/C(=O)OCC 2230a_100000209983_100016267167 [0,2,0,0,0,0|0,0,2]=4 2770 B13R0.2 CCCCCNCCCC(=O)OCC 2230a_100000209983_100009991533 [0,2,0,0,0,0|0,0,2]=4 2771 B13R0.2 CCCCCOC/C=C/C(=O)OCC 34a_100000210253_100016267167 [0,2,0,0,0,0|0,0,2]=4 2772 B13R0.2 CCCCCOC/C=C/C(=O)OCC 7a_100000210253_100016267167 [0,2,0,0,0,0|0,0,2]=4 2773 B13R0.2 CCCCCOCCCC(=O)OCC 34a_100000210253_100009991533 [0,2,0,0,0,0|0,0,2]=4 2774 B13R0.2 CCCCCOCCCC(=O)OCC 7a_100000210253_100011215271 [0,2,0,0,0,0|0,0,2]=4 2775 B13R0.2 CCCCCOCCCC(=O)OCC 7a_100012001163_100000210326 [0,2,0,0,0,0|0,0,2]=4 2776 B13R0.2 CCCCCOCCNC(=O)OCC 34a_100000158857_100000718602 [0,2,0,0,0,0|1,0,1]=4 2777 B13R0.2 CCCCCOCCNC(=O)OCC 7a_100000210253_200011445536 [0,2,0,0,0,0|1,0,1]=4 2778 B13R0.2 CCCCCSC/C=C/C(=O)OCC 62a_100000210326_100016267167 [0,2,0,0,0,0|0,0,2]=4 2779 B13R0.2 CCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210326 [0,2,0,0,0,0|0,0,2]=4 2780 B13R0.2 CCCCCSCCCC(=O)OCC 62a_100000210326_100009991533 [0,2,0,0,0,0|0,0,2]=4 2781 B13R0.2 CCCCCSCCCC(=O)OCC 62a_100009991533_100000210326 [0,2,0,0,0,0|0,0,2]=4 2782 B13R0.2 CCCCCSCCNC(=O)OCC 62a_100000210326_200011445536 [0,2,0,0,0,0|1,0,1]=4 2783 B13R0.2 CCCCNCCCCC(=O)OCC 2230a_100000102301_100000750268 [0,2,0,0,0,0|0,0,2]=4 2784 B13R0.2 CCCCNCCCCC(=O)OCC 7a_106832991798_100000750268 [0,2,0,0,0,0|0,0,2]=4 2785 B13R0.2 CCCCNCCOCC(=O)OCC 2230a_100000102301_100000088970 [0,2,0,0,0,0|1,0,1]=4 2786 B13R0.2 CCCCNCCOCC(=O)OCC 7a_106832991798_100000088970 [0,2,0,0,0,0|1,0,1]=4 2787 B13R0.2 CCCCOCCCCC(=O)OCC 34a_100000210227_100000750268 [0,2,0,0,0,0|0,0,2]=4 2788 B13R0.2 CCCCOCCCCC(=O)OCC 7a_100000210227_100000750268 [0,2,0,0,0,0|0,0,2]=4 2789 B13R0.2 CCCCOCCCNC(=O)COC 1626a_200000211371_100000210968 [0,2,0,0,0,0|1,0,1]=4 2790 B13R0.2 CCCCOCCCNC(=O)COC 240690a_200000211371_100000210968 [0,2,0,0,0,0|1,0,1]=4 2791 B13R0.2 CCCCOCCCNC(=O)COC 527a_200000211371_100000210968 [0,2,0,0,0,0|1,0,1]=4 2792 B13R0.2 CCCCOCCOCC(=O)OCC 34a_100000210227_100000088970 [0,2,0,0,0,0|1,0,1]=4 2793 B13R0.2 CCCCOCCOCC(=O)OCC 34a_100000210238_100000188475 [0,2,0,0,0,0|1,0,1]=4 2794 B13R0.2 CCCCOCCOCC(=O)OCC 7a_100000210227_100000088970 [0,2,0,0,0,0|1,0,1]=4 2795 B13R0.2 CCCCOCCOCC(=O)OCC 7a_100000210238_100000188475 [0,2,0,0,0,0|1,0,1]=4 2796 B13R0.2 CCCCOCCSCC(=O)OCC 62a_100000188475_100000743108 [0,2,0,0,0,0|1,0,1]=4 2797 B13R0.2 CCCCOCCSCC(=O)OCC 62a_100000743108_100000188475 [0,2,0,0,0,0|1,0,1]=4 2798 B13R0.2 CCCCOCCSCC(=O)OCC 7a_200000230590_100000210211 [0,2,0,0,0,0|1,0,1]=4 2799 B13R0.2 CCCCSCCCCC(=O)OCC 62a_100000210211_100000750268 [0,2,0,0,0,0|0,0,2]=4 2800 B13R0.2 CCCCSCCCCC(=O)OCC 62a_100000750268_100000210210 [0,2,0,0,0,0|0,0,2]=4 2801 B13R0.2 CCCCSCCNCC(=O)OCC 2230a_100025743550_100000188475 [0,2,0,0,0,0|1,0,1]=4 2802 B13R0.2 CCCCSCCOCC(=O)OCC 34a_200000230436_100000188475 [0,2,0,0,0,0|1,0,1]=4 2803 B13R0.2 CCCCSCCOCC(=O)OCC 62a_100000088970_100000210210 [0,2,0,0,0,0|1,0,1]=4 2804 B13R0.2 CCCCSCCOCC(=O)OCC 62a_100000210211_100000088970 [0,2,0,0,0,0|1,0,1]=4 2805 B13R0.2 CCCCSCCOCC(=O)OCC 7a_200000230436_100000188475 [0,2,0,0,0,0|1,0,1]=4 2806 B13R0.2 CCCOCCCCCC(=O)OCC 34a_100000210258_100000755133 [0,2,0,0,0,0|0,0,2]=4 2807 B13R0.2 CCCOCCCCCC(=O)OCC 7a_100011214988_100000210303 [0,2,0,0,0,0|0,0,2]=4 2808 B13R0.2 CCCOCCCNCC(=O)OCC 2230a_100011217757_100000188475 [0,2,0,0,0,0|1,0,1]=4 2809 B13R0.2 CCCOCCCNCC(=O)OCC 34a_100011217757_100000188475 [0,2,0,0,0,0|1,0,1]=4 2810 B13R0.2 CCCOCCCOCC(=O)OCC 34a_100000210258_100009893628 [0,2,0,0,0,0|1,0,1]=4 2811 B13R0.2 CCCSCCCCCC(=O)OCC 62a_100000210303_100000755133 [0,2,0,0,0,0|0,0,2]=4 2812 B13R0.2 CCCSCCCCCC(=O)OCC 62a_100000755133_100000210303 [0,2,0,0,0,0|0,0,2]=4 2813 B13R0.2 CCCSCCCOCC(=O)OCC 62a_100000210303_100009893628 [0,2,0,0,0,0|1,0,1]=4 2814 B13R0.2 CCCSCCCOCC(=O)OCC 62a_100009893628_100000210303 [0,2,0,0,0,0|1,0,1]=4 2815 B13R0.2 CCNCCCCCCC(=O)OCC 2230a_100015525214_100009814379 [0,2,0,0,0,0|0,0,2]=4 2816 B13R0.2 CCOC(=O)CCCCCCCNC 2230a_106832991635_100009991516 [0,2,0,0,0,0|0,0,2]=4 2817 B13R0.2 CCOC(=O)CCCCCCCNC 34a_100102657272_100009991516 [0,2,0,0,0,0|0,0,2]=4 2818 B13R0.2 CCOC(=O)CCCCCCCNC 7a_106832991635_100009991516 [0,2,0,0,0,0|0,0,2]=4 2819 B13R0.2 CCOC(=O)CCCCCCCOC 34a_100138415774_100009991516 [0,2,0,0,0,0|0,0,2]=4 2820 B13R0.2 CCOC(=O)CCCCCCCSC 62a_200000210301_100009991516 [0,2,0,0,0,0|0,0,2]=4 2821 B13R0.2 CCOC(=O)CCCCCCCS[13CH3] 62a_200025704644_100009991516 [0,2,0,0,0,0|0,0,2]=4 2822 B13R0.2 CCOC(=O)CCCCCCSCC 62a_100000210202_100009814379 [0,2,0,0,0,0|0,0,2]=4 2823 B13R0.2 CCOC(=O)CNCCCCCCO 2230a_100000686447_100000188475 [0,2,0,0,0,0|1,0,1]=4 2824 B13R0.2 CCOC(=O)CNCCCCCCO 34a_100000686447_100000188475 [0,2,0,0,0,0|1,0,1]=4 2825 B13R0.2 CCOC(=O)CNCCCCCOC 2230a_100000747528_100000188475 [0,2,0,0,0,0|1,0,1]=4 2826 B13R0.2 CCOC(=O)CNCCCCCOC 34a_100000747528_100000188475 [0,2,0,0,0,0|1,0,1]=4 2827 B13R0.2 CCOC(=O)COCCCCCCBr 34a_100011215345_100000188475 [0,2,0,0,0,0|1,0,1]=4 2828 B13R0.2 CCOC(=O)COCCCCCCBr 7a_100011215345_100000188475 [0,2,0,0,0,0|1,0,1]=4 2829 B13R0.2 CCOC(=O)COCCCCCCCl 34a_100000766143_100000188475 [0,2,0,0,0,0|1,0,1]=4 2830 B13R0.2 CCOC(=O)COCCCCCCCl 7a_100000766143_100000188475 [0,2,0,0,0,0|1,0,1]=4 2831 B13R0.2 CCOC(=O)COCCCCCCF 34a_100000732779_100000188475 [0,2,0,0,0,0|1,0,1]=4 2832 B13R0.2 CCOC(=O)COCCCCCCF 7a_100000732779_100000188475 [0,2,0,0,0,0|1,0,1]=4 2833 B13R0.2 CCOC(=O)COCCCCCCN 34a_100000686447_100000188475 [0,2,0,0,0,0|1,0,1]=4 2834 B13R0.2 CCOC(=O)COCCCCCNC 34a_100000722520_100000188475 [0,2,0,0,0,0|1,0,1]=4 2835 B13R0.2 CCOC(=O)CSCCCCCCF 62a_100000188475_100015922095 [0,2,0,0,0,0|1,0,1]=4 2836 B13R0.2 CCOC(=O)CSCCCCCCF 62a_100015922095_100000188475 [0,2,0,0,0,0|1,0,1]=4 2837 B13R0.2 CCOC(=O)CSCCCCCCO 62a_100000188475_100000766143 [0,2,0,0,0,0|1,0,1]=4 2838 B13R0.2 CCOC(=O)CSCCCCCCO 62a_100000766143_100000188475 [0,2,0,0,0,0|1,0,1]=4 2839 B13R0.2 CCOCCCCCCC(=O)OCC 34a_100121572206_100009814379 [0,2,0,0,0,0|0,0,2]=4 2840 B13R0.2 COCC(=O)CCCCCCCCO 1458a_100000210968_100000033203 [0,2,0,0,0,0|0,0,2]=4 2841 B13R0.2 COCC(=O)NCCCCCCCO 240690a_100011996573_100000210968 [0,2,0,0,0,0|1,0,1]=4 2842 B13R0.66 C=CCOC(=O)CNCCCCCC 2230a_100000210581_100000033060 [0,2,0,0,0,0|1,0,1]=4 2843 B13R0.66 C=CCOC(=O)COCCCCCC 34a_100000210259_100000033060 [0,2,0,0,0,0|1,0,1]=4 2844 B13R0.66 C=CCOC(=O)COCCCCCC 7a_100000210259_100000033060 [0,2,0,0,0,0|1,0,1]=4 2845 B13R0.66 C=CCOC(=O)CSCCCCCC 62a_100000033060_100000210757 [0,2,0,0,0,0|1,0,1]=4 2846 B13R0.66 C=CCOC(=O)CSCCCCCC 62a_100000210314_100000033060 [0,2,0,0,0,0|1,0,1]=4 2847 B13R0.66 CCCCCC#CCC(=O)C=COC 1458a_100016268678_100009816472 [0,2,0,0,0,0|0,0,2]=4 2848 B13R0.66 CCCCCC#CCC(=O)CCOC 1458a_100000749529_100009816472 [0,2,0,0,0,0|0,0,2]=4 2849 B13R0.66 CCCCCC#CCC(=O)COCC 1458a_100000211967_100009816472 [0,2,0,0,0,0|0,0,2]=4 2850 B13R0.66 CCCCCCC=CC(=O)CCOC 1458a_200015324643_100000233755 [0,2,0,0,0,0|0,0,2]=4 2851 B13R0.66 CCCCCCCCC(=O)C=COC 1458a_100016268678_100000210759 [0,2,0,0,0,0|0,0,2]=4 2852 B13R0.66 CCCCCCCCC(=O)CCOC 1458a_100000210188_100000233755 [0,2,0,0,0,0|0,0,2]=4 2853 B13R0.66 CCCCCCCCC(=O)CCOC 1458a_100000749529_100000210759 [0,2,0,0,0,0|0,0,2]=4 2854 B13R0.66 CCCCCCCCC(=O)COCC 1458a_100000211967_100000210759 [0,2,0,0,0,0|0,0,2]=4 2855 B13R0.66 CCCCCCCNC(=O)C=COC 1626a_100000229938_100016268678 [0,2,0,0,0,0|1,0,1]=4 2856 B13R0.66 CCCCCCCNC(=O)C=COC 240690a_100000229938_100016268678 [0,2,0,0,0,0|1,0,1]=4 2857 B13R0.66 CCCCCCCNC(=O)CCOC 11a_100000229938_100000749529 [0,2,0,0,0,0|1,0,1]=4 2858 B13R0.66 CCCCCCCNC(=O)CCOC 1626a_100000229938_100000749529 [0,2,0,0,0,0|1,0,1]=4 2859 B13R0.66 CCCCCCCNC(=O)CCOC 240690a_100000229938_100000749529 [0,2,0,0,0,0|1,0,1]=4 2860 B13R0.66 CCCCCCCNC(=O)CCOC 527a_100000229938_100000749529 [0,2,0,0,0,0|1,0,1]=4 2861 B13R0.66 CCCCCCCNC(=O)COCC 11a_100000229938_100000211967 [0,2,0,0,0,0|1,0,1]=4 2862 B13R0.66 CCCCCCCNC(=O)COCC 1626a_100000229938_100000211967 [0,2,0,0,0,0|1,0,1]=4 2863 B13R0.66 CCCCCCCNC(=O)COCC 240690a_100000229938_100000211967 [0,2,0,0,0,0|1,0,1]=4 2864 B13R0.66 CCCCCCCNC(=O)COCC 527a_100000229938_100000211967 [0,2,0,0,0,0|1,0,1]=4 2865 B13R0.66 CCCCCCNCC(=O)OCCC 2230a_100000210581_200011215008 [0,2,0,0,0,0|1,0,1]=4 2866 B13R0.66 CCCCCCOCC(=O)OCCC 34a_100000210259_200011215008 [0,2,0,0,0,0|1,0,1]=4 2867 B13R0.66 CCCCCCOCC(=O)OCCC 7a_100000210259_200011215008 [0,2,0,0,0,0|1,0,1]=4 2868 B13R0.66 CCCCCCSCC(=O)OCCC 62a_100000210314_200011215008 [0,2,0,0,0,0|1,0,1]=4 2869 B13R0.66 CCCCCCSCC(=O)OCCC 62a_200011215008_100000210757 [0,2,0,0,0,0|1,0,1]=4 2870 B13R0.87 CCCC(=O)CCCCCC(=O)OC 1458a_100000211992_100009816466 [0,2,0,0,0,0|0,0,2]=4 2871 B13R0.87 CCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210303 [0,2,0,0,0,0|0,0,2]=4 2872 B13R0.87 CCCC(C)CCCOCC(=O)OC 34a_100011713154_100000747449 [0,2,0,0,0,0|0,0,2]=4 2873 B13R0.87 CCCC(C)CCCOCC(=O)OC 7a_100011713154_100000747449 [0,2,0,0,0,0|0,0,2]=4 2874 B13R0.87 CCCC(C)CCOCCC(=O)OC 34a_100011217855_100000742370 [0,2,0,0,0,0|0,0,2]=4 2875 B13R0.87 CCCC(C)CCOCCC(=O)OC 7a_100011217855_100000204255 [0,2,0,0,0,0|0,0,2]=4 2876 B13R0.87 CCCC(C)COC/C=C/C(=O)OC 34a_100000688023_100000742655 [0,2,0,0,0,0|0,0,2]=4 2877 B13R0.87 CCCC(C)COC/C=C/C(=O)OC 7a_100000688023_100000742655 [0,2,0,0,0,0|0,0,2]=4 2878 B13R0.87 CCCC(C)COCCCC(=O)OC 34a_100000688023_100000742333 [0,2,0,0,0,0|0,0,2]=4 2879 B13R0.87 CCCC(C)COCCCC(=O)OC 7a_100000688023_100011218270 [0,2,0,0,0,0|0,0,2]=4 2880 B13R0.87 CCCC(C)COCCNC(=O)OC 34a_100000757965_100011216630 [0,2,0,0,0,0|1,0,1]=4 2881 B13R0.87 CCCC(C)COCCOC(=O)OC 34a_100010262106_100011216630 [0,2,0,0,0,0|1,0,1]=4 2882 B13R0.87 CCCC(C)CSC/C=C/C(=O)OC 62a_100000742655_100011216630 [0,2,0,0,0,0|0,0,2]=4 2883 B13R0.87 CCCC(C)CSC/C=C/C(=O)OC 62a_100011216630_100000742655 [0,2,0,0,0,0|0,0,2]=4 2884 B13R0.87 CCCC(C)CSCCCC(=O)OC 62a_100011216630_100011218270 [0,2,0,0,0,0|0,0,2]=4 2885 B13R0.87 CCCC(C)CSCCCC(=O)OC 62a_100011218270_100011216630 [0,2,0,0,0,0|0,0,2]=4 2886 B13R0.87 CCCC(C)NCCCCC(=O)OC 2230a_100000741246_100000204269 [0,2,0,0,0,0|0,0,2]=4 2887 B13R0.87 CCCC(C)NCCOCC(=O)OC 2230a_100000741246_100000090808 [0,2,0,0,0,0|1,0,1]=4 2888 B13R0.87 CCCC(C)OCCCCC(=O)OC 34a_100000059025_100000766640 [0,2,0,0,0,0|0,0,2]=4 2889 B13R0.87 CCCC(C)OCCCCC(=O)OC 34a_100000764384_100000204269 [0,2,0,0,0,0|0,0,2]=4 2890 B13R0.87 CCCC(C)OCCCCC(=O)OC 7a_100000059025_100000766640 [0,2,0,0,0,0|0,0,2]=4 2891 B13R0.87 CCCC(C)OCCCCC(=O)OC 7a_100000764384_100000204269 [0,2,0,0,0,0|0,0,2]=4 2892 B13R0.87 CCCC(C)OCCOCC(=O)OC 34a_100000764384_100000090808 [0,2,0,0,0,0|1,0,1]=4 2893 B13R0.87 CCCC(C)OCCOCC(=O)OC 7a_100000764384_100000090808 [0,2,0,0,0,0|1,0,1]=4 2894 B13R0.87 CCCC(C)SCCCCC(=O)OC 62a_100000204269_100000766640 [0,2,0,0,0,0|0,0,2]=4 2895 B13R0.87 CCCC(C)SCCCCC(=O)OC 62a_100000766640_100000204269 [0,2,0,0,0,0|0,0,2]=4 2896 B13R0.87 CCCC(C)SCCOCC(=O)OC 62a_100000090808_100000766640 [0,2,0,0,0,0|1,0,1]=4 2897 B13R0.87 CCCC(C)SCCOCC(=O)OC 62a_100000766640_100000090808 [0,2,0,0,0,0|1,0,1]=4 2898 B13R0.87 CCCN(C)CCCCCC(=O)OC 2230a_100000747261_100009816466 [0,2,0,0,0,0|0,0,2]=4 2899 B13R0.87 CCCN(C)CCCCCC(=O)OC 269982a_100000747261_100009816466 [0,2,0,0,0,0|0,0,2]=4 2900 B13R0.87 CCC[C@H](N)CCOCCC(=O)OC 34a_100015193777_100000742370 [0,2,0,0,0,0|0,0,2]=4 2901 B13R0.87 CCC[C@H](N)COC/C=C/C(=O)OC 34a_100000732646_100000742655 [0,2,0,0,0,0|0,0,2]=4 2902 B13R0.87 CCC[C@H](N)COCCCC(=O)OC 34a_100000732646_100000742333 [0,2,0,0,0,0|0,0,2]=4 2903 B13R0.87 CCOC(=O)COCCCC(C)CC 7a_100011216074_100000188475 [0,2,0,0,0,0|1,0,1]=4 2904 B13R0.88 CCOC(=O)COCCCCC(C)C 34a_100011214890_100000188475 [0,2,0,0,0,0|1,0,1]=4 2905 B13R0.88 CCOC(=O)COCCCCC(C)C 7a_100011214890_100000188475 [0,2,0,0,0,0|1,0,1]=4 2906 B13R0.88 CCOC(=O)CSCCCCC(C)C 62a_100000188475_100011216152 [0,2,0,0,0,0|1,0,1]=4 2907 B13R0.88 CCOC(=O)CSCCCCC(C)C 62a_100011216152_100000188475 [0,2,0,0,0,0|1,0,1]=4 2908 B13R0.88 COCC(=O)NCCCCCC(C)C 1626a_100011290863_100000210968 [0,2,0,0,0,0|1,0,1]=4 2909 B13R0.88 COCC(=O)NCCCCCC(C)C 240690a_100011290863_100000210968 [0,2,0,0,0,0|1,0,1]=4 2910 B13R0.88 COCC(=O)NCCCCCC(C)C 527a_100011290863_100000210968 [0,2,0,0,0,0|1,0,1]=4 2911 B13R0.175 CCCCC(C)COCC(=O)OCC 34a_100011995851_100000188475 [0,2,0,0,0,0|1,0,1]=4 2912 B13R0.175 CCCCC(C)COCC(=O)OCC 7a_100011995851_100000188475 [0,2,0,0,0,0|1,0,1]=4 2913 B13R0.175 CCCC[C@H](N)COCC(=O)OCC 34a_100011934283_100000188475 [0,2,0,0,0,0|1,0,1]=4 2914 B13R0.193 CCCCCC(C)NCC(=O)OCC 2230a_100000211957_100000188475 [0,2,0,0,0,0|1,0,1]=4 2915 B13R0.193 CCCCCC(C)OCC(=O)OCC 34a_100011215632_100000188475 [0,2,0,0,0,0|1,0,1]=4 2916 B13R0.193 CCCCCC(C)OCC(=O)OCC 7a_100011215632_100000188475 [0,2,0,0,0,0|1,0,1]=4 2917 B13R0.193 CCCCCC(C)SCC(=O)OCC 62a_100000188475_200011218191 [0,2,0,0,0,0|1,0,1]=4 2918 B13R0.193 CCCCCC(C)SCC(=O)OCC 62a_200011218191_100000188475 [0,2,0,0,0,0|1,0,1]=4 2919 B13R0.275 CCCCCCCC(C)C(=O)COC 1458a_100000210968_200011218727 [0,2,0,0,0,0|0,0,2]=4 2920 B13R0.275 CCCCCCCN(C)C(=O)COC 11a_100000228206_100000210968 [0,2,0,0,0,0|1,0,1]=4 2921 B13R0.275 CCCCCCCN(C)C(=O)COC 1626a_100000228206_100000210968 [0,2,0,0,0,0|1,0,1]=4 2922 B13R0.275 CCCCCCCN(C)C(=O)COC 240690a_100000228206_100000210968 [0,2,0,0,0,0|1,0,1]=4 2923 B13R0.275 CCCCCCCN(C)C(=O)COC 527a_100000228206_100000210968 [0,2,0,0,0,0|1,0,1]=4 2924 B13R0.275 CCCCCCNC(=O)C(=O)OCC 11a_100000210581_100014798877 [0,2,0,0,0,0|1,0,1]=4 2925 B13R0.275 CCCCCCNC(=O)C(=O)OCC 1626a_100000210581_100014798877 [0,2,0,0,0,0|1,0,1]=4 2926 B13R0.275 CCCCCCNC(=O)C(=O)OCC 240690a_100000210581_100014798877 [0,2,0,0,0,0|1,0,1]=4 2927 B13R0.275 CCCCCCNC(C)C(=O)OCC 2230a_100000210581_100011215307 [0,2,0,0,0,0|1,0,1]=4 2928 B13R0.275 CCCCCCNC(F)C(=O)OCC 2230a_100000210581_100000760018 [0,2,0,0,0,0|1,0,1]=4 2929 B13R0.275 CCCCCCOC(C)C(=O)OCC 34a_100000210259_100011216346 [0,2,0,0,0,0|1,0,1]=4 2930 B13R0.275 CCCCCCOC(C)C(=O)OCC 7a_100000210259_100011216346 [0,2,0,0,0,0|1,0,1]=4 2931 B13R0.275 CCCCCCOC(F)C(=O)OCC 34a_100000210259_100000760018 [0,2,0,0,0,0|1,0,1]=4 2932 B13R0.275 CCCCCCOC(F)C(=O)OCC 7a_100000210259_100000040065 [0,2,0,0,0,0|1,0,1]=4 2933 B13R0.275 CCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210314 [0,2,0,0,0,0|1,0,1]=4 2934 B13R0.275 CCCCCCSC(C)C(=O)OCC 62a_100000210314_100011216346 [0,2,0,0,0,0|1,0,1]=4 2935 B13R0.275 CCCCCCSC(C)C(=O)OCC 62a_100011216346_100000210757 [0,2,0,0,0,0|1,0,1]=4 2936 B13R0.275 CCCCCCSC(F)C(=O)OCC 62a_100000210314_100000760018 [0,2,0,0,0,0|1,0,1]=4 2937 B13R0.275 CCCCCCSC(F)C(=O)OCC 62a_100000760018_100000210757 [0,2,0,0,0,0|1,0,1]=4 2938 B13R0.330 CCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210757 [0,2,0,0,0,0|0,0,2]=4 2939 B13R0.330 CCCCCCC(=O)CC(=O)OCC 1458a_100102632555_100000188475 [0,2,0,0,0,0|0,0,2]=4 2940 B13R0.330 CCCCCCC(C)NC(=O)COC 11a_100000210919_100000210968 [0,2,0,0,0,0|1,0,1]=4 2941 B13R0.330 CCCCCCC(C)NC(=O)COC 1626a_100000210919_100000210968 [0,2,0,0,0,0|1,0,1]=4 2942 B13R0.330 CCCCCCC(C)NC(=O)COC 240690a_100000210919_100000210968 [0,2,0,0,0,0|1,0,1]=4 2943 B13R0.330 CCCCCCC(C)NC(=O)COC 34a_100138415774_100000230341 [0,2,0,0,0,0|1,0,1]=4 2944 B13R0.330 CCCCCCC(C)NC(=O)COC 527a_100000210919_100000210968 [0,2,0,0,0,0|1,0,1]=4 2945 B13R0.330 CCCCCCN(C)CC(=O)OCC 2230a_100000220588_100000210314 [0,2,0,0,0,0|1,0,1]=4 2946 B13R0.330 CCCCCCN(C)CC(=O)OCC 2230a_106256046315_100000188475 [0,2,0,0,0,0|1,0,1]=4 2947 B13R0.330 CCCCCCN(C)CC(=O)OCC 269982a_106256046315_100000188475 [0,2,0,0,0,0|1,0,1]=4 2948 B13R0.335 CCCCCCNCC(=O)OC(C)C 2230a_100000210581_100011215430 [0,2,0,0,0,0|1,0,1]=4 2949 B13R0.335 CCCCCCOCC(=O)OC(C)C 34a_100000210259_100011215430 [0,2,0,0,0,0|1,0,1]=4 2950 B13R0.335 CCCCCCOCC(=O)OC(C)C 7a_100000210259_100011215430 [0,2,0,0,0,0|1,0,1]=4 2951 B13R0.335 CCCCCCSCC(=O)OC(C)C 62a_100000210314_100011215430 [0,2,0,0,0,0|1,0,1]=4 2952 B13R0.335 CCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210757 [0,2,0,0,0,0|1,0,1]=4 2953 B13R0.340 C=C(COCCCCCC)C(=O)OC 34a_100000210259_100009813391 [0,2,0,0,0,0|0,0,2]=4 2954 B13R0.340 C=C(CSCCCCCC)C(=O)OC 62a_100000210314_100009813391 [0,2,0,0,0,0|0,0,2]=4 2955 B13R0.340 C=C(CSCCCCCC)C(=O)OC 62a_100009813391_100000210757 [0,2,0,0,0,0|0,0,2]=4 2956 B13R0.340 CCCCCC#CCC(=O)C(C)OC 1458a_100000743197_100009816472 [0,2,0,0,0,0|0,0,2]=4 2957 B13R0.340 CCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000210759 [0,2,0,0,0,0|0,0,2]=4 2958 B13R0.340 