0 B9R0.24 C=CC(=O)NCC(=O)CC 1458a_200011222540_100000210202 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.24 C=CC(=O)NCC(=O)NC 11a_106832991635_200011222540 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.24 C=CC(=O)NCC(=O)NC 240690a_100000693194_200121576911 [0,0,0,0,0,0|3,0,1]=4 3 B9R0.24 C=CC(=O)NCC(=O)NC 240690a_100102657272_200011222540 [0,0,0,0,0,0|3,0,1]=4 4 B9R0.24 C=CC(=O)NCC(=O)NC 527a_100102657272_200011222540 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.24 CCC(=O)C=CC(=O)NC 1458a_100016259477_100000210202 [0,0,0,0,0,0|2,0,2]=4 6 B9R0.24 CCC(=O)CCC(=O)NC 1458a_100011309844_100000210202 [0,0,0,0,0,0|2,0,0]=2 7 B9R0.24 CCC(=O)CCC(=O)OC 1458a_100000187943_100000210202 [0,0,0,0,0,0|1,0,0]=1 8 B9R0.24 CCC(=O)CCC(C)CC 1458a_100000701222_100000210202 [0,0,0,0,0,0|3,0,1]=4 9 B9R0.24 CCC(=O)CCN(C)CC 1458a_100000755305_100000210202 [0,0,0,0,0,0|4,0,0]=4 10 B9R0.24 CCC(=O)CCS(=O)CC 1458a_100011387550_100000210202 [0,0,0,0,0,0|3,0,0]=3 11 B9R0.24 CCC(=O)CNC(=O)CC 1458a_100000194589_100000210202 [0,0,0,0,0,0|3,0,0]=3 12 B9R0.24 CCC(=O)CNC(=O)OC 1458a_100000215747_100000210202 [0,0,0,0,0,0|2,0,0]=2 13 B9R0.24 CCC(=O)CSC(C)OC 62a_100000747405_100009879195 [0,0,0,0,0,0|3,0,1]=4 14 B9R0.24 CCC(=O)CSC(C)OC 62a_100009879195_100000747405 [0,0,0,0,0,0|3,0,1]=4 15 B9R0.24 CCC(=O)NCC(=O)CF 1458a_100000194589_100015361967 [0,0,0,0,0,0|4,0,0]=4 16 B9R0.24 CCC(=O)NCC(=O)NC 11a_100000693194_100000210414 [0,0,0,0,0,0|3,0,0]=3 17 B9R0.24 CCC(=O)NCC(=O)NC 11a_106832991635_100000194589 [0,0,0,0,0,0|3,0,0]=3 18 B9R0.24 CCC(=O)NCC(=O)NC 1626a_100102657272_100000194589 [0,0,0,0,0,0|3,0,0]=3 19 B9R0.24 CCC(=O)NCC(=O)NC 240690a_100000693194_100000210414 [0,0,0,0,0,0|3,0,0]=3 20 B9R0.24 CCC(=O)NCC(=O)NC 240690a_100102657272_100000194589 [0,0,0,0,0,0|3,0,0]=3 21 B9R0.24 CCC(=O)NCC(=O)NC 527a_100000693194_100000210414 [0,0,0,0,0,0|3,0,0]=3 22 B9R0.24 CCC(=O)NCC(=O)NC 527a_100102657272_100000194589 [0,0,0,0,0,0|3,0,0]=3 23 B9R0.24 CCC(=O)NCC(=O)OC 188690a_100000185156_100000210414 [0,0,0,0,0,0|2,0,0]=2 24 B9R0.24 CCC(=O)NC[C@@H](C)OC 11a_100020591295_100000210414 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.24 CCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000210414 [0,0,0,0,0,0|3,0,1]=4 26 B9R0.24 CCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000210414 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.24 CCC(=O)NC[C@@H](C)OC 527a_100020591295_100000210414 [0,0,0,0,0,0|3,0,1]=4 28 B9R0.24 CCC(=O)NNC(=O)CC 22a_100000183195_100000210414 [0,0,0,0,0,0|4,0,0]=4 29 B9R0.24 CCC(=O)NNC(=O)NC 273464a_100102657272_100000183195 [0,0,0,0,0,0|4,0,0]=4 30 B9R0.24 CCC(=O)NNC(=O)NC 512a_106832991638_100000183195 [0,0,0,0,0,0|4,0,0]=4 31 B9R0.24 CCC(C)CCC(=O)NC 11a_106832991635_100000701222 [0,0,0,0,0,0|3,0,1]=4 32 B9R0.24 CCC(C)CCC(=O)NC 1626a_100102657272_100000701222 [0,0,0,0,0,0|3,0,1]=4 33 B9R0.24 CCC(C)CCC(=O)NC 240690a_100102657272_100000701222 [0,0,0,0,0,0|3,0,1]=4 34 B9R0.24 CCC(C)CCC(=O)NC 527a_100102657272_100000701222 [0,0,0,0,0,0|3,0,1]=4 35 B9R0.24 CCC(C)NCC(=O)OC 2230a_100000209981_100000747449 [0,0,0,0,0,0|3,0,1]=4 36 B9R0.24 CCC(C)OCC(=O)OC 7a_100000210228_100000747449 [0,0,0,0,0,0|3,0,1]=4 37 B9R0.24 CCC(C)SCC(=O)OC 62a_100000747449_100000758301 [0,0,0,0,0,0|3,0,1]=4 38 B9R0.24 CCC(C)SCC(=O)OC 62a_100000758301_100000747449 [0,0,0,0,0,0|3,0,1]=4 39 B9R0.24 CCC(O)CCC(=O)NC 1626a_100102657272_203496584001 [0,0,0,0,0,0|2,0,2]=4 40 B9R0.24 CCC(O)CCC(=O)NC 240690a_100102657272_203496584001 [0,0,0,0,0,0|2,0,2]=4 41 B9R0.24 CCN(C)CCC(=O)NC 2230a_100000225621_100000737683 [0,0,0,0,0,0|4,0,0]=4 42 B9R0.24 CCN(C)CCC(=O)NC 2230a_100000750875_100000210202 [0,0,0,0,0,0|4,0,0]=4 43 B9R0.24 CCN(C)CCC(=O)NC 240690a_100102657272_100000755305 [0,0,0,0,0,0|4,0,0]=4 44 B9R0.24 CCN(C)CCC(=O)NC 269982a_100000225621_100000737683 [0,0,0,0,0,0|4,0,0]=4 45 B9R0.24 CCN(C)CCC(=O)NC 269982a_100000750875_100000204670 [0,0,0,0,0,0|4,0,0]=4 46 B9R0.24 CCN(C)CCC(=O)OC 2230a_100000225621_100000204255 [0,0,0,0,0,0|3,0,0]=3 47 B9R0.24 CCN(C)CCC(=O)OC 2230a_100000229097_200000210301 [0,0,0,0,0,0|3,0,0]=3 48 B9R0.24 CCN(C)CCC(=O)OC 269982a_100000225621_100000204255 [0,0,0,0,0,0|3,0,0]=3 49 B9R0.24 CCN(C)CCC(=O)OC 269982a_100000229097_200000210301 [0,0,0,0,0,0|3,0,0]=3 50 B9R0.24 CCN(C)CCC(=O)OC 269982a_100025711912_100000204670 [0,0,0,0,0,0|3,0,0]=3 51 B9R0.24 CCN([13CH3])CCC(=O)OC 2230a_100000229097_200025704644 [0,0,0,0,0,0|3,0,0]=3 52 B9R0.24 CCN([13CH3])CCC(=O)OC 269982a_100000229097_200025704644 [0,0,0,0,0,0|3,0,0]=3 53 B9R0.24 CCS(=O)CCC(=O)CF 1458a_100011387550_100015361967 [0,0,0,0,0,0|4,0,0]=4 54 B9R0.24 CCS(=O)CCC(=O)NC 11a_106832991635_100011387550 [0,0,0,0,0,0|3,0,0]=3 55 B9R0.24 CCS(=O)CCC(=O)NC 1626a_100102657272_100011387550 [0,0,0,0,0,0|3,0,0]=3 56 B9R0.24 CCS(=O)CCC(=O)NC 240690a_100102657272_100011387550 [0,0,0,0,0,0|3,0,0]=3 57 B9R0.24 CCS(=O)CCC(=O)NC 527a_100102657272_100011387550 [0,0,0,0,0,0|3,0,0]=3 58 B9R0.24 CNC(=O)C=CC(=O)NC 1626a_100102657272_100016259477 [0,0,0,0,0,0|2,0,2]=4 59 B9R0.24 CNC(=O)C=CC(=O)OC 1626a_100102657272_100016283253 [0,0,0,0,0,0|1,0,2]=3 60 B9R0.24 CNC(=O)CCC(=O)CF 1458a_100011309844_100015361967 [0,0,0,0,0,0|3,0,0]=3 61 B9R0.24 CNC(=O)CCC(=O)NC 11a_106832991635_100011309844 [0,0,0,0,0,0|2,0,0]=2 62 B9R0.24 CNC(=O)CCC(=O)NC 1626a_100102657272_100011309844 [0,0,0,0,0,0|2,0,0]=2 63 B9R0.24 CNC(=O)CCC(=O)NC 240690a_100102657272_100011309844 [0,0,0,0,0,0|2,0,0]=2 64 B9R0.24 CNC(=O)CCC(=O)NC 527a_100102657272_100011309844 [0,0,0,0,0,0|2,0,0]=2 65 B9R0.24 CNC(=O)CCC(=O)OC 11a_106832991635_100000187943 [0,0,0,0,0,0|1,0,0]=1 66 B9R0.24 CNC(=O)CCC(=O)OC 1626a_100102657272_100000187943 [0,0,0,0,0,0|1,0,0]=1 67 B9R0.24 CNC(=O)CCC(=O)OC 240690a_100102657272_100000187943 [0,0,0,0,0,0|1,0,0]=1 68 B9R0.24 CNC(=O)CCC(=O)OC 527a_100102657272_100000187943 [0,0,0,0,0,0|1,0,0]=1 69 B9R0.24 CNC(=O)CNC(=O)CO 240690a_100000693194_100000210174 [0,0,0,0,0,0|4,0,0]=4 70 B9R0.24 CNC(=O)CNC(=O)CO 527a_100000693194_100000210174 [0,0,0,0,0,0|4,0,0]=4 71 B9R0.24 CNC(=O)CNC(=O)NC 2708a_100102657272_100000693194 [0,0,0,0,0,0|3,0,0]=3 72 B9R0.24 CNC(=O)CNC(=O)NC 273464a_100000693194_100102657272 [0,0,0,0,0,0|3,0,0]=3 73 B9R0.24 CNC(=O)CNC(=O)NC 273464a_100102657272_100000693194 [0,0,0,0,0,0|3,0,0]=3 74 B9R0.24 CNC(=O)CNC(=O)NC 512a_106832991638_100000693194 [0,0,0,0,0,0|3,0,0]=3 75 B9R0.24 CNC(=O)CNC(=O)OC 11a_106832991635_100000215747 [0,0,0,0,0,0|2,0,0]=2 76 B9R0.24 CNC(=O)CNC(=O)OC 1626a_100102657272_100000215747 [0,0,0,0,0,0|2,0,0]=2 77 B9R0.24 CNC(=O)CNC(=O)OC 240690a_100102657272_100000215747 [0,0,0,0,0,0|2,0,0]=2 78 B9R0.24 CNC(=O)CNC(=O)OC 527a_100102657272_100000215747 [0,0,0,0,0,0|2,0,0]=2 79 B9R0.24 CNC(=O)CSC(C)OC 62a_100000183359_100009879195 [0,0,0,0,0,0|3,0,1]=4 80 B9R0.24 CNC(=O)CSC(C)OC 62a_100009879195_100000183359 [0,0,0,0,0,0|3,0,1]=4 81 B9R0.24 CNC(=O)NC[C@@H](C)OC 2708a_100020591295_106832991635 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.24 CNC(=O)NC[C@@H](C)OC 2708a_100102657272_100020591295 [0,0,0,0,0,0|3,0,1]=4 83 B9R0.24 CNC(=O)NC[C@@H](C)OC 273464a_100020591295_100102657272 [0,0,0,0,0,0|3,0,1]=4 84 B9R0.24 CNC(=O)NC[C@@H](C)OC 273464a_100102657272_100020591295 [0,0,0,0,0,0|3,0,1]=4 85 B9R0.24 CNC(=O)NC[C@@H](C)OC 512a_100020591295_100102657272 [0,0,0,0,0,0|3,0,1]=4 86 B9R0.24 CNC(=O)NC[C@@H](C)OC 512a_106832991638_100020591295 [0,0,0,0,0,0|3,0,1]=4 87 B9R0.24 COC(=O)CCC(=O)CF 1458a_100000187943_100015361967 [0,0,0,0,0,0|2,0,0]=2 88 B9R0.24 COC(=O)CCN(C)CF 269982a_100025711912_100015361967 [0,0,0,0,0,0|4,0,0]=4 89 B9R0.24 COC(=O)CNC(=O)CO 188690a_100000185156_100000210174 [0,0,0,0,0,0|3,0,0]=3 90 B9R0.24 COC(=O)CSC(C)OC 62a_100000747449_100009879195 [0,0,0,0,0,0|2,0,1]=3 91 B9R0.24 COC(=O)CSC(C)OC 62a_100009879195_100000747449 [0,0,0,0,0,0|2,0,1]=3 92 B9R0.24 COC(=O)NCC(=O)CF 1458a_100000215747_100015361967 [0,0,0,0,0,0|3,0,0]=3 93 B8R0.6 C#CC(=O)CCCOC 1458a_100000211873_100000740836 [1,0,0,0,0,0|1,0,2]=4 94 B8R0.6 C=CC(=O)CCCOC 1458a_100000185746_100000740836 [1,0,0,0,0,0|1,0,2]=4 95 B8R0.6 CC/C=C/CC(=O)CC 1458a_100016274230_100000210202 [1,0,0,0,0,0|2,0,1]=4 96 B8R0.6 CC/C=C/CC(=O)NC 11a_106832991635_100016274230 [1,0,0,0,0,0|2,0,1]=4 97 B8R0.6 CC/C=C/CC(=O)NC 1626a_100102657272_100016274230 [1,0,0,0,0,0|2,0,1]=4 98 B8R0.6 CC/C=C/CC(=O)NC 240690a_100102657272_100016274230 [1,0,0,0,0,0|2,0,1]=4 99 B8R0.6 CC/C=C/CC(=O)NC 527a_100102657272_100016274230 [1,0,0,0,0,0|2,0,1]=4 100 B8R0.6 CC/C=C\CC(=O)CC 1458a_100000210414_100103147603 [1,0,0,0,0,0|2,0,1]=4 101 B8R0.6 CCC(=O)CCCOC 1458a_100000210414_100000740836 [1,0,0,0,0,0|1,0,1]=3 102 B8R0.6 CCC(=O)CCCOC 1458a_100000741012_100000210202 [1,0,0,0,0,0|1,0,1]=3 103 B8R0.6 CCC(=O)CCCSC 1458a_100000173376_100000210202 [1,0,0,0,0,0|1,1,1]=4 104 B8R0.6 CCC(=O)CSCOC 62a_100000747405_100000766300 [1,0,0,0,0,0|2,0,1]=4 105 B8R0.6 CCC(=O)CSCOC 62a_100000766300_100000747405 [1,0,0,0,0,0|2,0,1]=4 106 B8R0.6 CCC(=O)NCCOC 1626a_100000209980_100000210414 [1,0,0,0,0,0|2,0,1]=4 107 B8R0.6 CCC(=O)NCCOC 240690a_100000209980_100000210414 [1,0,0,0,0,0|2,0,1]=4 108 B8R0.6 CCC(=O)NCCOC 34a_200000158885_200000210301 [1,0,0,0,0,0|2,0,1]=4 109 B8R0.6 CCC(=O)NCCOC 527a_100000209980_100000210414 [1,0,0,0,0,0|2,0,1]=4 110 B8R0.6 CCC(=O)NCCOC 7a_200000158885_200000210301 [1,0,0,0,0,0|2,0,1]=4 111 B8R0.6 CCC(=O)NCCO[13CH3] 34a_200000158885_200025704644 [1,0,0,0,0,0|2,0,1]=4 112 B8R0.6 CCC(=O)NCCO[13CH3] 7a_200000158885_200025704644 [1,0,0,0,0,0|2,0,1]=4 113 B8R0.6 CCC(=O)OCCOC 7a_200000031056_200000210301 [1,0,0,0,0,0|2,0,1]=4 114 B8R0.6 CCC(=O)OCCO[13CH3] 7a_200000031056_200025704644 [1,0,0,0,0,0|2,0,1]=4 115 B8R0.6 CCCCCC(=O)CC 1458a_100000210414_100000210326 [1,0,0,0,0,0|2,0,1]=4 116 B8R0.6 CCCCCC(=O)CC 1458a_100000212188_100000210202 [1,0,0,0,0,0|2,0,1]=4 117 B8R0.6 CCCCCC(=O)NC 11a_106832991635_100000212188 [1,0,0,0,0,0|2,0,1]=4 118 B8R0.6 CCCCCC(=O)NC 1626a_100102657272_100000212188 [1,0,0,0,0,0|2,0,1]=4 119 B8R0.6 CCCCCC(=O)NC 240690a_100102657272_100000212188 [1,0,0,0,0,0|2,0,1]=4 120 B8R0.6 CCCCCC(=O)NC 527a_100102657272_100000212188 [1,0,0,0,0,0|2,0,1]=4 121 B8R0.6 CCCOCC(=O)OC 34a_100000210258_100000747449 [1,0,0,0,0,0|2,0,1]=4 122 B8R0.6 CCCSCC(=O)OC 62a_100000210303_100000747449 [1,0,0,0,0,0|2,0,1]=4 123 B8R0.6 CCCSCC(=O)OC 62a_100000747449_100000210303 [1,0,0,0,0,0|2,0,1]=4 124 B8R0.6 CCNCCC(=O)NC 2230a_100000738227_100000210202 [1,0,0,0,0,0|3,0,0]=4 125 B8R0.6 CCNCCC(=O)NC 2230a_100015525214_100000737683 [1,0,0,0,0,0|3,0,0]=4 126 B8R0.6 CCNCCC(=O)NC 34a_100000738227_100000210202 [1,0,0,0,0,0|3,0,0]=4 127 B8R0.6 CCNCCC(=O)OC 2230a_100015525214_100000204255 [1,0,0,0,0,0|2,0,0]=3 128 B8R0.6 CCOCCC(=O)CC 1458a_100000210414_100011215890 [1,0,0,0,0,0|3,0,0]=4 129 B8R0.6 CCOCCC(=O)CC 1458a_100000749530_100000210202 [1,0,0,0,0,0|3,0,0]=4 130 B8R0.6 CCOCCC(=O)NC 11a_106832991635_100000749530 [1,0,0,0,0,0|3,0,0]=4 131 B8R0.6 CCOCCC(=O)NC 1626a_100102657272_100000749530 [1,0,0,0,0,0|3,0,0]=4 132 B8R0.6 CCOCCC(=O)NC 240690a_100102657272_100000749530 [1,0,0,0,0,0|3,0,0]=4 133 B8R0.6 CCOCCC(=O)NC 34a_100000754576_100000210202 [1,0,0,0,0,0|3,0,0]=4 134 B8R0.6 CCOCCC(=O)NC 34a_100121572206_100012179268 [1,0,0,0,0,0|3,0,0]=4 135 B8R0.6 CCOCCC(=O)NC 527a_100102657272_100000749530 [1,0,0,0,0,0|3,0,0]=4 136 B8R0.6 CCOCCC(=O)OC 34a_100121572206_100000742370 [1,0,0,0,0,0|2,0,0]=3 137 B8R0.6 CCSCCC(=O)CC 1458a_100000210414_100000757381 [1,0,0,0,0,0|3,0,0]=4 138 B8R0.6 CCSCCC(=O)CC 1458a_100000230768_100000210202 [1,0,0,0,0,0|3,0,0]=4 139 B8R0.6 CCSCCC(=O)NC 11a_106832991635_100000230768 [1,0,0,0,0,0|3,0,0]=4 140 B8R0.6 CCSCCC(=O)NC 1626a_100102657272_100000230768 [1,0,0,0,0,0|3,0,0]=4 141 B8R0.6 CCSCCC(=O)NC 240690a_100102657272_100000230768 [1,0,0,0,0,0|3,0,0]=4 142 B8R0.6 CCSCCC(=O)NC 527a_100102657272_100000230768 [1,0,0,0,0,0|3,0,0]=4 143 B8R0.6 CCSCCC(=O)NC 62a_100000210202_100000737683 [1,0,0,0,0,0|3,0,0]=4 144 B8R0.6 CCSCCC(=O)NC 62a_100000737683_100000210202 [1,0,0,0,0,0|3,0,0]=4 145 B8R0.6 CCSCCC(=O)OC 62a_100000204255_100000210202 [1,0,0,0,0,0|2,0,0]=3 146 B8R0.6 CCSCCC(=O)OC 62a_100000210202_100000204255 [1,0,0,0,0,0|2,0,0]=3 147 B8R0.6 CCSCOC(=O)OC 62a_100000210202_100000139417 [1,0,0,0,0,0|3,0,0]=4 148 B8R0.6 CNC(=O)CCCN[13CH3] 2230a_100000740002_200025704644 [1,0,0,0,0,0|2,0,1]=4 149 B8R0.6 CNC(=O)CCCN[13CH3] 34a_100000740002_200025704644 [1,0,0,0,0,0|2,0,1]=4 150 B8R0.6 CNC(=O)CCCOC 11a_106832991635_100000741012 [1,0,0,0,0,0|1,0,1]=3 151 B8R0.6 CNC(=O)CCCOC 1626a_100102657272_100000741012 [1,0,0,0,0,0|1,0,1]=3 152 B8R0.6 CNC(=O)CCCOC 240690a_100102657272_100000741012 [1,0,0,0,0,0|1,0,1]=3 153 B8R0.6 CNC(=O)CCCOC 34a_100138415774_100000741757 [1,0,0,0,0,0|1,0,1]=3 154 B8R0.6 CNC(=O)CCCOC 527a_100102657272_100000741012 [1,0,0,0,0,0|1,0,1]=3 155 B8R0.6 CNC(=O)CCCSC 11a_106832991635_100000173376 [1,0,0,0,0,0|1,1,1]=4 156 B8R0.6 CNC(=O)CCCSC 1626a_100102657272_100000173376 [1,0,0,0,0,0|1,1,1]=4 157 B8R0.6 CNC(=O)CCCSC 240690a_100102657272_100000173376 [1,0,0,0,0,0|1,1,1]=4 158 B8R0.6 CNC(=O)CCCSC 527a_100102657272_100000173376 [1,0,0,0,0,0|1,1,1]=4 159 B8R0.6 CNC(=O)CCCSC 62a_100000741757_200000210301 [1,0,0,0,0,0|1,1,1]=4 160 B8R0.6 CNC(=O)CCCSC 62a_200000210301_100000741757 [1,0,0,0,0,0|1,1,1]=4 161 B8R0.6 CNC(=O)CCCS[13CH3] 62a_100000741757_200025704644 [1,0,0,0,0,0|1,1,1]=4 162 B8R0.6 CNC(=O)CCCS[13CH3] 62a_200025704644_100000741757 [1,0,0,0,0,0|1,1,1]=4 163 B8R0.6 CNC(=O)CNCOC 2230a_100000693194_100000766300 [1,0,0,0,0,0|2,0,1]=4 164 B8R0.6 CNC(=O)CSCOC 62a_100000183359_100000766300 [1,0,0,0,0,0|2,0,1]=4 165 B8R0.6 CNC(=O)CSCOC 62a_100000766300_100000183359 [1,0,0,0,0,0|2,0,1]=4 166 B8R0.6 CNC(=O)NCCOC 2708a_100102657272_100000209980 [1,0,0,0,0,0|2,0,1]=4 167 B8R0.6 CNC(=O)NCCOC 273464a_100000209980_100102657272 [1,0,0,0,0,0|2,0,1]=4 168 B8R0.6 CNC(=O)NCCOC 273464a_100102657272_100000209980 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.6 CNC(=O)OCCOC 34a_100138415774_200011997002 [1,0,0,0,0,0|2,0,1]=4 170 B8R0.6 CNCCCC(=O)NC 2230a_100000740002_200000210301 [1,0,0,0,0,0|2,0,1]=4 171 B8R0.6 CNCCCC(=O)NC 2230a_106832991635_100000741757 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.6 CNCCCC(=O)NC 34a_100000740002_200000210301 [1,0,0,0,0,0|2,0,1]=4 173 B8R0.6 CNCCCC(=O)NC 34a_100102657272_100000741757 [1,0,0,0,0,0|2,0,1]=4 174 B8R0.6 CNCCCC(=O)NC 7a_106832991635_100000741757 [1,0,0,0,0,0|2,0,1]=4 175 B8R0.6 CNCCCC(=O)OC 2230a_106832991635_100011218270 [1,0,0,0,0,0|1,0,1]=3 176 B8R0.6 CNCCCC(=O)OC 34a_100102657272_100000742333 [1,0,0,0,0,0|1,0,1]=3 177 B8R0.6 CNCCCC(=O)OC 7a_106832991635_100011218270 [1,0,0,0,0,0|1,0,1]=3 178 B8R0.6 COC(=O)CCCSC 62a_100011218270_200000210301 [1,0,0,0,0,0|0,1,1]=3 179 B8R0.6 COC(=O)CCCSC 62a_200000210301_100011218270 [1,0,0,0,0,0|0,1,1]=3 180 B8R0.6 COC(=O)CCCS[13CH3] 62a_100011218270_200025704644 [1,0,0,0,0,0|0,1,1]=3 181 B8R0.6 COC(=O)CCCS[13CH3] 62a_200025704644_100011218270 [1,0,0,0,0,0|0,1,1]=3 182 B8R0.6 COC(=O)CCSCF 62a_100000204255_100015361967 [1,0,0,0,0,0|3,0,0]=4 183 B8R0.6 COC(=O)CCSCF 62a_100015361967_100000204255 [1,0,0,0,0,0|3,0,0]=4 184 B8R0.6 COC(=O)CSCSC 62a_100000747449_100011218213 [1,0,0,0,0,0|1,1,1]=4 185 B8R0.6 COC(=O)CSCSC 62a_100011218213_100000747449 [1,0,0,0,0,0|1,1,1]=4 186 B8R0.6 COC(=O)NCCO[13CH3] 34a_100000757965_200025704644 [1,0,0,0,0,0|1,0,1]=3 187 B8R0.6 COC(=O)OCCO[13CH3] 34a_100010262106_200025704644 [1,0,0,0,0,0|1,0,1]=3 188 B8R0.6 COC/C=C/C(=O)OC 34a_100138415774_100000742655 [1,0,0,0,0,0|0,0,3]=4 189 B8R0.6 COCCCC(=O)CF 1458a_100000741012_100015361967 [1,0,0,0,0,0|2,0,1]=4 190 B8R0.6 COCCCC(=O)CO 1458a_100000210174_100000740836 [1,0,0,0,0,0|2,0,1]=4 191 B8R0.6 COCCCC(=O)NN 34a_100000211488_200000210301 [1,0,0,0,0,0|2,0,1]=4 192 B8R0.6 COCCCC(=O)OC 34a_100138415774_100000742333 [1,0,0,0,0,0|0,0,1]=2 193 B8R0.6 COCCCC(C)OC 34a_200011539412_200000210301 [1,0,0,0,0,0|1,0,2]=4 194 B8R0.6 COCCCC(C)OC 7a_200011539412_200000210301 [1,0,0,0,0,0|1,0,2]=4 195 B8R0.6 COCCCC(C)O[13CH3] 34a_200011539412_200025704644 [1,0,0,0,0,0|1,0,2]=4 196 B8R0.6 COCCCC(C)O[13CH3] 7a_200011539412_200025704644 [1,0,0,0,0,0|1,0,2]=4 197 B8R0.6 COCCNC(=O)OC 34a_100000757965_200000210301 [1,0,0,0,0,0|1,0,1]=3 198 B8R0.6 COCCOC(=O)OC 34a_100010262106_200000210301 [1,0,0,0,0,0|1,0,1]=3 199 B8R0.6 COCSCC(=O)OC 62a_100000747449_100000766300 [1,0,0,0,0,0|1,0,1]=3 200 B8R0.6 COCSCC(=O)OC 62a_100000766300_100000747449 [1,0,0,0,0,0|1,0,1]=3 201 B8R0.6 [13CH3]OCCCC(=O)NN 34a_100000211488_200025704644 [1,0,0,0,0,0|2,0,1]=4 202 B8R0.9 C#CC(=O)CCC(=C)C 1458a_100000211873_100000730704 [1,0,0,0,0,0|2,0,1]=4 203 B8R0.9 C=C(C)CCC(=O)CC 1458a_100000210414_100000730704 [1,0,0,0,0,0|2,0,0]=3 204 B8R0.9 C=C(C)CCC(=O)CC 1458a_200000688413_100000210202 [1,0,0,0,0,0|2,0,0]=3 205 B8R0.9 C=C(C)CCC(=O)CF 1458a_200000688413_100015361967 [1,0,0,0,0,0|3,0,0]=4 206 B8R0.9 C=C(C)CCC(=O)CO 1458a_100000210174_100000730704 [1,0,0,0,0,0|3,0,0]=4 207 B8R0.9 C=C(C)CCC(=O)NC 11a_106832991635_200000688413 [1,0,0,0,0,0|2,0,0]=3 208 B8R0.9 C=C(C)CCC(=O)NC 1626a_100102657272_200000688413 [1,0,0,0,0,0|2,0,0]=3 209 B8R0.9 C=C(C)CCC(=O)NC 240690a_100102657272_200000688413 [1,0,0,0,0,0|2,0,0]=3 210 B8R0.9 C=C(C)CCC(=O)NC 527a_100102657272_200000688413 [1,0,0,0,0,0|2,0,0]=3 211 B8R0.9 C=C(C)CNC(=O)CC 11a_100000765925_100000210414 [1,0,0,0,0,0|3,0,0]=4 212 B8R0.9 C=C(C)CNC(=O)CC 1626a_100000765925_100000210414 [1,0,0,0,0,0|3,0,0]=4 213 B8R0.9 C=C(C)CNC(=O)CC 240690a_100000765925_100000210414 [1,0,0,0,0,0|3,0,0]=4 214 B8R0.9 C=C(C)CNC(=O)CC 527a_100000765925_100000210414 [1,0,0,0,0,0|3,0,0]=4 215 B8R0.9 C=C(C)CNC(=O)NC 2708a_100000765925_106832991635 [1,0,0,0,0,0|3,0,0]=4 216 B8R0.9 C=C(C)CNC(=O)NC 2708a_100102657272_100000765925 [1,0,0,0,0,0|3,0,0]=4 217 B8R0.9 C=C(C)CNC(=O)NC 273464a_100000765925_100102657272 [1,0,0,0,0,0|3,0,0]=4 218 B8R0.9 C=C(C)CNC(=O)NC 273464a_100102657272_100000765925 [1,0,0,0,0,0|3,0,0]=4 219 B8R0.9 C=C(C)CNC(=O)NC 512a_100000765925_100102657272 [1,0,0,0,0,0|3,0,0]=4 220 B8R0.9 C=C(C)CNC(=O)NC 512a_106832991638_100000765925 [1,0,0,0,0,0|3,0,0]=4 221 B8R0.9 C=CC(=O)CCC(=C)C 1458a_100000185746_100000730704 [1,0,0,0,0,0|2,0,1]=4 222 B8R0.9 C=CC(=O)NCC(=O)C 1458a_200011222540_200000210301 [1,0,0,0,0,0|2,0,1]=4 223 B8R0.9 C=CC(=O)NCC(=O)[13CH3] 1458a_200011222540_200025704644 [1,0,0,0,0,0|2,0,1]=4 224 B8R0.9 CC(=O)NCC(=O)CF 1458a_100000194580_100015361967 [1,0,0,0,0,0|3,0,0]=4 225 B8R0.9 CC(=O)OCC(=O)CF 1458a_100000183556_100015361967 [1,0,0,0,0,0|3,0,0]=4 226 B8R0.9 CC(=O)SCC(=O)CF 1458a_100000049016_100015361967 [1,0,0,0,0,0|3,0,0]=4 227 B8R0.9 CCC(=O)CC=C(C)C 1458a_100000210414_100000761012 [1,0,0,0,0,0|2,0,1]=4 228 B8R0.9 CCC(=O)CC=C(C)C 1458a_100011220947_100000210202 [1,0,0,0,0,0|2,0,1]=4 229 B8R0.9 CCC(=O)CCC(=O)N 1458a_100011215257_100000210202 [1,0,0,0,0,0|2,0,0]=3 230 B8R0.9 CCC(=O)CCC(C)C 1458a_100000181311_100000210202 [1,0,0,0,0,0|2,0,1]=4 231 B8R0.9 CCC(=O)CCC(C)C 1458a_100000210414_100000210312 [1,0,0,0,0,0|2,0,1]=4 232 B8R0.9 CCC(=O)CCC(C)O 1458a_100000210414_100012276601 [1,0,0,0,0,0|1,0,2]=4 233 B8R0.9 CCC(=O)CC[N+](=O)[O-] 1458a_200000064761_100000210202 [1,0,0,0,0,0|2,0,1]=4 234 B8R0.9 CCC(=O)CC[S+](C)C 1458a_100009452791_100000210202 [1,0,0,0,0,0|3,0,0]=4 235 B8R0.9 CCC(=O)CNC(=O)C 1458a_100000194580_100000210202 [1,0,0,0,0,0|2,0,0]=3 236 B8R0.9 CCC(=O)CNC(=O)N 1458a_100000184981_100000210202 [1,0,0,0,0,0|3,0,0]=4 237 B8R0.9 CCC(=O)COC(=O)C 1458a_100000183556_100000210202 [1,0,0,0,0,0|2,0,0]=3 238 B8R0.9 CCC(=O)CSC(=O)C 1458a_100000049016_100000210202 [1,0,0,0,0,0|2,0,0]=3 239 B8R0.9 CCC(=O)NCC(=O)C 1458a_100000194589_200000210301 [1,0,0,0,0,0|2,0,0]=3 240 B8R0.9 CCC(=O)NCC(=O)N 11a_100000711301_100000210414 [1,0,0,0,0,0|3,0,0]=4 241 B8R0.9 CCC(=O)NCC(=O)N 240690a_100000711301_100000210414 [1,0,0,0,0,0|3,0,0]=4 242 B8R0.9 CCC(=O)NCC(=O)N 527a_100000711301_100000210414 [1,0,0,0,0,0|3,0,0]=4 243 B8R0.9 CCC(=O)NCC(=O)[13CH3] 1458a_100000194589_200025704644 [1,0,0,0,0,0|2,0,0]=3 244 B8R0.9 CCC(=O)NNC(=O)C 22a_100000183195_100000070787 [1,0,0,0,0,0|3,0,0]=4 245 B8R0.9 CCC(=O)NNC(=O)C 22a_100000189765_100000210414 [1,0,0,0,0,0|3,0,0]=4 246 B8R0.9 CCC(C)CCC(=O)C 1458a_100000701222_200000210301 [1,0,0,0,0,0|2,0,1]=4 247 B8R0.9 CCC(C)CCC(=O)[13CH3] 1458a_100000701222_200025704644 [1,0,0,0,0,0|2,0,1]=4 248 B8R0.9 CCN(C)CCC(=O)C 1458a_100000755305_200000210301 [1,0,0,0,0,0|3,0,0]=4 249 B8R0.9 CCN(C)CCC(=O)C 269982a_100000225621_100000053229 [1,0,0,0,0,0|3,0,0]=4 250 B8R0.9 CCN(C)CCC(=O)[13CH3] 1458a_100000755305_200025704644 [1,0,0,0,0,0|3,0,0]=4 251 B8R0.9 CCS(=O)CCC(=O)C 1458a_100011387550_200000210301 [1,0,0,0,0,0|2,0,0]=3 252 B8R0.9 CCS(=O)CCC(=O)[13CH3] 1458a_100011387550_200025704644 [1,0,0,0,0,0|2,0,0]=3 253 B8R0.9 CNC(=O)C=CC(=O)C 1458a_100016259477_200000210301 [1,0,0,0,0,0|1,0,2]=4 254 B8R0.9 CNC(=O)C=CC(=O)[13CH3] 1458a_100016259477_200025704644 [1,0,0,0,0,0|1,0,2]=4 255 B8R0.9 CNC(=O)CC=C(C)C 11a_106832991635_100011220947 [1,0,0,0,0,0|2,0,1]=4 256 B8R0.9 CNC(=O)CC=C(C)C 1626a_100102657272_100011220947 [1,0,0,0,0,0|2,0,1]=4 257 B8R0.9 CNC(=O)CC=C(C)C 240690a_100102657272_100011220947 [1,0,0,0,0,0|2,0,1]=4 258 B8R0.9 CNC(=O)CC=C(C)C 527a_100102657272_100011220947 [1,0,0,0,0,0|2,0,1]=4 259 B8R0.9 CNC(=O)CCC(=O)C 1458a_100011309844_200000210301 [1,0,0,0,0,0|1,0,0]=2 260 B8R0.9 CNC(=O)CCC(=O)N 240690a_100102657272_100011215257 [1,0,0,0,0,0|2,0,0]=3 261 B8R0.9 CNC(=O)CCC(=O)N 527a_100102657272_100011215257 [1,0,0,0,0,0|2,0,0]=3 262 B8R0.9 CNC(=O)CCC(=O)[13CH3] 1458a_100011309844_200025704644 [1,0,0,0,0,0|1,0,0]=2 263 B8R0.9 CNC(=O)CCC(C)C 11a_106832991635_100000181311 [1,0,0,0,0,0|2,0,1]=4 264 B8R0.9 CNC(=O)CCC(C)C 1626a_100102657272_100000181311 [1,0,0,0,0,0|2,0,1]=4 265 B8R0.9 CNC(=O)CCC(C)C 240690a_100102657272_100000181311 [1,0,0,0,0,0|2,0,1]=4 266 B8R0.9 CNC(=O)CCC(C)C 527a_100102657272_100000181311 [1,0,0,0,0,0|2,0,1]=4 267 B8R0.9 CNC(=O)CCC(C)O 1626a_100102657272_100000718519 [1,0,0,0,0,0|1,0,2]=4 268 B8R0.9 CNC(=O)CCN(C)C 11a_106832991635_100000689311 [1,0,0,0,0,0|3,0,0]=4 269 B8R0.9 CNC(=O)CCN(C)C 2230a_100000750875_200000210301 [1,0,0,0,0,0|3,0,0]=4 270 B8R0.9 CNC(=O)CCN(C)C 2230a_100102631434_100000737683 [1,0,0,0,0,0|3,0,0]=4 271 B8R0.9 CNC(=O)CCN(C)C 240690a_100102657272_100000689311 [1,0,0,0,0,0|3,0,0]=4 272 B8R0.9 CNC(=O)CCN(C)C 269982a_100000750875_200000210301 [1,0,0,0,0,0|3,0,0]=4 273 B8R0.9 CNC(=O)CCN(C)C 269982a_100102631434_100000737683 [1,0,0,0,0,0|3,0,0]=4 274 B8R0.9 CNC(=O)CCN(C)C 527a_100102657272_100000689311 [1,0,0,0,0,0|3,0,0]=4 275 B8R0.9 CNC(=O)CCN(C)[13CH3] 2230a_100000750875_200025704644 [1,0,0,0,0,0|3,0,0]=4 276 B8R0.9 CNC(=O)CCN(C)[13CH3] 269982a_100000750875_200025704644 [1,0,0,0,0,0|3,0,0]=4 277 B8R0.9 CNC(=O)CC[N+](=O)[O-] 11a_106832991635_200000064761 [1,0,0,0,0,0|2,0,1]=4 278 B8R0.9 CNC(=O)CC[N+](=O)[O-] 1626a_100102657272_200000064761 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.9 CNC(=O)CC[N+](=O)[O-] 240690a_100102657272_200000064761 [1,0,0,0,0,0|2,0,1]=4 280 B8R0.9 CNC(=O)CC[S+](C)C 11a_106832991635_100009452791 [1,0,0,0,0,0|3,0,0]=4 281 B8R0.9 CNC(=O)CC[S+](C)C 1626a_100102657272_100009452791 [1,0,0,0,0,0|3,0,0]=4 282 B8R0.9 CNC(=O)CC[S+](C)C 240690a_100102657272_100009452791 [1,0,0,0,0,0|3,0,0]=4 283 B8R0.9 CNC(=O)CNC(=O)C 11a_100000693194_100015343762 [1,0,0,0,0,0|2,0,0]=3 284 B8R0.9 CNC(=O)CNC(=O)C 11a_106832991635_100000194580 [1,0,0,0,0,0|2,0,0]=3 285 B8R0.9 CNC(=O)CNC(=O)C 1626a_100102657272_100000194580 [1,0,0,0,0,0|2,0,0]=3 286 B8R0.9 CNC(=O)CNC(=O)C 240690a_100000693194_100015343762 [1,0,0,0,0,0|2,0,0]=3 287 B8R0.9 CNC(=O)CNC(=O)C 240690a_100102657272_100000194580 [1,0,0,0,0,0|2,0,0]=3 288 B8R0.9 CNC(=O)CNC(=O)C 527a_100000693194_100103153847 [1,0,0,0,0,0|2,0,0]=3 289 B8R0.9 CNC(=O)CNC(=O)C 527a_100102657272_100000194580 [1,0,0,0,0,0|2,0,0]=3 290 B8R0.9 CNC(=O)CNC(=O)N 240690a_100102657272_100000184981 [1,0,0,0,0,0|3,0,0]=4 291 B8R0.9 CNC(=O)CNC(=O)N 527a_100102657272_100000184981 [1,0,0,0,0,0|3,0,0]=4 292 B8R0.9 CNC(=O)COC(=O)C 1626a_100102657272_100000183556 [1,0,0,0,0,0|2,0,0]=3 293 B8R0.9 CNC(=O)COC(=O)C 240690a_100102657272_100000183556 [1,0,0,0,0,0|2,0,0]=3 294 B8R0.9 CNC(=O)COC(=O)C 527a_100102657272_100000183556 [1,0,0,0,0,0|2,0,0]=3 295 B8R0.9 CNC(=O)CSC(=O)C 11a_106832991635_100000049016 [1,0,0,0,0,0|2,0,0]=3 296 B8R0.9 CNC(=O)CSC(=O)C 1626a_100102657272_100000049016 [1,0,0,0,0,0|2,0,0]=3 297 B8R0.9 CNC(=O)CSC(=O)C 240690a_100102657272_100000049016 [1,0,0,0,0,0|2,0,0]=3 298 B8R0.9 CNC(=O)CSC(=O)N 240690a_100102657272_200015941356 [1,0,0,0,0,0|3,0,0]=4 299 B8R0.9 CNC(=O)NCC(=O)N 2708a_100102657272_100000711301 [1,0,0,0,0,0|3,0,0]=4 300 B8R0.9 CNC(=O)NCC(=O)N 273464a_100000711301_100102657272 [1,0,0,0,0,0|3,0,0]=4 301 B8R0.9 CNC(=O)NCC(=O)N 273464a_100102657272_100000711301 [1,0,0,0,0,0|3,0,0]=4 302 B8R0.9 CNC(=O)NCC(=O)N 512a_106832991638_100000711301 [1,0,0,0,0,0|3,0,0]=4 303 B8R0.9 CNC(=O)NNC(=O)C 273464a_100102657272_100000189765 [1,0,0,0,0,0|3,0,0]=4 304 B8R0.9 CNC(=O)NNC(=O)C 512a_100000189765_100102657272 [1,0,0,0,0,0|3,0,0]=4 305 B8R0.9 COC(=O)CCC(=O)C 1458a_100000187943_200000210301 [1,0,0,0,0,0|0,0,0]=1 306 B8R0.9 COC(=O)CCC(=O)[13CH3] 1458a_100000187943_200025704644 [1,0,0,0,0,0|0,0,0]=1 307 B8R0.9 COC(=O)CCN(C)C 2230a_100102631434_100000204255 [1,0,0,0,0,0|2,0,0]=3 308 B8R0.9 COC(=O)CCN(C)C 269982a_100025711912_200000210301 [1,0,0,0,0,0|2,0,0]=3 309 B8R0.9 COC(=O)CCN(C)C 269982a_100102631434_100000204255 [1,0,0,0,0,0|2,0,0]=3 310 B8R0.9 COC(=O)CCN(C)[13CH3] 269982a_100025711912_200025704644 [1,0,0,0,0,0|2,0,0]=3 311 B8R0.9 COC(=O)CNC(=O)C 188690a_100000185156_100015343762 [1,0,0,0,0,0|1,0,0]=2 312 B8R0.9 COC(=O)CNC(C)C 2230a_100138425928_100000747449 [1,0,0,0,0,0|2,0,1]=4 313 B8R0.9 COC(=O)CNC(C)C 34a_100138425928_100000747449 [1,0,0,0,0,0|2,0,1]=4 314 B8R0.9 COC(=O)COC(C)C 34a_100000212225_100000747449 [1,0,0,0,0,0|2,0,1]=4 315 B8R0.9 COC(=O)CSC(C)C 62a_100000210206_100000747449 [1,0,0,0,0,0|2,0,1]=4 316 B8R0.9 COC(=O)CSC(C)C 62a_100000747449_100000210206 [1,0,0,0,0,0|2,0,1]=4 317 B8R0.9 COC(=O)NCC(=O)C 1458a_100000215747_200000210301 [1,0,0,0,0,0|1,0,0]=2 318 B8R0.9 COC(=O)NCC(=O)[13CH3] 1458a_100000215747_200025704644 [1,0,0,0,0,0|1,0,0]=2 319 B8R0.9 COC(C)NCC(=O)O 269956a_100016091260_100009879195 [1,0,0,0,0,0|2,0,1]=4 320 B8R0.9 CO[C@H](C)CNC(=O)C 11a_100020591295_100015343762 [1,0,0,0,0,0|2,0,1]=4 321 B8R0.9 CO[C@H](C)CNC(=O)C 1626a_100020591295_100015343762 [1,0,0,0,0,0|2,0,1]=4 322 B8R0.9 CO[C@H](C)CNC(=O)C 240690a_100020591295_100015343762 [1,0,0,0,0,0|2,0,1]=4 323 B8R0.9 CO[C@H](C)CNC(=O)C 527a_100020591295_100103153847 [1,0,0,0,0,0|2,0,1]=4 324 B8R0.9 NC(=O)CCC(=O)CF 1458a_100011215257_100015361967 [1,0,0,0,0,0|3,0,0]=4 325 B10R0.45 CCC(=O)CCC(OC)OC 1458a_100000210414_100000139399 [0,1,0,0,0,0|1,0,2]=4 326 B10R0.45 CCC(=O)CCC(OC)OC 1458a_200000082759_100000210202 [0,1,0,0,0,0|1,0,2]=4 327 B10R0.45 CCN(CC)CCC(=O)OC 2230a_100000229097_100000210202 [0,1,0,0,0,0|3,0,0]=4 328 B10R0.45 CCN(CC)CCC(=O)OC 2230a_100000724800_100000204255 [0,1,0,0,0,0|3,0,0]=4 329 B10R0.45 CCN(CC)CCC(=O)OC 269956a_100000042499_100000204255 [0,1,0,0,0,0|3,0,0]=4 330 B10R0.45 CCN(CC)CCC(=O)OC 269982a_100000229097_100000204670 [0,1,0,0,0,0|3,0,0]=4 331 B10R0.45 CCN(CC)CCC(=O)OC 269982a_100000724800_100000204255 [0,1,0,0,0,0|3,0,0]=4 332 B10R0.45 CCN(CF)CCC(=O)OC 269982a_100000229097_100015361967 [0,1,0,0,0,0|3,0,0]=4 333 B10R0.45 CNC(=O)CCC(OC)OC 11a_106832991635_200000082759 [0,1,0,0,0,0|1,0,2]=4 334 B10R0.45 CNC(=O)CCC(OC)OC 1626a_100102657272_200000082759 [0,1,0,0,0,0|1,0,2]=4 335 B10R0.45 CNC(=O)CCC(OC)OC 240690a_100102657272_200000082759 [0,1,0,0,0,0|1,0,2]=4 336 B10R0.45 CNC(=O)CCC(OC)OC 527a_100102657272_200000082759 [0,1,0,0,0,0|1,0,2]=4 337 B10R0.46 C/C=C(\C)/C(=O)CC(=O)OC 1458a_100020587367_100000747449 [0,1,0,0,0,0|2,0,1]=4 338 B10R0.46 C=C(CC(=O)OC)C(=O)NC 1626a_100102657272_100000040833 [0,1,0,0,0,0|1,0,1]=3 339 B10R0.46 C=CC(=O)N(C)CC(=O)OC 1626a_100000198492_100000185746 [0,1,0,0,0,0|2,0,1]=4 340 B10R0.46 C=CC(=O)N(C)CC(=O)OC 240690a_100000198492_200121576911 [0,1,0,0,0,0|2,0,1]=4 341 B10R0.46 CCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000210202 [0,1,0,0,0,0|1,0,0]=2 342 B10R0.46 CCC(=O)CC(=O)C(=O)NC 1458a_100011218921_100000747405 [0,1,0,0,0,0|2,0,1]=4 343 B10R0.46 CCC(=O)N(C)CC(=O)NC 11a_100000189611_100000210414 [0,1,0,0,0,0|3,0,0]=4 344 B10R0.46 CCC(=O)N(C)CC(=O)NC 240690a_100000189611_100000210414 [0,1,0,0,0,0|3,0,0]=4 345 B10R0.46 CCC(=O)N(C)CC(=O)NC 527a_100000189611_100000210414 [0,1,0,0,0,0|3,0,0]=4 346 B10R0.46 CCC(=O)N(C)CC(=O)OC 11a_100000198492_100000210414 [0,1,0,0,0,0|2,0,0]=3 347 B10R0.46 CCC(=O)N(C)CC(=O)OC 1626a_100000198492_100000210414 [0,1,0,0,0,0|2,0,0]=3 348 B10R0.46 CCC(=O)N(C)CC(=O)OC 240690a_100000198492_100000210414 [0,1,0,0,0,0|2,0,0]=3 349 B10R0.46 CCC(=O)N(C)CC(=O)OC 527a_100000198492_100000210414 [0,1,0,0,0,0|2,0,0]=3 350 B10R0.46 CCC(=O)NC(C)C(=O)CC 1458a_100000194823_100000210202 [0,1,0,0,0,0|3,0,0]=4 351 B10R0.46 CCC(=O)NC(C)C(=O)NC 11a_106832991635_100000194823 [0,1,0,0,0,0|3,0,0]=4 352 B10R0.46 CCC(=O)NC(C)C(=O)NC 1626a_100102657272_100000194823 [0,1,0,0,0,0|3,0,0]=4 353 B10R0.46 CCC(=O)NC(C)C(=O)NC 240690a_100102657272_100000194823 [0,1,0,0,0,0|3,0,0]=4 354 B10R0.46 CCC(=O)NC(C)C(=O)NC 527a_100102657272_100000194823 [0,1,0,0,0,0|3,0,0]=4 355 B10R0.46 CCC(=O)N[C@H](C)C(=O)NC 11a_100000684985_100000210414 [0,1,0,0,0,0|3,0,0]=4 356 B10R0.46 CCC(=O)N[C@H](C)C(=O)NC 240690a_100000684985_100000210414 [0,1,0,0,0,0|3,0,0]=4 357 B10R0.46 CCC(=O)N[C@H](C)C(=O)NC 527a_100000684985_100000210414 [0,1,0,0,0,0|3,0,0]=4 358 B10R0.46 CCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210414 [0,1,0,0,0,0|2,0,0]=3 359 B10R0.46 CCN(C)C(C)CC(=O)OC 2230a_100000225621_100009817358 [0,1,0,0,0,0|3,0,0]=4 360 B10R0.46 CCN(C)C(C)CC(=O)OC 269982a_100000225621_100009817358 [0,1,0,0,0,0|3,0,0]=4 361 B10R0.46 CCN(C)CC(C)C(=O)OC 269982a_100000225621_100000698445 [0,1,0,0,0,0|3,0,0]=4 362 B10R0.46 CNC(=O)C(=O)CC(=O)OC 1458a_100011218921_100000747449 [0,1,0,0,0,0|1,0,1]=3 363 B10R0.46 CNC(=O)C(C)CC(=O)OC 1626a_100102657272_100000037256 [0,1,0,0,0,0|1,0,0]=2 364 B10R0.46 CNC(=O)C(C)CC(=O)OC 240690a_100102657272_100000037256 [0,1,0,0,0,0|1,0,0]=2 365 B10R0.46 CNC(=O)C(C)CC(=O)OC 527a_100102657272_100000037256 [0,1,0,0,0,0|1,0,0]=2 366 B10R0.46 CNC(=O)CC(=O)C(=O)NC 1458a_100011218921_100000183359 [0,1,0,0,0,0|2,0,1]=4 367 B10R0.46 CNC(=O)CN(C)C(=O)NC 2708a_100102657272_100000189611 [0,1,0,0,0,0|3,0,0]=4 368 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 2708a_100102657272_100000684985 [0,1,0,0,0,0|3,0,0]=4 369 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 273464a_100000684985_100102657272 [0,1,0,0,0,0|3,0,0]=4 370 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 512a_100000684985_100102657272 [0,1,0,0,0,0|3,0,0]=4 371 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 512a_106832991638_100000684985 [0,1,0,0,0,0|3,0,0]=4 372 B10R0.46 COC(=O)C(C)SC(C)OC 62a_100000211248_100009879195 [0,1,0,0,0,0|2,0,1]=4 373 B10R0.46 COC(=O)C(C)SC(C)OC 62a_100009879195_100000211248 [0,1,0,0,0,0|2,0,1]=4 374 B10R0.46 COC(=O)CC(=O)C(C)OC 1458a_100000743197_100000747449 [0,1,0,0,0,0|1,0,2]=4 375 B10R0.46 COC(=O)CC(C)C(=O)CF 1458a_100000037256_100015361967 [0,1,0,0,0,0|2,0,0]=3 376 B10R0.46 COC(=O)CN(C)C(=O)CO 240690a_100000198492_100000210174 [0,1,0,0,0,0|3,0,0]=4 377 B10R0.46 COC(=O)CN(C)C(=O)CO 527a_100000198492_100000210174 [0,1,0,0,0,0|3,0,0]=4 378 B10R0.46 COC(=O)[C@@H](C)NC(=O)CO 188690a_100000687819_100000210174 [0,1,0,0,0,0|3,0,0]=4 379 B10R0.82 C=C(C)C(=O)NCC(=O)CC 1458a_100000076187_100000210202 [0,1,0,0,0,0|3,0,0]=4 380 B10R0.82 C=C(C)C(=O)NCC(=O)NC 11a_100000693194_100000185857 [0,1,0,0,0,0|3,0,0]=4 381 B10R0.82 C=C(C)C(=O)NCC(=O)NC 11a_106832991635_100000076187 [0,1,0,0,0,0|3,0,0]=4 382 B10R0.82 C=C(C)C(=O)NCC(=O)NC 240690a_100102657272_100000076187 [0,1,0,0,0,0|3,0,0]=4 383 B10R0.82 C=C(C)C(=O)NCC(=O)NC 527a_100102657272_100000076187 [0,1,0,0,0,0|3,0,0]=4 384 B10R0.82 C=C(C)C(=O)NCC(=O)OC 188690a_100000185156_100000185857 [0,1,0,0,0,0|2,0,0]=3 385 B10R0.82 CCC(=O)CCC(=O)N(C)C 1458a_100011200748_100000210202 [0,1,0,0,0,0|2,0,0]=3 386 B10R0.82 CCC(=O)CNC(=O)C(C)C 1458a_100000194582_100000210202 [0,1,0,0,0,0|3,0,0]=4 387 B10R0.82 CCC(=O)COC(=O)C(C)C 1458a_100000210414_100000139345 [0,1,0,0,0,0|3,0,0]=4 388 B10R0.82 CCC(=O)NCC(=O)C(C)C 1458a_100000194589_100000210206 [0,1,0,0,0,0|3,0,0]=4 389 B10R0.82 CCC(=O)NCC(=O)N(C)C 11a_100015183351_100000210414 [0,1,0,0,0,0|3,0,0]=4 390 B10R0.82 CCC(=O)NCC(=O)N(C)C 11a_100102631434_100000194589 [0,1,0,0,0,0|3,0,0]=4 391 B10R0.82 CCC(=O)NCC(=O)N(C)C 1626a_100102631434_100000194589 [0,1,0,0,0,0|3,0,0]=4 392 B10R0.82 CCC(=O)NCC(=O)N(C)C 240690a_100015183351_100000210414 [0,1,0,0,0,0|3,0,0]=4 393 B10R0.82 CCC(=O)NCC(=O)N(C)C 240690a_100102631434_100000194589 [0,1,0,0,0,0|3,0,0]=4 394 B10R0.82 CCC(=O)NCC(=O)N(C)C 527a_100015183351_100000210414 [0,1,0,0,0,0|3,0,0]=4 395 B10R0.82 CCC(=O)NCC(=O)N(C)C 527a_100102631434_100000194589 [0,1,0,0,0,0|3,0,0]=4 396 B10R0.82 CCS(=O)CCC(=O)C(C)C 1458a_100011387550_100000210206 [0,1,0,0,0,0|3,0,0]=4 397 B10R0.82 CCS(=O)CCC(=O)N(C)C 11a_100102631434_100011387550 [0,1,0,0,0,0|3,0,0]=4 398 B10R0.82 CCS(=O)CCC(=O)N(C)C 1626a_100102631434_100011387550 [0,1,0,0,0,0|3,0,0]=4 399 B10R0.82 CCS(=O)CCC(=O)N(C)C 240690a_100102631434_100011387550 [0,1,0,0,0,0|3,0,0]=4 400 B10R0.82 CCS(=O)CCC(=O)N(C)C 527a_100102631434_100011387550 [0,1,0,0,0,0|3,0,0]=4 401 B10R0.82 CN(C)C(=O)CCC(=O)CF 1458a_100011200748_100015361967 [0,1,0,0,0,0|3,0,0]=4 402 B10R0.82 CNC(=O)CCC(=O)C(C)C 1458a_100011309844_100000210206 [0,1,0,0,0,0|2,0,0]=3 403 B10R0.82 CNC(=O)CCC(=O)N(C)C 11a_100102631434_100011309844 [0,1,0,0,0,0|2,0,0]=3 404 B10R0.82 CNC(=O)CCC(=O)N(C)C 11a_106832991635_100011200748 [0,1,0,0,0,0|2,0,0]=3 405 B10R0.82 CNC(=O)CCC(=O)N(C)C 1626a_100102631434_100011309844 [0,1,0,0,0,0|2,0,0]=3 406 B10R0.82 CNC(=O)CCC(=O)N(C)C 1626a_100102657272_100011200748 [0,1,0,0,0,0|2,0,0]=3 407 B10R0.82 CNC(=O)CCC(=O)N(C)C 240690a_100102631434_100011309844 [0,1,0,0,0,0|2,0,0]=3 408 B10R0.82 CNC(=O)CCC(=O)N(C)C 240690a_100102657272_100011200748 [0,1,0,0,0,0|2,0,0]=3 409 B10R0.82 CNC(=O)CCC(=O)N(C)C 527a_100102631434_100011309844 [0,1,0,0,0,0|2,0,0]=3 410 B10R0.82 CNC(=O)CCC(=O)N(C)C 527a_100102657272_100011200748 [0,1,0,0,0,0|2,0,0]=3 411 B10R0.82 CNC(=O)CNC(=O)C(C)C 11a_100000693194_100000210198 [0,1,0,0,0,0|3,0,0]=4 412 B10R0.82 CNC(=O)CNC(=O)C(C)C 11a_106832991635_100000194582 [0,1,0,0,0,0|3,0,0]=4 413 B10R0.82 CNC(=O)CNC(=O)C(C)C 1626a_100102657272_100000194582 [0,1,0,0,0,0|3,0,0]=4 414 B10R0.82 CNC(=O)CNC(=O)C(C)C 240690a_100000693194_100000210198 [0,1,0,0,0,0|3,0,0]=4 415 B10R0.82 CNC(=O)CNC(=O)C(C)C 240690a_100102657272_100000194582 [0,1,0,0,0,0|3,0,0]=4 416 B10R0.82 CNC(=O)CNC(=O)C(C)C 527a_100000693194_100000210198 [0,1,0,0,0,0|3,0,0]=4 417 B10R0.82 CNC(=O)CNC(=O)C(C)C 527a_100102657272_100000194582 [0,1,0,0,0,0|3,0,0]=4 418 B10R0.82 CNC(=O)CNC(=O)C(C)F 11a_100000693194_100000062450 [0,1,0,0,0,0|3,0,0]=4 419 B10R0.82 CNC(=O)CNC(=O)C(C)F 240690a_100000693194_100000062450 [0,1,0,0,0,0|3,0,0]=4 420 B10R0.82 CNC(=O)CNC(=O)C(C)F 527a_100000693194_100000062450 [0,1,0,0,0,0|3,0,0]=4 421 B10R0.82 CNC(=O)CNC(=O)[C@@H](C)O 240690a_100000693194_100000717761 [0,1,0,0,0,0|3,0,0]=4 422 B10R0.82 CNC(=O)CNC(=O)[C@H](C)O 240690a_100000693194_217856618621 [0,1,0,0,0,0|3,0,0]=4 423 B10R0.82 CNC(=O)NCC(=O)N(C)C 2708a_100015183351_106832991635 [0,1,0,0,0,0|3,0,0]=4 424 B10R0.82 CNC(=O)NCC(=O)N(C)C 2708a_100102657272_100015183351 [0,1,0,0,0,0|3,0,0]=4 425 B10R0.82 CNC(=O)NCC(=O)N(C)C 273464a_100015183351_100102657272 [0,1,0,0,0,0|3,0,0]=4 426 B10R0.82 CNC(=O)NCC(=O)N(C)C 273464a_100102657272_100015183351 [0,1,0,0,0,0|3,0,0]=4 427 B10R0.82 CNC(=O)NCC(=O)N(C)C 512a_100015183351_100102657272 [0,1,0,0,0,0|3,0,0]=4 428 B10R0.82 CNC(=O)NCC(=O)N(C)C 512a_106832991638_100015183351 [0,1,0,0,0,0|3,0,0]=4 429 B10R0.82 COC(=O)C=CC(=O)N(C)C 1626a_100102631434_100016283253 [0,1,0,0,0,0|1,0,2]=4 430 B10R0.82 COC(=O)CCC(=O)C(C)C 1458a_100000187943_100000210206 [0,1,0,0,0,0|1,0,0]=2 431 B10R0.82 COC(=O)CCC(=O)N(C)C 11a_100102631434_100000187943 [0,1,0,0,0,0|1,0,0]=2 432 B10R0.82 COC(=O)CCC(=O)N(C)C 1626a_100102631434_100000187943 [0,1,0,0,0,0|1,0,0]=2 433 B10R0.82 COC(=O)CCC(=O)N(C)C 240690a_100102631434_100000187943 [0,1,0,0,0,0|1,0,0]=2 434 B10R0.82 COC(=O)CCC(=O)N(C)C 527a_100102631434_100000187943 [0,1,0,0,0,0|1,0,0]=2 435 B10R0.82 COC(=O)CCN(C)C(=O)C 11a_100025711912_100015343762 [0,1,0,0,0,0|3,0,0]=4 436 B10R0.82 COC(=O)CCN(C)C(=O)C 1626a_100025711912_100015343762 [0,1,0,0,0,0|3,0,0]=4 437 B10R0.82 COC(=O)CCN(C)C(=O)C 240690a_100025711912_100015343762 [0,1,0,0,0,0|3,0,0]=4 438 B10R0.82 COC(=O)CCN(C)C(=O)C 527a_100025711912_100103153847 [0,1,0,0,0,0|3,0,0]=4 439 B10R0.82 COC(=O)CCN(C)C(C)C 2230a_100000228967_200000210301 [0,1,0,0,0,0|3,0,0]=4 440 B10R0.82 COC(=O)CCN(C)C(C)C 269982a_100000228967_200000210301 [0,1,0,0,0,0|3,0,0]=4 441 B10R0.82 COC(=O)CCN(C)C(C)C 269982a_100025711912_100000210206 [0,1,0,0,0,0|3,0,0]=4 442 B10R0.82 COC(=O)CCN(C)C(C)C 269982a_200000211004_100000204255 [0,1,0,0,0,0|3,0,0]=4 443 B10R0.82 COC(=O)CCN([13CH3])C(C)C 2230a_100000228967_200025704644 [0,1,0,0,0,0|3,0,0]=4 444 B10R0.82 COC(=O)CCN([13CH3])C(C)C 269982a_100000228967_200025704644 [0,1,0,0,0,0|3,0,0]=4 445 B10R0.82 COC(=O)CNC(=O)C(C)C 188690a_100000185156_100000210198 [0,1,0,0,0,0|2,0,0]=3 446 B10R0.82 COC(=O)CNC(=O)C(C)F 188690a_100000185156_100000062450 [0,1,0,0,0,0|2,0,0]=3 447 B10R0.82 COC(=O)CNC(=O)C(O)O 188690a_100000185156_100000233687 [0,1,0,0,0,0|3,0,0]=4 448 B10R0.82 COC(=O)CNC(=O)[C@@H](C)O 188690a_100000185156_100000717761 [0,1,0,0,0,0|2,0,0]=3 449 B10R0.82 COC(=O)CNC(=O)[C@H](C)O 188690a_100000185156_217856618621 [0,1,0,0,0,0|2,0,0]=3 450 B10R0.82 COC(=O)NCC(=O)C(C)C 1458a_100000215747_100000210206 [0,1,0,0,0,0|2,0,0]=3 451 B10R0.82 COC(=O)NCC(=O)N(C)C 11a_100102631434_100000215747 [0,1,0,0,0,0|2,0,0]=3 452 B10R0.82 COC(=O)NCC(=O)N(C)C 1626a_100102631434_100000215747 [0,1,0,0,0,0|2,0,0]=3 453 B10R0.82 COC(=O)NCC(=O)N(C)C 240690a_100102631434_100000215747 [0,1,0,0,0,0|2,0,0]=3 454 B10R0.82 COC(=O)NCC(=O)N(C)C 527a_100102631434_100000215747 [0,1,0,0,0,0|2,0,0]=3 455 B10R0.108 C#CCC(=O)CCC(=O)NC 1458a_100011309844_100000184674 [0,1,0,0,0,0|2,0,1]=4 456 B10R0.108 C#CCC(=O)CCC(=O)OC 1458a_100000187943_100000184674 [0,1,0,0,0,0|1,0,1]=3 457 B10R0.108 C#CCC(=O)CNC(=O)OC 1458a_100000215747_100000184674 [0,1,0,0,0,0|2,0,1]=4 458 B10R0.108 C#CCC(=O)NCC(=O)OC 188690a_100000185156_100011220946 [0,1,0,0,0,0|2,0,1]=4 459 B10R0.108 C=CCC(=O)CCC(=O)NC 1458a_100011309844_100000210623 [0,1,0,0,0,0|2,0,1]=4 460 B10R0.108 C=CCC(=O)CCC(=O)OC 1458a_100000187943_100000210623 [0,1,0,0,0,0|1,0,1]=3 461 B10R0.108 C=CCC(=O)CNC(=O)OC 1458a_100000215747_100000210623 [0,1,0,0,0,0|2,0,1]=4 462 B10R0.108 C=CCC(=O)NCC(=O)OC 188690a_100000185156_100000210193 [0,1,0,0,0,0|2,0,1]=4 463 B10R0.108 CC=CC(=O)NCC(=O)NC 11a_100000693194_100000210699 [0,1,0,0,0,0|3,0,0]=4 464 B10R0.108 CC=CC(=O)NCC(=O)NC 240690a_100000693194_100000210699 [0,1,0,0,0,0|3,0,0]=4 465 B10R0.108 CC=CC(=O)NCC(=O)OC 