CCCCCCCNC(=O)C(=O)OC 11a_100000229938_100000024059 [0,2,0,0,0,0|0,0,2]=4 2959 B13R0.340 CCCCCCCNC(=O)C(=O)OC 1626a_100000229938_100000024059 [0,2,0,0,0,0|0,0,2]=4 2960 B13R0.340 CCCCCCCNC(=O)C(=O)OC 240690a_100000229938_100000024059 [0,2,0,0,0,0|0,0,2]=4 2961 B13R0.340 CCCCCCCNC(=O)C(=O)OC 527a_100000229938_100000024059 [0,2,0,0,0,0|0,0,2]=4 2962 B13R0.340 CCCCCCCNC(=O)C(C)OC 11a_100000229938_100000743197 [0,2,0,0,0,0|1,0,1]=4 2963 B13R0.340 CCCCCCCNC(=O)C(C)OC 1626a_100000229938_100000743197 [0,2,0,0,0,0|1,0,1]=4 2964 B13R0.340 CCCCCCCNC(=O)C(C)OC 240690a_100000229938_100000743197 [0,2,0,0,0,0|1,0,1]=4 2965 B13R0.340 CCCCCCCNC(=O)C(C)OC 527a_100000229938_100000743197 [0,2,0,0,0,0|1,0,1]=4 2966 B13R0.340 CCCCCCCNC(C)C(=O)OC 2230a_100000229938_100000211248 [0,2,0,0,0,0|0,0,2]=4 2967 B13R0.340 CCCCCCCOC(C)C(=O)OC 34a_100000210272_100000211248 [0,2,0,0,0,0|0,0,2]=4 2968 B13R0.340 CCCCCCCOC(C)C(=O)OC 34a_100011215400_100000210614 [0,2,0,0,0,0|0,0,2]=4 2969 B13R0.340 CCCCCCCOC(C)C(=O)OC 7a_100000210272_100000211248 [0,2,0,0,0,0|0,0,2]=4 2970 B13R0.340 CCCCCCCSC(C)C(=O)OC 62a_100000210614_100000211248 [0,2,0,0,0,0|0,0,2]=4 2971 B13R0.340 CCCCCCCSC(C)C(=O)OC 62a_100000211248_100000210316 [0,2,0,0,0,0|0,0,2]=4 2972 B13R0.340 CCCCCCNCC(=O)N(C)OC 2230a_100000210581_100000764215 [0,2,0,0,0,0|1,0,1]=4 2973 B13R0.340 CCCCCCNCC(=O)N(C)OC 2230a_100015207273_100000210314 [0,2,0,0,0,0|1,0,1]=4 2974 B13R0.340 CCCCCCOCC(=O)C(=O)OC 34a_100000210259_100011610305 [0,2,0,0,0,0|0,0,2]=4 2975 B13R0.340 CCCCCCOCC(=O)N(C)OC 7a_100000210259_100000764215 [0,2,0,0,0,0|1,0,1]=4 2976 B13R0.340 CCCCCCOCC(C)C(=O)OC 34a_100000210259_100000698445 [0,2,0,0,0,0|0,0,2]=4 2977 B13R0.340 CCCCCCOCC(C)C(=O)OC 34a_100000749362_100000210314 [0,2,0,0,0,0|0,0,2]=4 2978 B13R0.340 CCCCCCOCC(C)C(=O)OC 7a_100000749362_100000210314 [0,2,0,0,0,0|0,0,2]=4 2979 B13R0.340 CCCCCCOCC(F)C(=O)OC 34a_200009849844_100000210314 [0,2,0,0,0,0|0,0,2]=4 2980 B13R0.340 CCCCCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210314 [0,2,0,0,0,0|0,0,2]=4 2981 B13R0.340 CCCCCCSCC(=O)C(=O)OC 62a_100000210314_100011610305 [0,2,0,0,0,0|0,0,2]=4 2982 B13R0.340 CCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210757 [0,2,0,0,0,0|0,0,2]=4 2983 B13R0.340 CCCCCCSCC(=O)N(C)OC 62a_100000210314_100000764215 [0,2,0,0,0,0|1,0,1]=4 2984 B13R0.340 CCCCCCSCC(=O)N(C)OC 62a_100000764215_100000210757 [0,2,0,0,0,0|1,0,1]=4 2985 B13R0.340 CCCCCCSCC(C)C(=O)OC 62a_100000210314_100000698445 [0,2,0,0,0,0|0,0,2]=4 2986 B13R0.340 CCCCCCSCC(C)C(=O)OC 62a_100000698445_100000210757 [0,2,0,0,0,0|0,0,2]=4 2987 B13R0.340 CCCCCNCCC(C)C(=O)OC 2230a_100000209983_100000034942 [0,2,0,0,0,0|0,0,2]=4 2988 B13R0.340 CCCCCOCCC(C)C(=O)OC 34a_100000210253_100000034942 [0,2,0,0,0,0|0,0,2]=4 2989 B13R0.340 CCCCCOCCC(C)C(=O)OC 7a_100000210253_100000034942 [0,2,0,0,0,0|0,0,2]=4 2990 B13R0.340 CCCCCSCCC(C)C(=O)OC 62a_100000034942_100000210326 [0,2,0,0,0,0|0,0,2]=4 2991 B13R0.340 CCCCCSCCC(C)C(=O)OC 62a_100000210326_100000034942 [0,2,0,0,0,0|0,0,2]=4 2992 B13R0.340 CCCCOCCOC(C)C(=O)OC 34a_100000210238_100000211248 [0,2,0,0,0,0|1,0,1]=4 2993 B13R0.340 CCCCOCCOC(C)C(=O)OC 34a_100011215400_100000743108 [0,2,0,0,0,0|1,0,1]=4 2994 B13R0.340 CCCCOCCOC(C)C(=O)OC 7a_100000210238_100000211248 [0,2,0,0,0,0|1,0,1]=4 2995 B13R0.340 CCCCOCCSC(C)C(=O)OC 62a_100000211248_100000743108 [0,2,0,0,0,0|1,0,1]=4 2996 B13R0.340 CCCCOCCSC(C)C(=O)OC 62a_100000743108_100000211248 [0,2,0,0,0,0|1,0,1]=4 2997 B13R0.340 CCCCSCCNC(=O)C(=O)OC 11a_100025743550_100000024059 [0,2,0,0,0,0|1,0,1]=4 2998 B13R0.340 CCCCSCCNC(=O)C(=O)OC 1626a_100025743550_100000024059 [0,2,0,0,0,0|1,0,1]=4 2999 B13R0.340 CCCCSCCNC(=O)C(=O)OC 240690a_100025743550_100000024059 [0,2,0,0,0,0|1,0,1]=4 3000 B13R0.340 CCCCSCCNC(=O)C(=O)OC 527a_100025743550_100000024059 [0,2,0,0,0,0|1,0,1]=4 3001 B13R0.340 CCCCSCCNC(C)C(=O)OC 2230a_100025743550_100000211248 [0,2,0,0,0,0|1,0,1]=4 3002 B13R0.340 CCCCSCCOC(C)C(=O)OC 34a_200000230436_100000211248 [0,2,0,0,0,0|1,0,1]=4 3003 B13R0.340 CCCCSCCOC(C)C(=O)OC 7a_200000230436_100000211248 [0,2,0,0,0,0|1,0,1]=4 3004 B13R0.340 CCCOCCCNC(=O)C(=O)OC 1626a_100011217757_100000024059 [0,2,0,0,0,0|1,0,1]=4 3005 B13R0.340 CCCOCCCNC(=O)C(=O)OC 240690a_100011217757_100000024059 [0,2,0,0,0,0|1,0,1]=4 3006 B13R0.340 CCCOCCCNC(=O)C(=O)OC 527a_100011217757_100000024059 [0,2,0,0,0,0|1,0,1]=4 3007 B13R0.340 CCCOCCCNC(C)C(=O)OC 2230a_100011217757_100000211248 [0,2,0,0,0,0|1,0,1]=4 3008 B13R0.340 CCCOCCCNC(C)C(=O)OC 34a_100011217757_100000211248 [0,2,0,0,0,0|1,0,1]=4 3009 B13R0.340 CNCCCCCOC(C)C(=O)OC 34a_100000722520_100000211248 [0,2,0,0,0,0|1,0,1]=4 3010 B13R0.340 COC(=O)C(=O)NCCCCCCO 240690a_100000686447_100000024059 [0,2,0,0,0,0|1,0,1]=4 3011 B13R0.340 COC(=O)C(=O)NCCCCCCO 527a_100000686447_100000024059 [0,2,0,0,0,0|1,0,1]=4 3012 B13R0.340 COC(=O)C(C)NCCCCCCO 2230a_100000686447_100000211248 [0,2,0,0,0,0|1,0,1]=4 3013 B13R0.340 COC(=O)C(C)NCCCCCCO 34a_100000686447_100000211248 [0,2,0,0,0,0|1,0,1]=4 3014 B13R0.340 COC(=O)C(C)OCCCCCCBr 34a_100011215345_100000211248 [0,2,0,0,0,0|1,0,1]=4 3015 B13R0.340 COC(=O)C(C)OCCCCCCBr 7a_100011215345_100000211248 [0,2,0,0,0,0|1,0,1]=4 3016 B13R0.340 COC(=O)C(C)OCCCCCCCl 34a_100000766143_100000211248 [0,2,0,0,0,0|1,0,1]=4 3017 B13R0.340 COC(=O)C(C)OCCCCCCCl 7a_100000766143_100000211248 [0,2,0,0,0,0|1,0,1]=4 3018 B13R0.340 COC(=O)C(C)OCCCCCCF 34a_100000732779_100000211248 [0,2,0,0,0,0|1,0,1]=4 3019 B13R0.340 COC(=O)C(C)OCCCCCCF 34a_100011215400_100015922095 [0,2,0,0,0,0|1,0,1]=4 3020 B13R0.340 COC(=O)C(C)OCCCCCCF 7a_100000732779_100000211248 [0,2,0,0,0,0|1,0,1]=4 3021 B13R0.340 COC(=O)C(C)OCCCCCCN 34a_100000686447_100000211248 [0,2,0,0,0,0|1,0,1]=4 3022 B13R0.340 COC(=O)C(C)OCCCCCCO 34a_100011215400_100000766143 [0,2,0,0,0,0|1,0,1]=4 3023 B13R0.340 COC(=O)C(C)SCCCCCCF 62a_100000211248_100015922095 [0,2,0,0,0,0|1,0,1]=4 3024 B13R0.340 COC(=O)C(C)SCCCCCCF 62a_100015922095_100000211248 [0,2,0,0,0,0|1,0,1]=4 3025 B13R0.340 COC(=O)C(C)SCCCCCCO 62a_100000211248_100000766143 [0,2,0,0,0,0|1,0,1]=4 3026 B13R0.340 COC(=O)C(C)SCCCCCCO 62a_100000766143_100000211248 [0,2,0,0,0,0|1,0,1]=4 3027 B13R0.340 COCCCCCNC(=O)C(=O)OC 11a_100000747528_100000024059 [0,2,0,0,0,0|1,0,1]=4 3028 B13R0.340 COCCCCCNC(=O)C(=O)OC 1626a_100000747528_100000024059 [0,2,0,0,0,0|1,0,1]=4 3029 B13R0.340 COCCCCCNC(=O)C(=O)OC 240690a_100000747528_100000024059 [0,2,0,0,0,0|1,0,1]=4 3030 B13R0.340 COCCCCCNC(=O)C(=O)OC 527a_100000747528_100000024059 [0,2,0,0,0,0|1,0,1]=4 3031 B13R0.340 COCCCCCNC(C)C(=O)OC 2230a_100000747528_100000211248 [0,2,0,0,0,0|1,0,1]=4 3032 B13R0.340 COCCCCCNC(C)C(=O)OC 34a_100000747528_100000211248 [0,2,0,0,0,0|1,0,1]=4 3033 B13R0.367 CCCC(C)CCOCC(=O)OCC 34a_100011217855_100000188475 [0,2,0,0,0,0|1,0,1]=4 3034 B13R0.367 CCCC(C)CCOCC(=O)OCC 7a_100011217855_100000188475 [0,2,0,0,0,0|1,0,1]=4 3035 B13R0.367 CCC[C@H](N)CCOCC(=O)OCC 34a_100015193777_100000188475 [0,2,0,0,0,0|1,0,1]=4 3036 B13R0.60 CCCCCCNC(CC)C(=O)OC 2230a_100000210581_100000235869 [0,2,0,0,0,0|1,0,1]=4 3037 B13R0.60 CCCCCCOC(C=O)C(=O)OC 34a_100000210259_100000046368 [0,2,0,0,0,0|1,0,1]=4 3038 B13R0.60 CCCCCCOC(CC)C(=O)OC 34a_100000210259_100000235869 [0,2,0,0,0,0|1,0,1]=4 3039 B13R0.60 CCCCCCOC(CC)C(=O)OC 34a_100000695916_100000210314 [0,2,0,0,0,0|1,0,1]=4 3040 B13R0.60 CCCCCCOC(CC)C(=O)OC 7a_100000210259_100000742303 [0,2,0,0,0,0|1,0,1]=4 3041 B13R0.60 CCCCCCOC(CC)C(=O)OC 7a_100000695916_100000210314 [0,2,0,0,0,0|1,0,1]=4 3042 B13R0.60 CCCCCCOC(CN)C(=O)OC 34a_100000695228_100000210314 [0,2,0,0,0,0|1,0,1]=4 3043 B13R0.60 CCCCCCOC(CO)C(=O)OC 34a_100000210259_100012276630 [0,2,0,0,0,0|1,0,1]=4 3044 B13R0.60 CCCCCCOC(OC)C(=O)OC 34a_100000036821_100000210314 [0,2,0,0,0,0|1,0,1]=4 3045 B13R0.60 CCCCCCOC(OC)C(=O)OC 34a_100000210259_100000101307 [0,2,0,0,0,0|1,0,1]=4 3046 B13R0.60 CCCCCCSC(C=O)C(=O)OC 62a_100000046368_100000210757 [0,2,0,0,0,0|1,0,1]=4 3047 B13R0.60 CCCCCCSC(C=O)C(=O)OC 62a_100000210314_100000046368 [0,2,0,0,0,0|1,0,1]=4 3048 B13R0.60 CCCCCCSC(CC)C(=O)OC 62a_100000210314_100000235869 [0,2,0,0,0,0|1,0,1]=4 3049 B13R0.60 CCCCCCSC(CC)C(=O)OC 62a_100000235869_100000210757 [0,2,0,0,0,0|1,0,1]=4 3050 B13R0.60 CCCCCCSC(CO)C(=O)OC 62a_100000210314_100012276630 [0,2,0,0,0,0|1,0,1]=4 3051 B13R0.60 CCCCCCSC(CO)C(=O)OC 62a_100012276630_100000210757 [0,2,0,0,0,0|1,0,1]=4 3052 B13R0.60 CCCCCCSC(OC)C(=O)OC 62a_100000101307_100000210757 [0,2,0,0,0,0|1,0,1]=4 3053 B13R0.60 CCCCCCSC(OC)C(=O)OC 62a_100000210314_100000101307 [0,2,0,0,0,0|1,0,1]=4 3054 B13R0.101 COC(=O)C(C)OCCCCC(C)C 34a_100011214890_100000211248 [0,2,0,0,0,0|1,0,1]=4 3055 B13R0.101 COC(=O)C(C)OCCCCC(C)C 34a_100011215400_100011216152 [0,2,0,0,0,0|1,0,1]=4 3056 B13R0.101 COC(=O)C(C)OCCCCC(C)C 7a_100011214890_100000211248 [0,2,0,0,0,0|1,0,1]=4 3057 B13R0.101 COC(=O)C(C)SCCCCC(C)C 62a_100000211248_100011216152 [0,2,0,0,0,0|1,0,1]=4 3058 B13R0.101 COC(=O)C(C)SCCCCC(C)C 62a_100011216152_100000211248 [0,2,0,0,0,0|1,0,1]=4 3059 B13R0.131 CCCCC(C)COC(C)C(=O)OC 34a_100011995851_100000211248 [0,2,0,0,0,0|1,0,1]=4 3060 B13R0.131 CCCCC(C)COC(C)C(=O)OC 7a_100011995851_100000211248 [0,2,0,0,0,0|1,0,1]=4 3061 B13R0.131 CCCC[C@H](N)COC(C)C(=O)OC 34a_100011934283_100000211248 [0,2,0,0,0,0|1,0,1]=4 3062 B13R0.250 CCC(C)CCCOC(C)C(=O)OC 7a_100011216074_100000211248 [0,2,0,0,0,0|1,0,1]=4 3063 B13R0.369 CCCC(C)CCOC(C)C(=O)OC 34a_100011217855_100000211248 [0,2,0,0,0,0|1,0,1]=4 3064 B13R0.369 CCCC(C)CCOC(C)C(=O)OC 7a_100011217855_100000211248 [0,2,0,0,0,0|1,0,1]=4 3065 B13R0.369 CCC[C@H](N)CCOC(C)C(=O)OC 34a_100015193777_100000211248 [0,2,0,0,0,0|1,0,1]=4 3066 B13R0.422 CCCCCCC(=O)C(C)C(=O)OC 1458a_100012027023_100000210757 [0,2,0,0,0,0|0,0,2]=4 3067 B13R0.422 CCCCCCC(=O)C(C)C(=O)OC 1458a_100102632555_100000211248 [0,2,0,0,0,0|0,0,2]=4 3068 B13R0.422 CCCCCCN(C)C(=O)C(=O)OC 11a_106256046315_100000024059 [0,2,0,0,0,0|1,0,1]=4 3069 B13R0.422 CCCCCCN(C)C(=O)C(=O)OC 1626a_106256046315_100000024059 [0,2,0,0,0,0|1,0,1]=4 3070 B13R0.422 CCCCCCN(C)C(=O)C(=O)OC 240690a_106256046315_100000024059 [0,2,0,0,0,0|1,0,1]=4 3071 B13R0.422 CCCCCCN(C)C(=O)C(=O)OC 527a_106256046315_100000024059 [0,2,0,0,0,0|1,0,1]=4 3072 B13R0.422 CCCCCCN(C)C(C)C(=O)OC 2230a_100000725243_100000210314 [0,2,0,0,0,0|1,0,1]=4 3073 B13R0.422 CCCCCCN(C)C(C)C(=O)OC 2230a_106256046315_100000211248 [0,2,0,0,0,0|1,0,1]=4 3074 B13R0.422 CCCCCCN(C)C(C)C(=O)OC 269982a_100000725243_100000210757 [0,2,0,0,0,0|1,0,1]=4 3075 B13R0.422 CCCCCCN(C)C(C)C(=O)OC 269982a_106256046315_100000211248 [0,2,0,0,0,0|1,0,1]=4 3076 B13R0.714 CCCCCCNC(C)(C)C(=O)OC 2230a_100000210581_100000689032 [0,2,0,0,0,0|1,0,1]=4 3077 B13R0.714 CCCCCCNC(C)(F)C(=O)OC 2230a_100000210581_200009867631 [0,2,0,0,0,0|1,0,1]=4 3078 B13R0.714 CCCCCCOC(C)(C)C(=O)OC 34a_100011217581_100000210314 [0,2,0,0,0,0|1,0,1]=4 3079 B13R0.714 CCCCCCOC(C)(C)C(=O)OC 7a_100011217581_100000210314 [0,2,0,0,0,0|1,0,1]=4 3080 B13R0.714 CCCCCCOC(C)(F)C(=O)OC 34a_100000210259_200009867631 [0,2,0,0,0,0|1,0,1]=4 3081 B13R0.714 CCCCCCOC(F)(F)C(=O)OC 34a_100000210259_100000211177 [0,2,0,0,0,0|1,0,1]=4 3082 B13R0.714 CCCCCCOC(F)(F)C(=O)OC 7a_100000210259_100000211177 [0,2,0,0,0,0|1,0,1]=4 3083 B13R0.714 CCCCCCSC(C)(C)C(=O)OC 62a_100000210314_100000689032 [0,2,0,0,0,0|1,0,1]=4 3084 B13R0.714 CCCCCCSC(C)(C)C(=O)OC 62a_100000689032_100000210757 [0,2,0,0,0,0|1,0,1]=4 3085 B13R0.714 CCCCCCSC(C)(F)C(=O)OC 62a_100000210314_200009867631 [0,2,0,0,0,0|1,0,1]=4 3086 B13R0.714 CCCCCCSC(C)(F)C(=O)OC 62a_200009867631_100000210757 [0,2,0,0,0,0|1,0,1]=4 3087 B13R0.714 CCCCCCSC(F)(F)C(=O)OC 62a_100000210314_100000211177 [0,2,0,0,0,0|1,0,1]=4 3088 B13R0.714 CCCCCCSC(F)(F)C(=O)OC 62a_100000211177_100000210757 [0,2,0,0,0,0|1,0,1]=4 3089 B13R0.1293 CCCCCC(C)NC(=O)C(=O)OC 11a_100000211957_100000024059 [0,2,0,0,0,0|1,0,1]=4 3090 B13R0.1293 CCCCCC(C)NC(=O)C(=O)OC 1626a_100000211957_100000024059 [0,2,0,0,0,0|1,0,1]=4 3091 B13R0.1293 CCCCCC(C)NC(=O)C(=O)OC 240690a_100000211957_100000024059 [0,2,0,0,0,0|1,0,1]=4 3092 B13R0.1293 CCCCCC(C)NC(=O)C(=O)OC 527a_100000211957_100000024059 [0,2,0,0,0,0|1,0,1]=4 3093 B13R0.1293 CCCCCC(C)NC(C)C(=O)OC 2230a_100000211957_100000211248 [0,2,0,0,0,0|1,0,1]=4 3094 B13R0.1293 CCCCCC(C)OC(C)C(=O)OC 34a_100011215400_200011218191 [0,2,0,0,0,0|1,0,1]=4 3095 B13R0.1293 CCCCCC(C)OC(C)C(=O)OC 34a_100011215632_100000211248 [0,2,0,0,0,0|1,0,1]=4 3096 B13R0.1293 CCCCCC(C)OC(C)C(=O)OC 7a_100011215632_100000211248 [0,2,0,0,0,0|1,0,1]=4 3097 B13R0.1293 CCCCCC(C)SC(C)C(=O)OC 62a_100000211248_200011218191 [0,2,0,0,0,0|1,0,1]=4 3098 B13R0.1293 CCCCCC(C)SC(C)C(=O)OC 62a_200011218191_100000211248 [0,2,0,0,0,0|1,0,1]=4 3099 B13R0.194 CCCCCC(=O)CCCC(=O)OC 1458a_100000212188_100011218270 [0,2,0,0,0,0|0,0,2]=4 3100 B13R0.194 CCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210326 [0,2,0,0,0,0|0,0,2]=4 3101 B13R0.194 CCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210326 [0,2,0,0,0,0|1,0,1]=4 3102 B13R0.194 CCCCCC(=O)CSCC(=O)OC 62a_100000747449_200012276598 [0,2,0,0,0,0|1,0,1]=4 3103 B13R0.194 CCCCCC(=O)CSCC(=O)OC 62a_200012276598_100000747449 [0,2,0,0,0,0|1,0,1]=4 3104 B13R0.194 CCCCCC(C)NCCC(=O)OC 2230a_100000211957_100000204255 [0,2,0,0,0,0|0,0,2]=4 3105 B13R0.194 CCCCCC(C)OCCC(=O)OC 34a_100011215632_100000742370 [0,2,0,0,0,0|0,0,2]=4 3106 B13R0.194 CCCCCC(C)OCCC(=O)OC 7a_100011215632_100000204255 [0,2,0,0,0,0|0,0,2]=4 3107 B13R0.194 CCCCCC(C)SCCC(=O)OC 62a_100000204255_200011218191 [0,2,0,0,0,0|0,0,2]=4 3108 B13R0.194 CCCCCC(C)SCCC(=O)OC 62a_200011218191_100000204255 [0,2,0,0,0,0|0,0,2]=4 3109 B13R0.194 CCCCCC(C)SCOC(=O)OC 62a_200011218191_100000139417 [0,2,0,0,0,0|1,0,1]=4 3110 B13R0.194 CCCCCN(C)C/C=C/C(=O)OC 2230a_100000223495_100000742655 [0,2,0,0,0,0|0,0,2]=4 3111 B13R0.194 CCCCCN(C)C/C=C/C(=O)OC 269982a_100000223495_100000742655 [0,2,0,0,0,0|0,0,2]=4 3112 B13R0.194 CCCCCN(C)CCCC(=O)OC 2230a_100000223495_100011218270 [0,2,0,0,0,0|0,0,2]=4 3113 B13R0.194 CCCCCN(C)CCCC(=O)OC 269982a_100000223495_100011218270 [0,2,0,0,0,0|0,0,2]=4 3114 B13R0.194 CCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210215 [0,2,0,0,0,0|0,0,2]=4 3115 B13R0.194 COC(=O)COC[C@@H](N)CCCCN 34a_100016993712_100000747449 [0,2,0,0,0,0|1,0,1]=4 3116 B13R0.306 CCCCC(CC)CNCC(=O)OC 2230a_100000209976_100000747449 [0,2,0,0,0,0|1,0,1]=4 3117 B13R0.306 CCCCC(CC)COCC(=O)OC 34a_100000210273_100000747449 [0,2,0,0,0,0|1,0,1]=4 3118 B13R0.306 CCCCC(CC)COCC(=O)OC 7a_100000210273_100000747449 [0,2,0,0,0,0|1,0,1]=4 3119 B13R0.306 CCCCC(CC)CSCC(=O)OC 62a_100000211942_100000747449 [0,2,0,0,0,0|1,0,1]=4 3120 B13R0.306 CCCCC(CC)CSCC(=O)OC 62a_100000747449_100000211942 [0,2,0,0,0,0|1,0,1]=4 3121 B13R0.462 CCCCC(C)(C)COCC(=O)OC 7a_200011995781_100000747449 [0,2,0,0,0,0|1,0,1]=4 3122 B13R0.71 COC(=O)CC(=O)CCCCC(C)C 1458a_100000211351_100011216152 [0,2,0,0,0,0|0,0,2]=4 3123 B13R0.71 COC(=O)CC(=O)CCCCC(C)C 1458a_100011933920_100000747449 [0,2,0,0,0,0|0,0,2]=4 3124 B13R0.71 COC(=O)CN(C)CCCCC(C)C 2230a_100000198492_100011216152 [0,2,0,0,0,0|1,0,1]=4 3125 B13R0.151 CCCCCC(C)C(=O)CC(=O)OC 1458a_100000211351_200011218191 [0,2,0,0,0,0|0,0,2]=4 3126 B13R0.151 CCCCCC(C)C(=O)CC(=O)OC 1458a_100011215998_100000747449 [0,2,0,0,0,0|0,0,2]=4 3127 B13R0.151 CCCCCC(C)N(C)CC(=O)OC 2230a_100000198492_200011218191 [0,2,0,0,0,0|1,0,1]=4 3128 B13R0.151 CCCCCC(C)N(C)CC(=O)OC 270004a_100000198492_100000211708 [0,2,0,0,0,0|1,0,1]=4 3129 B13R0.274 CCCCCC#CC(=O)CC(=O)OC 1458a_100011215388_100000747449 [0,2,0,0,0,0|0,0,2]=4 3130 B13R0.274 CCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210614 [0,2,0,0,0,0|0,0,2]=4 3131 B13R0.274 CCCCCCCC(=O)CC(=O)OC 1458a_100000211969_100000747449 [0,2,0,0,0,0|0,0,2]=4 3132 B13R0.274 CCCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210681 [0,2,0,0,0,0|0,0,2]=4 3133 B13R0.274 CCCCCCCN(C)CC(=O)OC 2230a_100000228206_100000747449 [0,2,0,0,0,0|0,0,2]=4 3134 B13R0.274 CCCCCCCN(C)CC(=O)OC 269982a_100000228206_100000747449 [0,2,0,0,0,0|0,0,2]=4 3135 B13R0.274 CCCCCCNC(=O)CC(=O)OC 240690a_100000210581_100000211351 [0,2,0,0,0,0|0,0,2]=4 3136 B13R0.274 CCCCCCNC(C)CC(=O)OC 2230a_100000210581_100009817358 [0,2,0,0,0,0|0,0,2]=4 3137 B13R0.274 CCCCCCOC(C)CC(=O)OC 34a_100000210259_100009817358 [0,2,0,0,0,0|0,0,2]=4 3138 B13R0.274 CCCCCCOC(C)CC(=O)OC 7a_100000210259_100009817358 [0,2,0,0,0,0|0,0,2]=4 3139 B13R0.274 CCCCCCSC(C)CC(=O)OC 62a_100000210314_100009817358 [0,2,0,0,0,0|0,0,2]=4 3140 B13R0.274 CCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210757 [0,2,0,0,0,0|0,0,2]=4 3141 B13R0.274 CCCCCOC[C@H](O)CC(=O)OC 34a_100000210253_100000754131 [0,2,0,0,0,0|0,0,2]=4 3142 B13R0.274 CCCCCOC[C@H](O)CC(=O)OC 7a_100000210253_100000754131 [0,2,0,0,0,0|0,0,2]=4 3143 B13R0.274 CCCCCSCC(=O)CC(=O)OC 62a_100000210326_100000210525 [0,2,0,0,0,0|0,0,2]=4 3144 B13R0.274 CCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210326 [0,2,0,0,0,0|0,0,2]=4 3145 B13R0.274 CCCCCSCC(=O)NC(=O)OC 62a_100000210326_100000010850 [0,2,0,0,0,0|1,0,1]=4 3146 B13R0.274 CCCCCSC[C@H](O)CC(=O)OC 62a_100000210326_100000754131 [0,2,0,0,0,0|0,0,2]=4 3147 B13R0.274 CCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210326 [0,2,0,0,0,0|0,0,2]=4 3148 B13R0.274 CCCCOCCC(=O)CC(=O)OC 1458a_100000211351_100000743108 [0,2,0,0,0,0|0,0,2]=4 3149 B13R0.274 CCCCOCCN(C)CC(=O)OC 2230a_100000198492_100000743108 [0,2,0,0,0,0|1,0,1]=4 3150 B13R0.274 COC(=O)CC(=O)CCCCCCF 1458a_100000211351_100015922095 [0,2,0,0,0,0|0,0,2]=4 3151 B13R0.274 COC(=O)CC(=O)CCCCCCO 1458a_100000211351_100000766143 [0,2,0,0,0,0|0,0,2]=4 3152 B13R0.274 COC(=O)CC(=O)CCCCCCO 1458a_100011996774_100000747449 [0,2,0,0,0,0|0,0,2]=4 3153 B13R0.274 COC(=O)CN(C)CCCCCCF 2230a_100000198492_100015922095 [0,2,0,0,0,0|1,0,1]=4 3154 B13R0.274 COC(=O)CN(C)CCCCCCO 2230a_100000198492_100000766143 [0,2,0,0,0,0|1,0,1]=4 3155 B13R0.274 COCCCCCC(=O)CC(=O)OC 1458a_100011935119_100000747449 [0,2,0,0,0,0|0,0,2]=4 3156 B13R0.287 CCCCCCC(CC(=O)OC)OC 7a_100000076500_200000210301 [0,2,0,0,0,0|0,0,2]=4 3157 B13R0.287 CCCCCCC(CC(=O)OC)O[13CH3] 7a_100000076500_200025704644 [0,2,0,0,0,0|0,0,2]=4 3158 B13R0.493 COC(=O)CNC(C)CCCC(C)C 2230a_100000210607_100000747449 [0,2,0,0,0,0|1,0,1]=4 3159 B13R0.493 COC(=O)COC(C)CCCC(C)C 34a_200011218570_100000747449 [0,2,0,0,0,0|1,0,1]=4 3160 B13R0.493 COC(=O)COC(C)CCCC(C)C 7a_200011218570_100000747449 [0,2,0,0,0,0|1,0,1]=4 3161 B13R0.961 CCC(C)CCC(C)OCC(=O)OC 7a_200011216552_100000747449 [0,2,0,0,0,0|1,0,1]=4 3162 B13R0.1052 C#CC(CCCCC)OCC(=O)OC 34a_100011216489_100000747449 [0,2,0,0,0,0|1,0,1]=4 3163 B13R0.1052 C#CC(CCCCC)OCC(=O)OC 7a_100011216489_100000747449 [0,2,0,0,0,0|1,0,1]=4 3164 B13R0.1052 C=CC(CCCCC)OCC(=O)OC 34a_100011216863_100000747449 [0,2,0,0,0,0|1,0,1]=4 3165 B13R0.1052 C=CC(CCCCC)OCC(=O)OC 7a_100011216863_100000747449 [0,2,0,0,0,0|1,0,1]=4 3166 B13R0.1052 CCCCCC(CC)OCC(=O)OC 34a_100011215405_100000747449 [0,2,0,0,0,0|1,0,1]=4 3167 B13R0.1052 CCCCCC(CC)OCC(=O)OC 7a_100011215405_100000747449 [0,2,0,0,0,0|1,0,1]=4 3168 B13R0.1170 CCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210757 [0,2,0,0,0,0|0,0,2]=4 3169 B13R0.1170 CCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210757 [0,2,0,0,0,0|0,0,2]=4 3170 B13R0.1170 CCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100102632555 [0,2,0,0,0,0|0,0,2]=4 3171 B13R0.1170 CCCCCCC(C)NCC(=O)OC 2230a_100000210919_100000747449 [0,2,0,0,0,0|0,0,2]=4 3172 B13R0.1170 CCCCCCC(C)NCC(=O)OC 34a_100000210919_100000747449 [0,2,0,0,0,0|0,0,2]=4 3173 B13R0.1170 CCCCCCC(C)OCC(=O)OC 34a_100000210265_100000747449 [0,2,0,0,0,0|0,0,2]=4 3174 B13R0.1170 CCCCCCC(C)OCC(=O)OC 7a_100000210265_100000747449 [0,2,0,0,0,0|0,0,2]=4 3175 B13R0.1170 CCCCCCC(C)SCC(=O)OC 62a_100000747449_100011215978 [0,2,0,0,0,0|0,0,2]=4 3176 B13R0.1170 CCCCCCC(C)SCC(=O)OC 62a_100011215978_100000747449 [0,2,0,0,0,0|0,0,2]=4 3177 B13R0.1170 CCCCCCN(C)CCC(=O)OC 2230a_106256046315_100000204255 [0,2,0,0,0,0|0,0,2]=4 3178 B13R0.1170 CCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210757 [0,2,0,0,0,0|0,0,2]=4 3179 B13R0.1170 CCCCCCN(C)CCC(=O)OC 269982a_106256046315_100000204255 [0,2,0,0,0,0|0,0,2]=4 3180 B13R0.1170 CCCCOCC(C)OCC(=O)OC 34a_100011217071_100000747449 [0,2,0,0,0,0|1,0,1]=4 3181 B13R0.1170 CCCCOCC(C)OCC(=O)OC 7a_100011217071_100000747449 [0,2,0,0,0,0|1,0,1]=4 3182 B13R0.198 COC(=O)COCC[C@@H](N)CC(C)C 34a_100161151251_100000747449 [0,2,0,0,0,0|1,0,1]=4 3183 B13R0.201 CCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210202 [0,2,0,0,0,0|0,0,2]=4 3184 B13R0.201 CCC(=O)CCCCCCC(=O)OC 1458a_100000210414_100009815986 [0,2,0,0,0,0|0,0,2]=4 3185 B13R0.201 CCC(C)CCCOCCC(=O)OC 7a_100011216074_100000204255 [0,2,0,0,0,0|0,0,2]=4 3186 B13R0.201 CCC(C)CCNC/C=C/C(=O)OC 2230a_100020591266_100000742655 [0,2,0,0,0,0|0,0,2]=4 3187 B13R0.201 CCC(C)CCNCCCC(=O)OC 2230a_100020591266_100011218270 [0,2,0,0,0,0|0,0,2]=4 3188 B13R0.201 CCC(C)CCOC/C=C/C(=O)OC 7a_100011215188_100000742655 [0,2,0,0,0,0|0,0,2]=4 3189 B13R0.201 CCC(C)CCOCCCC(=O)OC 7a_100011215188_100011218270 [0,2,0,0,0,0|0,0,2]=4 3190 B13R0.201 CCC(C)CNCCCCC(=O)OC 2230a_100020588543_100000204269 [0,2,0,0,0,0|0,0,2]=4 3191 B13R0.201 CCC(C)CNCCOCC(=O)OC 2230a_100020588543_100000090808 [0,2,0,0,0,0|1,0,1]=4 3192 B13R0.201 CCC(C)COCCCCC(=O)OC 34a_100000059025_100000748023 [0,2,0,0,0,0|0,0,2]=4 3193 B13R0.201 CCC(C)COCCCCC(=O)OC 7a_100000059025_100000748023 [0,2,0,0,0,0|0,0,2]=4 3194 B13R0.201 CCC(C)CSCCCCC(=O)OC 62a_100000204269_100000748023 [0,2,0,0,0,0|0,0,2]=4 3195 B13R0.201 CCC(C)CSCCCCC(=O)OC 62a_100000748023_100000204269 [0,2,0,0,0,0|0,0,2]=4 3196 B13R0.201 CCC(C)CSCCOCC(=O)OC 62a_100000090808_100000748023 [0,2,0,0,0,0|1,0,1]=4 3197 B13R0.201 CCC(C)CSCCOCC(=O)OC 62a_100000748023_100000090808 [0,2,0,0,0,0|1,0,1]=4 3198 B13R0.201 CCC(C)NCCCCCC(=O)OC 2230a_100000209981_100009816466 [0,2,0,0,0,0|0,0,2]=4 3199 B13R0.201 CCC(C)OCCCCCC(=O)OC 34a_100000074720_100011215416 [0,2,0,0,0,0|0,0,2]=4 3200 B13R0.201 CCC(C)OCCCCCC(=O)OC 7a_100000074720_100000758301 [0,2,0,0,0,0|0,0,2]=4 3201 B13R0.201 CCC(C)OCCCCCC(=O)OC 7a_100000210228_100009816466 [0,2,0,0,0,0|0,0,2]=4 3202 B13R0.201 CCC(C)SCCCCCC(=O)OC 62a_100000758301_100009816466 [0,2,0,0,0,0|0,0,2]=4 3203 B13R0.201 CCC(C)SCCCCCC(=O)OC 62a_100009816466_100000758301 [0,2,0,0,0,0|0,0,2]=4 3204 B13R0.201 CCC(O)CNCCCCC(=O)OC 2230a_100011218483_100000204269 [0,2,0,0,0,0|0,0,2]=4 3205 B13R0.201 CCC(O)CNCCOCC(=O)OC 2230a_100011218483_100000090808 [0,2,0,0,0,0|1,0,1]=4 3206 B13R0.201 CCC(O)COCCCCC(=O)OC 34a_100000059025_100011218378 [0,2,0,0,0,0|0,0,2]=4 3207 B13R0.201 CCC(O)COCCCCC(=O)OC 7a_100000059025_100011218378 [0,2,0,0,0,0|0,0,2]=4 3208 B13R0.201 CCC(O)CSCCCCC(=O)OC 62a_100000204269_100011218378 [0,2,0,0,0,0|0,0,2]=4 3209 B13R0.201 CCC(O)CSCCCCC(=O)OC 62a_100011218378_100000204269 [0,2,0,0,0,0|0,0,2]=4 3210 B13R0.201 CCC(O)CSCCOCC(=O)OC 62a_100000090808_100011218378 [0,2,0,0,0,0|1,0,1]=4 3211 B13R0.201 CCC(O)CSCCOCC(=O)OC 62a_100011218378_100000090808 [0,2,0,0,0,0|1,0,1]=4 3212 B13R0.201 CCN(C)CCCCCCC(=O)OC 2230a_100000225621_100009815986 [0,2,0,0,0,0|0,0,2]=4 3213 B13R0.201 CCN(C)CCCCCCC(=O)OC 269982a_100000225621_100009815986 [0,2,0,0,0,0|0,0,2]=4 3214 B13R0.201 CC[C@H](C)COCCCCC(=O)OC 34a_100000059025_100009816398 [0,2,0,0,0,0|0,0,2]=4 3215 B13R0.201 CC[C@H](C)COCCCCC(=O)OC 7a_100000059025_100009816398 [0,2,0,0,0,0|0,0,2]=4 3216 B13R0.201 CC[C@H](C)COCCCCC(=O)OC 7a_100009816381_100000204269 [0,2,0,0,0,0|0,0,2]=4 3217 B13R0.201 CC[C@H](C)COCCOCC(=O)OC 7a_100009816381_100000090808 [0,2,0,0,0,0|1,0,1]=4 3218 B13R0.201 CC[C@H](C)CSCCCCC(=O)OC 62a_100000204269_100009816398 [0,2,0,0,0,0|0,0,2]=4 3219 B13R0.201 CC[C@H](C)CSCCCCC(=O)OC 62a_100009816398_100000204269 [0,2,0,0,0,0|0,0,2]=4 3220 B13R0.201 CC[C@H](C)CSCCOCC(=O)OC 62a_100000090808_100009816398 [0,2,0,0,0,0|1,0,1]=4 3221 B13R0.201 CC[C@H](C)CSCCOCC(=O)OC 62a_100009816398_100000090808 [0,2,0,0,0,0|1,0,1]=4 3222 B13R0.113 CCCCC(=O)CCCCC(=O)OC 1458a_100000210183_100000204269 [0,2,0,0,0,0|0,0,2]=4 3223 B13R0.113 CCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210211 [0,2,0,0,0,0|0,0,2]=4 3224 B13R0.113 CCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210211 [0,2,0,0,0,0|1,0,1]=4 3225 B13R0.113 CCCCC(=O)CCOCC(=O)OC 1458a_100000210183_100000090808 [0,2,0,0,0,0|1,0,1]=4 3226 B13R0.113 CCCCC(C)COCCC(=O)OC 34a_100011995851_100000742370 [0,2,0,0,0,0|0,0,2]=4 3227 B13R0.113 CCCCC(C)COCCC(=O)OC 7a_100011995851_100000204255 [0,2,0,0,0,0|0,0,2]=4 3228 B13R0.113 CCCCC(C)NC/C=C/C(=O)OC 2230a_100000126638_100000742655 [0,2,0,0,0,0|0,0,2]=4 3229 B13R0.113 CCCCC(C)NCCCC(=O)OC 2230a_100000126638_100011218270 [0,2,0,0,0,0|0,0,2]=4 3230 B13R0.113 CCCCC(C)OC/C=C/C(=O)OC 34a_100000687866_100000742655 [0,2,0,0,0,0|0,0,2]=4 3231 B13R0.113 CCCCC(C)OC/C=C/C(=O)OC 7a_100000687866_100000742655 [0,2,0,0,0,0|0,0,2]=4 3232 B13R0.113 CCCCC(C)OCCCC(=O)OC 34a_100000687866_100000742333 [0,2,0,0,0,0|0,0,2]=4 3233 B13R0.113 CCCCC(C)OCCCC(=O)OC 7a_100000687866_100011218270 [0,2,0,0,0,0|0,0,2]=4 3234 B13R0.113 CCCCC(C)OCCNC(=O)OC 34a_100000757965_200011215066 [0,2,0,0,0,0|1,0,1]=4 3235 B13R0.113 CCCCC(C)OCCOC(=O)OC 34a_100010262106_200011215066 [0,2,0,0,0,0|1,0,1]=4 3236 B13R0.113 CCCCC(C)SC/C=C/C(=O)OC 62a_100000742655_200011215066 [0,2,0,0,0,0|0,0,2]=4 3237 B13R0.113 CCCCC(C)SC/C=C/C(=O)OC 62a_200011215066_100000742655 [0,2,0,0,0,0|0,0,2]=4 3238 B13R0.113 CCCCC(C)SCCCC(=O)OC 62a_100011218270_200011215066 [0,2,0,0,0,0|0,0,2]=4 3239 B13R0.113 CCCCC(C)SCCCC(=O)OC 62a_200011215066_100011218270 [0,2,0,0,0,0|0,0,2]=4 3240 B13R0.113 CCCCN(C)CCCCC(=O)OC 2230a_100000207549_100000204269 [0,2,0,0,0,0|0,0,2]=4 3241 B13R0.113 CCCCN(C)CCCCC(=O)OC 269982a_100000207549_100000204269 [0,2,0,0,0,0|0,0,2]=4 3242 B13R0.113 CCCCN(C)CCOCC(=O)OC 2230a_100000207549_100000090808 [0,2,0,0,0,0|1,0,1]=4 3243 B13R0.113 CCCC[C@H](N)COCCC(=O)OC 34a_100011934283_100000742370 [0,2,0,0,0,0|0,0,2]=4 3244 B13R0.147 C#CCCCCCCOCC(=O)OC 34a_100011217361_100000747449 [0,2,0,0,0,0|1,0,1]=4 3245 B13R0.147 C#CCCCCCCOCC(=O)OC 7a_100011217361_100000747449 [0,2,0,0,0,0|1,0,1]=4 3246 B13R0.147 C#CCCCCCCSCC(=O)OC 62a_100000747449_100012276617 [0,2,0,0,0,0|1,0,1]=4 3247 B13R0.147 C#CCCCCCCSCC(=O)OC 62a_100012276617_100000747449 [0,2,0,0,0,0|1,0,1]=4 3248 B13R0.147 C=CCCCCCCOCC(=O)OC 34a_200011216477_100000747449 [0,2,0,0,0,0|1,0,1]=4 3249 B13R0.147 C=CCCCCCCOCC(=O)OC 7a_200011216477_100000747449 [0,2,0,0,0,0|1,0,1]=4 3250 B13R0.147 C=CCCCCCCSCC(=O)OC 62a_100000747449_100011215473 [0,2,0,0,0,0|1,0,1]=4 3251 B13R0.147 C=CCCCCCCSCC(=O)OC 62a_100011215473_100000747449 [0,2,0,0,0,0|1,0,1]=4 3252 B13R0.147 CC/C=C\CCCCOCC(=O)OC 34a_100016287862_100000747449 [0,2,0,0,0,0|1,0,1]=4 3253 B13R0.147 CC/C=C\CCCCOCC(=O)OC 7a_100016287862_100000747449 [0,2,0,0,0,0|1,0,1]=4 3254 B13R0.147 CCCC/C=C\CCOCC(=O)OC 34a_200016286491_100000747449 [0,2,0,0,0,0|1,0,1]=4 3255 B13R0.147 CCCC/C=C\CCOCC(=O)OC 7a_200016286491_100000747449 [0,2,0,0,0,0|1,0,1]=4 3256 B13R0.147 CCCCC#CCCOCC(=O)OC 34a_100000037610_100000747449 [0,2,0,0,0,0|1,0,1]=4 3257 B13R0.147 CCCCC#CCCOCC(=O)OC 7a_100000037610_100000747449 [0,2,0,0,0,0|1,0,1]=4 3258 B13R0.147 CCCCC/C=C/COCC(=O)OC 34a_100016258190_100000747449 [0,2,0,0,0,0|1,0,1]=4 3259 B13R0.147 CCCCC/C=C/COCC(=O)OC 7a_100016258190_100000747449 [0,2,0,0,0,0|1,0,1]=4 3260 B13R0.147 CCCCCC#CCOCC(=O)OC 34a_200000033628_100000747449 [0,2,0,0,0,0|0,0,2]=4 3261 B13R0.147 CCCCCC#CCOCC(=O)OC 7a_200000033628_100000747449 [0,2,0,0,0,0|0,0,2]=4 3262 B13R0.147 CCCCCC#CCSCC(=O)OC 62a_100000747449_100009816472 [0,2,0,0,0,0|0,0,2]=4 3263 B13R0.147 CCCCCC#CCSCC(=O)OC 62a_100009816472_100000747449 [0,2,0,0,0,0|0,0,2]=4 3264 B13R0.147 CCCCCCCCNCC(=O)OC 2230a_100000229939_100000747449 [0,2,0,0,0,0|0,0,2]=4 3265 B13R0.147 CCCCCCCCNCC(=O)OC 34a_100000229939_100000747449 [0,2,0,0,0,0|0,0,2]=4 3266 B13R0.147 CCCCCCCCOCC(=O)OC 34a_100000210232_100000747449 [0,2,0,0,0,0|0,0,2]=4 3267 B13R0.147 CCCCCCCCOCC(=O)OC 7a_100000210232_100000747449 [0,2,0,0,0,0|0,0,2]=4 3268 B13R0.147 CCCCCCCCSCC(=O)OC 62a_100000210759_100000747449 [0,2,0,0,0,0|0,0,2]=4 3269 B13R0.147 CCCCCCCCSCC(=O)OC 62a_100000747449_100000210317 [0,2,0,0,0,0|0,0,2]=4 3270 B13R0.147 CCCCCCCNCCC(=O)OC 2230a_100000229938_100000204255 [0,2,0,0,0,0|0,0,2]=4 3271 B13R0.147 CCCCCCCOCCC(=O)OC 34a_100000210272_100000742370 [0,2,0,0,0,0|0,0,2]=4 3272 B13R0.147 CCCCCCCOCCC(=O)OC 7a_100000210272_100000204255 [0,2,0,0,0,0|0,0,2]=4 3273 B13R0.147 CCCCCCCSCCC(=O)OC 62a_100000204255_100000210316 [0,2,0,0,0,0|0,0,2]=4 3274 B13R0.147 CCCCCCCSCCC(=O)OC 62a_100000210614_100000204255 [0,2,0,0,0,0|0,0,2]=4 3275 B13R0.147 CCCCCCCSCOC(=O)OC 62a_100000210614_100000139417 [0,2,0,0,0,0|0,0,2]=4 3276 B13R0.147 CCCCCCNC/C=C/C(=O)OC 2230a_100000210581_100000742655 [0,2,0,0,0,0|0,0,2]=4 3277 B13R0.147 CCCCCCNCCCC(=O)OC 2230a_100000210581_100011218270 [0,2,0,0,0,0|0,0,2]=4 3278 B13R0.147 CCCCCCOC/C=C/C(=O)OC 34a_100000210259_100000742655 [0,2,0,0,0,0|0,0,2]=4 3279 B13R0.147 CCCCCCOC/C=C/C(=O)OC 7a_100000210259_100000742655 [0,2,0,0,0,0|0,0,2]=4 3280 B13R0.147 CCCCCCOCCCC(=O)OC 34a_100000210259_100000742333 [0,2,0,0,0,0|0,0,2]=4 3281 B13R0.147 CCCCCCOCCCC(=O)OC 7a_100000210259_100011218270 [0,2,0,0,0,0|0,0,2]=4 3282 B13R0.147 CCCCCCOCCNC(=O)OC 34a_100000757965_100000210314 [0,2,0,0,0,0|0,0,2]=4 3283 B13R0.147 CCCCCCOCCOC(=O)OC 34a_100010262106_100000210314 [0,2,0,0,0,0|0,0,2]=4 3284 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000210314_100000742655 [0,2,0,0,0,0|0,0,2]=4 3285 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210757 [0,2,0,0,0,0|0,0,2]=4 3286 B13R0.147 CCCCCCSCCCC(=O)OC 62a_100000210314_100011218270 [0,2,0,0,0,0|0,0,2]=4 3287 B13R0.147 CCCCCCSCCCC(=O)OC 62a_100011218270_100000210757 [0,2,0,0,0,0|0,0,2]=4 3288 B13R0.147 CCCCCNCCCCC(=O)OC 2230a_100000209983_100000204269 [0,2,0,0,0,0|0,0,2]=4 3289 B13R0.147 CCCCCNCCOCC(=O)OC 2230a_100000209983_100000090808 [0,2,0,0,0,0|0,0,2]=4 3290 B13R0.147 CCCCCNCCOCC(=O)OC 34a_100000224656_100000747449 [0,2,0,0,0,0|0,0,2]=4 3291 B13R0.147 CCCCCOCCCCC(=O)OC 34a_100000059025_100000718602 [0,2,0,0,0,0|0,0,2]=4 3292 B13R0.147 CCCCCOCCCCC(=O)OC 34a_100000210253_100000204269 [0,2,0,0,0,0|0,0,2]=4 3293 B13R0.147 CCCCCOCCCCC(=O)OC 7a_100000059025_100000210326 [0,2,0,0,0,0|0,0,2]=4 3294 B13R0.147 CCCCCOCCCCC(=O)OC 7a_100000210253_100000204269 [0,2,0,0,0,0|0,0,2]=4 3295 B13R0.147 CCCCCOCCOCC(=O)OC 34a_100000210253_100000090808 [0,2,0,0,0,0|0,0,2]=4 3296 B13R0.147 CCCCCOCCOCC(=O)OC 34a_100011215259_100000747449 [0,2,0,0,0,0|0,0,2]=4 3297 B13R0.147 CCCCCOCCOCC(=O)OC 7a_100000210253_100000090808 [0,2,0,0,0,0|0,0,2]=4 3298 B13R0.147 CCCCCOCCOCC(=O)OC 7a_100011215259_100000747449 [0,2,0,0,0,0|0,0,2]=4 3299 B13R0.147 CCCCCSCCCCC(=O)OC 62a_100000204269_100000210326 [0,2,0,0,0,0|0,0,2]=4 3300 B13R0.147 CCCCCSCCCCC(=O)OC 62a_100000210326_100000204269 [0,2,0,0,0,0|0,0,2]=4 3301 B13R0.147 CCCCCSCCOCC(=O)OC 62a_100000090808_100000210326 [0,2,0,0,0,0|0,0,2]=4 3302 B13R0.147 CCCCCSCCOCC(=O)OC 62a_100000210326_100000090808 [0,2,0,0,0,0|0,0,2]=4 3303 B13R0.147 CCCCNCCCCCC(=O)OC 2230a_100000102301_100009816466 [0,2,0,0,0,0|0,0,2]=4 3304 B13R0.147 CCCCNCCCCCC(=O)OC 7a_106832991798_100009816466 [0,2,0,0,0,0|0,0,2]=4 3305 B13R0.147 CCCCOCCCCCC(=O)OC 34a_100000074720_100000210210 [0,2,0,0,0,0|0,0,2]=4 3306 B13R0.147 CCCCOCCCCCC(=O)OC 34a_100000210227_100009816466 [0,2,0,0,0,0|0,0,2]=4 3307 B13R0.147 CCCCOCCCCCC(=O)OC 7a_100000074720_100000210211 [0,2,0,0,0,0|0,0,2]=4 3308 B13R0.147 CCCCOCCCCCC(=O)OC 7a_100000210227_100009816466 [0,2,0,0,0,0|0,0,2]=4 3309 B13R0.147 CCCCOCCCNCC(=O)OC 2230a_200000211371_100000747449 [0,2,0,0,0,0|0,0,2]=4 3310 B13R0.147 CCCCOCCCNCC(=O)OC 34a_200000211371_100000747449 [0,2,0,0,0,0|0,0,2]=4 3311 B13R0.147 CCCCOCCCOCC(=O)OC 34a_200011215613_100000747449 [0,2,0,0,0,0|0,0,2]=4 3312 B13R0.147 CCCCOCCCOCC(=O)OC 7a_200011215613_100000747449 [0,2,0,0,0,0|0,0,2]=4 3313 B13R0.147 CCCCOCCOCCC(=O)OC 34a_100000210238_100000742370 [0,2,0,0,0,0|0,0,2]=4 3314 B13R0.147 CCCCOCCOCCC(=O)OC 7a_100000210238_100000204255 [0,2,0,0,0,0|0,0,2]=4 3315 B13R0.147 CCCCOCCSCCC(=O)OC 62a_100000204255_100000743108 [0,2,0,0,0,0|0,0,2]=4 3316 B13R0.147 CCCCOCCSCCC(=O)OC 62a_100000743108_100000204255 [0,2,0,0,0,0|0,0,2]=4 3317 B13R0.147 CCCCOCCSCOC(=O)OC 62a_100000743108_100000139417 [0,2,0,0,0,0|1,0,1]=4 3318 B13R0.147 CCCCOCOCCNC(=O)OC 34a_100000757965_100011995733 [0,2,0,0,0,0|1,0,1]=4 3319 B13R0.147 CCCCOCOCCOC(=O)OC 34a_100010262106_100011995733 [0,2,0,0,0,0|1,0,1]=4 3320 B13R0.147 CCCCOCSC/C=C/C(=O)OC 62a_100000742655_100011995733 [0,2,0,0,0,0|0,0,2]=4 3321 B13R0.147 CCCCOCSC/C=C/C(=O)OC 62a_100011995733_100000742655 [0,2,0,0,0,0|0,0,2]=4 3322 B13R0.147 CCCCOCSCCCC(=O)OC 62a_100011218270_100011995733 [0,2,0,0,0,0|0,0,2]=4 3323 B13R0.147 CCCCOCSCCCC(=O)OC 62a_100011995733_100011218270 [0,2,0,0,0,0|0,0,2]=4 3324 B13R0.147 CCCCSCCCCCC(=O)OC 62a_100000210211_100009816466 [0,2,0,0,0,0|0,0,2]=4 3325 B13R0.147 CCCCSCCCCCC(=O)OC 62a_100009816466_100000210210 [0,2,0,0,0,0|0,0,2]=4 3326 B13R0.147 CCCCSCCNCCC(=O)OC 2230a_100025743550_100000204255 [0,2,0,0,0,0|0,0,2]=4 3327 B13R0.147 CCCCSCCOCCC(=O)OC 34a_200000230436_100000742370 [0,2,0,0,0,0|0,0,2]=4 3328 B13R0.147 CCCCSCCOCCC(=O)OC 7a_200000230436_100000204255 [0,2,0,0,0,0|0,0,2]=4 3329 B13R0.147 CCCOCCCCCCC(=O)OC 34a_100000210258_100009815986 [0,2,0,0,0,0|0,0,2]=4 3330 B13R0.147 CCCOCCCCCCC(=O)OC 34a_100009863599_100000210303 [0,2,0,0,0,0|0,0,2]=4 3331 B13R0.147 CCCOCCCCCCC(=O)OC 7a_100009863599_100000210303 [0,2,0,0,0,0|0,0,2]=4 3332 B13R0.147 CCCOCCCNCCC(=O)OC 2230a_100011217757_100000204255 [0,2,0,0,0,0|0,0,2]=4 3333 B13R0.147 CCCOCCCNCCC(=O)OC 34a_100011217757_100000742370 [0,2,0,0,0,0|0,0,2]=4 3334 B13R0.147 CCCOCCNC/C=C/C(=O)OC 2230a_100161115042_100000742655 [0,2,0,0,0,0|0,0,2]=4 3335 B13R0.147 CCCOCCNC/C=C/C(=O)OC 34a_100161115042_100000742655 [0,2,0,0,0,0|0,0,2]=4 3336 B13R0.147 CCCOCCNCCCC(=O)OC 2230a_100161115042_100011218270 [0,2,0,0,0,0|0,0,2]=4 3337 B13R0.147 CCCOCCNCCCC(=O)OC 34a_100161115042_100000742333 [0,2,0,0,0,0|0,0,2]=4 3338 B13R0.147 CCCOCCOC/C=C/C(=O)OC 34a_100000752267_100000742655 [0,2,0,0,0,0|0,0,2]=4 3339 B13R0.147 CCCOCCOC/C=C/C(=O)OC 7a_100000752267_100000742655 [0,2,0,0,0,0|0,0,2]=4 3340 B13R0.147 CCCOCCOCCCC(=O)OC 34a_100000752267_100000742333 [0,2,0,0,0,0|0,0,2]=4 3341 B13R0.147 CCCOCCOCCCC(=O)OC 7a_100000752267_100011218270 [0,2,0,0,0,0|0,0,2]=4 3342 B13R0.147 CCCOCCOCCNC(=O)OC 34a_100000757965_100011215938 [0,2,0,0,0,0|1,0,1]=4 3343 B13R0.147 CCCOCCOCCOC(=O)OC 34a_100010262106_100011215938 [0,2,0,0,0,0|1,0,1]=4 3344 B13R0.147 CCCOCCSC/C=C/C(=O)OC 62a_100000742655_100011215938 [0,2,0,0,0,0|0,0,2]=4 3345 B13R0.147 CCCOCCSC/C=C/C(=O)OC 62a_100011215938_100000742655 [0,2,0,0,0,0|0,0,2]=4 3346 B13R0.147 CCCOCCSCCCC(=O)OC 62a_100011215938_100011218270 [0,2,0,0,0,0|0,0,2]=4 3347 B13R0.147 CCCOCCSCCCC(=O)OC 62a_100011218270_100011215938 [0,2,0,0,0,0|0,0,2]=4 3348 B13R0.147 CCCSCCCCCCC(=O)OC 62a_100000210303_100009815986 [0,2,0,0,0,0|0,0,2]=4 3349 B13R0.147 CCCSCCCCCCC(=O)OC 62a_100009815986_100000210303 [0,2,0,0,0,0|0,0,2]=4 3350 B13R0.147 CCCSCCNC/C=C/C(=O)OC 2230a_100020603323_100000742655 [0,2,0,0,0,0|0,0,2]=4 3351 B13R0.147 CCCSCCNCCCC(=O)OC 2230a_100020603323_100011218270 [0,2,0,0,0,0|0,0,2]=4 3352 B13R0.147 CCCSCCOC/C=C/C(=O)OC 34a_200000230433_100000742655 [0,2,0,0,0,0|0,0,2]=4 3353 B13R0.147 CCCSCCOC/C=C/C(=O)OC 7a_200000230433_100000742655 [0,2,0,0,0,0|0,0,2]=4 3354 B13R0.147 CCCSCCOCCCC(=O)OC 34a_200000230433_100000742333 [0,2,0,0,0,0|0,0,2]=4 3355 B13R0.147 CCCSCCOCCCC(=O)OC 7a_200000230433_100011218270 [0,2,0,0,0,0|0,0,2]=4 3356 B13R0.147 CCNCCCCCCCC(=O)OC 2230a_100015525214_100010004213 [0,2,0,0,0,0|0,0,2]=4 3357 B13R0.147 CCOCCCCCCCC(=O)OC 34a_100011022521_100000210202 [0,2,0,0,0,0|0,0,2]=4 3358 B13R0.147 CCOCCCCCCCC(=O)OC 34a_100121572206_100010004213 [0,2,0,0,0,0|0,0,2]=4 3359 B13R0.147 CCOCCCCCCCC(=O)OC 7a_100011022521_100000210202 [0,2,0,0,0,0|0,0,2]=4 3360 B13R0.147 CCOCCCNC/C=C/C(=O)OC 2230a_100000210961_100000742655 [0,2,0,0,0,0|0,0,2]=4 3361 B13R0.147 CCOCCCNC/C=C/C(=O)OC 34a_100000210961_100000742655 [0,2,0,0,0,0|0,0,2]=4 3362 B13R0.147 CCOCCCNCCCC(=O)OC 2230a_100000210961_100011218270 [0,2,0,0,0,0|0,0,2]=4 3363 B13R0.147 CCOCCCNCCCC(=O)OC 34a_100000210961_100000742333 [0,2,0,0,0,0|0,0,2]=4 3364 B13R0.147 CCOCCCOC/C=C/C(=O)OC 34a_100000757476_100000742655 [0,2,0,0,0,0|0,0,2]=4 3365 B13R0.147 CCOCCCOC/C=C/C(=O)OC 7a_100000757476_100000742655 [0,2,0,0,0,0|0,0,2]=4 3366 B13R0.147 CCOCCCOCCCC(=O)OC 34a_100000757476_100000742333 [0,2,0,0,0,0|0,0,2]=4 3367 B13R0.147 CCOCCCOCCCC(=O)OC 7a_100000757476_100011218270 [0,2,0,0,0,0|0,0,2]=4 3368 B13R0.147 CCOCCCOCCNC(=O)OC 34a_100000757965_100012232248 [0,2,0,0,0,0|1,0,1]=4 3369 B13R0.147 CCOCCCOCCOC(=O)OC 34a_100010262106_100012232248 [0,2,0,0,0,0|1,0,1]=4 3370 B13R0.147 CCOCCCSC/C=C/C(=O)OC 62a_100000742655_100012232248 [0,2,0,0,0,0|0,0,2]=4 3371 B13R0.147 CCOCCCSC/C=C/C(=O)OC 62a_100012232248_100000742655 [0,2,0,0,0,0|0,0,2]=4 3372 B13R0.147 CCOCCCSCCCC(=O)OC 62a_100011218270_100012232248 [0,2,0,0,0,0|0,0,2]=4 3373 B13R0.147 CCOCCCSCCCC(=O)OC 62a_100012232248_100011218270 [0,2,0,0,0,0|0,0,2]=4 3374 B13R0.147 CCOCCNCCCCC(=O)OC 2230a_102516460346_100000204269 [0,2,0,0,0,0|0,0,2]=4 3375 B13R0.147 CCOCCNCCCCC(=O)OC 34a_102516460346_100000204269 [0,2,0,0,0,0|0,0,2]=4 3376 B13R0.147 CCOCCNCCOCC(=O)OC 2230a_102516460346_100000090808 [0,2,0,0,0,0|1,0,1]=4 3377 B13R0.147 CCOCCNCCOCC(=O)OC 34a_102516460346_100000090808 [0,2,0,0,0,0|1,0,1]=4 3378 B13R0.147 CCOCCOCCCCC(=O)OC 34a_100000059025_100000210147 [0,2,0,0,0,0|0,0,2]=4 3379 B13R0.147 CCOCCOCCCCC(=O)OC 34a_100000210136_100000204269 [0,2,0,0,0,0|0,0,2]=4 3380 B13R0.147 CCOCCOCCCCC(=O)OC 7a_100000059025_100011215890 [0,2,0,0,0,0|0,0,2]=4 3381 B13R0.147 CCOCCOCCCCC(=O)OC 7a_100000210136_100000204269 [0,2,0,0,0,0|0,0,2]=4 3382 B13R0.147 CCOCCOCCNCC(=O)OC 2230a_100102712874_100000747449 [0,2,0,0,0,0|1,0,1]=4 3383 B13R0.147 CCOCCOCCNCC(=O)OC 34a_100102712874_100000747449 [0,2,0,0,0,0|1,0,1]=4 3384 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100000210136_100000090808 [0,2,0,0,0,0|1,0,1]=4 3385 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100000210240_100000747449 [0,2,0,0,0,0|1,0,1]=4 3386 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100011023656_100000210202 [0,2,0,0,0,0|1,0,1]=4 3387 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100000210136_100000090808 [0,2,0,0,0,0|1,0,1]=4 3388 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100000210240_100000747449 [0,2,0,0,0,0|1,0,1]=4 3389 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100011023656_100000210202 [0,2,0,0,0,0|1,0,1]=4 3390 B13R0.147 CCOCCOCCSCC(=O)OC 62a_100000747449_100011211534 [0,2,0,0,0,0|1,0,1]=4 3391 B13R0.147 CCOCCOCCSCC(=O)OC 62a_100011211534_100000747449 [0,2,0,0,0,0|1,0,1]=4 3392 B13R0.147 CCOCCSCCCCC(=O)OC 62a_100000204269_100011215890 [0,2,0,0,0,0|0,0,2]=4 3393 B13R0.147 CCOCCSCCCCC(=O)OC 62a_100000210147_100000204269 [0,2,0,0,0,0|0,0,2]=4 3394 B13R0.147 CCOCCSCCOCC(=O)OC 62a_100000090808_100011215890 [0,2,0,0,0,0|1,0,1]=4 3395 B13R0.147 CCOCCSCCOCC(=O)OC 62a_100000210147_100000090808 [0,2,0,0,0,0|1,0,1]=4 3396 B13R0.147 CCOCSCCCCCC(=O)OC 62a_100000739092_100009816466 [0,2,0,0,0,0|0,0,2]=4 3397 B13R0.147 CCOCSCCCCCC(=O)OC 62a_100009816466_100000739092 [0,2,0,0,0,0|0,0,2]=4 3398 B13R0.147 CCSCCCCCCCC(=O)OC 62a_100000210202_100010004213 [0,2,0,0,0,0|0,0,2]=4 3399 B13R0.147 CCSCCCCCCCC(=O)OC 62a_100010004213_100000210202 [0,2,0,0,0,0|0,0,2]=4 3400 B13R0.147 CCSCCCOC/C=C/C(=O)OC 34a_100011216438_100000742655 [0,2,0,0,0,0|0,0,2]=4 3401 B13R0.147 CCSCCCOC/C=C/C(=O)OC 7a_100011216438_100000742655 [0,2,0,0,0,0|0,0,2]=4 3402 B13R0.147 CCSCCCOCCCC(=O)OC 34a_100011216438_100000742333 [0,2,0,0,0,0|0,0,2]=4 3403 B13R0.147 CCSCCCOCCCC(=O)OC 7a_100011216438_100011218270 [0,2,0,0,0,0|0,0,2]=4 3404 B13R0.147 CCSCCNCCCCC(=O)OC 2230a_100000106463_100000204269 [0,2,0,0,0,0|0,0,2]=4 3405 B13R0.147 CCSCCNCCOCC(=O)OC 2230a_100000106463_100000090808 [0,2,0,0,0,0|1,0,1]=4 3406 B13R0.147 CCSCCOCCCCC(=O)OC 34a_100000059025_100000757381 [0,2,0,0,0,0|0,0,2]=4 3407 B13R0.147 CCSCCOCCCCC(=O)OC 34a_100000212035_100000204269 [0,2,0,0,0,0|0,0,2]=4 3408 B13R0.147 CCSCCOCCCCC(=O)OC 7a_100000059025_100000757381 [0,2,0,0,0,0|0,0,2]=4 3409 B13R0.147 CCSCCOCCCCC(=O)OC 7a_100000212035_100000204269 [0,2,0,0,0,0|0,0,2]=4 3410 B13R0.147 CCSCCOCCOCC(=O)OC 34a_100000212035_100000090808 [0,2,0,0,0,0|1,0,1]=4 3411 B13R0.147 CCSCCOCCOCC(=O)OC 7a_100000212035_100000090808 [0,2,0,0,0,0|1,0,1]=4 3412 B13R0.147 CCSCCSCCCCC(=O)OC 62a_100000204269_100000757381 [0,2,0,0,0,0|0,0,2]=4 3413 B13R0.147 CCSCCSCCCCC(=O)OC 62a_100000757381_100000204269 [0,2,0,0,0,0|0,0,2]=4 3414 B13R0.147 CCSCCSCCOCC(=O)OC 62a_100000090808_100000757381 [0,2,0,0,0,0|1,0,1]=4 3415 B13R0.147 CCSCCSCCOCC(=O)OC 62a_100000757381_100000090808 [0,2,0,0,0,0|1,0,1]=4 3416 B13R0.147 CNCCCCCCCCC(=O)OC 2230a_106832991635_100010282707 [0,2,0,0,0,0|0,0,2]=4 3417 B13R0.147 CNCCCCCCCCC(=O)OC 34a_100102657272_100010282707 [0,2,0,0,0,0|0,0,2]=4 3418 B13R0.147 CNCCCCCCCCC(=O)OC 7a_106832991635_100010282707 [0,2,0,0,0,0|0,0,2]=4 3419 B13R0.147 CNCCCCCOCCC(=O)OC 34a_100000722520_100000742370 [0,2,0,0,0,0|0,0,2]=4 3420 B13R0.147 CNCCCOCCCCC(=O)OC 34a_100000213112_100000204269 [0,2,0,0,0,0|0,0,2]=4 3421 B13R0.147 CNCCCOCCOCC(=O)OC 34a_100000213112_100000090808 [0,2,0,0,0,0|1,0,1]=4 3422 B13R0.147 COC(=O)/C=C/CNCCCCCO 2230a_100000762737_100000742655 [0,2,0,0,0,0|0,0,2]=4 3423 B13R0.147 COC(=O)/C=C/CNCCCCCO 34a_100000762737_100000742655 [0,2,0,0,0,0|0,0,2]=4 3424 B13R0.147 COC(=O)/C=C/COCCCCCBr 34a_100000746331_100000742655 [0,2,0,0,0,0|0,0,2]=4 3425 B13R0.147 COC(=O)/C=C/COCCCCCBr 7a_100000746331_100000742655 [0,2,0,0,0,0|0,0,2]=4 3426 B13R0.147 COC(=O)/C=C/COCCCCCCl 34a_100000746330_100000742655 [0,2,0,0,0,0|0,0,2]=4 3427 B13R0.147 COC(=O)/C=C/COCCCCCCl 7a_100000746330_100000742655 [0,2,0,0,0,0|0,0,2]=4 3428 B13R0.147 COC(=O)/C=C/COCCCCCI 34a_200012148887_100000742655 [0,2,0,0,0,0|0,0,2]=4 3429 B13R0.147 COC(=O)/C=C/COCCCCCI 7a_200012148887_100000742655 [0,2,0,0,0,0|0,0,2]=4 3430 B13R0.147 COC(=O)/C=C/COCCCCCN 34a_100000762737_100000742655 [0,2,0,0,0,0|0,0,2]=4 3431 B13R0.147 COC(=O)/C=C/COCCCCSC 34a_100011217163_100000742655 [0,2,0,0,0,0|0,0,2]=4 3432 B13R0.147 COC(=O)/C=C/COCCCCSC 7a_100011217163_100000742655 [0,2,0,0,0,0|0,0,2]=4 3433 B13R0.147 COC(=O)/C=C/CSCCCCCF 62a_100000729378_100000742655 [0,2,0,0,0,0|0,0,2]=4 3434 B13R0.147 COC(=O)/C=C/CSCCCCCF 62a_100000742655_100000729378 [0,2,0,0,0,0|0,0,2]=4 3435 B13R0.147 COC(=O)/C=C/CSCCCCCO 62a_100000742655_100000746330 [0,2,0,0,0,0|0,0,2]=4 3436 B13R0.147 COC(=O)/C=C/CSCCCCCO 62a_100000746330_100000742655 [0,2,0,0,0,0|0,0,2]=4 3437 B13R0.147 COC(=O)CCCCCCCCO[13CH3] 34a_100000035544_200025704644 [0,2,0,0,0,0|0,0,2]=4 3438 B13R0.147 COC(=O)CCCCCCCCO[13CH3] 7a_100000035544_200025704644 [0,2,0,0,0,0|0,0,2]=4 3439 B13R0.147 COC(=O)CCCCCCCCSC 62a_100010282707_200000210301 [0,2,0,0,0,0|0,0,2]=4 3440 B13R0.147 COC(=O)CCCCCCCCSC 62a_200000210301_100010282707 [0,2,0,0,0,0|0,0,2]=4 3441 B13R0.147 COC(=O)CCCCCCCCS[13CH3] 62a_100010282707_200025704644 [0,2,0,0,0,0|0,0,2]=4 3442 B13R0.147 COC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100010282707 [0,2,0,0,0,0|0,0,2]=4 3443 B13R0.147 COC(=O)CCCCCCCOCF 34a_100011022521_100015361967 [0,2,0,0,0,0|0,0,2]=4 3444 B13R0.147 COC(=O)CCCCCCCOCF 7a_100011022521_100015361967 [0,2,0,0,0,0|0,0,2]=4 3445 B13R0.147 COC(=O)CCCCCCCSCF 62a_100010004213_100015361967 [0,2,0,0,0,0|0,0,2]=4 3446 B13R0.147 COC(=O)CCCCCCCSCF 62a_100015361967_100010004213 [0,2,0,0,0,0|0,0,2]=4 3447 B13R0.147 COC(=O)CCCCCCNCCF 34a_100000724931_100009815986 [0,2,0,0,0,0|0,0,2]=4 3448 B13R0.147 COC(=O)CCCCCCNCCO 2230a_100016997473_100009815986 [0,2,0,0,0,0|0,0,2]=4 3449 B13R0.147 COC(=O)CCCCCCNCCO 34a_100016990907_100009815986 [0,2,0,0,0,0|0,0,2]=4 3450 B13R0.147 COC(=O)CCCCCCOCCBr 34a_100000211926_100009815986 [0,2,0,0,0,0|0,0,2]=4 3451 B13R0.147 COC(=O)CCCCCCOCCF 34a_100009863599_100011217306 [0,2,0,0,0,0|0,0,2]=4 3452 B13R0.147 COC(=O)CCCCCCOCCF 7a_100009863599_100011217306 [0,2,0,0,0,0|0,0,2]=4 3453 B13R0.147 COC(=O)CCCCCCOCCN 34a_100000210304_100009815986 [0,2,0,0,0,0|0,0,2]=4 3454 B13R0.147 COC(=O)CCCCCCOCCO 34a_100009863599_100000211926 [0,2,0,0,0,0|0,0,2]=4 3455 B13R0.147 COC(=O)CCCCCCOCCO 7a_100009863599_100000211926 [0,2,0,0,0,0|0,0,2]=4 3456 B13R0.147 COC(=O)CCCCCCOCSC 34a_100009863599_100011218213 [0,2,0,0,0,0|0,0,2]=4 3457 B13R0.147 COC(=O)CCCCCCSCCF 62a_100009815986_100011217306 [0,2,0,0,0,0|0,0,2]=4 3458 B13R0.147 COC(=O)CCCCCCSCCF 62a_100011217306_100009815986 [0,2,0,0,0,0|0,0,2]=4 3459 B13R0.147 COC(=O)CCCCCCSCCO 62a_100000211926_100009815986 [0,2,0,0,0,0|0,0,2]=4 3460 B13R0.147 COC(=O)CCCCCCSCCO 62a_100009815986_100000211926 [0,2,0,0,0,0|0,0,2]=4 3461 B13R0.147 COC(=O)CCCCCCSCSC 62a_100009815986_100011218213 [0,2,0,0,0,0|0,0,2]=4 3462 B13R0.147 COC(=O)CCCCCCSCSC 62a_100011218213_100009815986 [0,2,0,0,0,0|0,0,2]=4 3463 B13R0.147 COC(=O)CCCCCNCCCF 2230a_100015189416_100009816466 [0,2,0,0,0,0|0,0,2]=4 3464 B13R0.147 COC(=O)CCCCCNCCCF 34a_100015189416_100009816466 [0,2,0,0,0,0|0,0,2]=4 3465 B13R0.147 COC(=O)CCCCCNCCSC 2230a_100020590264_100009816466 [0,2,0,0,0,0|0,0,2]=4 3466 B13R0.147 COC(=O)CCCCCOCCCBr 34a_100011217188_100009816466 [0,2,0,0,0,0|0,0,2]=4 3467 B13R0.147 COC(=O)CCCCCOCCCCl 34a_100000230001_100009816466 [0,2,0,0,0,0|0,0,2]=4 3468 B13R0.147 COC(=O)CCCCCOCCCF 34a_100000074720_100011934791 [0,2,0,0,0,0|0,0,2]=4 3469 B13R0.147 COC(=O)CCCCCOCCCF 34a_100000759539_100009816466 [0,2,0,0,0,0|0,0,2]=4 3470 B13R0.147 COC(=O)CCCCCOCCCF 7a_100000074720_100011934791 [0,2,0,0,0,0|0,0,2]=4 3471 B13R0.147 COC(=O)CCCCCOCCCN 34a_100000182051_100009816466 [0,2,0,0,0,0|0,0,2]=4 3472 B13R0.147 COC(=O)CCCCCOCCCO 34a_100000074720_100000230001 [0,2,0,0,0,0|0,0,2]=4 3473 B13R0.147 COC(=O)CCCCCOCCCO 7a_100000074720_100011215043 [0,2,0,0,0,0|0,0,2]=4 3474 B13R0.147 COC(=O)CCCCCOCCSC 34a_100000074720_100000212216 [0,2,0,0,0,0|0,0,2]=4 3475 B13R0.147 COC(=O)CCCCCOCCSC 34a_100000230434_100009816466 [0,2,0,0,0,0|0,0,2]=4 3476 B13R0.147 COC(=O)CCCCCOCCSC 7a_100000074720_100000212216 [0,2,0,0,0,0|0,0,2]=4 3477 B13R0.147 COC(=O)CCCCCOCCSC 7a_100000230434_100009816466 [0,2,0,0,0,0|0,0,2]=4 3478 B13R0.147 COC(=O)CCCCCSCCCF 62a_100009816466_100011934791 [0,2,0,0,0,0|0,0,2]=4 3479 B13R0.147 COC(=O)CCCCCSCCCF 62a_100011934791_100009816466 [0,2,0,0,0,0|0,0,2]=4 3480 B13R0.147 COC(=O)CCCCCSCCCO 62a_100009816466_100011215043 [0,2,0,0,0,0|0,0,2]=4 3481 B13R0.147 COC(=O)CCCCCSCCCO 62a_100011215043_100009816466 [0,2,0,0,0,0|0,0,2]=4 3482 B13R0.147 COC(=O)CCCCCSCCSC 62a_100000212216_100009816466 [0,2,0,0,0,0|0,0,2]=4 3483 B13R0.147 COC(=O)CCCCCSCCSC 62a_100009816466_100000751147 [0,2,0,0,0,0|0,0,2]=4 3484 B13R0.147 COC(=O)CCCCNCCCCO 2230a_100000750430_100000204269 [0,2,0,0,0,0|0,0,2]=4 3485 B13R0.147 COC(=O)CCCCNCCCCO 34a_100000750430_100000204269 [0,2,0,0,0,0|0,0,2]=4 3486 B13R0.147 COC(=O)CCCCNCCCSC 2230a_100000749238_100000204269 [0,2,0,0,0,0|0,0,2]=4 3487 B13R0.147 COC(=O)CCCCOCCCCBr 34a_100011216708_100000204269 [0,2,0,0,0,0|0,0,2]=4 3488 B13R0.147 COC(=O)CCCCOCCCCCl 34a_100000210776_100000204269 [0,2,0,0,0,0|0,0,2]=4 3489 B13R0.147 COC(=O)CCCCOCCCCCl 7a_100000210776_100000204269 [0,2,0,0,0,0|0,0,2]=4 3490 B13R0.147 COC(=O)CCCCOCCCCF 34a_100000059025_100000729493 [0,2,0,0,0,0|0,0,2]=4 3491 B13R0.147 COC(=O)CCCCOCCCCF 34a_100011995726_100000204269 [0,2,0,0,0,0|0,0,2]=4 3492 B13R0.147 COC(=O)CCCCOCCCCF 7a_100000059025_100000729493 [0,2,0,0,0,0|0,0,2]=4 3493 B13R0.147 COC(=O)CCCCOCCCCF 7a_100011995726_100000204269 [0,2,0,0,0,0|0,0,2]=4 3494 B13R0.147 COC(=O)CCCCOCCCCI 34a_200012148704_100000204269 [0,2,0,0,0,0|0,0,2]=4 3495 B13R0.147 COC(=O)CCCCOCCCCN 34a_100000750430_100000204269 [0,2,0,0,0,0|0,0,2]=4 3496 B13R0.147 COC(=O)CCCCOCCCCO 34a_100000059025_100011216708 [0,2,0,0,0,0|0,0,2]=4 3497 B13R0.147 COC(=O)CCCCOCCCCO 7a_100000059025_100000210776 [0,2,0,0,0,0|0,0,2]=4 3498 B13R0.147 COC(=O)CCCCOCCCSC 34a_100000690336_100000204269 [0,2,0,0,0,0|0,0,2]=4 3499 B13R0.147 COC(=O)CCCCOCCCSC 7a_100000690336_100000204269 [0,2,0,0,0,0|0,0,2]=4 3500 B13R0.147 COC(=O)CCCCSCCCCF 62a_100000204269_100000729493 [0,2,0,0,0,0|0,0,2]=4 3501 B13R0.147 COC(=O)CCCCSCCCCF 62a_100000729493_100000204269 [0,2,0,0,0,0|0,0,2]=4 3502 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000204269_100000210776 [0,2,0,0,0,0|0,0,2]=4 3503 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000210776_100000204269 [0,2,0,0,0,0|0,0,2]=4 3504 B13R0.147 COC(=O)CCCNCCCCCO 2230a_100000762737_100011218270 [0,2,0,0,0,0|0,0,2]=4 3505 B13R0.147 COC(=O)CCCNCCCCCO 34a_100000762737_100000742333 [0,2,0,0,0,0|0,0,2]=4 3506 B13R0.147 COC(=O)CCCOCCCCCBr 34a_100000746331_100000742333 [0,2,0,0,0,0|0,0,2]=4 3507 B13R0.147 COC(=O)CCCOCCCCCBr 7a_100000746331_100011218270 [0,2,0,0,0,0|0,0,2]=4 3508 B13R0.147 COC(=O)CCCOCCCCCCl 34a_100000746330_100000742333 [0,2,0,0,0,0|0,0,2]=4 3509 B13R0.147 COC(=O)CCCOCCCCCCl 7a_100000746330_100011218270 [0,2,0,0,0,0|0,0,2]=4 3510 B13R0.147 COC(=O)CCCOCCCCCI 34a_200012148887_100000742333 [0,2,0,0,0,0|0,0,2]=4 3511 B13R0.147 COC(=O)CCCOCCCCCI 7a_200012148887_100011218270 [0,2,0,0,0,0|0,0,2]=4 3512 B13R0.147 COC(=O)CCCOCCCCCN 34a_100000762737_100000742333 [0,2,0,0,0,0|0,0,2]=4 3513 B13R0.147 COC(=O)CCCOCCCCSC 