188690a_100000185156_100000210699 [0,1,0,0,0,0|2,0,0]=3 466 B10R0.108 CCC(=O)NCC(=O)CCF 1458a_100000194589_100011217306 [0,1,0,0,0,0|3,0,0]=4 467 B10R0.108 CCC(=O)NCC(=O)CCO 1458a_100000194589_100000211926 [0,1,0,0,0,0|3,0,0]=4 468 B10R0.108 CCC(=O)NCC(=O)NNC 22a_100016993582_100000194589 [0,1,0,0,0,0|3,0,0]=4 469 B10R0.108 CCC(=O)NNC(=O)COC 22a_100000183195_100000210968 [0,1,0,0,0,0|3,0,0]=4 470 B10R0.108 CCC(=O)NNC(=O)COC 22a_100000216845_100000210414 [0,1,0,0,0,0|3,0,0]=4 471 B10R0.108 CCCC(=O)CCC(=O)NC 1458a_100011309844_100000210303 [0,1,0,0,0,0|2,0,0]=3 472 B10R0.108 CCCC(=O)CCC(=O)OC 1458a_100000187943_100000210303 [0,1,0,0,0,0|1,0,0]=2 473 B10R0.108 CCCC(=O)CCS(=O)CC 1458a_100011387550_100000210303 [0,1,0,0,0,0|3,0,0]=4 474 B10R0.108 CCCC(=O)CNC(=O)CC 1458a_100000194589_100000210303 [0,1,0,0,0,0|3,0,0]=4 475 B10R0.108 CCCC(=O)CNC(=O)OC 1458a_100000215747_100000210303 [0,1,0,0,0,0|2,0,0]=3 476 B10R0.108 CCCC(=O)NCC(=O)NC 11a_100000693194_100000211992 [0,1,0,0,0,0|3,0,0]=4 477 B10R0.108 CCCC(=O)NCC(=O)NC 240690a_100000693194_100000211992 [0,1,0,0,0,0|3,0,0]=4 478 B10R0.108 CCCC(=O)NCC(=O)NC 527a_100000693194_100000211992 [0,1,0,0,0,0|3,0,0]=4 479 B10R0.108 CCCC(=O)NCC(=O)OC 188690a_100000185156_100000211992 [0,1,0,0,0,0|2,0,0]=3 480 B10R0.108 CCCC(=O)OCC(=O)CC 1458a_100000210414_100000034017 [0,1,0,0,0,0|3,0,0]=4 481 B10R0.108 CCCN(C)CCC(=O)OC 2230a_100000747261_100000204255 [0,1,0,0,0,0|3,0,0]=4 482 B10R0.108 CCCN(C)CCC(=O)OC 269982a_100000747261_100000204255 [0,1,0,0,0,0|3,0,0]=4 483 B10R0.108 CCCN(C)CCC(=O)OC 269982a_100025711912_100000210303 [0,1,0,0,0,0|3,0,0]=4 484 B10R0.108 CCNC(=O)CCC(=O)CC 1458a_100000199579_100000210202 [0,1,0,0,0,0|2,0,0]=3 485 B10R0.108 CCNC(=O)CCC(=O)CF 1458a_100000199579_100015361967 [0,1,0,0,0,0|3,0,0]=4 486 B10R0.108 CCNC(=O)CCC(=O)NC 11a_100015525214_100011309844 [0,1,0,0,0,0|2,0,0]=3 487 B10R0.108 CCNC(=O)CCC(=O)NC 11a_106832991635_100000199579 [0,1,0,0,0,0|2,0,0]=3 488 B10R0.108 CCNC(=O)CCC(=O)NC 1626a_100102657272_100000199579 [0,1,0,0,0,0|2,0,0]=3 489 B10R0.108 CCNC(=O)CCC(=O)NC 240690a_100015525214_100011309844 [0,1,0,0,0,0|2,0,0]=3 490 B10R0.108 CCNC(=O)CCC(=O)NC 240690a_100102657272_100000199579 [0,1,0,0,0,0|2,0,0]=3 491 B10R0.108 CCNC(=O)CCC(=O)NC 527a_100015525214_100011309844 [0,1,0,0,0,0|2,0,0]=3 492 B10R0.108 CCNC(=O)CCC(=O)OC 11a_100015525214_100000187943 [0,1,0,0,0,0|1,0,0]=2 493 B10R0.108 CCNC(=O)CCC(=O)OC 240690a_100015525214_100000187943 [0,1,0,0,0,0|1,0,0]=2 494 B10R0.108 CCNC(=O)CCC(=O)OC 527a_100015525214_100000187943 [0,1,0,0,0,0|1,0,0]=2 495 B10R0.108 CCNC(=O)CCS(=O)CC 11a_100015525214_100011387550 [0,1,0,0,0,0|3,0,0]=4 496 B10R0.108 CCNC(=O)CCS(=O)CC 240690a_100015525214_100011387550 [0,1,0,0,0,0|3,0,0]=4 497 B10R0.108 CCNC(=O)CCS(=O)CC 527a_100015525214_100011387550 [0,1,0,0,0,0|3,0,0]=4 498 B10R0.108 CCNC(=O)CNC(=O)CC 11a_100015525214_100000194589 [0,1,0,0,0,0|3,0,0]=4 499 B10R0.108 CCNC(=O)CNC(=O)CC 11a_100016988866_100000210414 [0,1,0,0,0,0|3,0,0]=4 500 B10R0.108 CCNC(=O)CNC(=O)CC 1626a_100016988866_100000210414 [0,1,0,0,0,0|3,0,0]=4 501 B10R0.108 CCNC(=O)CNC(=O)CC 240690a_100015525214_100000194589 [0,1,0,0,0,0|3,0,0]=4 502 B10R0.108 CCNC(=O)CNC(=O)CC 240690a_100016988866_100000210414 [0,1,0,0,0,0|3,0,0]=4 503 B10R0.108 CCNC(=O)CNC(=O)CC 527a_100015525214_100000194589 [0,1,0,0,0,0|3,0,0]=4 504 B10R0.108 CCNC(=O)CNC(=O)CC 527a_100016988866_100000210414 [0,1,0,0,0,0|3,0,0]=4 505 B10R0.108 CCNC(=O)CNC(=O)NC 2708a_100016988866_106832991635 [0,1,0,0,0,0|3,0,0]=4 506 B10R0.108 CCNC(=O)CNC(=O)NC 2708a_100102657272_100016988866 [0,1,0,0,0,0|3,0,0]=4 507 B10R0.108 CCNC(=O)CNC(=O)NC 273464a_100016988866_100102657272 [0,1,0,0,0,0|3,0,0]=4 508 B10R0.108 CCNC(=O)CNC(=O)NC 273464a_100102657272_100016988866 [0,1,0,0,0,0|3,0,0]=4 509 B10R0.108 CCNC(=O)CNC(=O)NC 512a_100016988866_100102657272 [0,1,0,0,0,0|3,0,0]=4 510 B10R0.108 CCNC(=O)CNC(=O)NC 512a_106832991638_100016988866 [0,1,0,0,0,0|3,0,0]=4 511 B10R0.108 CCNC(=O)CNC(=O)OC 11a_100015525214_100000215747 [0,1,0,0,0,0|2,0,0]=3 512 B10R0.108 CCNC(=O)CNC(=O)OC 240690a_100015525214_100000215747 [0,1,0,0,0,0|2,0,0]=3 513 B10R0.108 CCNC(=O)CNC(=O)OC 527a_100015525214_100000215747 [0,1,0,0,0,0|2,0,0]=3 514 B10R0.108 CCNC(=O)NCC(=O)NC 2708a_100015525214_100000693194 [0,1,0,0,0,0|3,0,0]=4 515 B10R0.108 CCNC(=O)NCC(=O)NC 273464a_100000693194_100015525214 [0,1,0,0,0,0|3,0,0]=4 516 B10R0.108 CCNC(=O)NCC(=O)NC 273464a_100015525214_100000693194 [0,1,0,0,0,0|3,0,0]=4 517 B10R0.108 CCNC(=O)NCC(=O)NC 512a_100015525214_100000693194 [0,1,0,0,0,0|3,0,0]=4 518 B10R0.108 CCOC(=O)C=CC(=O)CC 1458a_100000210415_100000210202 [0,1,0,0,0,0|1,0,2]=4 519 B10R0.108 CCOC(=O)C=CC(=O)NC 1626a_100102657272_100000210415 [0,1,0,0,0,0|1,0,2]=4 520 B10R0.108 CCOC(=O)C=CC(=O)NC 240690a_100102657272_100000210415 [0,1,0,0,0,0|1,0,2]=4 521 B10R0.108 CCOC(=O)CCC(=O)CC 1458a_100000183558_100000210202 [0,1,0,0,0,0|1,0,0]=2 522 B10R0.108 CCOC(=O)CCC(=O)CF 1458a_100000183558_100015361967 [0,1,0,0,0,0|2,0,0]=3 523 B10R0.108 CCOC(=O)CCC(=O)NC 11a_106832991635_100000183558 [0,1,0,0,0,0|1,0,0]=2 524 B10R0.108 CCOC(=O)CCC(=O)NC 1626a_100102657272_100000183558 [0,1,0,0,0,0|1,0,0]=2 525 B10R0.108 CCOC(=O)CCC(=O)NC 240690a_100102657272_100000183558 [0,1,0,0,0,0|1,0,0]=2 526 B10R0.108 CCOC(=O)CCC(C)NC 2230a_106832991635_100000748298 [0,1,0,0,0,0|2,0,1]=4 527 B10R0.108 CCOC(=O)CCC(C)NC 34a_100102657272_100000748298 [0,1,0,0,0,0|2,0,1]=4 528 B10R0.108 CCOC(=O)CCC(C)NC 7a_106832991635_100000748298 [0,1,0,0,0,0|2,0,1]=4 529 B10R0.108 CCOC(=O)CCC(C)OC 34a_100138415774_100000748298 [0,1,0,0,0,0|1,0,1]=3 530 B10R0.108 CCOC(=O)CCC(C)SC 62a_100000748298_200000210301 [0,1,0,0,0,0|1,1,1]=4 531 B10R0.108 CCOC(=O)CCC(C)SC 62a_200000210301_100000748298 [0,1,0,0,0,0|1,1,1]=4 532 B10R0.108 CCOC(=O)CCC(C)S[13CH3] 62a_100000748298_200025704644 [0,1,0,0,0,0|1,1,1]=4 533 B10R0.108 CCOC(=O)CCC(C)S[13CH3] 62a_200025704644_100000748298 [0,1,0,0,0,0|1,1,1]=4 534 B10R0.108 CCOC(=O)CCN(C)CC 2230a_100000225621_100011206558 [0,1,0,0,0,0|3,0,0]=4 535 B10R0.108 CCOC(=O)CCN(C)CC 2230a_100000745921_100000210202 [0,1,0,0,0,0|3,0,0]=4 536 B10R0.108 CCOC(=O)CCN(C)CC 2230a_200011277716_200000210301 [0,1,0,0,0,0|3,0,0]=4 537 B10R0.108 CCOC(=O)CCN(C)CC 269982a_100000225621_100011206558 [0,1,0,0,0,0|3,0,0]=4 538 B10R0.108 CCOC(=O)CCN(C)CC 269982a_100000745921_100000204670 [0,1,0,0,0,0|3,0,0]=4 539 B10R0.108 CCOC(=O)CCN(C)CC 269982a_200011277716_200000210301 [0,1,0,0,0,0|3,0,0]=4 540 B10R0.108 CCOC(=O)CCN([13CH3])CC 2230a_200011277716_200025704644 [0,1,0,0,0,0|3,0,0]=4 541 B10R0.108 CCOC(=O)CCN([13CH3])CC 269982a_200011277716_200025704644 [0,1,0,0,0,0|3,0,0]=4 542 B10R0.108 CCOC(=O)CNC(=O)CC 188690a_100000741813_100000210414 [0,1,0,0,0,0|2,0,0]=3 543 B10R0.108 CCOC(=O)CNC(=O)CO 188690a_100000741813_100000210174 [0,1,0,0,0,0|3,0,0]=4 544 B10R0.108 CCOC(=O)CSC(C)OC 62a_100000188475_100009879195 [0,1,0,0,0,0|2,0,1]=4 545 B10R0.108 CCOC(=O)CSC(C)OC 62a_100009879195_100000188475 [0,1,0,0,0,0|2,0,1]=4 546 B10R0.108 CCOC(=O)NCC(=O)CC 1458a_100000190774_100000210202 [0,1,0,0,0,0|2,0,0]=3 547 B10R0.108 CCOC(=O)NCC(=O)CF 1458a_100000190774_100015361967 [0,1,0,0,0,0|3,0,0]=4 548 B10R0.108 CCOC(=O)NCC(=O)NC 11a_106832991635_100000190774 [0,1,0,0,0,0|2,0,0]=3 549 B10R0.108 CCOC(=O)NCC(=O)NC 1626a_100102657272_100000190774 [0,1,0,0,0,0|2,0,0]=3 550 B10R0.108 CCOC(=O)NCC(=O)NC 240690a_100102657272_100000190774 [0,1,0,0,0,0|2,0,0]=3 551 B10R0.108 CCOC(=O)NCC(=O)NC 527a_100102657272_100000190774 [0,1,0,0,0,0|2,0,0]=3 552 B10R0.108 CCS(=O)CCC(=O)CCF 1458a_100011387550_100011217306 [0,1,0,0,0,0|3,0,0]=4 553 B10R0.108 CCS(=O)CCC(=O)CCO 1458a_100011387550_100000211926 [0,1,0,0,0,0|3,0,0]=4 554 B10R0.108 CNC(=O)CCC(=O)CC#N 1458a_100011309844_100011214920 [0,1,0,0,0,0|2,0,1]=4 555 B10R0.108 CNC(=O)CCC(=O)CCF 1458a_100011309844_100011217306 [0,1,0,0,0,0|2,0,0]=3 556 B10R0.108 CNC(=O)CCC(=O)CCO 1458a_100011309844_100000211926 [0,1,0,0,0,0|2,0,0]=3 557 B10R0.108 CNC(=O)CCN(C)COC 2230a_100000750875_100000766300 [0,1,0,0,0,0|3,0,0]=4 558 B10R0.108 CNC(=O)CCN(C)COC 269982a_100000750875_100000766300 [0,1,0,0,0,0|3,0,0]=4 559 B10R0.108 CNC(=O)CNC(=O)CCO 240690a_100000693194_100011216618 [0,1,0,0,0,0|3,0,0]=4 560 B10R0.108 CNC(=O)CNC(=O)COC 11a_100000693194_100000210968 [0,1,0,0,0,0|2,0,0]=3 561 B10R0.108 CNC(=O)CNC(=O)COC 240690a_100000693194_100000210968 [0,1,0,0,0,0|2,0,0]=3 562 B10R0.108 CNC(=O)CNC(=O)COC 527a_100000693194_100000210968 [0,1,0,0,0,0|2,0,0]=3 563 B10R0.108 CNC(=O)CNC(=O)CSC 11a_100000693194_100000184570 [0,1,0,0,0,0|2,1,0]=4 564 B10R0.108 CNC(=O)CNC(=O)CSC 240690a_100000693194_100000184570 [0,1,0,0,0,0|2,1,0]=4 565 B10R0.108 CNC(=O)CNC(=O)CSC 527a_100000693194_100000184570 [0,1,0,0,0,0|2,1,0]=4 566 B10R0.108 CNC(=O)NNC(=O)COC 273464a_100102657272_100000216845 [0,1,0,0,0,0|3,0,0]=4 567 B10R0.108 CNCC(=O)CCC(=O)OC 2230a_106832991635_100000691467 [0,1,0,0,0,0|1,0,0]=2 568 B10R0.108 CNCC(=O)CCC(=O)OC 34a_100102657272_100000691467 [0,1,0,0,0,0|1,0,0]=2 569 B10R0.108 CNCC(=O)CCC(=O)OC 7a_106832991635_100000691467 [0,1,0,0,0,0|1,0,0]=2 570 B10R0.108 CNCC(=O)NCC(=O)OC 2230a_106832991635_100000182966 [0,1,0,0,0,0|2,0,0]=3 571 B10R0.108 CNCC(=O)NCC(=O)OC 34a_100102657272_100000182966 [0,1,0,0,0,0|2,0,0]=3 572 B10R0.108 CNCC(=O)NCC(=O)OC 7a_106832991635_100000182966 [0,1,0,0,0,0|2,0,0]=3 573 B10R0.108 CNNC(=O)C=CC(=O)OC 22a_100016993582_100016283253 [0,1,0,0,0,0|1,0,2]=4 574 B10R0.108 CNNC(=O)CCC(=O)NC 22a_100016993582_100011309844 [0,1,0,0,0,0|2,0,0]=3 575 B10R0.108 CNNC(=O)CNC(=O)OC 22a_100016993582_100000215747 [0,1,0,0,0,0|2,0,0]=3 576 B10R0.108 CNNC(=O)NCC(=O)NC 273464a_100000693194_100016993582 [0,1,0,0,0,0|3,0,0]=4 577 B10R0.108 CNNC(=O)NCC(=O)NC 512a_100016993582_100000693194 [0,1,0,0,0,0|3,0,0]=4 578 B10R0.108 COC(=O)CCC(=O)CC#N 1458a_100000187943_100011214920 [0,1,0,0,0,0|1,0,1]=3 579 B10R0.108 COC(=O)CCC(=O)CCF 1458a_100000187943_100011217306 [0,1,0,0,0,0|1,0,0]=2 580 B10R0.108 COC(=O)CCC(=O)CCO 1458a_100000187943_100000211926 [0,1,0,0,0,0|1,0,0]=2 581 B10R0.108 COC(=O)CCC(=O)CSC 62a_100000691467_200000210301 [0,1,0,0,0,0|0,1,0]=2 582 B10R0.108 COC(=O)CCC(=O)CSC 62a_200000210301_100000691467 [0,1,0,0,0,0|0,1,0]=2 583 B10R0.108 COC(=O)CCC(=O)CS[13CH3] 62a_100000691467_200025704644 [0,1,0,0,0,0|0,1,0]=2 584 B10R0.108 COC(=O)CCC(=O)CS[13CH3] 62a_200025704644_100000691467 [0,1,0,0,0,0|0,1,0]=2 585 B10R0.108 COC(=O)CCN(C)CCF 269982a_100025711912_100011217306 [0,1,0,0,0,0|3,0,0]=4 586 B10R0.108 COC(=O)CCN(C)CCO 2230a_100000210263_100000204255 [0,1,0,0,0,0|3,0,0]=4 587 B10R0.108 COC(=O)CCN(C)CCO 269982a_100000210263_100000204255 [0,1,0,0,0,0|3,0,0]=4 588 B10R0.108 COC(=O)CCN(C)CCO 269982a_100025711912_100000211926 [0,1,0,0,0,0|3,0,0]=4 589 B10R0.108 COC(=O)CCN(C)CSC 269982a_100025711912_100011218213 [0,1,0,0,0,0|2,1,0]=4 590 B10R0.108 COC(=O)CNC(=O)CSC 188690a_100000185156_100000184570 [0,1,0,0,0,0|1,1,0]=3 591 B10R0.108 COC(=O)CNC(=O)CSC 62a_100000182966_200000210301 [0,1,0,0,0,0|1,1,0]=3 592 B10R0.108 COC(=O)CNC(=O)CSC 62a_200000210301_100000182966 [0,1,0,0,0,0|1,1,0]=3 593 B10R0.108 COC(=O)CNC(=O)CS[13CH3] 62a_100000182966_200025704644 [0,1,0,0,0,0|1,1,0]=3 594 B10R0.108 COC(=O)CNC(=O)CS[13CH3] 62a_200025704644_100000182966 [0,1,0,0,0,0|1,1,0]=3 595 B10R0.108 COC(=O)NCC(=O)CC#N 1458a_100000215747_100011214920 [0,1,0,0,0,0|2,0,1]=4 596 B10R0.108 COC(=O)NCC(=O)CCF 1458a_100000215747_100011217306 [0,1,0,0,0,0|2,0,0]=3 597 B10R0.108 COC(=O)NCC(=O)CCO 1458a_100000215747_100000211926 [0,1,0,0,0,0|2,0,0]=3 598 B10R0.108 COCC(=O)CCC(=O)OC 34a_100138415774_100000691467 [0,1,0,0,0,0|0,0,0]=1 599 B10R0.108 COCC(=O)NCC(=O)OC 188690a_100000185156_100000210968 [0,1,0,0,0,0|1,0,0]=2 600 B10R0.108 COCC(=O)NCC(=O)OC 34a_100138415774_100000182966 [0,1,0,0,0,0|1,0,0]=2 601 B10R0.108 COCC(=O)NC[C@@H](C)OC 11a_100020591295_100000210968 [0,1,0,0,0,0|2,0,1]=4 602 B10R0.108 COCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000210968 [0,1,0,0,0,0|2,0,1]=4 603 B10R0.108 COCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000210968 [0,1,0,0,0,0|2,0,1]=4 604 B10R0.108 COCC(=O)NC[C@@H](C)OC 527a_100020591295_100000210968 [0,1,0,0,0,0|2,0,1]=4 605 B10R0.108 COCC(C)SCC(=O)OC 62a_100000747449_100000765312 [0,1,0,0,0,0|2,0,1]=4 606 B10R0.108 COCC(C)SCC(=O)OC 62a_100000765312_100000747449 [0,1,0,0,0,0|2,0,1]=4 607 B10R0.108 COCN(C)CCC(=O)OC 269982a_100025711912_100000766300 [0,1,0,0,0,0|2,0,0]=3 608 B10R0.108 COC[C@@H](C)NCC(=O)OC 2230a_100000764878_100000747449 [0,1,0,0,0,0|2,0,1]=4 609 B10R0.108 COC[C@@H](C)OCC(=O)OC 34a_100011934205_100000747449 [0,1,0,0,0,0|2,0,1]=4 610 B10R0.115 CCC(=O)CCS(=O)(=O)CC 1458a_100000210414_100000756660 [0,1,0,0,0,0|3,0,0]=4 611 B10R0.115 CNS(=O)(=O)CCC(=O)OC 270084a_100102657272_100000205946 [0,1,0,0,0,0|2,0,0]=3 612 B10R0.115 CNS(=O)(=O)CCC(=O)OC 274078a_100102657272_100000205946 [0,1,0,0,0,0|2,0,0]=3 613 B10R1.14 CCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210202 [0,0,0,1,0,0|3,0,0]=4 614 B10R1.14 CCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210202 [0,0,0,1,0,0|2,0,0]=3 615 B10R1.14 CCC(=O)C1CNC(=O)N1 1458a_100000033324_100000210202 [0,0,0,1,0,0|3,0,0]=4 616 B10R1.14 CCC(=O)N1CNC(=O)C1 11a_200000708111_100000210414 [0,0,0,1,0,0|3,0,0]=4 617 B10R1.14 CCC(=O)N1CNC(=O)C1 1626a_200000708111_100000210414 [0,0,0,1,0,0|3,0,0]=4 618 B10R1.14 CCC(=O)N1CNC(=O)C1 240690a_200000708111_100000210414 [0,0,0,1,0,0|3,0,0]=4 619 B10R1.14 CCC(=O)N1CNC(=O)C1 527a_200000708111_100000210414 [0,0,0,1,0,0|3,0,0]=4 620 B10R1.14 CCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210202 [0,0,0,1,0,0|3,0,0]=4 621 B10R1.14 CCC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_100000210202 [0,0,0,1,0,0|2,1,0]=4 622 B10R1.14 CNC(=O)C1CCC(=O)N1 240690a_100102657272_100000210400 [0,0,0,1,0,0|3,0,0]=4 623 B10R1.14 CNC(=O)C1CNC(=O)C1 11a_106832991635_100000747279 [0,0,0,1,0,0|2,0,0]=3 624 B10R1.14 CNC(=O)C1CNC(=O)C1 1626a_100102657272_100000747279 [0,0,0,1,0,0|2,0,0]=3 625 B10R1.14 CNC(=O)C1CNC(=O)C1 240690a_100102657272_100000747279 [0,0,0,1,0,0|2,0,0]=3 626 B10R1.14 CNC(=O)C1CNC(=O)C1 527a_100102657272_100000747279 [0,0,0,1,0,0|2,0,0]=3 627 B10R1.14 CNC(=O)C1CNC(=O)N1 11a_106832991635_100000033324 [0,0,0,1,0,0|3,0,0]=4 628 B10R1.14 CNC(=O)C1CNC(=O)N1 240690a_100102657272_100000033324 [0,0,0,1,0,0|3,0,0]=4 629 B10R1.14 CNC(=O)N1CNC(=O)C1 2708a_100102657272_200000708111 [0,0,0,1,0,0|3,0,0]=4 630 B10R1.14 CNC(=O)N1CNC(=O)C1 273464a_100102657272_200000708111 [0,0,0,1,0,0|3,0,0]=4 631 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 11a_106832991635_100009814974 [0,0,0,1,0,0|3,0,0]=4 632 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 1626a_100102657272_100009814974 [0,0,0,1,0,0|3,0,0]=4 633 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 240690a_100102657272_100009814974 [0,0,0,1,0,0|3,0,0]=4 634 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 527a_100102657272_100009814974 [0,0,0,1,0,0|3,0,0]=4 635 B10R1.14 CNC(=O)[C@@H]1CSC(=O)N1 240690a_100102657272_100000735014 [0,0,0,1,0,0|2,1,0]=4 636 B10R1.14 COC(=O)[C@@H]1CCN(C1)C 2230a_100016989057_200000210301 [0,0,0,1,0,0|3,0,0]=4 637 B10R1.14 COC(=O)[C@@H]1CCN(C1)C 269982a_100016989057_200000210301 [0,0,0,1,0,0|3,0,0]=4 638 B10R1.14 COC(=O)[C@@H]1CCN(C1)[13CH3] 2230a_100016989057_200025704644 [0,0,0,1,0,0|3,0,0]=4 639 B10R1.14 COC(=O)[C@@H]1CCN(C1)[13CH3] 269982a_100016989057_200025704644 [0,0,0,1,0,0|3,0,0]=4 640 B10R1.14 O=C1CC(CN1)C(=O)CF 1458a_100000747279_100015361967 [0,0,0,1,0,0|3,0,0]=4 641 B10R1.151 COC(=O)CCN1CCC1 269982a_100000754969_100000204255 [0,0,0,1,0,0|3,0,0]=4 642 B10R1.169 CCC(=O)C1CC(C1)OC 1458a_100011999411_100000210202 [0,0,0,1,0,0|2,0,1]=4 643 B10R1.169 CCN1CC(C1)C(=O)OC 269982a_100015188540_100000204670 [0,0,0,1,0,0|3,0,0]=4 644 B10R1.169 CNC(=O)C1CC(C1)OC 11a_106832991635_100011999411 [0,0,0,1,0,0|2,0,1]=4 645 B10R1.169 CNC(=O)C1CC(C1)OC 1626a_100102657272_100011999411 [0,0,0,1,0,0|2,0,1]=4 646 B10R1.169 CNC(=O)C1CC(C1)OC 240690a_100102657272_100011999411 [0,0,0,1,0,0|2,0,1]=4 647 B10R1.169 CNC(=O)C1CC(C1)OC 527a_100102657272_100011999411 [0,0,0,1,0,0|2,0,1]=4 648 B10R1.169 CNC1CC(C1)C(=O)OC 34a_100102657272_100009897219 [0,0,0,1,0,0|2,0,1]=4 649 B10R1.169 CNC1CC(C1)C(=O)OC 7a_106832991635_100009897219 [0,0,0,1,0,0|2,0,1]=4 650 B10R1.169 COC(=O)C1CC(C1)OC 34a_100138415774_100009897219 [0,0,0,1,0,0|1,0,1]=3 651 B10R1.169 COC(=O)C1CC(C1)OC 7a_100000076263_200000210301 [0,0,0,1,0,0|1,0,1]=3 652 B10R1.169 COC(=O)C1CC(C1)O[13CH3] 7a_100000076263_200025704644 [0,0,0,1,0,0|1,0,1]=3 653 B10R1.169 COC(=O)C1CC(C1)SC 62a_100009897219_200000210301 [0,0,0,1,0,0|1,1,1]=4 654 B10R1.169 COC(=O)C1CC(C1)SC 62a_200000210301_100009897219 [0,0,0,1,0,0|1,1,1]=4 655 B10R1.169 COC(=O)C1CC(C1)S[13CH3] 62a_100009897219_200025704644 [0,0,0,1,0,0|1,1,1]=4 656 B10R1.169 COC(=O)C1CC(C1)S[13CH3] 62a_200025704644_100009897219 [0,0,0,1,0,0|1,1,1]=4 657 B10R1.473 CC1(CCC(=O)CC1)O[13CH3] 34a_100012184276_200025704644 [0,0,0,1,0,0|2,0,1]=4 658 B10R1.473 CC1(CCC(=O)CC1)O[13CH3] 7a_100012184276_200025704644 [0,0,0,1,0,0|2,0,1]=4 659 B10R1.473 COC1(CCC(=O)CC1)C 34a_100012184276_200000210301 [0,0,0,1,0,0|2,0,1]=4 660 B10R1.473 COC1(CCC(=O)CC1)C 7a_100012184276_200000210301 [0,0,0,1,0,0|2,0,1]=4 661 B8R0.19 C#CC(=O)CC(=O)CC 1458a_100000211873_100000747405 [0,0,0,0,1,0|2,0,1]=4 662 B8R0.19 C#CC(=O)CC(=O)NC 1458a_100000211873_100000183359 [0,0,0,0,1,0|2,0,1]=4 663 B8R0.19 C#CC(=O)CC(=O)OC 1458a_100000211873_100000747449 [0,0,0,0,1,0|1,0,1]=3 664 B8R0.19 C=CC(=O)CC(=O)CC 1458a_100000185746_100000747405 [0,0,0,0,1,0|2,0,1]=4 665 B8R0.19 C=CC(=O)CC(=O)NC 1458a_100000185746_100000183359 [0,0,0,0,1,0|2,0,1]=4 666 B8R0.19 C=CC(=O)CC(=O)OC 1458a_100000185746_100000747449 [0,0,0,0,1,0|1,0,1]=3 667 B8R0.19 CCC(=O)CC(=O)CC 1458a_100000210414_100000747405 [0,0,0,0,1,0|2,0,0]=3 668 B8R0.19 CCC(=O)CC(=O)CO 1458a_100000210174_100000747405 [0,0,0,0,1,0|3,0,0]=4 669 B8R0.19 CCC(=O)CC(=O)NC 1458a_100000210414_100000183359 [0,0,0,0,1,0|2,0,0]=3 670 B8R0.19 CCC(=O)CC(=O)OC 1458a_100000210414_100000747449 [0,0,0,0,1,0|1,0,0]=2 671 B8R0.19 CCC(=O)CC(=O)OC 1458a_100000211351_100000210202 [0,0,0,0,1,0|1,0,0]=2 672 B8R0.19 CCN(C)CC(=O)OC 2230a_100000198492_100000210202 [0,0,0,0,1,0|3,0,0]=4 673 B8R0.19 CCN(C)CC(=O)OC 2230a_100000225621_100000747449 [0,0,0,0,1,0|3,0,0]=4 674 B8R0.19 CCN(C)CC(=O)OC 269982a_100000225621_100000747449 [0,0,0,0,1,0|3,0,0]=4 675 B8R0.19 CNC(=O)CC(=O)CO 1458a_100000210174_100000183359 [0,0,0,0,1,0|3,0,0]=4 676 B8R0.19 CNC(=O)CC(=O)OC 240690a_100102657272_100000211351 [0,0,0,0,1,0|1,0,0]=2 677 B8R0.19 CNC(C)CC(=O)OC 2230a_106832991635_100009817358 [0,0,0,0,1,0|2,0,1]=4 678 B8R0.19 CNC(C)CC(=O)OC 34a_100102657272_100009817358 [0,0,0,0,1,0|2,0,1]=4 679 B8R0.19 CNC(C)CC(=O)OC 7a_106832991635_100009817358 [0,0,0,0,1,0|2,0,1]=4 680 B8R0.19 COC(=O)CC(=O)CF 1458a_100000211351_100015361967 [0,0,0,0,1,0|2,0,0]=3 681 B8R0.19 COC(=O)CC(=O)CO 1458a_100000210174_100000747449 [0,0,0,0,1,0|2,0,0]=3 682 B8R0.19 COC(=O)CC(C)OC 34a_100138415774_100009817358 [0,0,0,0,1,0|1,0,1]=3 683 B8R0.19 COC(=O)CC(C)SC 62a_100009817358_200000210301 [0,0,0,0,1,0|1,1,1]=4 684 B8R0.19 COC(=O)CC(C)SC 62a_200000210301_100009817358 [0,0,0,0,1,0|1,1,1]=4 685 B8R0.19 COC(=O)CC(C)S[13CH3] 62a_100009817358_200025704644 [0,0,0,0,1,0|1,1,1]=4 686 B8R0.19 COC(=O)CC(C)S[13CH3] 62a_200025704644_100009817358 [0,0,0,0,1,0|1,1,1]=4 687 B10R0.59 C#CC(=O)CCCC(=O)NC 1458a_100000211873_100000741757 [0,0,0,0,0,1|2,0,1]=4 688 B10R0.59 C#CC(=O)CCCC(=O)OC 1458a_100000211873_100011218270 [0,0,0,0,0,1|1,0,1]=3 689 B10R0.59 C#CC(=O)CCOC(=O)NC 1458a_100000211873_200011997002 [0,0,0,0,0,1|2,0,1]=4 690 B10R0.59 C=C(C#N)CSCC(=O)OC 62a_100000747449_100000694840 [0,0,0,0,0,1|3,0,0]=4 691 B10R0.59 C=CC(=O)CCCC(=O)NC 1458a_100000185746_100000741757 [0,0,0,0,0,1|2,0,1]=4 692 B10R0.59 C=CC(=O)CCCC(=O)OC 1458a_100000185746_100011218270 [0,0,0,0,0,1|1,0,1]=3 693 B10R0.59 C=CC(=O)CCOC(=O)NC 1458a_100000185746_200011997002 [0,0,0,0,0,1|2,0,1]=4 694 B10R0.59 C=CC(=O)NCCC(=O)NC 240690a_100000738227_200121576911 [0,0,0,0,0,1|2,0,1]=4 695 B10R0.59 C=CC(=O)OCCC(=O)CC 1458a_100000065099_100000210202 [0,0,0,0,0,1|2,0,1]=4 696 B10R0.59 C=CC(=O)OCCC(=O)CC 1458a_100000210414_100009813456 [0,0,0,0,0,1|2,0,1]=4 697 B10R0.59 C=CC(=O)OCCC(=O)NC 240690a_100102657272_100000065099 [0,0,0,0,0,1|2,0,1]=4 698 B10R0.59 CCC(=O)CCCC(=O)NC 1458a_100000210414_100000741757 [0,0,0,0,0,1|2,0,0]=3 699 B10R0.59 CCC(=O)CCCC(=O)OC 1458a_100000210414_100011218270 [0,0,0,0,0,1|1,0,0]=2 700 B10R0.59 CCC(=O)CCCC(=O)OC 1458a_100000239890_100000210202 [0,0,0,0,0,1|1,0,0]=2 701 B10R0.59 CCC(=O)CCOC(=O)NC 1458a_100000210414_200011997002 [0,0,0,0,0,1|2,0,0]=3 702 B10R0.59 CCC(=O)COCC(=O)NC 34a_100000725409_100000183359 [0,0,0,0,0,1|2,0,0]=3 703 B10R0.59 CCC(=O)COCC(=O)OC 34a_100000725409_100000747449 [0,0,0,0,0,1|1,0,0]=2 704 B10R0.59 CCC(=O)CSCC(=O)CC 62a_100000747405_100000747405 [0,0,0,0,0,1|2,0,0]=3 705 B10R0.59 CCC(=O)CSCC(=O)NC 62a_100000183359_100000747405 [0,0,0,0,0,1|2,0,0]=3 706 B10R0.59 CCC(=O)CSCC(=O)NC 62a_100000747405_100000183359 [0,0,0,0,0,1|2,0,0]=3 707 B10R0.59 CCC(=O)CSCC(=O)OC 1458a_100000191316_100000210202 [0,0,0,0,0,1|1,0,0]=2 708 B10R0.59 CCC(=O)CSCC(=O)OC 62a_100000747405_100000747449 [0,0,0,0,0,1|1,0,0]=2 709 B10R0.59 CCC(=O)CSCC(=O)OC 62a_100000747449_100000747405 [0,0,0,0,0,1|1,0,0]=2 710 B10R0.59 CCC(=O)NCCC(=O)NC 11a_100000738227_100000210414 [0,0,0,0,0,1|2,0,0]=3 711 B10R0.59 CCC(=O)NCCC(=O)NC 240690a_100000738227_100000210414 [0,0,0,0,0,1|2,0,0]=3 712 B10R0.59 CCC(=O)NCCC(=O)NC 527a_100000738227_100000210414 [0,0,0,0,0,1|2,0,0]=3 713 B10R0.59 CCC(=O)NCCC(=O)OC 188690a_100000683876_100000210414 [0,0,0,0,0,1|1,0,0]=2 714 B10R0.59 CCC(=O)NN=CC(=O)OC 4a_100000183195_200011823558 [0,0,0,0,0,1|2,0,1]=4 715 B10R0.59 CCC(C)CNCC(=O)OC 2230a_100020588543_100000747449 [0,0,0,0,0,1|2,0,1]=4 716 B10R0.59 CCC(C)CSCC(=O)OC 62a_100000747449_100000748023 [0,0,0,0,0,1|2,0,1]=4 717 B10R0.59 CCC(C)CSCC(=O)OC 62a_100000748023_100000747449 [0,0,0,0,0,1|2,0,1]=4 718 B10R0.59 CCC(C)NCCC(=O)OC 2230a_100000209981_100000204255 [0,0,0,0,0,1|2,0,1]=4 719 B10R0.59 CCC(C)OCCC(=O)OC 7a_100000210228_100000204255 [0,0,0,0,0,1|2,0,1]=4 720 B10R0.59 CCC(C)SCCC(=O)OC 62a_100000204255_100000758301 [0,0,0,0,0,1|2,0,1]=4 721 B10R0.59 CCC(C)SCCC(=O)OC 62a_100000758301_100000204255 [0,0,0,0,0,1|2,0,1]=4 722 B10R0.59 CCC(O)CNCC(=O)OC 2230a_100011218483_100000747449 [0,0,0,0,0,1|1,0,2]=4 723 B10R0.59 CCC(O)CSCC(=O)OC 62a_100000747449_100011218378 [0,0,0,0,0,1|1,0,2]=4 724 B10R0.59 CCC(O)CSCC(=O)OC 62a_100011218378_100000747449 [0,0,0,0,0,1|1,0,2]=4 725 B10R0.59 CCN(C)CCCC(=O)OC 2230a_100000225621_100011218270 [0,0,0,0,0,1|3,0,0]=4 726 B10R0.59 CCN(C)CCCC(=O)OC 269982a_100000225621_100011218270 [0,0,0,0,0,1|3,0,0]=4 727 B10R0.59 CCN(C)CCCC(=O)OC 269982a_100000739225_100000204670 [0,0,0,0,0,1|3,0,0]=4 728 B10R0.59 CC[C@H](C)COCC(=O)OC 7a_100009816381_100000747449 [0,0,0,0,0,1|2,0,1]=4 729 B10R0.59 CC[C@H](C)CSCC(=O)OC 62a_100000747449_100009816398 [0,0,0,0,0,1|2,0,1]=4 730 B10R0.59 CC[C@H](C)CSCC(=O)OC 62a_100009816398_100000747449 [0,0,0,0,0,1|2,0,1]=4 731 B10R0.59 CNC(=O)CCCC(=O)CO 1458a_100000210174_100000741757 [0,0,0,0,0,1|3,0,0]=4 732 B10R0.59 CNC(=O)CCCC(=O)OC 11a_106832991635_100000239890 [0,0,0,0,0,1|1,0,0]=2 733 B10R0.59 CNC(=O)CCCC(=O)OC 1626a_100102657272_100000239890 [0,0,0,0,0,1|1,0,0]=2 734 B10R0.59 CNC(=O)CCCC(=O)OC 240690a_100102657272_100000239890 [0,0,0,0,0,1|1,0,0]=2 735 B10R0.59 CNC(=O)CCCC(=O)OC 527a_100102657272_100000239890 [0,0,0,0,0,1|1,0,0]=2 736 B10R0.59 CNC(=O)CCNC(=O)CO 240690a_100000738227_100000210174 [0,0,0,0,0,1|3,0,0]=4 737 B10R0.59 CNC(=O)CCNC(=O)CO 527a_100000738227_100000210174 [0,0,0,0,0,1|3,0,0]=4 738 B10R0.59 CNC(=O)CCNC(=O)NC 2708a_100102657272_100000738227 [0,0,0,0,0,1|2,0,0]=3 739 B10R0.59 CNC(=O)CCNC(=O)NC 273464a_100000738227_100102657272 [0,0,0,0,0,1|2,0,0]=3 740 B10R0.59 CNC(=O)CCNC(=O)NC 273464a_100102657272_100000738227 [0,0,0,0,0,1|2,0,0]=3 741 B10R0.59 CNC(=O)CCNC(=O)NC 512a_100000738227_100102657272 [0,0,0,0,0,1|2,0,0]=3 742 B10R0.59 CNC(=O)CCNC(=O)NC 512a_106832991638_100000738227 [0,0,0,0,0,1|2,0,0]=3 743 B10R0.59 CNC(=O)CCSC(C)OC 62a_100000737683_100009879195 [0,0,0,0,0,1|2,0,1]=4 744 B10R0.59 CNC(=O)CCSC(C)OC 62a_100009879195_100000737683 [0,0,0,0,0,1|2,0,1]=4 745 B10R0.59 CNC(=O)CNCC(=O)NC 2230a_100000693194_100000183359 [0,0,0,0,0,1|2,0,0]=3 746 B10R0.59 CNC(=O)CNCC(=O)OC 2230a_100000693194_100000747449 [0,0,0,0,0,1|1,0,0]=2 747 B10R0.59 CNC(=O)CNC[C@@H](C)OC 2230a_100020591295_100000183359 [0,0,0,0,0,1|2,0,1]=4 748 B10R0.59 CNC(=O)COCC(=O)NC 34a_100000750040_100000183359 [0,0,0,0,0,1|2,0,0]=3 749 B10R0.59 CNC(=O)COCC(=O)OC 34a_100000750040_100000747449 [0,0,0,0,0,1|1,0,0]=2 750 B10R0.59 CNC(=O)COCC(C)OC 34a_100000690652_100000183359 [0,0,0,0,0,1|2,0,1]=4 751 B10R0.59 CNC(=O)CSCC(=O)NC 62a_100000183359_100000183359 [0,0,0,0,0,1|2,0,0]=3 752 B10R0.59 CNC(=O)CSCC(=O)OC 11a_106832991635_100000191316 [0,0,0,0,0,1|1,0,0]=2 753 B10R0.59 CNC(=O)CSCC(=O)OC 1626a_100102657272_100000191316 [0,0,0,0,0,1|1,0,0]=2 754 B10R0.59 CNC(=O)CSCC(=O)OC 240690a_100102657272_100000191316 [0,0,0,0,0,1|1,0,0]=2 755 B10R0.59 CNC(=O)CSCC(=O)OC 62a_100000183359_100000747449 [0,0,0,0,0,1|1,0,0]=2 756 B10R0.59 CNC(=O)CSCC(=O)OC 62a_100000747449_100000183359 [0,0,0,0,0,1|1,0,0]=2 757 B10R0.59 CNC(=O)OCCC(=O)CO 1458a_100000210174_200011997002 [0,0,0,0,0,1|3,0,0]=4 758 B10R0.59 COC(=O)CCCC(=O)CF 1458a_100000239890_100015361967 [0,0,0,0,0,1|2,0,0]=3 759 B10R0.59 COC(=O)CCCC(=O)CO 1458a_100000210174_100011218270 [0,0,0,0,0,1|2,0,0]=3 760 B10R0.59 COC(=O)CCNC(=O)CO 188690a_100000683876_100000210174 [0,0,0,0,0,1|2,0,0]=3 761 B10R0.59 COC(=O)CCSC(C)OC 62a_100000204255_100009879195 [0,0,0,0,0,1|1,0,1]=3 762 B10R0.59 COC(=O)CCSC(C)OC 62a_100009879195_100000204255 [0,0,0,0,0,1|1,0,1]=3 763 B10R0.59 COC(=O)CNC[C@@H](C)OC 2230a_100020591295_100000747449 [0,0,0,0,0,1|1,0,1]=3 764 B10R0.59 COC(=O)COCC(C)OC 34a_100000690652_100000747449 [0,0,0,0,0,1|1,0,1]=3 765 B10R0.59 COC(=O)CSCC(=O)CF 1458a_100000191316_100015361967 [0,0,0,0,0,1|2,0,0]=3 