34a_100011217163_100000742333 [0,2,0,0,0,0|0,0,2]=4 3514 B13R0.147 COC(=O)CCCOCCCCSC 7a_100011217163_100011218270 [0,2,0,0,0,0|0,0,2]=4 3515 B13R0.147 COC(=O)CCCSCCCCCF 62a_100000729378_100011218270 [0,2,0,0,0,0|0,0,2]=4 3516 B13R0.147 COC(=O)CCCSCCCCCF 62a_100011218270_100000729378 [0,2,0,0,0,0|0,0,2]=4 3517 B13R0.147 COC(=O)CCCSCCCCCO 62a_100000746330_100011218270 [0,2,0,0,0,0|0,0,2]=4 3518 B13R0.147 COC(=O)CCCSCCCCCO 62a_100011218270_100000746330 [0,2,0,0,0,0|0,0,2]=4 3519 B13R0.147 COC(=O)CCNCCCCCCO 2230a_100000686447_100000204255 [0,2,0,0,0,0|0,0,2]=4 3520 B13R0.147 COC(=O)CCNCCCCCCO 34a_100000686447_100000742370 [0,2,0,0,0,0|0,0,2]=4 3521 B13R0.147 COC(=O)CCOCCCCCCBr 34a_100011215345_100000742370 [0,2,0,0,0,0|0,0,2]=4 3522 B13R0.147 COC(=O)CCOCCCCCCBr 7a_100011215345_100000204255 [0,2,0,0,0,0|0,0,2]=4 3523 B13R0.147 COC(=O)CCOCCCCCCCl 34a_100000766143_100000742370 [0,2,0,0,0,0|0,0,2]=4 3524 B13R0.147 COC(=O)CCOCCCCCCCl 7a_100000766143_100000204255 [0,2,0,0,0,0|0,0,2]=4 3525 B13R0.147 COC(=O)CCOCCCCCCF 34a_100000732779_100000742370 [0,2,0,0,0,0|0,0,2]=4 3526 B13R0.147 COC(=O)CCOCCCCCCF 7a_100000732779_100000204255 [0,2,0,0,0,0|0,0,2]=4 3527 B13R0.147 COC(=O)CCOCCCCCCN 34a_100000686447_100000742370 [0,2,0,0,0,0|0,0,2]=4 3528 B13R0.147 COC(=O)CCSCCCCCCF 62a_100000204255_100015922095 [0,2,0,0,0,0|0,0,2]=4 3529 B13R0.147 COC(=O)CCSCCCCCCF 62a_100015922095_100000204255 [0,2,0,0,0,0|0,0,2]=4 3530 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000204255_100000766143 [0,2,0,0,0,0|0,0,2]=4 3531 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000766143_100000204255 [0,2,0,0,0,0|0,0,2]=4 3532 B13R0.147 COC(=O)CNCCCCCCCO 2230a_100011996573_100000747449 [0,2,0,0,0,0|0,0,2]=4 3533 B13R0.147 COC(=O)CNCCCCCCCO 34a_100011996573_100000747449 [0,2,0,0,0,0|0,0,2]=4 3534 B13R0.147 COC(=O)CNCCCOCCCO 2230a_100011310245_100000747449 [0,2,0,0,0,0|1,0,1]=4 3535 B13R0.147 COC(=O)CNCCCOCCCO 34a_100011310245_100000747449 [0,2,0,0,0,0|1,0,1]=4 3536 B13R0.147 COC(=O)COCCCCCCCBr 34a_100000760002_100000747449 [0,2,0,0,0,0|0,0,2]=4 3537 B13R0.147 COC(=O)COCCCCCCCBr 7a_100000760002_100000747449 [0,2,0,0,0,0|0,0,2]=4 3538 B13R0.147 COC(=O)COCCCCCCCN 34a_100011996573_100000747449 [0,2,0,0,0,0|0,0,2]=4 3539 B13R0.147 COC(=O)COCCCOCCCN 34a_100011310245_100000747449 [0,2,0,0,0,0|1,0,1]=4 3540 B13R0.147 COC(=O)COCCNCCCCO 2230a_100000750430_100000090808 [0,2,0,0,0,0|1,0,1]=4 3541 B13R0.147 COC(=O)COCCNCCCCO 34a_100000750430_100000090808 [0,2,0,0,0,0|1,0,1]=4 3542 B13R0.147 COC(=O)COCCNCCCSC 2230a_100000749238_100000090808 [0,2,0,0,0,0|1,0,1]=4 3543 B13R0.147 COC(=O)COCCOCCCCBr 34a_100011216708_100000090808 [0,2,0,0,0,0|1,0,1]=4 3544 B13R0.147 COC(=O)COCCOCCCCCl 34a_100000210776_100000090808 [0,2,0,0,0,0|1,0,1]=4 3545 B13R0.147 COC(=O)COCCOCCCCCl 7a_100000210776_100000090808 [0,2,0,0,0,0|1,0,1]=4 3546 B13R0.147 COC(=O)COCCOCCCCF 34a_100011995726_100000090808 [0,2,0,0,0,0|1,0,1]=4 3547 B13R0.147 COC(=O)COCCOCCCCF 7a_100011995726_100000090808 [0,2,0,0,0,0|1,0,1]=4 3548 B13R0.147 COC(=O)COCCOCCCCI 34a_200012148704_100000090808 [0,2,0,0,0,0|1,0,1]=4 3549 B13R0.147 COC(=O)COCCOCCCCN 34a_100000750430_100000090808 [0,2,0,0,0,0|1,0,1]=4 3550 B13R0.147 COC(=O)COCCOCCCSC 34a_100000690336_100000090808 [0,2,0,0,0,0|1,0,1]=4 3551 B13R0.147 COC(=O)COCCOCCCSC 7a_100000690336_100000090808 [0,2,0,0,0,0|1,0,1]=4 3552 B13R0.147 COC(=O)COCCSCCCCF 62a_100000090808_100000729493 [0,2,0,0,0,0|1,0,1]=4 3553 B13R0.147 COC(=O)COCCSCCCCF 62a_100000729493_100000090808 [0,2,0,0,0,0|1,0,1]=4 3554 B13R0.147 COC(=O)COCCSCCCCO 62a_100000090808_100000210776 [0,2,0,0,0,0|1,0,1]=4 3555 B13R0.147 COC(=O)COCCSCCCCO 62a_100000210776_100000090808 [0,2,0,0,0,0|1,0,1]=4 3556 B13R0.147 COC(=O)CSCCCCCCC#N 62a_100000747449_100009813337 [0,2,0,0,0,0|1,0,1]=4 3557 B13R0.147 COC(=O)CSCCCCCCC#N 62a_100009813337_100000747449 [0,2,0,0,0,0|1,0,1]=4 3558 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000747449_100000760002 [0,2,0,0,0,0|0,0,2]=4 3559 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000760002_100000747449 [0,2,0,0,0,0|0,0,2]=4 3560 B13R0.147 COC(=O)NCCOCCCCCF 34a_100000757965_100000729378 [0,2,0,0,0,0|1,0,1]=4 3561 B13R0.147 COC(=O)NCCOCCCCCO 34a_100000757965_100000746330 [0,2,0,0,0,0|1,0,1]=4 3562 B13R0.147 COC(=O)OCCOCCCCCF 34a_100010262106_100000729378 [0,2,0,0,0,0|1,0,1]=4 3563 B13R0.147 COC(=O)OCCOCCCCCO 34a_100010262106_100000746330 [0,2,0,0,0,0|1,0,1]=4 3564 B13R0.147 COC(=O)OCSCCCCCCF 62a_100015922095_100000139417 [0,2,0,0,0,0|1,0,1]=4 3565 B13R0.147 COC(=O)OCSCCCCCCO 62a_100000766143_100000139417 [0,2,0,0,0,0|1,0,1]=4 3566 B13R0.147 COCCCCCCCCC(=O)OC 34a_100000035544_200000210301 [0,2,0,0,0,0|0,0,2]=4 3567 B13R0.147 COCCCCCCCCC(=O)OC 34a_100138415774_100010282707 [0,2,0,0,0,0|0,0,2]=4 3568 B13R0.147 COCCCCCCCCC(=O)OC 7a_100000035544_200000210301 [0,2,0,0,0,0|0,0,2]=4 3569 B13R0.147 COCCCCCCOCC(=O)OC 34a_200012092642_100000747449 [0,2,0,0,0,0|0,0,2]=4 3570 B13R0.147 COCCCCCCOCC(=O)OC 7a_200012092642_100000747449 [0,2,0,0,0,0|0,0,2]=4 3571 B13R0.147 COCCCCCCSCC(=O)OC 62a_100000747449_100011998445 [0,2,0,0,0,0|0,0,2]=4 3572 B13R0.147 COCCCCCCSCC(=O)OC 62a_100011998445_100000747449 [0,2,0,0,0,0|0,0,2]=4 3573 B13R0.147 COCCCCCNCCC(=O)OC 2230a_100000747528_100000204255 [0,2,0,0,0,0|0,0,2]=4 3574 B13R0.147 COCCCCCNCCC(=O)OC 34a_100000747528_100000742370 [0,2,0,0,0,0|0,0,2]=4 3575 B13R0.147 COCCCCOC/C=C/C(=O)OC 34a_100000740925_100000742655 [0,2,0,0,0,0|0,0,2]=4 3576 B13R0.147 COCCCCOCCCC(=O)OC 34a_100000740925_100000742333 [0,2,0,0,0,0|0,0,2]=4 3577 B13R0.147 COCCCCOCCNC(=O)OC 34a_100000757965_100000755781 [0,2,0,0,0,0|1,0,1]=4 3578 B13R0.147 COCCCCOCCOC(=O)OC 34a_100010262106_100000755781 [0,2,0,0,0,0|1,0,1]=4 3579 B13R0.147 COCCCCSC/C=C/C(=O)OC 62a_100000730899_100000742655 [0,2,0,0,0,0|0,0,2]=4 3580 B13R0.147 COCCCCSC/C=C/C(=O)OC 62a_100000742655_100000730899 [0,2,0,0,0,0|0,0,2]=4 3581 B13R0.147 COCCCCSCCCC(=O)OC 62a_100000730899_100011218270 [0,2,0,0,0,0|0,0,2]=4 3582 B13R0.147 COCCCCSCCCC(=O)OC 62a_100011218270_100000730899 [0,2,0,0,0,0|0,0,2]=4 3583 B13R0.147 COCCCNCCCCC(=O)OC 34a_100150723488_100000204269 [0,2,0,0,0,0|0,0,2]=4 3584 B13R0.147 COCCCNCCOCC(=O)OC 34a_100150723488_100000090808 [0,2,0,0,0,0|1,0,1]=4 3585 B13R0.147 COCCCOCCCCC(=O)OC 34a_100000059025_100000740836 [0,2,0,0,0,0|0,0,2]=4 3586 B13R0.147 COCCCOCCCCC(=O)OC 34a_100000740835_100000204269 [0,2,0,0,0,0|0,0,2]=4 3587 B13R0.147 COCCCOCCCCC(=O)OC 7a_100000059025_100000740836 [0,2,0,0,0,0|0,0,2]=4 3588 B13R0.147 COCCCOCCOCC(=O)OC 34a_100000740835_100000090808 [0,2,0,0,0,0|1,0,1]=4 3589 B13R0.147 COCCCSCCCCC(=O)OC 62a_100000204269_100000709357 [0,2,0,0,0,0|0,0,2]=4 3590 B13R0.147 COCCCSCCCCC(=O)OC 62a_100000709357_100000204269 [0,2,0,0,0,0|0,0,2]=4 3591 B13R0.147 COCCCSCCOCC(=O)OC 62a_100000090808_100000709357 [0,2,0,0,0,0|1,0,1]=4 3592 B13R0.147 COCCCSCCOCC(=O)OC 62a_100000709357_100000090808 [0,2,0,0,0,0|1,0,1]=4 3593 B13R0.147 COCCNCCCCCC(=O)OC 2230a_100000209980_100009816466 [0,2,0,0,0,0|0,0,2]=4 3594 B13R0.147 COCCOCCCCCC(=O)OC 34a_100000074720_100011201679 [0,2,0,0,0,0|0,0,2]=4 3595 B13R0.147 COCCOCCCCCC(=O)OC 34a_100000210237_100009816466 [0,2,0,0,0,0|0,0,2]=4 3596 B13R0.147 COCCOCCCCCC(=O)OC 7a_100000074720_100000233755 [0,2,0,0,0,0|0,0,2]=4 3597 B13R0.147 COCCOCCCNCC(=O)OC 2230a_100000206027_100000747449 [0,2,0,0,0,0|1,0,1]=4 3598 B13R0.147 COCCOCCCNCC(=O)OC 34a_100000206027_100000747449 [0,2,0,0,0,0|1,0,1]=4 3599 B13R0.147 COCCOCCCSCC(=O)OC 62a_100000747449_100011216529 [0,2,0,0,0,0|1,0,1]=4 3600 B13R0.147 COCCOCCCSCC(=O)OC 62a_100011216529_100000747449 [0,2,0,0,0,0|1,0,1]=4 3601 B13R0.147 COCCSCCCCCC(=O)OC 62a_100000233755_100009816466 [0,2,0,0,0,0|0,0,2]=4 3602 B13R0.147 COCCSCCCCCC(=O)OC 62a_100009816466_100000233755 [0,2,0,0,0,0|0,0,2]=4 3603 B13R0.147 COCSCCCCCCC(=O)OC 62a_100000766300_100009815986 [0,2,0,0,0,0|0,0,2]=4 3604 B13R0.147 COCSCCCCCCC(=O)OC 62a_100009815986_100000766300 [0,2,0,0,0,0|0,0,2]=4 3605 B13R0.202 COC(=O)/C=C/CNCCCC(C)C 2230a_200000737386_100000742655 [0,2,0,0,0,0|0,0,2]=4 3606 B13R0.202 COC(=O)/C=C/CNCCCC(C)C 34a_200000737386_100000742655 [0,2,0,0,0,0|0,0,2]=4 3607 B13R0.202 COC(=O)/C=C/COCCCC(C)C 34a_100000210774_100000742655 [0,2,0,0,0,0|0,0,2]=4 3608 B13R0.202 COC(=O)/C=C/COCCCC(C)C 7a_100000210774_100000742655 [0,2,0,0,0,0|0,0,2]=4 3609 B13R0.202 COC(=O)/C=C/CSCCCC(C)C 62a_100000742655_100011214892 [0,2,0,0,0,0|0,0,2]=4 3610 B13R0.202 COC(=O)/C=C/CSCCCC(C)C 62a_100011214892_100000742655 [0,2,0,0,0,0|0,0,2]=4 3611 B13R0.202 COC(=O)/C=C/CSCCCC(C)O 62a_100000742655_200000718107 [0,2,0,0,0,0|0,0,2]=4 3612 B13R0.202 COC(=O)/C=C/CSCCCC(C)O 62a_200000718107_100000742655 [0,2,0,0,0,0|0,0,2]=4 3613 B13R0.202 COC(=O)CCCCCCCC(=O)C 1458a_100000033222_200000210301 [0,2,0,0,0,0|0,0,2]=4 3614 B13R0.202 COC(=O)CCCCCCCC(=O)C 1458a_100000070787_100010004213 [0,2,0,0,0,0|0,0,2]=4 3615 B13R0.202 COC(=O)CCCCCCCC(=O)[13CH3] 1458a_100000033222_200025704644 [0,2,0,0,0,0|0,0,2]=4 3616 B13R0.202 COC(=O)CCCCCCCN(C)C 2230a_100102631434_100010004213 [0,2,0,0,0,0|0,0,2]=4 3617 B13R0.202 COC(=O)CCCCCCCN(C)C 269982a_100102631434_100010004213 [0,2,0,0,0,0|0,0,2]=4 3618 B13R0.202 COC(=O)CCCCCCNC(C)C 2230a_100138425928_100009815986 [0,2,0,0,0,0|0,0,2]=4 3619 B13R0.202 COC(=O)CCCCCCNC(C)C 34a_100138425928_100009815986 [0,2,0,0,0,0|0,0,2]=4 3620 B13R0.202 COC(=O)CCCCCCOC(C)C 34a_100000212225_100009815986 [0,2,0,0,0,0|0,0,2]=4 3621 B13R0.202 COC(=O)CCCCCCOC(C)C 34a_100009863599_100000210206 [0,2,0,0,0,0|0,0,2]=4 3622 B13R0.202 COC(=O)CCCCCCOC(C)C 7a_100009863599_100000210206 [0,2,0,0,0,0|0,0,2]=4 3623 B13R0.202 COC(=O)CCCCCCSC(C)C 62a_100000210206_100009815986 [0,2,0,0,0,0|0,0,2]=4 3624 B13R0.202 COC(=O)CCCCCCSC(C)C 62a_100009815986_100000210206 [0,2,0,0,0,0|0,0,2]=4 3625 B13R0.202 COC(=O)CCCCCNCC(C)C 2230a_100000210953_100009816466 [0,2,0,0,0,0|0,0,2]=4 3626 B13R0.202 COC(=O)CCCCCNCC(C)C 34a_100000210953_100009816466 [0,2,0,0,0,0|0,0,2]=4 3627 B13R0.202 COC(=O)CCCCCNCC(C)O 2230a_100000210904_100009816466 [0,2,0,0,0,0|0,0,2]=4 3628 B13R0.202 COC(=O)CCCCCNCC(C)O 34a_100000210904_100009816466 [0,2,0,0,0,0|0,0,2]=4 3629 B13R0.202 COC(=O)CCCCCOCC(C)Br 34a_100012180447_100009816466 [0,2,0,0,0,0|0,0,2]=4 3630 B13R0.202 COC(=O)CCCCCOCC(C)C 34a_100000074720_100000210624 [0,2,0,0,0,0|0,0,2]=4 3631 B13R0.202 COC(=O)CCCCCOCC(C)C 34a_100000210257_100009816466 [0,2,0,0,0,0|0,0,2]=4 3632 B13R0.202 COC(=O)CCCCCOCC(C)C 7a_100000074720_100000210760 [0,2,0,0,0,0|0,0,2]=4 3633 B13R0.202 COC(=O)CCCCCOCC(C)F 34a_100015925927_100009816466 [0,2,0,0,0,0|0,0,2]=4 3634 B13R0.202 COC(=O)CCCCCOCC(C)O 34a_100000074720_100011218427 [0,2,0,0,0,0|0,0,2]=4 3635 B13R0.202 COC(=O)CCCCCOCC(C)O 7a_100000074720_100011218427 [0,2,0,0,0,0|0,0,2]=4 3636 B13R0.202 COC(=O)CCCCCOC[C@@H](C)Cl 34a_100016084084_100009816466 [0,2,0,0,0,0|0,0,2]=4 3637 B13R0.202 COC(=O)CCCCCOC[C@@H](C)N 34a_100000737577_100009816466 [0,2,0,0,0,0|0,0,2]=4 3638 B13R0.202 COC(=O)CCCCCOC[C@@H](C)O 34a_100000074720_100009817552 [0,2,0,0,0,0|0,0,2]=4 3639 B13R0.202 COC(=O)CCCCCOC[C@@H](C)O 7a_100000074720_100009817552 [0,2,0,0,0,0|0,0,2]=4 3640 B13R0.202 COC(=O)CCCCCSCC(C)C 62a_100000210624_100009816466 [0,2,0,0,0,0|0,0,2]=4 3641 B13R0.202 COC(=O)CCCCCSCC(C)C 62a_100009816466_100000210760 [0,2,0,0,0,0|0,0,2]=4 3642 B13R0.202 COC(=O)CCCCCSCC(C)O 62a_100009816466_100011218427 [0,2,0,0,0,0|0,0,2]=4 3643 B13R0.202 COC(=O)CCCCCSCC(C)O 62a_100011218427_100009816466 [0,2,0,0,0,0|0,0,2]=4 3644 B13R0.202 COC(=O)CCCCCSC[C@@H](C)O 62a_100009816466_100009817552 [0,2,0,0,0,0|0,0,2]=4 3645 B13R0.202 COC(=O)CCCCCSC[C@@H](C)O 62a_100009817552_100009816466 [0,2,0,0,0,0|0,0,2]=4 3646 B13R0.202 COC(=O)CCCCNCCC(C)O 2230a_200000755665_100000204269 [0,2,0,0,0,0|0,0,2]=4 3647 B13R0.202 COC(=O)CCCCOCCC(C)Br 34a_100009893172_100000204269 [0,2,0,0,0,0|0,0,2]=4 3648 B13R0.202 COC(=O)CCCCOCCC(C)C 34a_100000059025_100000210312 [0,2,0,0,0,0|0,0,2]=4 3649 B13R0.202 COC(=O)CCCCOCCC(C)C 34a_100000210254_100000204269 [0,2,0,0,0,0|0,0,2]=4 3650 B13R0.202 COC(=O)CCCCOCCC(C)C 7a_100000059025_100000210626 [0,2,0,0,0,0|0,0,2]=4 3651 B13R0.202 COC(=O)CCCCOCCC(C)C 7a_100000210254_100000204269 [0,2,0,0,0,0|0,0,2]=4 3652 B13R0.202 COC(=O)CCCCOCCC(C)O 34a_100000059025_100012276601 [0,2,0,0,0,0|0,0,2]=4 3653 B13R0.202 COC(=O)CCCCOCCC(C)O 7a_100000059025_100012276601 [0,2,0,0,0,0|0,0,2]=4 3654 B13R0.202 COC(=O)CCCCOCC[C@@H](C)N 34a_100000706166_100000204269 [0,2,0,0,0,0|0,0,2]=4 3655 B13R0.202 COC(=O)CCCCSCCC(C)C 62a_100000204269_100000210312 [0,2,0,0,0,0|0,0,2]=4 3656 B13R0.202 COC(=O)CCCCSCCC(C)C 62a_100000210312_100000204269 [0,2,0,0,0,0|0,0,2]=4 3657 B13R0.202 COC(=O)CCCCSCCC(C)O 62a_100000204269_100012276601 [0,2,0,0,0,0|0,0,2]=4 3658 B13R0.202 COC(=O)CCCCSCCC(C)O 62a_100012276601_100000204269 [0,2,0,0,0,0|0,0,2]=4 3659 B13R0.202 COC(=O)CCCNCCCC(C)C 2230a_200000737386_100011218270 [0,2,0,0,0,0|0,0,2]=4 3660 B13R0.202 COC(=O)CCCNCCCC(C)C 34a_200000737386_100000742333 [0,2,0,0,0,0|0,0,2]=4 3661 B13R0.202 COC(=O)CCCOCCCC(C)C 34a_100000210774_100000742333 [0,2,0,0,0,0|0,0,2]=4 3662 B13R0.202 COC(=O)CCCOCCCC(C)C 7a_100000210774_100011218270 [0,2,0,0,0,0|0,0,2]=4 3663 B13R0.202 COC(=O)CCCSCCCC(C)C 62a_100011214892_100011218270 [0,2,0,0,0,0|0,0,2]=4 3664 B13R0.202 COC(=O)CCCSCCCC(C)C 62a_100011218270_100011214892 [0,2,0,0,0,0|0,0,2]=4 3665 B13R0.202 COC(=O)CCCSCCCC(C)O 62a_100011218270_200000718107 [0,2,0,0,0,0|0,0,2]=4 3666 B13R0.202 COC(=O)CCCSCCCC(C)O 62a_200000718107_100011218270 [0,2,0,0,0,0|0,0,2]=4 3667 B13R0.202 COC(=O)CCOCCCCC(C)C 34a_100011214890_100000742370 [0,2,0,0,0,0|0,0,2]=4 3668 B13R0.202 COC(=O)CCOCCCCC(C)C 7a_100011214890_100000204255 [0,2,0,0,0,0|0,0,2]=4 3669 B13R0.202 COC(=O)CCSCCCCC(C)C 62a_100000204255_100011216152 [0,2,0,0,0,0|0,0,2]=4 3670 B13R0.202 COC(=O)CCSCCCCC(C)C 62a_100011216152_100000204255 [0,2,0,0,0,0|0,0,2]=4 3671 B13R0.202 COC(=O)CNCCCCCC(C)C 2230a_100011290863_100000747449 [0,2,0,0,0,0|0,0,2]=4 3672 B13R0.202 COC(=O)CNCCCCCC(C)C 34a_100011290863_100000747449 [0,2,0,0,0,0|0,0,2]=4 3673 B13R0.202 COC(=O)CNCCCOCC(C)C 2230a_100000205972_100000747449 [0,2,0,0,0,0|1,0,1]=4 3674 B13R0.202 COC(=O)CNCCCOCC(C)C 34a_100000205972_100000747449 [0,2,0,0,0,0|1,0,1]=4 3675 B13R0.202 COC(=O)COCCCCCC(C)C 34a_100011995859_100000747449 [0,2,0,0,0,0|0,0,2]=4 3676 B13R0.202 COC(=O)COCCCCCC(C)C 7a_100011995859_100000747449 [0,2,0,0,0,0|0,0,2]=4 3677 B13R0.202 COC(=O)COCCCCNC(C)C 34a_100011521146_100000747449 [0,2,0,0,0,0|1,0,1]=4 3678 B13R0.202 COC(=O)COCCNCCC(C)O 2230a_200000755665_100000090808 [0,2,0,0,0,0|1,0,1]=4 3679 B13R0.202 COC(=O)COCCOCCC(C)Br 34a_100009893172_100000090808 [0,2,0,0,0,0|1,0,1]=4 3680 B13R0.202 COC(=O)COCCOCCC(C)C 34a_100000210254_100000090808 [0,2,0,0,0,0|1,0,1]=4 3681 B13R0.202 COC(=O)COCCOCCC(C)C 7a_100000210254_100000090808 [0,2,0,0,0,0|1,0,1]=4 3682 B13R0.202 COC(=O)COCCOCC[C@@H](C)N 34a_100000706166_100000090808 [0,2,0,0,0,0|1,0,1]=4 3683 B13R0.202 COC(=O)COCCSCCC(C)C 62a_100000090808_100000210312 [0,2,0,0,0,0|1,0,1]=4 3684 B13R0.202 COC(=O)COCCSCCC(C)C 62a_100000210312_100000090808 [0,2,0,0,0,0|1,0,1]=4 3685 B13R0.202 COC(=O)COCCSCCC(C)O 62a_100000090808_100012276601 [0,2,0,0,0,0|1,0,1]=4 3686 B13R0.202 COC(=O)COCCSCCC(C)O 62a_100012276601_100000090808 [0,2,0,0,0,0|1,0,1]=4 3687 B13R0.202 COC(=O)CSCCCCCC(C)C 62a_100000210682_100000747449 [0,2,0,0,0,0|0,0,2]=4 3688 B13R0.202 COC(=O)CSCCCCCC(C)C 62a_100000747449_100000210682 [0,2,0,0,0,0|0,0,2]=4 3689 B13R0.202 COC(=O)NCCOCCCC(C)C 34a_100000757965_100011214892 [0,2,0,0,0,0|1,0,1]=4 3690 B13R0.202 COC(=O)NCCOCCCC(C)O 34a_100000757965_200000718107 [0,2,0,0,0,0|1,0,1]=4 3691 B13R0.202 COC(=O)OCCOCCCC(C)C 34a_100010262106_100011214892 [0,2,0,0,0,0|1,0,1]=4 3692 B13R0.202 COC(=O)OCCOCCCC(C)O 34a_100010262106_200000718107 [0,2,0,0,0,0|1,0,1]=4 3693 B13R0.202 COC(=O)OCSCCCCC(C)C 62a_100011216152_100000139417 [0,2,0,0,0,0|1,0,1]=4 3694 B13R0.308 CCCC(CCOCC(=O)OC)SC 34a_100000032865_100000747449 [0,2,0,0,0,0|1,0,1]=4 3695 B13R0.308 CCCC(CCOCC(=O)OC)SC 7a_100000032865_100000747449 [0,2,0,0,0,0|1,0,1]=4 3696 B11R1.53 CCC1CCCCN1C(=O)C 11a_100000210034_100015343762 [1,0,0,1,0,0|1,0,1]=4 3697 B11R1.53 CCC1CCCCN1C(=O)C 1626a_100000210034_100015343762 [1,0,0,1,0,0|1,0,1]=4 3698 B11R1.53 CCC1CCCCN1C(=O)C 240690a_100000210034_100015343762 [1,0,0,1,0,0|1,0,1]=4 3699 B11R1.53 CCC1CCCCN1C(=O)C 527a_100000210034_100103153847 [1,0,0,1,0,0|1,0,1]=4 3700 B11R1.86 CC(=O)NC1CCCCC1C 