766 B10R0.59 COC(=O)CSCC(=O)OC 62a_100000747449_100000747449 [0,0,0,0,0,1|0,0,0]=1 767 B10R0.59 COC(=O)OCSC(C)OC 62a_100009879195_100000139417 [0,0,0,0,0,1|2,0,1]=4 768 B7R0.1 CC=CCCCOC 34a_100020645299_200000210301 [2,0,0,0,0,0|1,0,1]=4 769 B7R0.1 CC=CCCCO[13CH3] 34a_100020645299_200025704644 [2,0,0,0,0,0|1,0,1]=4 770 B7R0.1 COCCCCOC 34a_100000740925_200000210301 [2,0,0,0,0,0|0,0,2]=4 771 B7R0.1 COCCCCOC 34a_100138415774_100000755781 [2,0,0,0,0,0|0,0,2]=4 772 B7R0.1 COCCCCO[13CH3] 34a_100000740925_200025704644 [2,0,0,0,0,0|0,0,2]=4 773 B7R0.3 C#CC(=O)CCOC 1458a_100000211873_100000233755 [2,0,0,0,0,0|1,0,1]=4 774 B7R0.3 C/C=C/CC(=O)CC 1458a_100000210414_100102629194 [2,0,0,0,0,0|1,0,1]=4 775 B7R0.3 C=CC(=O)CCOC 1458a_100000185746_100000233755 [2,0,0,0,0,0|1,0,1]=4 776 B7R0.3 C=CCCC(=O)CC 1458a_100000210414_100000754431 [2,0,0,0,0,0|1,0,1]=4 777 B7R0.3 C=CCCC(=O)CC 1458a_100000749702_100000210202 [2,0,0,0,0,0|1,0,1]=4 778 B7R0.3 C=CCCC(=O)NC 11a_106832991635_100000749702 [2,0,0,0,0,0|1,0,1]=4 779 B7R0.3 C=CCCC(=O)NC 1626a_100102657272_100000749702 [2,0,0,0,0,0|1,0,1]=4 780 B7R0.3 C=CCCC(=O)NC 240690a_100102657272_100000749702 [2,0,0,0,0,0|1,0,1]=4 781 B7R0.3 C=CCCC(=O)NC 527a_100102657272_100000749702 [2,0,0,0,0,0|1,0,1]=4 782 B7R0.3 CC=CCC(=O)CC 1458a_100000210414_100000070051 [2,0,0,0,0,0|1,0,1]=4 783 B7R0.3 CC=CCC(=O)CC 1458a_100121576822_100000210202 [2,0,0,0,0,0|1,0,1]=4 784 B7R0.3 CC=CCC(=O)NC 11a_106832991635_100121576822 [2,0,0,0,0,0|1,0,1]=4 785 B7R0.3 CC=CCC(=O)NC 1626a_100102657272_100121576822 [2,0,0,0,0,0|1,0,1]=4 786 B7R0.3 CC=CCC(=O)NC 240690a_100102657272_100121576822 [2,0,0,0,0,0|1,0,1]=4 787 B7R0.3 CC=CCC(=O)NC 527a_100102657272_100121576822 [2,0,0,0,0,0|1,0,1]=4 788 B7R0.3 CCC(=O)C=COC 1458a_100016268678_100000210202 [2,0,0,0,0,0|1,0,1]=4 789 B7R0.3 CCC(=O)CCCO 1458a_100000210414_100011215043 [2,0,0,0,0,0|1,0,1]=4 790 B7R0.3 CCC(=O)CCOC 1458a_100000210414_100000233755 [2,0,0,0,0,0|1,0,0]=3 791 B7R0.3 CCC(=O)CCOC 1458a_100000749529_100000210202 [2,0,0,0,0,0|1,0,0]=3 792 B7R0.3 CCC(=O)CCSC 1458a_100000174002_100000210202 [2,0,0,0,0,0|1,1,0]=4 793 B7R0.3 CCC(=O)CCSC 1458a_100000210414_100000751147 [2,0,0,0,0,0|1,1,0]=4 794 B7R0.3 CCCCC(=O)CC 1458a_100000210183_100000210202 [2,0,0,0,0,0|1,0,1]=4 795 B7R0.3 CCCCC(=O)CC 1458a_100000210414_100000210211 [2,0,0,0,0,0|1,0,1]=4 796 B7R0.3 CCCCC(=O)NC 11a_106832991635_100000210183 [2,0,0,0,0,0|1,0,1]=4 797 B7R0.3 CCCCC(=O)NC 1626a_100102657272_100000210183 [2,0,0,0,0,0|1,0,1]=4 798 B7R0.3 CCCCC(=O)NC 240690a_100102657272_100000210183 [2,0,0,0,0,0|1,0,1]=4 799 B7R0.3 CCCCC(=O)NC 527a_100102657272_100000210183 [2,0,0,0,0,0|1,0,1]=4 800 B7R0.3 CCNCC(=O)OC 2230a_100015525214_100000747449 [2,0,0,0,0,0|1,0,1]=4 801 B7R0.3 CCOCC(=O)OC 34a_100121572206_100000747449 [2,0,0,0,0,0|1,0,1]=4 802 B7R0.3 CCSCC(=O)OC 62a_100000210202_100000747449 [2,0,0,0,0,0|1,0,1]=4 803 B7R0.3 CCSCC(=O)OC 62a_100000747449_100000210202 [2,0,0,0,0,0|1,0,1]=4 804 B7R0.3 CNC(=O)C=COC 1626a_100102657272_100016268678 [2,0,0,0,0,0|1,0,1]=4 805 B7R0.3 CNC(=O)C=COC 240690a_100102657272_100016268678 [2,0,0,0,0,0|1,0,1]=4 806 B7R0.3 CNC(=O)CCN[13CH3] 2230a_100000738227_200025704644 [2,0,0,0,0,0|2,0,0]=4 807 B7R0.3 CNC(=O)CCN[13CH3] 34a_100000738227_200025704644 [2,0,0,0,0,0|2,0,0]=4 808 B7R0.3 CNC(=O)CCOC 11a_106832991635_100000749529 [2,0,0,0,0,0|1,0,0]=3 809 B7R0.3 CNC(=O)CCOC 1626a_100102657272_100000749529 [2,0,0,0,0,0|1,0,0]=3 810 B7R0.3 CNC(=O)CCOC 240690a_100102657272_100000749529 [2,0,0,0,0,0|1,0,0]=3 811 B7R0.3 CNC(=O)CCOC 34a_100000754576_200000210301 [2,0,0,0,0,0|1,0,0]=3 812 B7R0.3 CNC(=O)CCOC 34a_100138415774_100012179268 [2,0,0,0,0,0|1,0,0]=3 813 B7R0.3 CNC(=O)CCOC 527a_100102657272_100000749529 [2,0,0,0,0,0|1,0,0]=3 814 B7R0.3 CNC(=O)CCO[13CH3] 34a_100000754576_200025704644 [2,0,0,0,0,0|1,0,0]=3 815 B7R0.3 CNC(=O)CCSC 11a_106832991635_100000174002 [2,0,0,0,0,0|1,1,0]=4 816 B7R0.3 CNC(=O)CCSC 1626a_100102657272_100000174002 [2,0,0,0,0,0|1,1,0]=4 817 B7R0.3 CNC(=O)CCSC 240690a_100102657272_100000174002 [2,0,0,0,0,0|1,1,0]=4 818 B7R0.3 CNC(=O)CCSC 527a_100102657272_100000174002 [2,0,0,0,0,0|1,1,0]=4 819 B7R0.3 CNC(=O)CCSC 62a_100000737683_200000210301 [2,0,0,0,0,0|1,1,0]=4 820 B7R0.3 CNC(=O)CCSC 62a_200000210301_100000737683 [2,0,0,0,0,0|1,1,0]=4 821 B7R0.3 CNC(=O)CCS[13CH3] 62a_100000737683_200025704644 [2,0,0,0,0,0|1,1,0]=4 822 B7R0.3 CNC(=O)CCS[13CH3] 62a_200025704644_100000737683 [2,0,0,0,0,0|1,1,0]=4 823 B7R0.3 CNCCC(=O)NC 2230a_100000738227_200000210301 [2,0,0,0,0,0|2,0,0]=4 824 B7R0.3 CNCCC(=O)NC 2230a_106832991635_100000737683 [2,0,0,0,0,0|2,0,0]=4 825 B7R0.3 CNCCC(=O)NC 34a_100000738227_200000210301 [2,0,0,0,0,0|2,0,0]=4 826 B7R0.3 CNCCC(=O)NC 34a_100102657272_100012179268 [2,0,0,0,0,0|2,0,0]=4 827 B7R0.3 CNCCC(=O)NC 7a_106832991635_100000737683 [2,0,0,0,0,0|2,0,0]=4 828 B7R0.3 CNCCC(=O)OC 2230a_106832991635_100000204255 [2,0,0,0,0,0|1,0,0]=3 829 B7R0.3 CNCCC(=O)OC 34a_100102657272_100000742370 [2,0,0,0,0,0|1,0,0]=3 830 B7R0.3 CNCCC(=O)OC 7a_106832991635_100000204255 [2,0,0,0,0,0|1,0,0]=3 831 B7R0.3 COC(=O)CCSC 62a_100000204255_200000210301 [2,0,0,0,0,0|0,1,0]=3 832 B7R0.3 COC(=O)CCSC 62a_200000210301_100000204255 [2,0,0,0,0,0|0,1,0]=3 833 B7R0.3 COC(=O)CCS[13CH3] 62a_100000204255_200025704644 [2,0,0,0,0,0|0,1,0]=3 834 B7R0.3 COC(=O)CCS[13CH3] 62a_200025704644_100000204255 [2,0,0,0,0,0|0,1,0]=3 835 B7R0.3 COC(=O)OCSC 62a_200000210301_100000139417 [2,0,0,0,0,0|1,1,0]=4 836 B7R0.3 COC(=O)OCS[13CH3] 62a_200025704644_100000139417 [2,0,0,0,0,0|1,1,0]=4 837 B7R0.3 COC(C)CCO[13CH3] 7a_100000764861_200025704644 [2,0,0,0,0,0|1,0,1]=4 838 B7R0.3 COCCC(=O)CF 1458a_100000749529_100015361967 [2,0,0,0,0,0|2,0,0]=4 839 B7R0.3 COCCC(=O)CO 1458a_100000210174_100000233755 [2,0,0,0,0,0|2,0,0]=4 840 B7R0.3 COCCC(=O)OC 34a_100138415774_100000742370 [2,0,0,0,0,0|0,0,0]=2 841 B7R0.3 COCCC(C)OC 7a_100000764861_200000210301 [2,0,0,0,0,0|1,0,1]=4 842 B7R0.4 CC(=O)CCCO[13CH3] 34a_100000759063_200025704644 [2,0,0,0,0,0|0,0,1]=3 843 B7R0.4 CC(=O)CCCO[13CH3] 7a_100000759063_200025704644 [2,0,0,0,0,0|0,0,1]=3 844 B7R0.4 CC(=O)CCCS[13CH3] 62a_100011215641_200025704644 [2,0,0,0,0,0|0,1,1]=4 845 B7R0.4 CC(=O)CCCS[13CH3] 62a_200025704644_100011215641 [2,0,0,0,0,0|0,1,1]=4 846 B7R0.4 CC(=O)NCCO[13CH3] 34a_100000158858_200025704644 [2,0,0,0,0,0|1,0,1]=4 847 B7R0.4 CC/C=C/CC(=O)C 1458a_100016274230_200000210301 [2,0,0,0,0,0|1,0,1]=4 848 B7R0.4 CC/C=C/CC(=O)[13CH3] 1458a_100016274230_200025704644 [2,0,0,0,0,0|1,0,1]=4 849 B7R0.4 CC/C=C\CC(=O)C 1458a_100000070787_100103147603 [2,0,0,0,0,0|1,0,1]=4 850 B7R0.4 CCCCCC(=O)C 1458a_100000070787_100000210326 [2,0,0,0,0,0|1,0,1]=4 851 B7R0.4 CCCCCC(=O)C 1458a_100000212188_200000210301 [2,0,0,0,0,0|1,0,1]=4 852 B7R0.4 CCCCCC(=O)[13CH3] 1458a_100000212188_200025704644 [2,0,0,0,0,0|1,0,1]=4 853 B7R0.4 CCOCCC(=O)C 1458a_100000070787_100011215890 [2,0,0,0,0,0|2,0,0]=4 854 B7R0.4 CCOCCC(=O)C 1458a_100000749530_200000210301 [2,0,0,0,0,0|2,0,0]=4 855 B7R0.4 CCOCCC(=O)C 34a_100000759926_100000210202 [2,0,0,0,0,0|2,0,0]=4 856 B7R0.4 CCOCCC(=O)C 7a_100000759926_100000210202 [2,0,0,0,0,0|2,0,0]=4 857 B7R0.4 CCOCCC(=O)[13CH3] 1458a_100000749530_200025704644 [2,0,0,0,0,0|2,0,0]=4 858 B7R0.4 CCSCCC(=O)C 1458a_100000070787_100000757381 [2,0,0,0,0,0|2,0,0]=4 859 B7R0.4 CCSCCC(=O)C 1458a_100000230768_200000210301 [2,0,0,0,0,0|2,0,0]=4 860 B7R0.4 CCSCCC(=O)C 62a_100000053229_100000210202 [2,0,0,0,0,0|2,0,0]=4 861 B7R0.4 CCSCCC(=O)C 62a_100000210202_100000053229 [2,0,0,0,0,0|2,0,0]=4 862 B7R0.4 CCSCCC(=O)[13CH3] 1458a_100000230768_200025704644 [2,0,0,0,0,0|2,0,0]=4 863 B7R0.4 CNCCCC(=O)C 34a_100102657272_100000685027 [2,0,0,0,0,0|1,0,1]=4 864 B7R0.4 CNCCCC(=O)C 7a_106832991635_100011215641 [2,0,0,0,0,0|1,0,1]=4 865 B7R0.4 COCCCC(=O)C 1458a_100000070787_100000740836 [2,0,0,0,0,0|0,0,1]=3 866 B7R0.4 COCCCC(=O)C 1458a_100000741012_200000210301 [2,0,0,0,0,0|0,0,1]=3 867 B7R0.4 COCCCC(=O)C 34a_100000759063_200000210301 [2,0,0,0,0,0|0,0,1]=3 868 B7R0.4 COCCCC(=O)C 34a_100138415774_100000685027 [2,0,0,0,0,0|0,0,1]=3 869 B7R0.4 COCCCC(=O)C 7a_100000759063_200000210301 [2,0,0,0,0,0|0,0,1]=3 870 B7R0.4 COCCCC(=O)N 34a_100138415774_100102525003 [2,0,0,0,0,0|1,0,1]=4 871 B7R0.4 COCCCC(=O)[13CH3] 1458a_100000741012_200025704644 [2,0,0,0,0,0|0,0,1]=3 872 B7R0.4 COCCNC(=O)C 1626a_100000209980_100015343762 [2,0,0,0,0,0|1,0,1]=4 873 B7R0.4 COCCNC(=O)C 240690a_100000209980_100015343762 [2,0,0,0,0,0|1,0,1]=4 874 B7R0.4 COCCNC(=O)C 34a_100000158858_200000210301 [2,0,0,0,0,0|1,0,1]=4 875 B7R0.4 COCCNC(=O)C 527a_100000209980_100103153847 [2,0,0,0,0,0|1,0,1]=4 876 B7R0.4 COCCOC(=O)C 34a_100138415774_100009814007 [2,0,0,0,0,0|1,0,1]=4 877 B7R0.4 COCNCC(=O)O 269956a_100016091260_100000766300 [2,0,0,0,0,0|1,0,1]=4 878 B7R0.4 CSCCCC(=O)C 1458a_100000173376_200000210301 [2,0,0,0,0,0|0,1,1]=4 879 B7R0.4 CSCCCC(=O)C 62a_100011215641_200000210301 [2,0,0,0,0,0|0,1,1]=4 880 B7R0.4 CSCCCC(=O)C 62a_200000210301_100011215641 [2,0,0,0,0,0|0,1,1]=4 881 B7R0.4 CSCCCC(=O)[13CH3] 1458a_100000173376_200025704644 [2,0,0,0,0,0|0,1,1]=4 882 B7R0.6 C=C(C)CCC(=O)C 1458a_100000070787_100000730704 [2,0,0,0,0,0|1,0,0]=3 883 B7R0.6 C=C(C)CCC(=O)C 1458a_200000688413_200000210301 [2,0,0,0,0,0|1,0,0]=3 884 B7R0.6 C=C(C)CCC(=O)[13CH3] 1458a_200000688413_200025704644 [2,0,0,0,0,0|1,0,0]=3 885 B7R0.6 C=C(C)CNC(=O)C 11a_100000765925_100015343762 [2,0,0,0,0,0|2,0,0]=4 886 B7R0.6 C=C(C)CNC(=O)C 1626a_100000765925_100015343762 [2,0,0,0,0,0|2,0,0]=4 887 B7R0.6 C=C(C)CNC(=O)C 240690a_100000765925_100015343762 [2,0,0,0,0,0|2,0,0]=4 888 B7R0.6 C=C(C)CNC(=O)C 527a_100000765925_100103153847 [2,0,0,0,0,0|2,0,0]=4 889 B7R0.6 CC(=CCC(=O)[13CH3])C 1458a_100011220947_200025704644 [2,0,0,0,0,0|1,0,1]=4 890 B7R0.6 CC(=O)CC=C(C)C 1458a_100000070787_100000761012 [2,0,0,0,0,0|1,0,1]=4 891 B7R0.6 CC(=O)CC=C(C)C 1458a_100011220947_200000210301 [2,0,0,0,0,0|1,0,1]=4 892 B7R0.6 CC(=O)CCC(=O)N 1458a_100011215257_200000210301 [2,0,0,0,0,0|1,0,0]=3 893 B7R0.6 CC(=O)CCC(C)C 1458a_100000070787_100000210312 [2,0,0,0,0,0|1,0,1]=4 894 B7R0.6 CC(=O)CCC(C)C 1458a_100000181311_200000210301 [2,0,0,0,0,0|1,0,1]=4 895 B7R0.6 CC(=O)CCC(C)O 1458a_100000070787_100012276601 [2,0,0,0,0,0|0,0,2]=4 896 B7R0.6 CC(=O)CCN(C)C 269982a_100102631434_100000053229 [2,0,0,0,0,0|2,0,0]=4 897 B7R0.6 CC(=O)CC[N+](=O)[O-] 1458a_200000064761_200000210301 [2,0,0,0,0,0|1,0,1]=4 898 B7R0.6 CC(=O)CC[S+](C)C 1458a_100009452791_200000210301 [2,0,0,0,0,0|2,0,0]=4 899 B7R0.6 CC(=O)CNC(=O)C 1458a_100000194580_200000210301 [2,0,0,0,0,0|1,0,0]=3 900 B7R0.6 CC(=O)CNC(=O)N 1458a_100000184981_200000210301 [2,0,0,0,0,0|2,0,0]=4 901 B7R0.6 CC(=O)COC(=O)C 1458a_100000183556_200000210301 [2,0,0,0,0,0|1,0,0]=3 902 B7R0.6 CC(=O)CSC(=O)C 1458a_100000049016_200000210301 [2,0,0,0,0,0|1,0,0]=3 903 B7R0.6 CC(=O)NCC(=O)N 11a_100000711301_100015343762 [2,0,0,0,0,0|2,0,0]=4 904 B7R0.6 CC(=O)NCC(=O)N 240690a_100000711301_100015343762 [2,0,0,0,0,0|2,0,0]=4 905 B7R0.6 CC(=O)NCC(=O)N 527a_100000711301_100103153847 [2,0,0,0,0,0|2,0,0]=4 906 B7R0.6 CC(=O)NCC(=O)[13CH3] 1458a_100000194580_200025704644 [2,0,0,0,0,0|1,0,0]=3 907 B7R0.6 CC(=O)NNC(=O)C 22a_100000189765_100000070787 [2,0,0,0,0,0|2,0,0]=4 908 B7R0.6 CC(=O)OCC(=O)[13CH3] 1458a_100000183556_200025704644 [2,0,0,0,0,0|1,0,0]=3 909 B7R0.6 CC(=O)SCC(=O)[13CH3] 1458a_100000049016_200025704644 [2,0,0,0,0,0|1,0,0]=3 910 B7R0.6 CC(C)CCC(=O)[13CH3] 1458a_100000181311_200025704644 [2,0,0,0,0,0|1,0,1]=4 911 B7R0.6 C[S+](C)CCC(=O)[13CH3] 1458a_100009452791_200025704644 [2,0,0,0,0,0|2,0,0]=4 912 B7R0.6 [13CH3]C(=O)CCC(=O)N 1458a_100011215257_200025704644 [2,0,0,0,0,0|1,0,0]=3 913 B7R0.6 [13CH3]C(=O)CC[N+](=O)[O-] 1458a_200000064761_200025704644 [2,0,0,0,0,0|1,0,1]=4 914 B7R0.6 [13CH3]C(=O)CNC(=O)N 1458a_100000184981_200025704644 [2,0,0,0,0,0|2,0,0]=4 915 B9R0.1 CCC(=O)CCC=C(C)C 1458a_100000210414_100011217483 [1,1,0,0,0,0|2,0,0]=4 916 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000070787_100011218270 [1,1,0,0,0,0|1,0,1]=4 917 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000239890_200000210301 [1,1,0,0,0,0|1,0,1]=4 918 B9R0.1 COC(=O)CCCC(=O)[13CH3] 1458a_100000239890_200025704644 [1,1,0,0,0,0|1,0,1]=4 919 B9R0.1 COC(=O)CCCN(C)C 2230a_100102631434_100011218270 [1,1,0,0,0,0|1,0,1]=4 920 B9R0.1 COC(=O)CCCN(C)C 269982a_100000739225_200000210301 [1,1,0,0,0,0|1,0,1]=4 921 B9R0.1 COC(=O)CCCN(C)C 269982a_100102631434_100011218270 [1,1,0,0,0,0|1,0,1]=4 922 B9R0.1 COC(=O)CCCN(C)[13CH3] 269982a_100000739225_200025704644 [1,1,0,0,0,0|1,0,1]=4 923 B9R0.1 COC(=O)CCNC(=O)C 188690a_100000683876_100015343762 [1,1,0,0,0,0|2,0,0]=4 924 B9R0.1 COC(=O)CCNC(C)C 2230a_100138425928_100000204255 [1,1,0,0,0,0|2,0,0]=4 925 B9R0.1 COC(=O)CCNC(C)C 34a_100138425928_100000742370 [1,1,0,0,0,0|2,0,0]=4 926 B9R0.1 COC(=O)CCOC(C)C 34a_100000212225_100000742370 [1,1,0,0,0,0|2,0,0]=4 927 B9R0.1 COC(=O)CCSC(C)C 62a_100000204255_100000210206 [1,1,0,0,0,0|2,0,0]=4 928 B9R0.1 COC(=O)CCSC(C)C 62a_100000210206_100000204255 [1,1,0,0,0,0|2,0,0]=4 929 B9R0.5 CC#CC(=O)CCCOC 1458a_100000763181_100000740836 [1,1,0,0,0,0|1,0,1]=4 930 B9R0.5 CC/C=C\CC(=O)COC 1458a_100000210968_100103147603 [1,1,0,0,0,0|1,0,1]=4 931 B9R0.5 CC=CC(=O)CCCOC 1458a_100000210699_100000740836 [1,1,0,0,0,0|1,0,1]=4 932 B9R0.5 CCCC(=O)CCCOC 1458a_100000211992_100000740836 [1,1,0,0,0,0|1,0,1]=4 933 B9R0.5 CCCC(=O)CCCOC 1458a_100000741012_100000210303 [1,1,0,0,0,0|1,0,1]=4 934 B9R0.5 CCCCCC(=O)COC 1458a_100000210968_100000210326 [1,1,0,0,0,0|1,0,1]=4 935 B9R0.5 CCCCCC(=O)COC 34a_100138415774_200012276598 [1,1,0,0,0,0|1,0,1]=4 936 B9R0.5 CCNC(=O)CCCOC 11a_100015525214_100000741012 [1,1,0,0,0,0|1,0,1]=4 937 B9R0.5 CCNC(=O)CCCOC 240690a_100015525214_100000741012 [1,1,0,0,0,0|1,0,1]=4 938 B9R0.5 CCNC(=O)CCCOC 527a_100015525214_100000741012 [1,1,0,0,0,0|1,0,1]=4 939 B9R0.5 CCNCCC(=O)OCC 2230a_100015525214_100011206558 [1,1,0,0,0,0|2,0,0]=4 940 B9R0.5 CCOC(=O)CCCNC 2230a_106832991635_100009991533 [1,1,0,0,0,0|1,0,1]=4 941 B9R0.5 CCOC(=O)CCCNC 34a_100102657272_100009991533 [1,1,0,0,0,0|1,0,1]=4 942 B9R0.5 CCOC(=O)CCCNC 7a_106832991635_100011215271 [1,1,0,0,0,0|1,0,1]=4 943 B9R0.5 CCOC(=O)CCCOC 34a_100138415774_100009991533 [1,1,0,0,0,0|0,0,1]=3 944 B9R0.5 CCOC(=O)CCCOC 7a_100012001163_200000210301 [1,1,0,0,0,0|0,0,1]=3 945 B9R0.5 CCOC(=O)CCCO[13CH3] 7a_100012001163_200025704644 [1,1,0,0,0,0|0,0,1]=3 946 B9R0.5 CCOC(=O)CCCSC 62a_100009991533_200000210301 [1,1,0,0,0,0|0,1,1]=4 947 B9R0.5 CCOC(=O)CCCSC 62a_200000210301_100009991533 [1,1,0,0,0,0|0,1,1]=4 948 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_100009991533_200025704644 [1,1,0,0,0,0|0,1,1]=4 949 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_200025704644_100009991533 [1,1,0,0,0,0|0,1,1]=4 950 B9R0.5 CCOC(=O)CCSCC 62a_100000210202_100000765890 [1,1,0,0,0,0|2,0,0]=4 951 B9R0.5 CCOC(=O)CCSCC 62a_100000765890_100000210202 [1,1,0,0,0,0|2,0,0]=4 952 B9R0.5 CCOC(=O)CSCOC 62a_100000188475_100000766300 [1,1,0,0,0,0|1,0,1]=4 953 B9R0.5 CCOC(=O)CSCOC 62a_100000766300_100000188475 [1,1,0,0,0,0|1,0,1]=4 954 B9R0.5 CCOC(=O)NCCOC 34a_100000158857_200000210301 [1,1,0,0,0,0|1,0,1]=4 955 B9R0.5 CCOC(=O)NCCO[13CH3] 34a_100000158857_200025704644 [1,1,0,0,0,0|1,0,1]=4 956 B9R0.5 CCOCCC(=O)COC 1458a_100000210968_100011215890 [1,1,0,0,0,0|2,0,0]=4 957 B9R0.5 CCOCCC(=O)OCC 34a_100121572206_100000765890 [1,1,0,0,0,0|2,0,0]=4 958 B9R0.5 CCSCCC(=O)COC 1458a_100000210968_100000757381 [1,1,0,0,0,0|2,0,0]=4 959 B9R0.5 CNNC(=O)CCCOC 22a_100016993582_100000741012 [1,1,0,0,0,0|1,0,1]=4 960 B9R0.5 COCCCC(=O)CCF 1458a_100000741012_100011217306 [1,1,0,0,0,0|1,0,1]=4 961 B9R0.5 COCCCC(=O)CCO 1458a_100000741012_100000211926 [1,1,0,0,0,0|1,0,1]=4 962 B9R0.5 COCCCC(=O)CCO 1458a_100011216618_100000740836 [1,1,0,0,0,0|1,0,1]=4 963 B9R0.5 COCCCC(=O)COC 1458a_100000210968_100000740836 [1,1,0,0,0,0|0,0,1]=3 964 B9R0.5 COCCCC(=O)CSC 1458a_100000184570_100000740836 [1,1,0,0,0,0|0,1,1]=4 965 B9R0.5 COCCNC(=O)COC 1626a_100000209980_100000210968 [1,1,0,0,0,0|1,0,1]=4 966 B9R0.5 COCCNC(=O)COC 240690a_100000209980_100000210968 [1,1,0,0,0,0|1,0,1]=4 967 B9R0.5 COCCNC(=O)COC 34a_100138415774_100000183275 [1,1,0,0,0,0|1,0,1]=4 968 B9R0.5 COCCNC(=O)COC 527a_100000209980_100000210968 [1,1,0,0,0,0|1,0,1]=4 969 B9R0.5 COCCOC(=O)COC 34a_100138415774_200000040189 [1,1,0,0,0,0|1,0,1]=4 970 B9R0.8 CCOCC(C)C(=O)OC 34a_100000749362_100000210202 [1,1,0,0,0,0|2,0,0]=4 971 B9R0.8 CCOCC(C)C(=O)OC 34a_100121572206_100000698445 [1,1,0,0,0,0|2,0,0]=4 972 B9R0.8 CCOCC(C)C(=O)OC 7a_100000749362_100000210202 [1,1,0,0,0,0|2,0,0]=4 973 B9R0.8 CCOCC(F)C(=O)OC 34a_200009849844_100000210202 [1,1,0,0,0,0|2,0,0]=4 974 B9R0.8 CCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210202 [1,1,0,0,0,0|2,0,0]=4 975 B9R0.8 CCSCC(C)C(=O)OC 62a_100000210202_100000698445 [1,1,0,0,0,0|2,0,0]=4 976 B9R0.8 CCSCC(C)C(=O)OC 62a_100000698445_100000210202 [1,1,0,0,0,0|2,0,0]=4 977 B9R0.8 CNCCC(C)C(=O)OC 2230a_106832991635_100000034942 [1,1,0,0,0,0|1,0,1]=4 978 B9R0.8 CNCCC(C)C(=O)OC 34a_100102657272_100000034942 [1,1,0,0,0,0|1,0,1]=4 979 B9R0.8 CNCCC(C)C(=O)OC 7a_106832991635_100000034942 [1,1,0,0,0,0|1,0,1]=4 980 B9R0.8 COC(=O)C(C)CCSC 62a_100000034942_200000210301 [1,1,0,0,0,0|0,1,1]=4 981 B9R0.8 COC(=O)C(C)CCSC 62a_200000210301_100000034942 [1,1,0,0,0,0|0,1,1]=4 982 B9R0.8 COC(=O)C(C)CCS[13CH3] 62a_100000034942_200025704644 [1,1,0,0,0,0|0,1,1]=4 983 B9R0.8 COC(=O)C(C)CCS[13CH3] 62a_200025704644_100000034942 [1,1,0,0,0,0|0,1,1]=4 984 B9R0.8 COCCC(C)C(=O)OC 34a_100138415774_100000034942 [1,1,0,0,0,0|0,0,1]=3 985 B9R0.8 COCSC(C)C(=O)OC 62a_100000211248_100000766300 [1,1,0,0,0,0|1,0,1]=4 986 B9R0.8 COCSC(C)C(=O)OC 62a_100000766300_100000211248 [1,1,0,0,0,0|1,0,1]=4 987 B9R0.34 CC=CC(=O)CC(=O)OC 1458a_100000210699_100000747449 [1,1,0,0,0,0|1,0,1]=4 988 B9R0.34 CCNC(C)CC(=O)OC 2230a_100015525214_100009817358 [1,1,0,0,0,0|2,0,0]=4 989 B9R0.34 CCOC(C)CC(=O)OC 34a_100121572206_100009817358 [1,1,0,0,0,0|2,0,0]=4 990 B9R0.34 CCSC(C)CC(=O)OC 62a_100000210202_100009817358 [1,1,0,0,0,0|2,0,0]=4 991 B9R0.34 CCSC(C)CC(=O)OC 62a_100009817358_100000210202 [1,1,0,0,0,0|2,0,0]=4 992 B9R0.34 CNC[C@H](O)CC(=O)OC 34a_100102657272_100000754131 [1,1,0,0,0,0|1,0,1]=4 993 B9R0.34 CNC[C@H](O)CC(=O)OC 7a_106832991635_100000754131 [1,1,0,0,0,0|1,0,1]=4 994 B9R0.34 COC(=O)C[C@@H](O)CSC 62a_100000754131_200000210301 [1,1,0,0,0,0|0,1,1]=4 995 B9R0.34 COC(=O)C[C@@H](O)CSC 62a_200000210301_100000754131 [1,1,0,0,0,0|0,1,1]=4 996 B9R0.34 COC(=O)C[C@@H](O)CS[13CH3] 62a_100000754131_200025704644 [1,1,0,0,0,0|0,1,1]=4 997 B9R0.34 COC(=O)C[C@@H](O)CS[13CH3] 62a_200025704644_100000754131 [1,1,0,0,0,0|0,1,1]=4 998 B9R0.34 COCC(=O)CC(=O)OC 1458a_100000210968_100000747449 [1,1,0,0,0,0|0,0,2]=4 999 B9R0.34 COCN(C)CC(=O)OC 2230a_100000198492_100000766300 [1,1,0,0,0,0|1,0,1]=4 1000 B9R0.34 COC[C@H](O)CC(=O)OC 34a_100138415774_100000754131 [1,1,0,0,0,0|0,0,1]=3 1001 B9R0.46 C/C=C/COCC(=O)CC 34a_100000725409_100102629194 [1,1,0,0,0,0|2,0,0]=4 1002 B9R0.46 C/C=C/COCC(=O)NC 34a_100000750040_100102629194 [1,1,0,0,0,0|2,0,0]=4 1003 B9R0.46 C/C=C/COCC(=O)NC 34a_100016270725_100000183359 [1,1,0,0,0,0|2,0,0]=4 1004 B9R0.46 C/C=C/COCC(=O)OC 34a_100016270725_100000747449 [1,1,0,0,0,0|1,0,0]=3 1005 B9R0.46 C/C=C/CSCC(=O)CC 62a_100000747405_100102629194 [1,1,0,0,0,0|2,0,0]=4 1006 B9R0.46 C/C=C/CSCC(=O)CC 62a_100102629194_100000747405 [1,1,0,0,0,0|2,0,0]=4 1007 B9R0.46 C/C=C/CSCC(=O)NC 62a_100000183359_100102629194 [1,1,0,0,0,0|2,0,0]=4 1008 B9R0.46 C/C=C/CSCC(=O)NC 62a_100102629194_100000183359 [1,1,0,0,0,0|2,0,0]=4 1009 B9R0.46 C/C=C/CSCC(=O)OC 62a_100000747449_100102629194 [1,1,0,0,0,0|1,0,0]=3 1010 B9R0.46 C/C=C/CSCC(=O)OC 62a_100102629194_100000747449 [1,1,0,0,0,0|1,0,0]=3 1011 B9R0.46 CC#CCNCC(=O)OC 2230a_100000685387_100000747449 [1,1,0,0,0,0|1,0,1]=4 1012 B9R0.46 CC#CCNCC(=O)OC 34a_100000685387_100000747449 [1,1,0,0,0,0|1,0,1]=4 1013 B9R0.46 CC#CCOCC(=O)OC 34a_100000761923_100000747449 [1,1,0,0,0,0|1,0,1]=4 1014 B9R0.46 CC#CCSCC(=O)OC 62a_100000747449_100000748600 [1,1,0,0,0,0|1,0,1]=4 1015 B9R0.46 CC#CCSCC(=O)OC 62a_100000748600_100000747449 [1,1,0,0,0,0|1,0,1]=4 1016 B9R0.46 CC/C=C\CCC(=O)CC 1458a_100000210414_100015370543 [1,1,0,0,0,0|2,0,0]=4 1017 B9R0.46 CC=CCNCC(=O)NC 2230a_100000693194_100000070051 [1,1,0,0,0,0|2,0,0]=4 1018 B9R0.46 CC=CCOCC(=O)CC 34a_100000725409_100000070051 [1,1,0,0,0,0|2,0,0]=4 1019 B9R0.46 CC=CCOCC(=O)NC 34a_100000750040_100000070051 [1,1,0,0,0,0|2,0,0]=4 1020 B9R0.46 CC=CCSCC(=O)CC 62a_100000070051_100000747405 [1,1,0,0,0,0|2,0,0]=4 1021 B9R0.46 CC=CCSCC(=O)CC 62a_100000747405_100000070051 [1,1,0,0,0,0|2,0,0]=4 1022 B9R0.46 CC=CCSCC(=O)NC 62a_100000070051_100000183359 [1,1,0,0,0,0|2,0,0]=4 1023 B9R0.46 CC=CCSCC(=O)NC 62a_100000183359_100000070051 [1,1,0,0,0,0|2,0,0]=4 1024 B9R0.46 CC=CCSCC(=O)OC 62a_100000070051_100000747449 [1,1,0,0,0,0|1,0,0]=3 1025 B9R0.46 CC=CCSCC(=O)OC 62a_100000747449_100000070051 [1,1,0,0,0,0|1,0,0]=3 1026 B9R0.46 CCC(=O)CCCCOC 1458a_100000210414_100000755781 [1,1,0,0,0,0|1,0,1]=4 1027 B9R0.46 CCC(=O)COCCOC 1458a_100000211095_100000210202 [1,1,0,0,0,0|1,0,1]=4 1028 B9R0.46 CCC(=O)COCCOC 34a_100000725409_100011201679 [1,1,0,0,0,0|1,0,1]=4 1029 B9R0.46 CCC(=O)CSCCOC 62a_100000233755_100000747405 [1,1,0,0,0,0|1,0,1]=4 1030 B9R0.46 CCC(=O)CSCCOC 62a_100000747405_100000233755 [1,1,0,0,0,0|1,0,1]=4 1031 B9R0.46 CCC(=O)NCCCOC 1626a_100150723488_100000210414 [1,1,0,0,0,0|1,0,1]=4 1032 B9R0.46 CCC(=O)NCCCOC 240690a_100150723488_100000210414 [1,1,0,0,0,0|1,0,1]=4 1033 B9R0.46 CCC(=O)NCCCOC 527a_100150723488_100000210414 [1,1,0,0,0,0|1,0,1]=4 1034 B9R0.46 CCCCNCC(=O)OC 2230a_100000102301_100000747449 [1,1,0,0,0,0|1,0,1]=4 1035 B9R0.46 CCCCNCC(=O)OC 7a_106832991798_100000747449 [1,1,0,0,0,0|1,0,1]=4 1036 B9R0.46 CCCCOCC(=O)OC 34a_100000210227_100000747449 [1,1,0,0,0,0|1,0,1]=4 1037 B9R0.46 CCCCOCC(=O)OC 7a_100000210227_100000747449 [1,1,0,0,0,0|1,0,1]=4 1038 B9R0.46 CCCCSCC(=O)OC 62a_100000210211_100000747449 [1,1,0,0,0,0|1,0,1]=4 1039 B9R0.46 CCCCSCC(=O)OC 62a_100000747449_100000210210 [1,1,0,0,0,0|1,0,1]=4 1040 B9R0.46 CCCOCCC(=O)OC 34a_100000210258_100000742370 [1,1,0,0,0,0|1,0,1]=4 1041 B9R0.46 CCCSCCC(=O)OC 62a_100000204255_100000210303 [1,1,0,0,0,0|1,0,1]=4 1042 B9R0.46 CCCSCCC(=O)OC 62a_100000210303_100000204255 [1,1,0,0,0,0|1,0,1]=4 1043 B9R0.46 CCNCCCC(=O)OC 2230a_100015525214_100011218270 [1,1,0,0,0,0|1,0,1]=4 1044 B9R0.46 CCOCCCC(=O)CC 1458a_100000210414_100012232248 [1,1,0,0,0,0|1,0,1]=4 1045 B9R0.46 CCOCCCC(=O)NC 34a_100121572206_100000741757 [1,1,0,0,0,0|1,0,1]=4 1046 B9R0.46 CCOCCCC(=O)OC 34a_100121572206_100000742333 [1,1,0,0,0,0|0,0,1]=3 1047 B9R0.46 CCOCCNC(=O)OC 34a_100000757965_100000210202 [1,1,0,0,0,0|1,0,1]=4 1048 B9R0.46 CCOCCOC(=O)OC 34a_100010262106_100000210202 [1,1,0,0,0,0|1,0,1]=4 1049 B9R0.46 CCOCSCC(=O)OC 62a_100000739092_100000747449 [1,1,0,0,0,0|1,0,1]=4 1050 B9R0.46 CCOCSCC(=O)OC 62a_100000747449_100000739092 [1,1,0,0,0,0|1,0,1]=4 1051 B9R0.46 CCSCCCC(=O)OC 62a_100000210202_100011218270 [1,1,0,0,0,0|0,1,1]=4 1052 B9R0.46 CCSCCCC(=O)OC 62a_100011218270_100000210202 [1,1,0,0,0,0|0,1,1]=4 1053 B9R0.46 CNC(=O)CCNCOC 2230a_100000738227_100000766300 [1,1,0,0,0,0|1,0,1]=4 1054 B9R0.46 CNC(=O)CCSCOC 62a_100000737683_100000766300 [1,1,0,0,0,0|1,0,1]=4 1055 B9R0.46 CNC(=O)CCSCOC 62a_100000766300_100000737683 [1,1,0,0,0,0|1,0,1]=4 1056 B9R0.46 CNC(=O)CNCCOC 2230a_100000209980_100000183359 [1,1,0,0,0,0|1,0,1]=4 1057 B9R0.46 CNC(=O)CNCCOC 2230a_100000693194_100011201679 [1,1,0,0,0,0|1,0,1]=4 1058 B9R0.46 CNC(=O)COCCOC 11a_106832991635_100000211095 [1,1,0,0,0,0|1,0,1]=4 1059 B9R0.46 CNC(=O)COCCOC 1626a_100102657272_100000211095 [1,1,0,0,0,0|1,0,1]=4 1060 B9R0.46 CNC(=O)COCCOC 240690a_100102657272_100000211095 [1,1,0,0,0,0|1,0,1]=4 1061 B9R0.46 CNC(=O)COCCOC 34a_100000210237_100000183359 [1,1,0,0,0,0|1,0,1]=4 1062 B9R0.46 CNC(=O)COCCOC 34a_100000750040_100011201679 [1,1,0,0,0,0|1,0,1]=4 1063 B9R0.46 CNC(=O)COCCOC 527a_100102657272_100000211095 [1,1,0,0,0,0|1,0,1]=4 1064 B9R0.46 CNC(=O)CSCCOC 62a_100000183359_100000233755 [1,1,0,0,0,0|1,0,1]=4 1065 B9R0.46 CNC(=O)CSCCOC 62a_100000233755_100000183359 [1,1,0,0,0,0|1,0,1]=4 1066 B9R0.46 CNC(=O)NCCCOC 2708a_100102657272_100150723488 [1,1,0,0,0,0|1,0,1]=4 1067 B9R0.46 CNC(=O)NCCCOC 2708a_100150723488_106832991635 [1,1,0,0,0,0|1,0,1]=4 1068 B9R0.46 CNC(=O)NCCCOC 273464a_100102657272_100150723488 [1,1,0,0,0,0|1,0,1]=4 1069 B9R0.46 CNC(=O)NCCCOC 273464a_100150723488_100102657272 [1,1,0,0,0,0|1,0,1]=4 1070 B9R0.46 CNC(=O)NCCCOC 512a_106832991638_100150723488 [1,1,0,0,0,0|1,0,1]=4 1071 B9R0.46 CNCCCCC(=O)OC 2230a_106832991635_100000204269 [1,1,0,0,0,0|1,0,1]=4 1072 B9R0.46 CNCCCCC(=O)OC 34a_100102657272_100000204269 [1,1,0,0,0,0|1,0,1]=4 1073 B9R0.46 CNCCCCC(=O)OC 7a_106832991635_100000204269 [1,1,0,0,0,0|1,0,1]=4 1074 B9R0.46 CNCCOCC(=O)OC 2230a_106832991635_100000090808 [1,1,0,0,0,0|1,0,1]=4 1075 B9R0.46 CNCCOCC(=O)OC 34a_100102657272_100000090808 [1,1,0,0,0,0|1,0,1]=4 1076 B9R0.46 CNCCOCC(=O)OC 7a_106832991635_100000090808 [1,1,0,0,0,0|1,0,1]=4 1077 B9R0.46 COC(=O)CCCCO[13CH3] 34a_100000059025_200025704644 [1,1,0,0,0,0|0,0,1]=3 1078 B9R0.46 COC(=O)CCCCO[13CH3] 7a_100000059025_200025704644 [1,1,0,0,0,0|0,0,1]=3 1079 B9R0.46 COC(=O)CCCCSC 62a_100000204269_200000210301 [1,1,0,0,0,0|0,1,1]=4 1080 B9R0.46 COC(=O)CCCCSC 62a_200000210301_100000204269 [1,1,0,0,0,0|0,1,1]=4 1081 B9R0.46 COC(=O)CCCCS[13CH3] 62a_100000204269_200025704644 [1,1,0,0,0,0|0,1,1]=4 1082 B9R0.46 COC(=O)CCCCS[13CH3] 62a_200025704644_100000204269 [1,1,0,0,0,0|0,1,1]=4 1083 B9R0.46 COC(=O)CCCSCF 62a_100011218270_100015361967 [1,1,0,0,0,0|0,1,1]=4 1084 B9R0.46 COC(=O)CCCSCF 62a_100015361967_100011218270 [1,1,0,0,0,0|0,1,1]=4 1085 B9R0.46 COC(=O)CCNCCF 34a_100000724931_100000742370 [1,1,0,0,0,0|2,0,0]=4 1086 B9R0.46 COC(=O)CCNCCO 2230a_100016997473_100000204255 [1,1,0,0,0,0|2,0,0]=4 1087 B9R0.46 COC(=O)CCNCCO 34a_100016990907_100000742370 [1,1,0,0,0,0|2,0,0]=4 1088 B9R0.46 COC(=O)CCOCCBr 34a_100000211926_100000742370 [1,1,0,0,0,0|2,0,0]=4 1089 B9R0.46 COC(=O)CCOCCN 34a_100000210304_100000742370 [1,1,0,0,0,0|2,0,0]=4 1090 B9R0.46 