11a_100000211402_100015343762 [1,0,0,1,0,0|1,0,1]=4 3701 B11R1.86 CC(=O)NC1CCCCC1C 1626a_100000211402_100015343762 [1,0,0,1,0,0|1,0,1]=4 3702 B11R1.86 CC(=O)NC1CCCCC1C 240690a_100000211402_100015343762 [1,0,0,1,0,0|1,0,1]=4 3703 B11R1.86 CC(=O)NC1CCCCC1C 527a_100000211402_100103153847 [1,0,0,1,0,0|1,0,1]=4 3704 B11R1.91 CC(=O)C=CC1CCCCC1 1458a_100102566626_200000210301 [1,0,0,1,0,0|0,0,2]=4 3705 B11R1.91 CC(=O)CCC1CCCCC1 1458a_100000070787_100011273959 [1,0,0,1,0,0|0,0,2]=4 3706 B11R1.91 CC(=O)CCC1CCCCC1 1458a_100000211375_200000210301 [1,0,0,1,0,0|0,0,2]=4 3707 B11R1.91 CC(=O)COC1CCCCC1 1458a_100000070787_100011935260 [1,0,0,1,0,0|1,0,1]=4 3708 B11R1.91 CC(=O)COC1CCCCC1 1458a_100011223303_200000210301 [1,0,0,1,0,0|1,0,1]=4 3709 B11R1.91 CC(=O)COC1CCCCC1 34a_100000211253_100000210327 [1,0,0,1,0,0|1,0,1]=4 3710 B11R1.91 CC(=O)NCC1CCCCC1 11a_100000210473_100015343762 [1,0,0,1,0,0|1,0,1]=4 3711 B11R1.91 CC(=O)NCC1CCCCC1 1626a_100000210473_100015343762 [1,0,0,1,0,0|1,0,1]=4 3712 B11R1.91 CC(=O)NCC1CCCCC1 240690a_100000210473_100015343762 [1,0,0,1,0,0|1,0,1]=4 3713 B11R1.91 CC(=O)NCC1CCCCC1 527a_100000210473_100103153847 [1,0,0,1,0,0|1,0,1]=4 3714 B11R1.91 CC(=O)NNC1CCCCC1 22a_100000709804_100000070787 [1,0,0,1,0,0|2,0,0]=4 3715 B11R1.91 O=C(O)CNC1CCCCC1 269956a_100016091260_100000210327 [1,0,0,1,0,0|1,0,1]=4 3716 B11R1.91 [13CH3]C(=O)C=CC1CCCCC1 1458a_100102566626_200025704644 [1,0,0,1,0,0|0,0,2]=4 3717 B11R1.91 [13CH3]C(=O)CCC1CCCCC1 1458a_100000211375_200025704644 [1,0,0,1,0,0|0,0,2]=4 3718 B11R1.91 [13CH3]C(=O)COC1CCCCC1 1458a_100011223303_200025704644 [1,0,0,1,0,0|1,0,1]=4 3719 B11R1.172 CC(=O)CCCC1CCCC1 1458a_100000070787_100011713738 [1,0,0,1,0,0|0,0,2]=4 3720 B11R1.172 CC(=O)COCC1CCCC1 34a_100000211253_100000740388 [1,0,0,1,0,0|1,0,1]=4 3721 B11R1.172 CC(=O)NCCC1CCCC1 11a_100000739158_100015343762 [1,0,0,1,0,0|1,0,1]=4 3722 B11R1.172 CC(=O)NCCC1CCCC1 1626a_100000739158_100015343762 [1,0,0,1,0,0|1,0,1]=4 3723 B11R1.172 CC(=O)NCCC1CCCC1 240690a_100000739158_100015343762 [1,0,0,1,0,0|1,0,1]=4 3724 B11R1.172 CC(=O)NCCC1CCCC1 527a_100000739158_100103153847 [1,0,0,1,0,0|1,0,1]=4 3725 B11R1.172 O=C(O)CNCC1CCCC1 269956a_100016091260_100000740388 [1,0,0,1,0,0|1,0,1]=4 3726 B11R1.706 CC(=O)N1CCCCCCC1 11a_100000211400_100015343762 [1,0,0,1,0,0|1,0,1]=4 3727 B11R1.706 CC(=O)N1CCCCCCC1 1626a_100000211400_100015343762 [1,0,0,1,0,0|1,0,1]=4 3728 B11R1.706 CC(=O)N1CCCCCCC1 240690a_100000211400_100015343762 [1,0,0,1,0,0|1,0,1]=4 3729 B11R1.706 CC(=O)N1CCCCCCC1 527a_100000211400_100103153847 [1,0,0,1,0,0|1,0,1]=4 3730 B11R1.742 CC(=O)C=C1CCCCCC1 1458a_100011240665_200000210301 [1,0,0,1,0,0|0,0,2]=4 3731 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000070787_200000696569 [1,0,0,1,0,0|0,0,2]=4 3732 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000685095_200000210301 [1,0,0,1,0,0|0,0,2]=4 3733 B11R1.742 CC(=O)CN1CCCCCC1 1458a_100000740298_200000210301 [1,0,0,1,0,0|1,0,1]=4 3734 B11R1.742 CC(=O)NC1CCCCCC1 11a_100000210984_100015343762 [1,0,0,1,0,0|1,0,1]=4 3735 B11R1.742 CC(=O)NC1CCCCCC1 1626a_100000210984_100015343762 [1,0,0,1,0,0|1,0,1]=4 3736 B11R1.742 CC(=O)NC1CCCCCC1 240690a_100000210984_100015343762 [1,0,0,1,0,0|1,0,1]=4 3737 B11R1.742 CC(=O)NC1CCCCCC1 527a_100000210984_100103153847 [1,0,0,1,0,0|1,0,1]=4 3738 B11R1.742 [13CH3]C(=O)C=C1CCCCCC1 1458a_100011240665_200025704644 [1,0,0,1,0,0|0,0,2]=4 3739 B11R1.742 [13CH3]C(=O)CC1CCCCCC1 1458a_100000685095_200025704644 [1,0,0,1,0,0|0,0,2]=4 3740 B11R1.742 [13CH3]C(=O)CN1CCCCCC1 1458a_100000740298_200025704644 [1,0,0,1,0,0|1,0,1]=4 3741 B11R1.25 CCC(=O)CCC1CCCC1 1458a_100000210414_100000760354 [1,0,0,1,0,0|1,0,1]=4 3742 B11R1.25 CCC(=O)CCC1CCCC1 1458a_100000211120_100000210202 [1,0,0,1,0,0|1,0,1]=4 3743 B11R1.25 CCC(=O)NCC1CCCC1 11a_100000737975_100000210414 [1,0,0,1,0,0|2,0,0]=4 3744 B11R1.25 CCC(=O)NCC1CCCC1 1626a_100000737975_100000210414 [1,0,0,1,0,0|2,0,0]=4 3745 B11R1.25 CCC(=O)NCC1CCCC1 240690a_100000737975_100000210414 [1,0,0,1,0,0|2,0,0]=4 3746 B11R1.25 CCC(=O)NCC1CCCC1 527a_100000737975_100000210414 [1,0,0,1,0,0|2,0,0]=4 3747 B11R1.25 CNC(=O)CCC1CCCC1 11a_106832991635_100000211120 [1,0,0,1,0,0|1,0,1]=4 3748 B11R1.25 CNC(=O)CCC1CCCC1 1626a_100102657272_100000211120 [1,0,0,1,0,0|1,0,1]=4 3749 B11R1.25 CNC(=O)CCC1CCCC1 240690a_100102657272_100000211120 [1,0,0,1,0,0|1,0,1]=4 3750 B11R1.25 CNC(=O)CCC1CCCC1 527a_100102657272_100000211120 [1,0,0,1,0,0|1,0,1]=4 3751 B11R1.25 CNC(=O)NCC1CCCC1 2708a_100000737975_106832991635 [1,0,0,1,0,0|2,0,0]=4 3752 B11R1.25 CNC(=O)NCC1CCCC1 2708a_100102657272_100000737975 [1,0,0,1,0,0|2,0,0]=4 3753 B11R1.25 CNC(=O)NCC1CCCC1 273464a_100000737975_100102657272 [1,0,0,1,0,0|2,0,0]=4 3754 B11R1.25 CNC(=O)NCC1CCCC1 273464a_100102657272_100000737975 [1,0,0,1,0,0|2,0,0]=4 3755 B11R1.25 CNC(=O)NCC1CCCC1 512a_100000737975_100102657272 [1,0,0,1,0,0|2,0,0]=4 3756 B11R1.25 CNC(=O)NCC1CCCC1 512a_106832991638_100000737975 [1,0,0,1,0,0|2,0,0]=4 3757 B11R1.25 COC(=O)CCN1CCCC1 2230a_100000188435_100000204255 [1,0,0,1,0,0|1,0,1]=4 3758 B11R1.25 COC(=O)CCN1CCCC1 269982a_100000188435_100000204255 [1,0,0,1,0,0|1,0,1]=4 3759 B11R1.25 COC(=O)CNC1CCCC1 2230a_100000211070_100000747449 [1,0,0,1,0,0|1,0,1]=4 3760 B11R1.25 COC(=O)CNC1CCCC1 34a_100000211070_100000747449 [1,0,0,1,0,0|1,0,1]=4 3761 B11R1.25 COC(=O)COC1CCCC1 34a_100000210269_100000747449 [1,0,0,1,0,0|1,0,1]=4 3762 B11R1.25 COC(=O)COC1CCCC1 7a_100000210269_100000747449 [1,0,0,1,0,0|1,0,1]=4 3763 B11R1.25 COC(=O)CSC1CCCC1 62a_100000747449_100000179811 [1,0,0,1,0,0|1,0,1]=4 3764 B11R1.25 COC(=O)CSC1CCCC1 62a_100011217020_100000747449 [1,0,0,1,0,0|1,0,1]=4 3765 B11R1.40 CCC(=O)CC1CCCCC1 1458a_100000210414_100000211423 [1,0,0,1,0,0|1,0,1]=4 3766 B11R1.40 CCC(=O)CC1CCCCC1 1458a_100000211666_100000210202 [1,0,0,1,0,0|1,0,1]=4 3767 B11R1.40 CCC(=O)NC1CCCCC1 11a_100000182618_100000210414 [1,0,0,1,0,0|2,0,0]=4 3768 B11R1.40 CCC(=O)NC1CCCCC1 1626a_100000182618_100000210414 [1,0,0,1,0,0|2,0,0]=4 3769 B11R1.40 CCC(=O)NC1CCCCC1 240690a_100000182618_100000210414 [1,0,0,1,0,0|2,0,0]=4 3770 B11R1.40 CCC(=O)NC1CCCCC1 527a_100000182618_100000210414 [1,0,0,1,0,0|2,0,0]=4 3771 B11R1.40 CNC(=O)CC1CCCCC1 11a_106832991635_100000211666 [1,0,0,1,0,0|1,0,1]=4 3772 B11R1.40 CNC(=O)CC1CCCCC1 1626a_100102657272_100000211666 [1,0,0,1,0,0|1,0,1]=4 3773 B11R1.40 CNC(=O)CC1CCCCC1 240690a_100102657272_100000211666 [1,0,0,1,0,0|1,0,1]=4 3774 B11R1.40 CNC(=O)CC1CCCCC1 527a_100102657272_100000211666 [1,0,0,1,0,0|1,0,1]=4 3775 B11R1.40 CNC(=O)NC1CCCCC1 2708a_100000182618_106832991635 [1,0,0,1,0,0|2,0,0]=4 3776 B11R1.40 CNC(=O)NC1CCCCC1 2708a_100102657272_100000182618 [1,0,0,1,0,0|2,0,0]=4 3777 B11R1.40 CNC(=O)NC1CCCCC1 273464a_100000182618_100102657272 [1,0,0,1,0,0|2,0,0]=4 3778 B11R1.40 CNC(=O)NC1CCCCC1 273464a_100102657272_100000182618 [1,0,0,1,0,0|2,0,0]=4 3779 B11R1.59 CCC(=O)N1CCCC1CC 11a_100000754278_100000210414 [1,0,0,1,0,0|2,0,0]=4 3780 B11R1.59 CCC(=O)N1CCCC1CC 1626a_100000754278_100000210414 [1,0,0,1,0,0|2,0,0]=4 3781 B11R1.59 CCC(=O)N1CCCC1CC 240690a_100000754278_100000210414 [1,0,0,1,0,0|2,0,0]=4 3782 B11R1.59 CCC(=O)N1CCCC1CC 527a_100000754278_100000210414 [1,0,0,1,0,0|2,0,0]=4 3783 B11R1.59 CCC1CCCN1C(=O)NC 2708a_100102657272_100000754278 [1,0,0,1,0,0|2,0,0]=4 3784 B11R1.59 CCC1CCCN1C(=O)NC 273464a_100102657272_100000754278 [1,0,0,1,0,0|2,0,0]=4 3785 B11R1.59 CCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210202 [1,0,0,1,0,0|1,0,1]=4 3786 B11R1.59 CCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000204670 [1,0,0,1,0,0|1,0,1]=4 3787 B11R1.59 COC(=O)C1CCCC1OC 34a_200000081814_200000210301 [1,0,0,1,0,0|1,0,1]=4 3788 B11R1.59 COC(=O)C1CCCC1OC 7a_200000081814_200000210301 [1,0,0,1,0,0|1,0,1]=4 3789 B11R1.59 COC(=O)C1CCCC1O[13CH3] 34a_200000081814_200025704644 [1,0,0,1,0,0|1,0,1]=4 3790 B11R1.59 COC(=O)C1CCCC1O[13CH3] 7a_200000081814_200025704644 [1,0,0,1,0,0|1,0,1]=4 3791 B11R1.115 CCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210303 [1,0,0,1,0,0|1,0,1]=4 3792 B11R1.115 CCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210303 [1,0,0,1,0,0|1,0,1]=4 3793 B11R1.218 CCCCN1CC1C(=O)OC 2230a_200009830135_100000210211 [1,0,0,1,0,0|1,0,1]=4 3794 B11R1.222 CCC(=O)C1CCCCC1C 1458a_100011215568_100000210202 [1,0,0,1,0,0|1,0,1]=4 3795 B11R1.222 CCC(=O)N1CCCCC1C 11a_100000211376_100000210414 [1,0,0,1,0,0|2,0,0]=4 3796 B11R1.222 CCC(=O)N1CCCCC1C 1626a_100000211376_100000210414 [1,0,0,1,0,0|2,0,0]=4 3797 B11R1.222 CCC(=O)N1CCCCC1C 240690a_100000211376_100000210414 [1,0,0,1,0,0|2,0,0]=4 3798 B11R1.222 CCC(=O)N1CCCCC1C 527a_100000211376_100000210414 [1,0,0,1,0,0|2,0,0]=4 3799 B11R1.222 CNC(=O)C1CCCCC1C 11a_106832991635_100011215568 [1,0,0,1,0,0|1,0,1]=4 3800 B11R1.222 CNC(=O)C1CCCCC1C 1626a_100102657272_100011215568 [1,0,0,1,0,0|1,0,1]=4 3801 B11R1.222 CNC(=O)C1CCCCC1C 240690a_100102657272_100011215568 [1,0,0,1,0,0|1,0,1]=4 3802 B11R1.222 CNC(=O)C1CCCCC1C 527a_100102657272_100011215568 [1,0,0,1,0,0|1,0,1]=4 3803 B11R1.222 CNC(=O)N1CCCCC1C 2708a_100102657272_100000211376 [1,0,0,1,0,0|2,0,0]=4 3804 B11R1.222 CNC(=O)N1CCCCC1C 273464a_100102657272_100000211376 [1,0,0,1,0,0|2,0,0]=4 3805 B11R1.222 COC(=O)C1CCCCN1C 2230a_100000734855_200000210301 [1,0,0,1,0,0|1,0,1]=4 3806 B11R1.222 COC(=O)C1CCCCN1C 269982a_100000734855_200000210301 [1,0,0,1,0,0|1,0,1]=4 3807 B11R1.222 COC(=O)C1CCCCN1C 34a_100000734855_200000210301 [1,0,0,1,0,0|1,0,1]=4 3808 B11R1.222 COC(=O)C1CCCCN1[13CH3] 2230a_100000734855_200025704644 [1,0,0,1,0,0|1,0,1]=4 3809 B11R1.222 COC(=O)C1CCCCN1[13CH3] 269982a_100000734855_200025704644 [1,0,0,1,0,0|1,0,1]=4 3810 B11R1.222 COC(=O)C1CCCCN1[13CH3] 34a_100000734855_200025704644 [1,0,0,1,0,0|1,0,1]=4 3811 B11R1.223 COC(=O)CCN1CCC1C 269982a_100000755817_100000204255 [1,0,0,1,0,0|1,0,1]=4 3812 B11R1.223 COC(=O)CCN1CCC1C 34a_100000755817_100000742370 [1,0,0,1,0,0|1,0,1]=4 3813 B11R1.228 COC(=O)CN1CCC[C@@H]1C 2230a_100020605311_100000747449 [1,0,0,1,0,0|1,0,1]=4 3814 B11R1.228 COC(=O)CN1CCC[C@@H]1C 269982a_100020605311_100000747449 [1,0,0,1,0,0|1,0,1]=4 3815 B11R1.228 COC(=O)CN1CCC[C@H]1C 2230a_100015189458_100000747449 [1,0,0,1,0,0|1,0,1]=4 3816 B11R1.228 COC(=O)CN1CCC[C@H]1C 269982a_100015189458_100000747449 [1,0,0,1,0,0|1,0,1]=4 3817 B11R1.228 COC(=O)CN1CCC[C@H]1C 34a_100015189458_100000747449 [1,0,0,1,0,0|1,0,1]=4 3818 B11R1.228 COC(=O)C[C@H]1CCCN1C 2230a_100025726698_200000210301 [1,0,0,1,0,0|1,0,1]=4 3819 B11R1.228 COC(=O)C[C@H]1CCCN1C 269982a_100025726698_200000210301 [1,0,0,1,0,0|1,0,1]=4 3820 B11R1.228 COC(=O)C[C@H]1CCCN1C 34a_100025726698_200000210301 [1,0,0,1,0,0|1,0,1]=4 3821 B11R1.228 COC(=O)C[C@H]1CCCN1[13CH3] 2230a_100025726698_200025704644 [1,0,0,1,0,0|1,0,1]=4 3822 B11R1.228 COC(=O)C[C@H]1CCCN1[13CH3] 269982a_100025726698_200025704644 [1,0,0,1,0,0|1,0,1]=4 3823 B11R1.228 COC(=O)C[C@H]1CCCN1[13CH3] 34a_100025726698_200025704644 [1,0,0,1,0,0|1,0,1]=4 3824 B11R1.235 COC(=O)COCC1CC1C 34a_100000744939_100000747449 [1,0,0,1,0,0|1,0,1]=4 3825 B11R1.235 COC(=O)COCC1CC1C 7a_100000744939_100000747449 [1,0,0,1,0,0|1,0,1]=4 3826 B11R1.236 COC(=O)CCCN1CCC1 269982a_100000754969_100011218270 [1,0,0,1,0,0|1,0,1]=4 3827 B11R1.236 COC(=O)CCNC1CCC1 2230a_100000749019_100000204255 [1,0,0,1,0,0|1,0,1]=4 3828 B11R1.236 COC(=O)CCNC1CCC1 34a_100000749019_100000742370 [1,0,0,1,0,0|1,0,1]=4 3829 B11R1.236 COC(=O)CCOC1CCC1 34a_100000748187_100000742370 [1,0,0,1,0,0|1,0,1]=4 3830 B11R1.236 COC(=O)CCSC1CCC1 62a_100000204255_100000749161 [1,0,0,1,0,0|1,0,1]=4 3831 B11R1.236 COC(=O)CNCC1CCC1 2230a_100000738700_100000747449 [1,0,0,1,0,0|1,0,1]=4 3832 B11R1.236 COC(=O)CNCC1CCC1 34a_100000738700_100000747449 [1,0,0,1,0,0|1,0,1]=4 3833 B11R1.236 COC(=O)COCC1CCC1 34a_100000760304_100000747449 [1,0,0,1,0,0|1,0,1]=4 3834 B11R1.236 COC(=O)CSCC1CCC1 62a_100000747449_100000763275 [1,0,0,1,0,0|1,0,1]=4 3835 B11R1.236 COC(=O)CSCC1CCC1 62a_100000763275_100000747449 [1,0,0,1,0,0|1,0,1]=4 3836 B11R1.237 COC(=O)CCCNC1CC1 34a_100000212008_100000742333 [1,0,0,1,0,0|1,0,1]=4 3837 B11R1.237 COC(=O)CCCSC1CC1 62a_100011218270_100000211595 [1,0,0,1,0,0|1,0,1]=4 3838 B11R1.237 COC(=O)CCNCC1CC1 2230a_100000735609_100000204255 [1,0,0,1,0,0|1,0,1]=4 3839 B11R1.237 COC(=O)CCNCC1CC1 34a_100000735609_100000742370 [1,0,0,1,0,0|1,0,1]=4 3840 B11R1.237 COC(=O)CCOCC1CC1 34a_100000211283_100000742370 [1,0,0,1,0,0|1,0,1]=4 3841 B11R1.237 COC(=O)CCSCC1CC1 62a_100000204255_100000742324 [1,0,0,1,0,0|1,0,1]=4 3842 B11R1.237 COC(=O)CCSCC1CC1 62a_100000756562_100000204255 [1,0,0,1,0,0|1,0,1]=4 3843 B11R1.237 COC(=O)CNCCC1CC1 34a_100000764129_100000747449 [1,0,0,1,0,0|1,0,1]=4 3844 B11R1.237 COC(=O)COCCC1CC1 34a_100000754188_100000747449 [1,0,0,1,0,0|1,0,1]=4 3845 B11R1.237 COC(=O)COCCC1CC1 7a_100000754188_100000747449 [1,0,0,1,0,0|1,0,1]=4 3846 B11R1.237 COC(=O)CSCCC1CC1 62a_100000747449_100000764125 [1,0,0,1,0,0|1,0,1]=4 3847 B11R1.237 COC(=O)CSCCC1CC1 62a_100000764125_100000747449 [1,0,0,1,0,0|1,0,1]=4 3848 B11R1.237 COC(=O)NCCOC1CC1 34a_100000757965_100000211595 [1,0,0,1,0,0|2,0,0]=4 3849 B11R1.237 COC(=O)OCCOC1CC1 34a_100010262106_100000211595 [1,0,0,1,0,0|2,0,0]=4 3850 B11R1.237 COC(=O)OCSCC1CC1 62a_100000756562_100000139417 [1,0,0,1,0,0|2,0,0]=4 3851 B11R1.852 CCC(=O)C1CCCCCC1 1458a_100000210414_100011217769 [1,0,0,1,0,0|1,0,1]=4 3852 B11R1.852 CCC(=O)C1CCCCCC1 1458a_100000749507_100000210202 [1,0,0,1,0,0|1,0,1]=4 3853 B11R1.852 CCC(=O)N1CCCCCC1 11a_100000185865_100000210414 [1,0,0,1,0,0|2,0,0]=4 3854 B11R1.852 CCC(=O)N1CCCCCC1 1626a_100000185865_100000210414 [1,0,0,1,0,0|2,0,0]=4 3855 B11R1.852 CCC(=O)N1CCCCCC1 240690a_100000185865_100000210414 [1,0,0,1,0,0|2,0,0]=4 3856 B11R1.852 CCC(=O)N1CCCCCC1 527a_100000185865_100000210414 [1,0,0,1,0,0|2,0,0]=4 3857 B11R1.852 CNC(=O)C1CCCCCC1 11a_106832991635_100000749507 [1,0,0,1,0,0|1,0,1]=4 3858 B11R1.852 CNC(=O)C1CCCCCC1 1626a_100102657272_100000749507 [1,0,0,1,0,0|1,0,1]=4 3859 B11R1.852 CNC(=O)C1CCCCCC1 240690a_100102657272_100000749507 [1,0,0,1,0,0|1,0,1]=4 3860 B11R1.852 CNC(=O)C1CCCCCC1 527a_100102657272_100000749507 [1,0,0,1,0,0|1,0,1]=4 3861 B11R1.852 CNC(=O)N1CCCCCC1 2708a_100102657272_100000185865 [1,0,0,1,0,0|2,0,0]=4 3862 B11R1.852 CNC(=O)N1CCCCCC1 273464a_100102657272_100000185865 [1,0,0,1,0,0|2,0,0]=4 3863 B13R1.6 CCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210314 [0,1,0,1,0,0|1,0,1]=4 3864 B13R1.42 CCOC(=O)CNC1CCCCC1 2230a_100000182618_100000188475 [0,1,0,1,0,0|1,0,1]=4 3865 B13R1.42 CCOC(=O)CNC1CCCCC1 34a_100000182618_100000188475 [0,1,0,1,0,0|1,0,1]=4 3866 B13R1.42 CCOC(=O)COC1CCCCC1 34a_100000210231_100000188475 [0,1,0,1,0,0|1,0,1]=4 3867 B13R1.42 CCOC(=O)COC1CCCCC1 7a_100000210231_100000188475 [0,1,0,1,0,0|1,0,1]=4 3868 B13R1.42 CCOC(=O)CSC1CCCCC1 62a_100000188475_100000210327 [0,1,0,1,0,0|1,0,1]=4 3869 B13R1.42 CCOC(=O)CSC1CCCCC1 62a_100000210327_100000188475 [0,1,0,1,0,0|1,0,1]=4 3870 B13R1.42 COCC(=O)CCC1CCCCC1 1458a_100000210968_100011273959 [0,1,0,1,0,0|0,0,2]=4 3871 B13R1.42 COCC(=O)COC1CCCCC1 1458a_100000210968_100011935260 [0,1,0,1,0,0|1,0,1]=4 3872 B13R1.42 COCC(=O)NCC1CCCCC1 11a_100000210473_100000210968 [0,1,0,1,0,0|1,0,1]=4 3873 B13R1.42 COCC(=O)NCC1CCCCC1 1626a_100000210473_100000210968 [0,1,0,1,0,0|1,0,1]=4 3874 B13R1.42 COCC(=O)NCC1CCCCC1 240690a_100000210473_100000210968 [0,1,0,1,0,0|1,0,1]=4 3875 B13R1.42 COCC(=O)NCC1CCCCC1 34a_100138415774_100000183341 [0,1,0,1,0,0|1,0,1]=4 3876 B13R1.42 COCC(=O)NCC1CCCCC1 527a_100000210473_100000210968 [0,1,0,1,0,0|1,0,1]=4 3877 B13R1.42 COCC(=O)NNC1CCCCC1 22a_100000709804_100000210968 [0,1,0,1,0,0|2,0,0]=4 3878 B13R1.404 CCOC(=O)CNCC1CCCC1 2230a_100000737975_100000188475 [0,1,0,1,0,0|1,0,1]=4 3879 B13R1.404 CCOC(=O)CNCC1CCCC1 34a_100000737975_100000188475 [0,1,0,1,0,0|1,0,1]=4 3880 B13R1.404 CCOC(=O)COCC1CCCC1 34a_100000742336_100000188475 [0,1,0,1,0,0|1,0,1]=4 3881 B13R1.404 CCOC(=O)COCC1CCCC1 7a_100000742336_100000188475 [0,1,0,1,0,0|1,0,1]=4 3882 B13R1.404 CCOC(=O)CSCC1CCCC1 62a_100000188475_100000740388 [0,1,0,1,0,0|1,0,1]=4 3883 B13R1.404 CCOC(=O)CSCC1CCCC1 62a_100000740388_100000188475 [0,1,0,1,0,0|1,0,1]=4 3884 B13R1.404 COCC(=O)CCCC1CCCC1 1458a_100000210968_100011713738 [0,1,0,1,0,0|0,0,2]=4 3885 B13R1.404 COCC(=O)NCCC1CCCC1 11a_100000739158_100000210968 [0,1,0,1,0,0|1,0,1]=4 3886 B13R1.404 COCC(=O)NCCC1CCCC1 1626a_100000739158_100000210968 [0,1,0,1,0,0|1,0,1]=4 3887 B13R1.404 COCC(=O)NCCC1CCCC1 240690a_100000739158_100000210968 [0,1,0,1,0,0|1,0,1]=4 3888 B13R1.404 COCC(=O)NCCC1CCCC1 527a_100000739158_100000210968 [0,1,0,1,0,0|1,0,1]=4 3889 B13R1.443 CCOC(=O)CN1CCCC1CC 2230a_100000754278_100000188475 [0,1,0,1,0,0|1,0,1]=4 3890 B13R1.443 CCOC(=O)CN1CCCC1CC 269982a_100000754278_100000188475 [0,1,0,1,0,0|1,0,1]=4 3891 B13R1.443 CCOC(=O)CN1CCCC1CC 34a_100000754278_100000188475 [0,1,0,1,0,0|1,0,1]=4 3892 B13R1.444 CCOC(=O)COC1CCCC1C 34a_100011216460_100000188475 [0,1,0,1,0,0|1,0,1]=4 3893 B13R1.444 CCOC(=O)COC1CCCC1C 7a_100011216460_100000188475 [0,1,0,1,0,0|1,0,1]=4 3894 B13R1.464 CCC1CCCCN1C(=O)COC 11a_100000210034_100000210968 [0,1,0,1,0,0|1,0,1]=4 3895 B13R1.464 CCC1CCCCN1C(=O)COC 1626a_100000210034_100000210968 [0,1,0,1,0,0|1,0,1]=4 3896 B13R1.464 CCC1CCCCN1C(=O)COC 240690a_100000210034_100000210968 [0,1,0,1,0,0|1,0,1]=4 3897 B13R1.464 CCC1CCCCN1C(=O)COC 34a_100138415774_100000183412 [0,1,0,1,0,0|1,0,1]=4 3898 B13R1.464 CCC1CCCCN1C(=O)COC 527a_100000210034_100000210968 [0,1,0,1,0,0|1,0,1]=4 3899 B13R1.470 CCOC(=O)CN1CCCCC1C 2230a_100000211376_100000188475 [0,1,0,1,0,0|1,0,1]=4 3900 B13R1.470 CCOC(=O)CN1CCCCC1C 269982a_100000211376_100000188475 [0,1,0,1,0,0|1,0,1]=4 3901 B13R1.470 CCOC(=O)CN1CCCCC1C 34a_100000211376_100000188475 [0,1,0,1,0,0|1,0,1]=4 3902 B13R1.470 COCC(=O)NC1CCCCC1C 11a_100000211402_100000210968 [0,1,0,1,0,0|1,0,1]=4 3903 B13R1.470 COCC(=O)NC1CCCCC1C 1626a_100000211402_100000210968 [0,1,0,1,0,0|1,0,1]=4 3904 B13R1.470 COCC(=O)NC1CCCCC1C 240690a_100000211402_100000210968 [0,1,0,1,0,0|1,0,1]=4 3905 B13R1.470 COCC(=O)NC1CCCCC1C 34a_100138415774_100000182742 [0,1,0,1,0,0|1,0,1]=4 3906 B13R1.470 COCC(=O)NC1CCCCC1C 527a_100000211402_100000210968 [0,1,0,1,0,0|1,0,1]=4 3907 B13R1.654 CCCCCCNC1CCOC1=O 2230a_100000210581_100000211211 [0,1,0,1,0,0|1,0,1]=4 3908 B13R1.654 CCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100000210314 [0,1,0,1,0,0|1,0,1]=4 3909 B13R1.654 CCCCCCN[C@@H]1CONC1=O 34a_100000765999_100000210314 [0,1,0,1,0,0|1,0,1]=4 3910 B13R1.654 CCCCCCOC1CCOC1=O 34a_100000210259_100000211211 [0,1,0,1,0,0|1,0,1]=4 3911 B13R1.654 CCCCCCOC1CCOC1=O 7a_100000210259_100000211211 [0,1,0,1,0,0|1,0,1]=4 3912 B13R1.654 CCCCCCSC1CCOC1=O 62a_100000210314_100000211211 [0,1,0,1,0,0|1,0,1]=4 3913 B13R1.654 CCCCCCSC1CCOC1=O 62a_100000211211_100000210757 [0,1,0,1,0,0|1,0,1]=4 3914 B13R1.1464 COCC(=O)N1CCCCCCC1 11a_100000211400_100000210968 [0,1,0,1,0,0|1,0,1]=4 3915 B13R1.1464 COCC(=O)N1CCCCCCC1 1626a_100000211400_100000210968 [0,1,0,1,0,0|1,0,1]=4 3916 B13R1.1464 COCC(=O)N1CCCCCCC1 240690a_100000211400_100000210968 [0,1,0,1,0,0|1,0,1]=4 3917 B13R1.1464 COCC(=O)N1CCCCCCC1 34a_100138415774_100000230191 [0,1,0,1,0,0|1,0,1]=4 3918 B13R1.1464 COCC(=O)N1CCCCCCC1 527a_100000211400_100000210968 [0,1,0,1,0,0|1,0,1]=4 3919 B13R1.1575 CCOC(=O)CN1CCCCCC1 2230a_100000185865_100000188475 [0,1,0,1,0,0|1,0,1]=4 3920 B13R1.1575 CCOC(=O)CN1CCCCCC1 269982a_100000185865_100000188475 [0,1,0,1,0,0|1,0,1]=4 3921 B13R1.1575 CCOC(=O)CN1CCCCCC1 34a_100000185865_100000188475 [0,1,0,1,0,0|1,0,1]=4 3922 B13R1.1575 COCC(=O)CC1CCCCCC1 1458a_100000210968_200000696569 [0,1,0,1,0,0|0,0,2]=4 3923 B13R1.1575 COCC(=O)NC1CCCCCC1 11a_100000210984_100000210968 [0,1,0,1,0,0|1,0,1]=4 3924 B13R1.1575 COCC(=O)NC1CCCCCC1 1626a_100000210984_100000210968 [0,1,0,1,0,0|1,0,1]=4 3925 B13R1.1575 COCC(=O)NC1CCCCCC1 240690a_100000210984_100000210968 [0,1,0,1,0,0|1,0,1]=4 3926 B13R1.1575 COCC(=O)NC1CCCCCC1 34a_100138415774_100000183474 [0,1,0,1,0,0|1,0,1]=4 3927 B13R1.1575 COCC(=O)NC1CCCCCC1 527a_100000210984_100000210968 [0,1,0,1,0,0|1,0,1]=4 3928 B13R1.3151 CCCCCC#CCC(=O)C1CO1 1458a_100000701028_100009816472 [0,1,0,1,0,0|0,0,2]=4 3929 B13R1.3151 CCCCCCCCC(=O)C1CO1 1458a_100000701028_100000210759 [0,1,0,1,0,0|0,0,2]=4 3930 B13R1.3151 CCCCCCCNC(=O)C1CO1 11a_100000229938_100000701028 [0,1,0,1,0,0|1,0,1]=4 3931 B13R1.3151 CCCCCCCNC(=O)C1CO1 1626a_100000229938_100000701028 [0,1,0,1,0,0|1,0,1]=4 3932 B13R1.3151 CCCCCCCNC(=O)C1CO1 240690a_100000229938_100000701028 [0,1,0,1,0,0|1,0,1]=4 3933 B13R1.3151 CCCCCCCNC(=O)C1CO1 527a_100000229938_100000701028 [0,1,0,1,0,0|1,0,1]=4 3934 B13R1.102 CCC1CCCN1C(=O)C(=O)OC 11a_100000754278_100000024059 [0,1,0,1,0,0|1,0,1]=4 3935 B13R1.102 CCC1CCCN1C(=O)C(=O)OC 1626a_100000754278_100000024059 [0,1,0,1,0,0|1,0,1]=4 3936 B13R1.102 CCC1CCCN1C(=O)C(=O)OC 240690a_100000754278_100000024059 [0,1,0,1,0,0|1,0,1]=4 3937 B13R1.102 CCC1CCCN1C(=O)C(=O)OC 527a_100000754278_100000024059 [0,1,0,1,0,0|1,0,1]=4 3938 B13R1.102 CCC1CCCN1C(C)C(=O)OC 2230a_100000754278_100000211248 [0,1,0,1,0,0|1,0,1]=4 3939 B13R1.102 CCC1CCCN1C(C)C(=O)OC 269982a_100000754278_100000211248 [0,1,0,1,0,0|1,0,1]=4 3940 B13R1.102 CCC1CCCN1C(C)C(=O)OC 34a_100000754278_100000211248 [0,1,0,1,0,0|1,0,1]=4 3941 B13R1.135 COC(=O)C(=O)NC1CCCCC1 11a_100000182618_100000024059 [0,1,0,1,0,0|1,0,1]=4 3942 B13R1.135 COC(=O)C(=O)NC1CCCCC1 1626a_100000182618_100000024059 [0,1,0,1,0,0|1,0,1]=4 3943 B13R1.135 COC(=O)C(=O)NC1CCCCC1 240690a_100000182618_100000024059 [0,1,0,1,0,0|1,0,1]=4 3944 B13R1.135 COC(=O)C(=O)NC1CCCCC1 527a_100000182618_100000024059 [0,1,0,1,0,0|1,0,1]=4 3945 B13R1.135 COC(=O)C(C)NC1CCCCC1 2230a_100000182618_100000211248 [0,1,0,1,0,0|1,0,1]=4 3946 B13R1.135 COC(=O)C(C)NC1CCCCC1 34a_100000182618_100000211248 [0,1,0,1,0,0|1,0,1]=4 3947 B13R1.135 COC(=O)C(C)OC1CCCCC1 34a_100000210231_100000211248 [0,1,0,1,0,0|1,0,1]=4 3948 B13R1.135 COC(=O)C(C)OC1CCCCC1 34a_100011215400_100000210327 [0,1,0,1,0,0|1,0,1]=4 3949 B13R1.135 COC(=O)C(C)OC1CCCCC1 7a_100000210231_100000211248 [0,1,0,1,0,0|1,0,1]=4 3950 B13R1.135 COC(=O)C(C)SC1CCCCC1 62a_100000210327_100000211248 [0,1,0,1,0,0|1,0,1]=4 3951 B13R1.135 COC(=O)C(C)SC1CCCCC1 62a_100000211248_100000210327 [0,1,0,1,0,0|1,0,1]=4 3952 B13R1.554 COC(=O)C(=O)NCC1CCCC1 11a_100000737975_100000024059 [0,1,0,1,0,0|1,0,1]=4 3953 B13R1.554 COC(=O)C(=O)NCC1CCCC1 1626a_100000737975_100000024059 [0,1,0,1,0,0|1,0,1]=4 3954 B13R1.554 COC(=O)C(=O)NCC1CCCC1 240690a_100000737975_100000024059 [0,1,0,1,0,0|1,0,1]=4 3955 B13R1.554 COC(=O)C(=O)NCC1CCCC1 527a_100000737975_100000024059 [0,1,0,1,0,0|1,0,1]=4 3956 B13R1.554 COC(=O)C(C)NCC1CCCC1 2230a_100000737975_100000211248 [0,1,0,1,0,0|1,0,1]=4 3957 B13R1.554 COC(=O)C(C)NCC1CCCC1 34a_100000737975_100000211248 [0,1,0,1,0,0|1,0,1]=4 3958 B13R1.554 COC(=O)C(C)OCC1CCCC1 34a_100000742336_100000211248 [0,1,0,1,0,0|1,0,1]=4 3959 B13R1.554 COC(=O)C(C)OCC1CCCC1 34a_100011215400_100000740388 [0,1,0,1,0,0|1,0,1]=4 3960 B13R1.554 COC(=O)C(C)OCC1CCCC1 7a_100000742336_100000211248 [0,1,0,1,0,0|1,0,1]=4 3961 B13R1.554 COC(=O)C(C)SCC1CCCC1 62a_100000211248_100000740388 [0,1,0,1,0,0|1,0,1]=4 3962 B13R1.554 COC(=O)C(C)SCC1CCCC1 62a_100000740388_100000211248 [0,1,0,1,0,0|1,0,1]=4 3963 B13R1.696 COC(=O)C(=O)N1CCCCC1C 11a_100000211376_100000024059 [0,1,0,1,0,0|1,0,1]=4 3964 B13R1.696 COC(=O)C(=O)N1CCCCC1C 1626a_100000211376_100000024059 [0,1,0,1,0,0|1,0,1]=4 3965 B13R1.696 COC(=O)C(=O)N1CCCCC1C 240690a_100000211376_100000024059 [0,1,0,1,0,0|1,0,1]=4 3966 B13R1.696 COC(=O)C(=O)N1CCCCC1C 527a_100000211376_100000024059 [0,1,0,1,0,0|1,0,1]=4 3967 B13R1.696 COC(=O)C(C)N1CCCCC1C 2230a_100000211376_100000211248 [0,1,0,1,0,0|1,0,1]=4 3968 B13R1.696 COC(=O)C(C)N1CCCCC1C 269982a_100000211376_100000211248 [0,1,0,1,0,0|1,0,1]=4 3969 B13R1.696 COC(=O)C(C)N1CCCCC1C 34a_100000211376_100000211248 [0,1,0,1,0,0|1,0,1]=4 3970 B13R1.704 COC(=O)C(C)OC1CCCC1C 34a_100011216460_100000211248 [0,1,0,1,0,0|1,0,1]=4 3971 B13R1.704 COC(=O)C(C)OC1CCCC1C 7a_100011216460_100000211248 [0,1,0,1,0,0|1,0,1]=4 3972 B13R1.1885 CCCCCCN1CC1C(=O)OC 2230a_200009830135_100000210314 [0,1,0,1,0,0|0,0,2]=4 3973 B13R1.2620 COC(=O)C(=O)N1CCCCCC1 11a_100000185865_100000024059 [0,1,0,1,0,0|1,0,1]=4 3974 B13R1.2620 COC(=O)C(=O)N1CCCCCC1 1626a_100000185865_100000024059 [0,1,0,1,0,0|1,0,1]=4 3975 B13R1.2620 COC(=O)C(=O)N1CCCCCC1 240690a_100000185865_100000024059 [0,1,0,1,0,0|1,0,1]=4 3976 B13R1.2620 COC(=O)C(=O)N1CCCCCC1 527a_100000185865_100000024059 [0,1,0,1,0,0|1,0,1]=4 3977 B13R1.2620 COC(=O)C(C)N1CCCCCC1 2230a_100000185865_100000211248 [0,1,0,1,0,0|1,0,1]=4 3978 B13R1.2620 COC(=O)C(C)N1CCCCCC1 269982a_100000185865_100000211248 [0,1,0,1,0,0|1,0,1]=4 3979 B13R1.2620 COC(=O)C(C)N1CCCCCC1 34a_100000185865_100000211248 [0,1,0,1,0,0|1,0,1]=4 3980 B13R1.528 COC(=O)CCN1CCCCC1C 2230a_100000211376_100000204255 [0,1,0,1,0,0|0,0,2]=4 3981 B13R1.528 COC(=O)CCN1CCCCC1C 269982a_100000211376_100000204255 [0,1,0,1,0,0|0,0,2]=4 3982 B13R1.528 COC(=O)CCN1CCCCC1C 34a_100000211376_100000742370 [0,1,0,1,0,0|0,0,2]=4 3983 B13R1.528 COC(=O)CNC1CCCCC1C 2230a_100000211402_100000747449 [0,1,0,1,0,0|0,0,2]=4 3984 B13R1.528 COC(=O)CNC1CCCCC1C 34a_100000211402_100000747449 [0,1,0,1,0,0|0,0,2]=4 3985 B13R1.528 COC(=O)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000747449 [0,1,0,1,0,0|1,0,1]=4 3986 B13R1.528 COC(=O)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000747449 [0,1,0,1,0,0|1,0,1]=4 3987 B13R1.528 COC(=O)COC1CCCCC1C 34a_100000211207_100000747449 [0,1,0,1,0,0|0,0,2]=4 3988 B13R1.528 COC(=O)COC1CCCCC1C 7a_100000211207_100000747449 [0,1,0,1,0,0|0,0,2]=4 3989 B13R1.528 COC(=O)COC1CCCCC1Cl 34a_100000038908_100000747449 [0,1,0,1,0,0|1,0,1]=4 3990 B13R1.528 COC(=O)COC1CCCCC1Cl 7a_100000038908_100000747449 [0,1,0,1,0,0|1,0,1]=4 3991 B13R1.528 COC(=O)COC1CCNCC1C 34a_100011998114_100000747449 [0,1,0,1,0,0|1,0,1]=4 3992 B13R1.528 COC(=O)COC1CNCCC1C 34a_100000696640_100000747449 [0,1,0,1,0,0|1,0,1]=4 3993 B13R1.528 COC(=O)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000747449 [0,1,0,1,0,0|1,0,1]=4 3994 B13R1.528 COC(=O)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000747449 [0,1,0,1,0,0|1,0,1]=4 3995 B13R1.528 COC(=O)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100000747449 [0,1,0,1,0,0|1,0,1]=4 3996 B13R1.528 COC(=O)CSC1CCCCC1F 62a_100000747449_100015423560 [0,1,0,1,0,0|1,0,1]=4 3997 B13R1.528 COC(=O)CSC1CCCCC1F 62a_100015423560_100000747449 [0,1,0,1,0,0|1,0,1]=4 3998 B13R1.528 COC(=O)CSC1CCCCC1O 62a_100000038908_100000747449 [0,1,0,1,0,0|1,0,1]=4 3999 B13R1.528 COC(=O)CSC1CCCCC1O 62a_100000747449_100000038908 [0,1,0,1,0,0|1,0,1]=4 4000 B13R1.718 COC(=O)C=NNC1CCCCC1 4a_100000709804_200011823558 [0,1,0,1,0,0|1,0,1]=4 4001 B13R1.718 COC(=O)CCNC1CCCCC1 2230a_100000182618_100000204255 [0,1,0,1,0,0|0,0,2]=4 4002 B13R1.718 COC(=O)CCNC1CCCCC1 34a_100000182618_100000742370 [0,1,0,1,0,0|0,0,2]=4 4003 B13R1.718 COC(=O)CCOC1CCCCC1 34a_100000210231_100000742370 [0,1,0,1,0,0|0,0,2]=4 4004 B13R1.718 COC(=O)CCOC1CCCCC1 7a_100000210231_100000204255 [0,1,0,1,0,0|0,0,2]=4 4005 B13R1.718 COC(=O)CCSC1CCCCC1 62a_100000204255_100000210327 [0,1,0,1,0,0|0,0,2]=4 4006 B13R1.718 COC(=O)CCSC1CCCCC1 62a_100000210327_100000204255 [0,1,0,1,0,0|0,0,2]=4 4007 B13R1.718 COC(=O)CNCC1CCCCC1 2230a_100000210473_100000747449 [0,1,0,1,0,0|0,0,2]=4 4008 B13R1.718 COC(=O)CNCC1CCCCC1 34a_100000210473_100000747449 [0,1,0,1,0,0|0,0,2]=4 4009 B13R1.718 COC(=O)CNCC1CCCCO1 2230a_100000174945_100000747449 [0,1,0,1,0,0|1,0,1]=4 4010 B13R1.718 COC(=O)CNCC1CCCCO1 34a_100000174945_100000747449 [0,1,0,1,0,0|1,0,1]=4 4011 B13R1.718 COC(=O)CNCC1CCCOC1 2230a_100000720124_100000747449 [0,1,0,1,0,0|1,0,1]=4 4012 B13R1.718 COC(=O)CNCC1CCCOC1 34a_100000720124_100000747449 [0,1,0,1,0,0|1,0,1]=4 4013 B13R1.718 COC(=O)CNCC1CCOCC1 2230a_100000746373_100000747449 [0,1,0,1,0,0|1,0,1]=4 4014 B13R1.718 COC(=O)CNCC1CCOCC1 34a_100000746373_100000747449 [0,1,0,1,0,0|1,0,1]=4 4015 B13R1.718 COC(=O)CNCC1CCSCC1 2230a_100015188806_100000747449 [0,1,0,1,0,0|1,0,1]=4 4016 B13R1.718 COC(=O)CNCC1CCSCC1 34a_100015188806_100000747449 [0,1,0,1,0,0|1,0,1]=4 4017 B13R1.718 COC(=O)COCC1CCCCC1 34a_100000212181_100000747449 [0,1,0,1,0,0|0,0,2]=4 4018 B13R1.718 COC(=O)COCC1CCCCC1 7a_100000212181_100000747449 [0,1,0,1,0,0|0,0,2]=4 4019 B13R1.718 COC(=O)COCC1CCCCN1 34a_100000210821_100000747449 [0,1,0,1,0,0|1,0,1]=4 4020 B13R1.718 COC(=O)COCC1CCCCO1 34a_100000211370_100000747449 [0,1,0,1,0,0|1,0,1]=4 4021 B13R1.718 COC(=O)COCC1CCCCO1 7a_100000211370_100000747449 [0,1,0,1,0,0|1,0,1]=4 4022 B13R1.718 COC(=O)COCC1CCCNC1 34a_100000211344_100000747449 [0,1,0,1,0,0|1,0,1]=4 4023 B13R1.718 COC(=O)COCC1CCCOC1 34a_100000741520_100000747449 [0,1,0,1,0,0|1,0,1]=4 4024 B13R1.718 COC(=O)COCC1CCNCC1 34a_100000738675_100000747449 [0,1,0,1,0,0|1,0,1]=4 4025 B13R1.718 COC(=O)COCC1CCOCC1 34a_100000749013_100000747449 [0,1,0,1,0,0|1,0,1]=4 4026 B13R1.718 COC(=O)COCC1CCSCC1 34a_100000070558_100000747449 [0,1,0,1,0,0|1,0,1]=4 4027 B13R1.718 COC(=O)COCC1CCSCC1 7a_100000070558_100000747449 [0,1,0,1,0,0|1,0,1]=4 4028 B13R1.718 COC(=O)CSCC1CCCCC1 62a_100000211423_100000747449 [0,1,0,1,0,0|0,0,2]=4 4029 B13R1.718 COC(=O)CSCC1CCCCC1 62a_100000747449_100000211423 [0,1,0,1,0,0|0,0,2]=4 4030 B13R1.718 COC(=O)CSCC1CCCCO1 62a_100000211543_100000747449 [0,1,0,1,0,0|1,0,1]=4 4031 B13R1.718 COC(=O)CSCC1CCCCO1 62a_100000747449_100000211543 [0,1,0,1,0,0|1,0,1]=4 4032 B13R1.718 COC(=O)CSCC1CCCOC1 62a_100000741521_100000747449 [0,1,0,1,0,0|1,0,1]=4 4033 B13R1.718 COC(=O)CSCC1CCCOC1 62a_100000747449_100000741521 [0,1,0,1,0,0|1,0,1]=4 4034 B13R1.718 COC(=O)CSCC1CCOCC1 62a_100000747449_100000749018 [0,1,0,1,0,0|1,0,1]=4 4035 B13R1.718 COC(=O)CSCC1CCOCC1 62a_100000754603_100000747449 [0,1,0,1,0,0|1,0,1]=4 4036 B13R1.718 COC(=O)OCSC1CCCCC1 62a_100000210327_100000139417 [0,1,0,1,0,0|1,0,1]=4 4037 B13R1.1868 COC(=O)CN1CCCCC(C1)O 2230a_100025706797_100000747449 [0,1,0,1,0,0|1,0,1]=4 4038 B13R1.1868 COC(=O)CN1CCCCC(C1)O 269982a_100025706797_100000747449 [0,1,0,1,0,0|1,0,1]=4 4039 B13R1.2062 COC(=O)CNCC1(CCCC1)O 2230a_100000737848_100000747449 [0,1,0,1,0,0|1,0,1]=4 4040 B13R1.2062 COC(=O)COCC1(CCCC1)N 34a_100000749328_100000747449 [0,1,0,1,0,0|1,0,1]=4 4041 B13R1.11 COC(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000747449 [0,1,0,1,0,0|0,0,2]=4 4042 B13R1.11 COC(=O)CC(=O)C1CCCCC1 1458a_100000211351_100000210327 [0,1,0,1,0,0|0,0,2]=4 4043 B13R1.11 COC(=O)CN(C)C1CCCCC1 2230a_100000207522_100000747449 [0,1,0,1,0,0|1,0,1]=4 4044 B13R1.11 COC(=O)CN(C)C1CCCCC1 269982a_100000207522_100000747449 [0,1,0,1,0,0|1,0,1]=4 4045 B13R1.11 COC(=O)CN(C)C1CCCCC1 270004a_100000198492_100000210434 [0,1,0,1,0,0|1,0,1]=4 4046 B13R1.11 COC(=O)CN(C)C1CCCCC1 34a_100000207522_100000747449 [0,1,0,1,0,0|1,0,1]=4 4047 B13R1.439 COC(=O)CC(=O)C1CCCC1C 1458a_100000690547_100000747449 [0,1,0,1,0,0|0,0,2]=4 4048 B13R1.545 COC(=O)CC(=O)CC1CCCC1 1458a_100000210891_100000747449 [0,1,0,1,0,0|0,0,2]=4 4049 B13R1.545 COC(=O)CC(=O)CC1CCCC1 1458a_100000211351_100000740388 [0,1,0,1,0,0|0,0,2]=4 4050 B13R1.545 COC(=O)CN(C)CC1CCCC1 2230a_100000198492_100000740388 [0,1,0,1,0,0|1,0,1]=4 4051 B13R1.1870 COC(=O)CN1CCCCCCC1 2230a_100000211400_100000747449 [0,1,0,1,0,0|0,0,2]=4 4052 B13R1.1870 COC(=O)CN1CCCCCCC1 269982a_100000211400_100000747449 [0,1,0,1,0,0|0,0,2]=4 4053 B13R1.1870 COC(=O)CN1CCCCCCC1 34a_100000211400_100000747449 [0,1,0,1,0,0|0,0,2]=4 4054 B13R1.15 COC(=O)CNC1CCCC(C1)C 2230a_100011194320_100000747449 [0,1,0,1,0,0|1,0,1]=4 4055 B13R1.15 COC(=O)CNC1CCCC(C1)C 34a_100011194320_100000747449 [0,1,0,1,0,0|1,0,1]=4 4056 B13R1.15 COC(=O)CNC1CCCC(C1)O 2230a_100015190357_100000747449 [0,1,0,1,0,0|1,0,1]=4 4057 B13R1.15 COC(=O)COC1CCCC(C1)C 34a_100000211399_100000747449 [0,1,0,1,0,0|1,0,1]=4 4058 B13R1.162 COC(=O)CNC(C)C1CCCC1 2230a_100015185923_100000747449 [0,1,0,1,0,0|1,0,1]=4 4059 B13R1.162 COC(=O)CNC(C)C1CCCC1 34a_100015185923_100000747449 [0,1,0,1,0,0|1,0,1]=4 4060 B13R1.162 COC(=O)COC(C)C1CCCC1 34a_100011216366_100000747449 [0,1,0,1,0,0|1,0,1]=4 4061 B13R1.162 COC(=O)COC(C)C1CCCC1 7a_100011216366_100000747449 [0,1,0,1,0,0|1,0,1]=4 4062 B13R1.1711 COC(=O)CCN1CCCCCC1 2230a_100000185865_100000204255 [0,1,0,1,0,0|0,0,2]=4 4063 B13R1.1711 COC(=O)CCN1CCCCCC1 269982a_100000185865_100000204255 [0,1,0,1,0,0|0,0,2]=4 4064 B13R1.1711 COC(=O)CCN1CCCCCC1 34a_100000185865_100000742370 [0,1,0,1,0,0|0,0,2]=4 4065 B13R1.1711 COC(=O)CNC1CCCCCC1 2230a_100000210984_100000747449 [0,1,0,1,0,0|0,0,2]=4 4066 B13R1.1711 COC(=O)CNC1CCCCCC1 34a_100000210984_100000747449 [0,1,0,1,0,0|0,0,2]=4 4067 B13R1.1711 COC(=O)COC1CCCCCC1 34a_100000210887_100000747449 [0,1,0,1,0,0|0,0,2]=4 4068 B13R1.1711 COC(=O)COC1CCCCCC1 7a_100000210887_100000747449 [0,1,0,1,0,0|0,0,2]=4 4069 B13R1.1711 COC(=O)CSC1CCCCCC1 62a_100000747449_100011217769 [0,1,0,1,0,0|0,0,2]=4 4070 B13R1.1711 COC(=O)CSC1CCCCCC1 62a_100011217769_100000747449 [0,1,0,1,0,0|0,0,2]=4 4071 B13R1.2045 COC(=O)CNC1(CCCCC1)C 2230a_100000741114_100000747449 [0,1,0,1,0,0|1,0,1]=4 4072 B13R1.2045 COC(=O)CNC1(CCCCC1)C 34a_100000741114_100000747449 [0,1,0,1,0,0|1,0,1]=4 4073 B13R1.2045 COC(=O)COC1(CCCCC1)C 34a_100011215885_100000747449 [0,1,0,1,0,0|1,0,1]=4 4074 B13R1.2045 COC(=O)COC1(CCCCC1)C 7a_100011215885_100000747449 [0,1,0,1,0,0|1,0,1]=4 4075 B13R1.4928 COC(=O)CN1C(CCCC1C)C 2230a_100000210447_100000747449 [0,1,0,1,0,0|1,0,1]=4 4076 B13R1.4928 COC(=O)CN1C(CCCC1C)C 269982a_100000210447_100000747449 [0,1,0,1,0,0|1,0,1]=4 4077 B13R1.4928 COC(=O)CN1C(CCCC1C)C 34a_100000210447_100000747449 [0,1,0,1,0,0|1,0,1]=4 4078 B13R1.14 COC(=O)CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000747449 [0,1,0,1,0,0|1,0,1]=4 4079 B13R1.14 COC(=O)CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000747449 [0,1,0,1,0,0|1,0,1]=4 4080 B13R1.14 COC(=O)COC1CCC(CC1)C 34a_100000210714_100000747449 [0,1,0,1,0,0|1,0,1]=4 4081 B13R1.14 COC(=O)COC1CCC(CC1)C 7a_100000210714_100000747449 [0,1,0,1,0,0|1,0,1]=4 4082 B13R1.14 COC(=O)CO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000747449 [0,1,0,1,0,0|1,0,1]=4 4083 B13R1.14 COC(=O)CSC1CCC(CC1)C 62a_100000747449_200011216234 [0,1,0,1,0,0|1,0,1]=4 4084 B13R1.538 COC(=O)/C=C/COCC1CC1C 34a_100000744939_100000742655 [0,1,0,1,0,0|0,0,2]=4 4085 B13R1.538 COC(=O)/C=C/COCC1CC1C 7a_100000744939_100000742655 [0,1,0,1,0,0|0,0,2]=4 4086 B13R1.538 COC(=O)CCCOCC1CC1C 34a_100000744939_100000742333 [0,1,0,1,0,0|0,0,2]=4 4087 B13R1.538 COC(=O)CCCOCC1CC1C 7a_100000744939_100011218270 [0,1,0,1,0,0|0,0,2]=4 4088 B13R1.539 COC(=O)/C=C/CNCC1CCC1 2230a_100000738700_100000742655 [0,1,0,1,0,0|0,0,2]=4 4089 B13R1.539 COC(=O)/C=C/CNCC1CCC1 34a_100000738700_100000742655 [0,1,0,1,0,0|0,0,2]=4 4090 B13R1.539 COC(=O)/C=C/COCC1CCC1 34a_100000760304_100000742655 [0,1,0,1,0,0|0,0,2]=4 4091 B13R1.539 COC(=O)/C=C/CSCC1CCC1 62a_100000742655_100000763275 [0,1,0,1,0,0|0,0,2]=4 4092 B13R1.539 COC(=O)/C=C/CSCC1CCC1 62a_100000763275_100000742655 [0,1,0,1,0,0|0,0,2]=4 4093 B13R1.539 COC(=O)CCCCCN1CCC1 269982a_100000754969_100009816466 [0,1,0,1,0,0|0,0,2]=4 4094 B13R1.539 COC(=O)CCCCNC1CCC1 2230a_100000749019_100000204269 [0,1,0,1,0,0|0,0,2]=4 4095 B13R1.539 COC(=O)CCCCNC1CCC1 34a_100000749019_100000204269 [0,1,0,1,0,0|0,0,2]=4 4096 B13R1.539 COC(=O)CCCCOC1CCC1 34a_100000059025_100000749161 [0,1,0,1,0,0|0,0,2]=4 4097 B13R1.539 COC(=O)CCCCOC1CCC1 34a_100000748187_100000204269 [0,1,0,1,0,0|0,0,2]=4 4098 B13R1.539 COC(=O)CCCCSC1CCC1 62a_100000204269_100000749161 [0,1,0,1,0,0|0,0,2]=4 4099 B13R1.539 COC(=O)CCCNCC1CCC1 2230a_100000738700_100011218270 [0,1,0,1,0,0|0,0,2]=4 4100 B13R1.539 COC(=O)CCCNCC1CCC1 34a_100000738700_100000742333 [0,1,0,1,0,0|0,0,2]=4 4101 B13R1.539 COC(=O)CCCOCC1CCC1 34a_100000760304_100000742333 [0,1,0,1,0,0|0,0,2]=4 4102 B13R1.539 COC(=O)CCCSCC1CCC1 62a_100000763275_100011218270 [0,1,0,1,0,0|0,0,2]=4 4103 B13R1.539 COC(=O)CCCSCC1CCC1 62a_100011218270_100000763275 [0,1,0,1,0,0|0,0,2]=4 4104 B13R1.539 COC(=O)COCCNC1CCC1 2230a_100000749019_100000090808 [0,1,0,1,0,0|1,0,1]=4 4105 B13R1.539 COC(=O)COCCNC1CCC1 34a_100000749019_100000090808 [0,1,0,1,0,0|1,0,1]=4 4106 B13R1.539 COC(=O)COCCOC1CCC1 34a_100000748187_100000090808 [0,1,0,1,0,0|1,0,1]=4 4107 B13R1.539 COC(=O)COCCSC1CCC1 62a_100000090808_100000749161 [0,1,0,1,0,0|1,0,1]=4 4108 B13R1.539 COC(=O)NCCOCC1CCC1 34a_100000757965_100000763275 [0,1,0,1,0,0|1,0,1]=4 4109 B13R1.539 COC(=O)OCCOCC1CCC1 34a_100010262106_100000763275 [0,1,0,1,0,0|1,0,1]=4 4110 B13R1.595 COC(=O)CCCCN1CCC1C 269982a_100000755817_100000204269 [0,1,0,1,0,0|0,0,2]=4 4111 B13R1.595 COC(=O)CCCCN1CCC1C 34a_100000755817_100000204269 [0,1,0,1,0,0|0,0,2]=4 4112 B13R1.595 COC(=O)COCCN1CCC1C 34a_100000755817_100000090808 [0,1,0,1,0,0|1,0,1]=4 4113 B13R1.1869 COC(=O)CN1CCCC(CC1)C 2230a_100025706717_100000747449 [0,1,0,1,0,0|1,0,1]=4 4114 B13R1.1869 COC(=O)CN1CCCC(CC1)C 269982a_100025706717_100000747449 [0,1,0,1,0,0|1,0,1]=4 4115 B13R1.1869 COC(=O)CN1CCCC(CC1)C 34a_100025706717_100000747449 [0,1,0,1,0,0|1,0,1]=4 4116 B13R1.1869 COC(=O)CN1CCCC(CC1)O 2230a_100015186869_100000747449 [0,1,0,1,0,0|1,0,1]=4 4117 B13R1.1869 COC(=O)CN1CCCC(CC1)O 269982a_100015186869_100000747449 [0,1,0,1,0,0|1,0,1]=4 4118 B13R1.594 COC(=O)/C=C/CNCCC1CC1 34a_100000764129_100000742655 [0,1,0,1,0,0|0,0,2]=4 4119 B13R1.594 COC(=O)/C=C/COCCC1CC1 34a_100000754188_100000742655 [0,1,0,1,0,0|0,0,2]=4 4120 B13R1.594 COC(=O)/C=C/COCCC1CC1 7a_100000754188_100000742655 [0,1,0,1,0,0|0,0,2]=4 4121 B13R1.594 COC(=O)/C=C/CSCCC1CC1 62a_100000742655_100000764125 [0,1,0,1,0,0|0,0,2]=4 4122 B13R1.594 COC(=O)/C=C/CSCCC1CC1 62a_100000764125_100000742655 [0,1,0,1,0,0|0,0,2]=4 4123 B13R1.594 COC(=O)CCCCCNC1CC1 34a_100000212008_100009816466 [0,1,0,1,0,0|0,0,2]=4 4124 B13R1.594 COC(=O)CCCCCOC1CC1 34a_100000074720_100000211595 [0,1,0,1,0,0|0,0,2]=4 4125 B13R1.594 COC(=O)CCCCCSC1CC1 62a_100009816466_100000211595 [0,1,0,1,0,0|0,0,2]=4 4126 B13R1.594 COC(=O)CCCCNCC1CC1 2230a_100000735609_100000204269 [0,1,0,1,0,0|0,0,2]=4 4127 B13R1.594 COC(=O)CCCCNCC1CC1 34a_100000735609_100000204269 [0,1,0,1,0,0|0,0,2]=4 4128 B13R1.594 COC(=O)CCCCOCC1CC1 34a_100000059025_100000742324 [0,1,0,1,0,0|0,0,2]=4 4129 B13R1.594 COC(=O)CCCCOCC1CC1 34a_100000211283_100000204269 [0,1,0,1,0,0|0,0,2]=4 4130 B13R1.594 COC(=O)CCCCOCC1CC1 7a_100000059025_100000742324 [0,1,0,1,0,0|0,0,2]=4 4131 B13R1.594 COC(=O)CCCCSCC1CC1 62a_100000204269_100000742324 [0,1,0,1,0,0|0,0,2]=4 4132 B13R1.594 COC(=O)CCCCSCC1CC1 62a_100000756562_100000204269 [0,1,0,1,0,0|0,0,2]=4 4133 B13R1.594 COC(=O)CCCNCCC1CC1 34a_100000764129_100000742333 [0,1,0,1,0,0|0,0,2]=4 4134 B13R1.594 COC(=O)CCCOCCC1CC1 34a_100000754188_100000742333 [0,1,0,1,0,0|0,0,2]=4 4135 B13R1.594 COC(=O)CCCOCCC1CC1 7a_100000754188_100011218270 [0,1,0,1,0,0|0,0,2]=4 4136 B13R1.594 COC(=O)CCCSCCC1CC1 62a_100000764125_100011218270 [0,1,0,1,0,0|0,0,2]=4 4137 B13R1.594 COC(=O)CCCSCCC1CC1 62a_100011218270_100000764125 [0,1,0,1,0,0|0,0,2]=4 4138 B13R1.594 COC(=O)COCCNCC1CC1 2230a_100000735609_100000090808 [0,1,0,1,0,0|1,0,1]=4 4139 B13R1.594 COC(=O)COCCNCC1CC1 34a_100000735609_100000090808 [0,1,0,1,0,0|1,0,1]=4 4140 B13R1.594 COC(=O)COCCOCC1CC1 34a_100000211283_100000090808 [0,1,0,1,0,0|1,0,1]=4 4141 B13R1.594 COC(=O)COCCSCC1CC1 62a_100000090808_100000742324 [0,1,0,1,0,0|1,0,1]=4 4142 B13R1.594 COC(=O)COCCSCC1CC1 62a_100000756562_100000090808 [0,1,0,1,0,0|1,0,1]=4 4143 B13R1.594 COC(=O)NCCOCCC1CC1 34a_100000757965_100000694398 [0,1,0,1,0,0|1,0,1]=4 4144 B13R1.594 COC(=O)OCCOCCC1CC1 34a_100010262106_100000694398 [0,1,0,1,0,0|1,0,1]=4 4145 B13R1.598 COC(=O)CN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000747449 [0,1,0,1,0,0|1,0,1]=4 4146 B13R1.598 COC(=O)CN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000747449 [0,1,0,1,0,0|1,0,1]=4 4147 B13R1.598 COC(=O)COC1CCCC1(C)C 34a_100000726220_100000747449 [0,1,0,1,0,0|1,0,1]=4 4148 B13R1.598 COC(=O)COC1CCCC1(C)C 7a_100000726220_100000747449 [0,1,0,1,0,0|1,0,1]=4 4149 B13R1.2880 COC(=O)CN1CCCC1C(C)C 2230a_100000762757_100000747449 [0,1,0,1,0,0|1,0,1]=4 4150 B13R1.2880 COC(=O)CN1CCCC1C(C)C 269982a_100000762757_100000747449 [0,1,0,1,0,0|1,0,1]=4 4151 B13R1.2880 COC(=O)CN1CCCC1C(C)C 34a_100000762757_100000747449 [0,1,0,1,0,0|1,0,1]=4 4152 B13R1.27 CCCCCCOC1COC(=O)O1 34a_100000210259_100000032252 [0,1,0,1,0,0|1,0,1]=4 4153 B13R1.27 CCCCCCSC1COC(=O)O1 62a_100000210314_100000032252 [0,1,0,1,0,0|1,0,1]=4 4154 B13R1.27 CCCCCNC[C@H]1COC(=O)N1 2230a_100000209983_100015307671 [0,1,0,1,0,0|1,0,1]=4 4155 B13R1.27 CCCCCOCC1=CC(=O)OC1 34a_100000210253_100000716558 [0,1,0,1,0,0|0,0,2]=4 4156 B13R1.27 CCCCCOCC1COC(=O)O1 34a_100000210253_100000073702 [0,1,0,1,0,0|1,0,1]=4 4157 B13R1.27 CCCCCOC[C@H]1COC(=O)N1 34a_100000210253_100015307671 [0,1,0,1,0,0|1,0,1]=4 4158 B13R1.27 CCCCCOC[C@H]1COC(=O)N1 7a_100000210253_100015307671 [0,1,0,1,0,0|1,0,1]=4 4159 B13R1.27 CCCCCSCC1=CC(=O)OC1 62a_100000210326_100000716558 [0,1,0,1,0,0|0,0,2]=4 4160 B13R1.27 CCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210326 [0,1,0,1,0,0|0,0,2]=4 4161 B13R1.27 CCCCCSCC1COC(=O)O1 62a_100000073702_100000210326 [0,1,0,1,0,0|1,0,1]=4 4162 B13R1.27 CCCCCSCC1COC(=O)O1 62a_100000210326_100000073702 [0,1,0,1,0,0|1,0,1]=4 4163 B13R1.27 CCCCCSC[C@H]1COC(=O)N1 62a_100000210326_100015307671 [0,1,0,1,0,0|1,0,1]=4 4164 B13R1.27 CCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210326 [0,1,0,1,0,0|1,0,1]=4 4165 B13R1.91 CCC1CCCCN1CC(=O)OC 2230a_100000210034_100000747449 [0,1,0,1,0,0|0,0,2]=4 4166 B13R1.91 CCC1CCCCN1CC(=O)OC 269982a_100000210034_100000747449 [0,1,0,1,0,0|0,0,2]=4 4167 B13R1.91 CCC1CCCCN1CC(=O)OC 34a_100000210034_100000747449 [0,1,0,1,0,0|0,0,2]=4 4168 B13R1.91 CC[C@H]1COCCN1CC(=O)OC 2230a_100016988097_100000747449 [0,1,0,1,0,0|1,0,1]=4 4169 B13R1.91 CC[C@H]1COCCN1CC(=O)OC 269982a_100016988097_100000747449 [0,1,0,1,0,0|1,0,1]=4 4170 B13R1.91 CC[C@H]1COCCN1CC(=O)OC 34a_100016988097_100000747449 [0,1,0,1,0,0|1,0,1]=4 4171 B13R1.91 COC(=O)CN1CCCCC1CO 2230a_100000210821_100000747449 [0,1,0,1,0,0|1,0,1]=4 4172 B13R1.91 COC(=O)CN1CCCCC1CO 269982a_100000210821_100000747449 [0,1,0,1,0,0|1,0,1]=4 4173 B13R1.91 COC(=O)CN1CCCCC1CO 34a_100000210821_100000747449 [0,1,0,1,0,0|1,0,1]=4 4174 B13R1.382 CCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210303 [0,1,0,1,0,0|0,0,2]=4 4175 B13R1.382 CCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210303 [0,1,0,1,0,0|0,0,2]=4 4176 B13R1.382 CCCN1CCCCC1C(=O)OC 34a_100000734855_100000210303 [0,1,0,1,0,0|0,0,2]=4 4177 B13R1.382 CCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210202 [0,1,0,1,0,0|0,0,2]=4 4178 B13R1.382 CCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210202 [0,1,0,1,0,0|0,0,2]=4 4179 B13R1.393 CCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210303 [0,1,0,1,0,0|0,0,2]=4 4180 B13R1.393 CCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210303 [0,1,0,1,0,0|0,0,2]=4 4181 B13R1.393 CCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210303 [0,1,0,1,0,0|0,0,2]=4 4182 B13R1.393 COC[C@@H]1CCCN1CC(=O)OC 2230a_100020646714_100000747449 [0,1,0,1,0,0|1,0,1]=4 4183 B13R1.393 COC[C@@H]1CCCN1CC(=O)OC 269982a_100020646714_100000747449 [0,1,0,1,0,0|1,0,1]=4 4184 B13R1.393 COC[C@@H]1CCCN1CC(=O)OC 34a_100020646714_100000747449 [0,1,0,1,0,0|1,0,1]=4 4185 B13R1.536 COC(=O)/C=C/CNC1CCCC1 2230a_100000211070_100000742655 [0,1,0,1,0,0|0,0,2]=4 4186 B13R1.536 COC(=O)/C=C/CNC1CCCC1 34a_100000211070_100000742655 [0,1,0,1,0,0|0,0,2]=4 4187 B13R1.536 COC(=O)/C=C/COC1CCCC1 34a_100000210269_100000742655 [0,1,0,1,0,0|0,0,2]=4 4188 B13R1.536 COC(=O)/C=C/COC1CCCC1 7a_100000210269_100000742655 [0,1,0,1,0,0|0,0,2]=4 4189 B13R1.536 COC(=O)/C=C/CSC1CCCC1 62a_100000742655_100000179811 [0,1,0,1,0,0|0,0,2]=4 4190 B13R1.536 COC(=O)/C=C/CSC1CCCC1 62a_100011217020_100000742655 [0,1,0,1,0,0|0,0,2]=4 4191 B13R1.536 COC(=O)CCCCN1CCCC1 2230a_100000188435_100000204269 [0,1,0,1,0,0|0,0,2]=4 4192 B13R1.536 COC(=O)CCCCN1CCCC1 269982a_100000188435_100000204269 [0,1,0,1,0,0|0,0,2]=4 4193 B13R1.536 COC(=O)CCCNC1CCCC1 2230a_100000211070_100011218270 [0,1,0,1,0,0|0,0,2]=4 4194 B13R1.536 COC(=O)CCCNC1CCCC1 34a_100000211070_100000742333 [0,1,0,1,0,0|0,0,2]=4 4195 B13R1.536 COC(=O)CCCOC1CCCC1 34a_100000210269_100000742333 [0,1,0,1,0,0|0,0,2]=4 4196 B13R1.536 COC(=O)CCCOC1CCCC1 7a_100000210269_100011218270 [0,1,0,1,0,0|0,0,2]=4 4197 B13R1.536 COC(=O)CCCSC1CCCC1 62a_100011217020_100011218270 [0,1,0,1,0,0|0,0,2]=4 4198 B13R1.536 COC(=O)CCCSC1CCCC1 62a_100011218270_100000179811 [0,1,0,1,0,0|0,0,2]=4 4199 B13R1.536 COC(=O)CCNCC1CCCC1 2230a_100000737975_100000204255 [0,1,0,1,0,0|0,0,2]=4 4200 B13R1.536 COC(=O)CCNCC1CCCC1 34a_100000737975_100000742370 [0,1,0,1,0,0|0,0,2]=4 4201 B13R1.536 COC(=O)CCOCC1CCCC1 34a_100000742336_100000742370 [0,1,0,1,0,0|0,0,2]=4 4202 B13R1.536 COC(=O)CCOCC1CCCC1 7a_100000742336_100000204255 [0,1,0,1,0,0|0,0,2]=4 4203 B13R1.536 COC(=O)CCSCC1CCCC1 62a_100000204255_100000740388 [0,1,0,1,0,0|0,0,2]=4 4204 B13R1.536 COC(=O)CCSCC1CCCC1 62a_100000740388_100000204255 [0,1,0,1,0,0|0,0,2]=4 4205 B13R1.536 COC(=O)CNCCC1CCCC1 2230a_100000739158_100000747449 [0,1,0,1,0,0|0,0,2]=4 4206 B13R1.536 COC(=O)CNCCC1CCCC1 34a_100000739158_100000747449 [0,1,0,1,0,0|0,0,2]=4 4207 B13R1.536 COC(=O)COCCC1CCCC1 34a_100000749090_100000747449 [0,1,0,1,0,0|0,0,2]=4 4208 B13R1.536 COC(=O)COCCC1CCCC1 7a_100000749090_100000747449 [0,1,0,1,0,0|0,0,2]=4 4209 B13R1.536 COC(=O)COCCC1CCNC1 34a_100016987287_100000747449 [0,1,0,1,0,0|1,0,1]=4 4210 B13R1.536 COC(=O)COCCC1CCOC1 34a_100011879284_100000747449 [0,1,0,1,0,0|1,0,1]=4 4211 B13R1.536 COC(=O)COCCN1CCCC1 2230a_100000188435_100000090808 [0,1,0,1,0,0|1,0,1]=4 4212 B13R1.536 COC(=O)CSCCC1CCCC1 62a_100000747449_100000760354 [0,1,0,1,0,0|0,0,2]=4 4213 B13R1.536 COC(=O)CSCCC1CCCC1 62a_100000760354_100000747449 [0,1,0,1,0,0|0,0,2]=4 4214 B13R1.536 COC(=O)CSCCN1CCCC1 62a_100000700749_100000747449 [0,1,0,1,0,0|1,0,1]=4 4215 B13R1.536 COC(=O)CSCCN1CCCC1 62a_100000747449_100000004467 [0,1,0,1,0,0|1,0,1]=4 4216 B13R1.536 COC(=O)NCCOC1CCCC1 34a_100000757965_100000179811 [0,1,0,1,0,0|1,0,1]=4 4217 B13R1.536 COC(=O)OCCOC1CCCC1 34a_100010262106_100000179811 [0,1,0,1,0,0|1,0,1]=4 4218 B13R1.536 COC(=O)OCSCC1CCCC1 62a_100000740388_100000139417 [0,1,0,1,0,0|1,0,1]=4 4219 B13R1.581 CCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210211 [0,1,0,1,0,0|0,0,2]=4 4220 B13R1.581 CCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210211 [0,1,0,1,0,0|0,0,2]=4 4221 B13R1.581 CCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210211 [0,1,0,1,0,0|1,0,1]=4 4222 B13R1.581 CCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210211 [0,1,0,1,0,0|1,0,1]=4 4223 B13R1.581 CCCOC1CCCC1C(=O)OC 34a_200000081814_100000210303 [0,1,0,1,0,0|0,0,2]=4 4224 B13R1.581 CCCOC1CCCC1C(=O)OC 7a_200000081814_100000210303 [0,1,0,1,0,0|0,0,2]=4 4225 B13R1.599 COC(=O)/C=C/CN1CCC[C@@H]1C 2230a_100020605311_100000742655 [0,1,0,1,0,0|0,0,2]=4 4226 B13R1.599 COC(=O)/C=C/CN1CCC[C@@H]1C 269982a_100020605311_100000742655 [0,1,0,1,0,0|0,0,2]=4 4227 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 2230a_100015189458_100000742655 [0,1,0,1,0,0|0,0,2]=4 4228 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 269982a_100015189458_100000742655 [0,1,0,1,0,0|0,0,2]=4 4229 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 34a_100015189458_100000742655 [0,1,0,1,0,0|0,0,2]=4 4230 B13R1.599 COC(=O)CCCN1CCC[C@@H]1C 2230a_100020605311_100011218270 [0,1,0,1,0,0|0,0,2]=4 4231 B13R1.599 COC(=O)CCCN1CCC[C@@H]1C 269982a_100020605311_100011218270 [0,1,0,1,0,0|0,0,2]=4 4232 B13R1.599 COC(=O)CCCN1CCC[C@H]1C 2230a_100015189458_100011218270 [0,1,0,1,0,0|0,0,2]=4 4233 B13R1.599 COC(=O)CCCN1CCC[C@H]1C 269982a_100015189458_100011218270 [0,1,0,1,0,0|0,0,2]=4 4234 B13R1.599 COC(=O)CCCN1CCC[C@H]1C 34a_100015189458_100000742333 [0,1,0,1,0,0|0,0,2]=4 4235 B13R1.599 COC(=O)CCOC1CCCC1C 34a_100011216460_100000742370 [0,1,0,1,0,0|0,0,2]=4 4236 B13R1.599 COC(=O)CCOC1CCCC1C 7a_100011216460_100000204255 [0,1,0,1,0,0|0,0,2]=4 4237 B13R1.599 COC(=O)COCC1CCCN1C 34a_100000743107_100000747449 [0,1,0,1,0,0|1,0,1]=4 4238 B13R1.613 CCC1CCCN1CCC(=O)OC 2230a_100000754278_100000204255 [0,1,0,1,0,0|0,0,2]=4 4239 B13R1.613 CCC1CCCN1CCC(=O)OC 269982a_100000754278_100000204255 [0,1,0,1,0,0|0,0,2]=4 4240 B13R1.613 CCC1CCCN1CCC(=O)OC 34a_100000754278_100000742370 [0,1,0,1,0,0|0,0,2]=4 4241 B13R1.2855 CCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210326 [0,1,0,1,0,0|0,0,2]=4 4242 B13R1.2855 CCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210215 [0,1,0,1,0,0|0,0,2]=4 4243 B13R2.1106 COC(=O)CN1C2CCC1CC2 2230a_100000735658_100000747449 [0,0,0,2,0,0|1,0,1]=4 4244 B13R2.1106 COC(=O)CN1C2CCC1CC2 269982a_100000735658_100000747449 [0,0,0,2,0,0|1,0,1]=4 4245 B13R2.1106 COC(=O)CN1C2CCC1CC2 34a_100000735658_100000747449 [0,0,0,2,0,0|1,0,1]=4 4246 B13R2.1304 COC(=O)COC1CCC2C1C2 34a_200012295571_100000747449 [0,0,0,2,0,0|1,0,1]=4 4247 B13R2.2400 COC(=O)CN1CCCC12CC2 2230a_100020620911_100000747449 [0,0,0,2,0,0|1,0,1]=4 4248 B13R2.2400 COC(=O)CN1CCCC12CC2 269982a_100020620911_100000747449 [0,0,0,2,0,0|1,0,1]=4 4249 B13R2.2400 COC(=O)CN1CCCC12CC2 34a_100020620911_100000747449 [0,0,0,2,0,0|1,0,1]=4 4250 B13R2.6859 COC(=O)CN1CC2CCC1C2 2230a_100000743476_100000747449 [0,0,0,2,0,0|1,0,1]=4 4251 B13R2.6859 COC(=O)CN1CC2CCC1C2 269982a_100000743476_100000747449 [0,0,0,2,0,0|1,0,1]=4 4252 B13R2.6859 COC(=O)CN1CC2CCC1C2 34a_100000743476_100000747449 [0,0,0,2,0,0|1,0,1]=4