COC(=O)CCSCCF 62a_100000204255_100011217306 [1,1,0,0,0,0|2,0,0]=4 1091 B9R0.46 COC(=O)CCSCCF 62a_100011217306_100000204255 [1,1,0,0,0,0|2,0,0]=4 1092 B9R0.46 COC(=O)CCSCCO 62a_100000204255_100000211926 [1,1,0,0,0,0|2,0,0]=4 1093 B9R0.46 COC(=O)CCSCCO 62a_100000211926_100000204255 [1,1,0,0,0,0|2,0,0]=4 1094 B9R0.46 COC(=O)CCSCSC 62a_100000204255_100011218213 [1,1,0,0,0,0|0,1,1]=4 1095 B9R0.46 COC(=O)CCSCSC 62a_100011218213_100000204255 [1,1,0,0,0,0|0,1,1]=4 1096 B9R0.46 COC(=O)CNCCSC 2230a_100020590264_100000747449 [1,1,0,0,0,0|0,1,1]=4 1097 B9R0.46 COC(=O)COCCON 34a_100000700252_100000747449 [1,1,0,0,0,0|1,0,1]=4 1098 B9R0.46 COC(=O)COCCSC 34a_100000230434_100000747449 [1,1,0,0,0,0|0,1,1]=4 1099 B9R0.46 COC(=O)COCCSC 62a_100000090808_200000210301 [1,1,0,0,0,0|0,1,1]=4 1100 B9R0.46 COC(=O)COCCSC 62a_200000210301_100000090808 [1,1,0,0,0,0|0,1,1]=4 1101 B9R0.46 COC(=O)COCCSC 7a_100000230434_100000747449 [1,1,0,0,0,0|0,1,1]=4 1102 B9R0.46 COC(=O)COCCS[13CH3] 62a_100000090808_200025704644 [1,1,0,0,0,0|0,1,1]=4 1103 B9R0.46 COC(=O)COCCS[13CH3] 62a_200025704644_100000090808 [1,1,0,0,0,0|0,1,1]=4 1104 B9R0.46 COC(=O)CSCCSC 62a_100000212216_100000747449 [1,1,0,0,0,0|0,1,1]=4 1105 B9R0.46 COC(=O)CSCCSC 62a_100000747449_100000751147 [1,1,0,0,0,0|0,1,1]=4 1106 B9R0.46 COC(=O)NCCOCF 34a_100000757965_100015361967 [1,1,0,0,0,0|1,0,1]=4 1107 B9R0.46 COC(=O)OCCOCF 34a_100010262106_100015361967 [1,1,0,0,0,0|1,0,1]=4 1108 B9R0.46 COCCCCC(=O)OC 34a_100000059025_200000210301 [1,1,0,0,0,0|0,0,1]=3 1109 B9R0.46 COCCCCC(=O)OC 34a_100138415774_100000204269 [1,1,0,0,0,0|0,0,1]=3 1110 B9R0.46 COCCCCC(=O)OC 7a_100000059025_200000210301 [1,1,0,0,0,0|0,0,1]=3 1111 B9R0.46 COCCNCC(=O)OC 2230a_100000209980_100000747449 [1,1,0,0,0,0|0,0,1]=3 1112 B9R0.46 COCCOCC(=O)OC 34a_100000210237_100000747449 [1,1,0,0,0,0|0,0,1]=3 1113 B9R0.46 COCCOCC(=O)OC 34a_100138415774_100000090808 [1,1,0,0,0,0|0,0,1]=3 1114 B9R0.46 COCCSCC(=O)OC 62a_100000233755_100000747449 [1,1,0,0,0,0|0,0,1]=3 1115 B9R0.46 COCCSCC(=O)OC 62a_100000747449_100000233755 [1,1,0,0,0,0|0,0,1]=3 1116 B9R0.46 COCSCCC(=O)OC 62a_100000204255_100000766300 [1,1,0,0,0,0|0,0,1]=3 1117 B9R0.46 COCSCCC(=O)OC 62a_100000766300_100000204255 [1,1,0,0,0,0|0,0,1]=3 1118 B9R0.46 COCSCOC(=O)OC 62a_100000766300_100000139417 [1,1,0,0,0,0|1,0,1]=4 1119 B9R0.47 C=C(C)C(=O)CCCOC 1458a_100000185857_100000740836 [1,1,0,0,0,0|1,0,1]=4 1120 B9R0.47 COCCCC(=O)C(C)C 1458a_100000210198_100000740836 [1,1,0,0,0,0|1,0,1]=4 1121 B9R0.47 COCCCC(=O)C(C)C 1458a_100000741012_100000210206 [1,1,0,0,0,0|1,0,1]=4 1122 B9R0.47 COCCCC(=O)C(C)F 1458a_100000062450_100000740836 [1,1,0,0,0,0|1,0,1]=4 1123 B9R0.47 COCCCC(=O)N(C)C 11a_100102631434_100000741012 [1,1,0,0,0,0|1,0,1]=4 1124 B9R0.47 COCCCC(=O)N(C)C 1626a_100102631434_100000741012 [1,1,0,0,0,0|1,0,1]=4 1125 B9R0.47 COCCCC(=O)N(C)C 240690a_100102631434_100000741012 [1,1,0,0,0,0|1,0,1]=4 1126 B9R0.47 COCCCC(=O)N(C)C 527a_100102631434_100000741012 [1,1,0,0,0,0|1,0,1]=4 1127 B9R0.47 COCCCC(=O)[C@@H](C)O 1458a_100000717761_100000740836 [1,1,0,0,0,0|1,0,1]=4 1128 B9R0.47 COCCCC(=O)[C@H](C)O 1458a_217856618621_100000740836 [1,1,0,0,0,0|1,0,1]=4 1129 B9R0.7 C=C(C)C(=O)NCC(=O)C 1458a_100000076187_200000210301 [1,1,0,0,0,0|2,0,0]=4 1130 B9R0.7 C=C(C)C(=O)NCC(=O)[13CH3] 1458a_100000076187_200025704644 [1,1,0,0,0,0|2,0,0]=4 1131 B9R0.7 C=C(C)CCC(=O)C(=C)C 1458a_100000185857_100000730704 [1,1,0,0,0,0|2,0,0]=4 1132 B9R0.7 C=C(C)CCC(=O)C(C)C 1458a_100000210198_100000730704 [1,1,0,0,0,0|2,0,0]=4 1133 B9R0.7 C=C(C)CCC(=O)C(C)C 1458a_200000688413_100000210206 [1,1,0,0,0,0|2,0,0]=4 1134 B9R0.7 C=C(C)CCC(=O)C(C)F 1458a_100000062450_100000730704 [1,1,0,0,0,0|2,0,0]=4 1135 B9R0.7 C=C(C)CCC(=O)N(C)C 11a_100102631434_200000688413 [1,1,0,0,0,0|2,0,0]=4 1136 B9R0.7 C=C(C)CCC(=O)N(C)C 1626a_100102631434_200000688413 [1,1,0,0,0,0|2,0,0]=4 1137 B9R0.7 C=C(C)CCC(=O)N(C)C 240690a_100102631434_200000688413 [1,1,0,0,0,0|2,0,0]=4 1138 B9R0.7 C=C(C)CCC(=O)N(C)C 527a_100102631434_200000688413 [1,1,0,0,0,0|2,0,0]=4 1139 B9R0.7 C=C(C)CCC(=O)[C@@H](C)O 1458a_100000717761_100000730704 [1,1,0,0,0,0|2,0,0]=4 1140 B9R0.7 C=C(C)CCC(=O)[C@H](C)O 1458a_217856618621_100000730704 [1,1,0,0,0,0|2,0,0]=4 1141 B9R0.7 CC(=O)CCC(=O)N(C)C 1458a_100011200748_200000210301 [1,1,0,0,0,0|1,0,0]=3 1142 B9R0.7 CC(=O)CNC(=O)C(C)C 1458a_100000194582_200000210301 [1,1,0,0,0,0|2,0,0]=4 1143 B9R0.7 CC(=O)COC(=O)C(C)C 1458a_100000070787_100000139345 [1,1,0,0,0,0|2,0,0]=4 1144 B9R0.7 CC(=O)NCC(=O)C(C)C 1458a_100000194580_100000210206 [1,1,0,0,0,0|2,0,0]=4 1145 B9R0.7 CC(=O)NCC(=O)N(C)C 11a_100015183351_100015343762 [1,1,0,0,0,0|2,0,0]=4 1146 B9R0.7 CC(=O)NCC(=O)N(C)C 11a_100102631434_100000194580 [1,1,0,0,0,0|2,0,0]=4 1147 B9R0.7 CC(=O)NCC(=O)N(C)C 1626a_100102631434_100000194580 [1,1,0,0,0,0|2,0,0]=4 1148 B9R0.7 CC(=O)NCC(=O)N(C)C 240690a_100015183351_100015343762 [1,1,0,0,0,0|2,0,0]=4 1149 B9R0.7 CC(=O)NCC(=O)N(C)C 240690a_100102631434_100000194580 [1,1,0,0,0,0|2,0,0]=4 1150 B9R0.7 CC(=O)NCC(=O)N(C)C 527a_100015183351_100103153847 [1,1,0,0,0,0|2,0,0]=4 1151 B9R0.7 CC(=O)NCC(=O)N(C)C 527a_100102631434_100000194580 [1,1,0,0,0,0|2,0,0]=4 1152 B9R0.7 CC(=O)OCC(=O)C(C)C 1458a_100000183556_100000210206 [1,1,0,0,0,0|2,0,0]=4 1153 B9R0.7 CC(=O)OCC(=O)N(C)C 1626a_100102631434_100000183556 [1,1,0,0,0,0|2,0,0]=4 1154 B9R0.7 CC(=O)OCC(=O)N(C)C 240690a_100102631434_100000183556 [1,1,0,0,0,0|2,0,0]=4 1155 B9R0.7 CC(=O)OCC(=O)N(C)C 527a_100102631434_100000183556 [1,1,0,0,0,0|2,0,0]=4 1156 B9R0.7 CC(=O)SCC(=O)C(C)C 1458a_100000049016_100000210206 [1,1,0,0,0,0|2,0,0]=4 1157 B9R0.7 CC(=O)SCC(=O)N(C)C 11a_100102631434_100000049016 [1,1,0,0,0,0|2,0,0]=4 1158 B9R0.7 CC(=O)SCC(=O)N(C)C 1626a_100102631434_100000049016 [1,1,0,0,0,0|2,0,0]=4 1159 B9R0.7 CC(=O)SCC(=O)N(C)C 240690a_100102631434_100000049016 [1,1,0,0,0,0|2,0,0]=4 1160 B9R0.7 CC(C)C(=O)CCC(=O)N 1458a_100011215257_100000210206 [1,1,0,0,0,0|2,0,0]=4 1161 B9R0.7 CC(C)C(=O)NCC(=O)[13CH3] 1458a_100000194582_200025704644 [1,1,0,0,0,0|2,0,0]=4 1162 B9R0.7 CN(C)C(=O)CCC(=O)N 240690a_100102631434_100011215257 [1,1,0,0,0,0|2,0,0]=4 1163 B9R0.7 CN(C)C(=O)CCC(=O)N 527a_100102631434_100011215257 [1,1,0,0,0,0|2,0,0]=4 1164 B9R0.7 CN(C)C(=O)CCC(=O)[13CH3] 1458a_100011200748_200025704644 [1,1,0,0,0,0|1,0,0]=3 1165 B9R0.21 CCC(=O)CCS(=O)(=O)C 1458a_100000210414_100000731031 [1,1,0,0,0,0|2,0,0]=4 1166 B9R0.21 CCC(=O)CCS(=O)(=O)C 1458a_100000737124_100000210202 [1,1,0,0,0,0|2,0,0]=4 1167 B9R0.21 CNC(=O)CCS(=O)(=O)C 11a_106832991635_100000737124 [1,1,0,0,0,0|2,0,0]=4 1168 B9R0.21 CNC(=O)CCS(=O)(=O)C 1626a_100102657272_100000737124 [1,1,0,0,0,0|2,0,0]=4 1169 B9R0.21 CNC(=O)CCS(=O)(=O)C 240690a_100102657272_100000737124 [1,1,0,0,0,0|2,0,0]=4 1170 B9R0.21 CNC(=O)CCS(=O)(=O)C 527a_100102657272_100000737124 [1,1,0,0,0,0|2,0,0]=4 1171 B9R0.23 CCC(=O)C(C)OC(=O)C 1458a_100000210414_100009818208 [1,1,0,0,0,0|2,0,0]=4 1172 B9R0.23 CCC(=O)[C@@H](C)NC(=O)C 1458a_100011504603_100000210202 [1,1,0,0,0,0|2,0,0]=4 1173 B9R0.23 CCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000210202 [1,1,0,0,0,0|2,0,0]=4 1174 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 11a_100000684985_100015343762 [1,1,0,0,0,0|2,0,0]=4 1175 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 11a_106832991635_100011504603 [1,1,0,0,0,0|2,0,0]=4 1176 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 1626a_100102657272_100011504603 [1,1,0,0,0,0|2,0,0]=4 1177 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 240690a_100000684985_100015343762 [1,1,0,0,0,0|2,0,0]=4 1178 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 240690a_100102657272_100011504603 [1,1,0,0,0,0|2,0,0]=4 1179 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 527a_100000684985_100103153847 [1,1,0,0,0,0|2,0,0]=4 1180 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 527a_100102657272_100011504603 [1,1,0,0,0,0|2,0,0]=4 1181 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 11a_106832991635_100009816467 [1,1,0,0,0,0|2,0,0]=4 1182 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 1626a_100102657272_100009816467 [1,1,0,0,0,0|2,0,0]=4 1183 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 240690a_100102657272_100009816467 [1,1,0,0,0,0|2,0,0]=4 1184 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 527a_100102657272_100009816467 [1,1,0,0,0,0|2,0,0]=4 1185 B9R0.23 COC(=O)C(C)CN(C)C 269982a_100102631434_100000698445 [1,1,0,0,0,0|2,0,0]=4 1186 B9R0.23 COC(=O)[C@@H](C)NC(=O)C 188690a_100000687819_100015343762 [1,1,0,0,0,0|1,0,0]=3 1187 B9R0.42 C=C(C)C(=O)CC(=O)OC 1458a_100000185857_100000747449 [1,1,0,0,0,0|1,0,1]=4 1188 B9R0.42 CCC(=O)CC(=O)C(=O)C 1458a_100000210414_100011261029 [1,1,0,0,0,0|1,0,1]=4 1189 B9R0.42 CCC(=O)CN(C)C(=O)C 1458a_100000194957_100000210202 [1,1,0,0,0,0|2,0,0]=4 1190 B9R0.42 CCC(=O)NC(C)C(=O)C 1458a_100000194823_200000210301 [1,1,0,0,0,0|2,0,0]=4 1191 B9R0.42 CCC(=O)NC(C)C(=O)[13CH3] 1458a_100000194823_200025704644 [1,1,0,0,0,0|2,0,0]=4 1192 B9R0.42 CNC(=O)CN(C)C(=O)C 11a_100000189611_100015343762 [1,1,0,0,0,0|2,0,0]=4 1193 B9R0.42 CNC(=O)CN(C)C(=O)C 11a_106832991635_100000194957 [1,1,0,0,0,0|2,0,0]=4 1194 B9R0.42 CNC(=O)CN(C)C(=O)C 1626a_100102657272_100000194957 [1,1,0,0,0,0|2,0,0]=4 1195 B9R0.42 CNC(=O)CN(C)C(=O)C 240690a_100000189611_100015343762 [1,1,0,0,0,0|2,0,0]=4 1196 B9R0.42 CNC(=O)CN(C)C(=O)C 240690a_100102657272_100000194957 [1,1,0,0,0,0|2,0,0]=4 1197 B9R0.42 CNC(=O)CN(C)C(=O)C 527a_100000189611_100103153847 [1,1,0,0,0,0|2,0,0]=4 1198 B9R0.42 CNC(=O)CN(C)C(=O)C 527a_100102657272_100000194957 [1,1,0,0,0,0|2,0,0]=4 1199 B9R0.42 COC(=O)CC(C)C(=O)C 1458a_100000037256_200000210301 [1,1,0,0,0,0|0,0,0]=2 1200 B9R0.42 COC(=O)CC(C)C(=O)[13CH3] 1458a_100000037256_200025704644 [1,1,0,0,0,0|0,0,0]=2 1201 B9R0.42 COC(=O)CC(C)N(C)C 2230a_100102631434_100009817358 [1,1,0,0,0,0|2,0,0]=4 1202 B9R0.42 COC(=O)CC(C)N(C)C 269982a_100102631434_100009817358 [1,1,0,0,0,0|2,0,0]=4 1203 B9R0.42 COC(=O)CN(C)C(=O)C 11a_100000198492_100015343762 [1,1,0,0,0,0|1,0,0]=3 1204 B9R0.42 COC(=O)CN(C)C(=O)C 1626a_100000198492_100015343762 [1,1,0,0,0,0|1,0,0]=3 1205 B9R0.42 COC(=O)CN(C)C(=O)C 240690a_100000198492_100015343762 [1,1,0,0,0,0|1,0,0]=3 1206 B9R0.42 COC(=O)CN(C)C(=O)C 527a_100000198492_100103153847 [1,1,0,0,0,0|1,0,0]=3 1207 B9R0.43 COC(CCC(=O)C)OC 1458a_100000070787_100000139399 [1,1,0,0,0,0|0,0,2]=4 1208 B9R0.43 COC(CCC(=O)C)OC 1458a_200000082759_200000210301 [1,1,0,0,0,0|0,0,2]=4 1209 B9R0.43 COC(CCC(=O)[13CH3])OC 1458a_200000082759_200025704644 [1,1,0,0,0,0|0,0,2]=4 1210 B9R0.48 C=C(C)CCC(=O)C#CC 1458a_100000763181_100000730704 [1,1,0,0,0,0|2,0,0]=4 1211 B9R0.48 C=C(C)CCC(=O)C=CC 1458a_100000210699_100000730704 [1,1,0,0,0,0|2,0,0]=4 1212 B9R0.48 C=C(C)CCC(=O)CCC 1458a_100000211992_100000730704 [1,1,0,0,0,0|2,0,0]=4 1213 B9R0.48 C=C(C)CCC(=O)CCC 1458a_200000688413_100000210303 [1,1,0,0,0,0|2,0,0]=4 1214 B9R0.48 C=C(C)CCC(=O)CCF 1458a_200000688413_100011217306 [1,1,0,0,0,0|2,0,0]=4 1215 B9R0.48 C=C(C)CCC(=O)CCO 1458a_100011216618_100000730704 [1,1,0,0,0,0|2,0,0]=4 1216 B9R0.48 C=C(C)CCC(=O)CCO 1458a_200000688413_100000211926 [1,1,0,0,0,0|2,0,0]=4 1217 B9R0.48 C=C(C)CCC(=O)COC 1458a_100000210968_100000730704 [1,1,0,0,0,0|1,0,0]=3 1218 B9R0.48 C=C(C)CCC(=O)CSC 1458a_100000184570_100000730704 [1,1,0,0,0,0|1,1,0]=4 1219 B9R0.48 C=C(C)CCC(=O)NCC 11a_100015525214_200000688413 [1,1,0,0,0,0|2,0,0]=4 1220 B9R0.48 C=C(C)CCC(=O)NCC 240690a_100015525214_200000688413 [1,1,0,0,0,0|2,0,0]=4 1221 B9R0.48 C=C(C)CCC(=O)NCC 527a_100015525214_200000688413 [1,1,0,0,0,0|2,0,0]=4 1222 B9R0.48 C=C(C)CCC(=O)NNC 22a_100016993582_200000688413 [1,1,0,0,0,0|2,0,0]=4 1223 B9R0.48 C=C(C)CNC(=O)COC 11a_100000765925_100000210968 [1,1,0,0,0,0|2,0,0]=4 1224 B9R0.48 C=C(C)CNC(=O)COC 1626a_100000765925_100000210968 [1,1,0,0,0,0|2,0,0]=4 1225 B9R0.48 C=C(C)CNC(=O)COC 240690a_100000765925_100000210968 [1,1,0,0,0,0|2,0,0]=4 1226 B9R0.48 C=C(C)CNC(=O)COC 527a_100000765925_100000210968 [1,1,0,0,0,0|2,0,0]=4 1227 B9R0.48 CC(=O)NCC(=O)CCF 1458a_100000194580_100011217306 [1,1,0,0,0,0|2,0,0]=4 1228 B9R0.48 CC(=O)NCC(=O)CCO 1458a_100000194580_100000211926 [1,1,0,0,0,0|2,0,0]=4 1229 B9R0.48 CC(=O)OCC(=O)CCF 1458a_100000183556_100011217306 [1,1,0,0,0,0|2,0,0]=4 1230 B9R0.48 CC(=O)OCC(=O)CCO 1458a_100000183556_100000211926 [1,1,0,0,0,0|2,0,0]=4 1231 B9R0.48 CC(=O)OCC(=O)CS[13CH3] 62a_100000036994_200025704644 [1,1,0,0,0,0|1,1,0]=4 1232 B9R0.48 CC(=O)OCC(=O)CS[13CH3] 62a_200025704644_100000036994 [1,1,0,0,0,0|1,1,0]=4 1233 B9R0.48 CC(=O)SCC(=O)CCF 1458a_100000049016_100011217306 [1,1,0,0,0,0|2,0,0]=4 1234 B9R0.48 CC(=O)SCC(=O)CCO 1458a_100000049016_100000211926 [1,1,0,0,0,0|2,0,0]=4 1235 B9R0.48 CCCC(=O)CCC(=O)N 1458a_100011215257_100000210303 [1,1,0,0,0,0|2,0,0]=4 1236 B9R0.48 CCCC(=O)CNC(=O)C 1458a_100000194580_100000210303 [1,1,0,0,0,0|2,0,0]=4 1237 B9R0.48 CCCC(=O)COC(=O)C 1458a_100000183556_100000210303 [1,1,0,0,0,0|2,0,0]=4 1238 B9R0.48 CCCC(=O)CSC(=O)C 1458a_100000049016_100000210303 [1,1,0,0,0,0|2,0,0]=4 1239 B9R0.48 CCCC(=O)OCC(=O)C 1458a_100000070787_100000034017 [1,1,0,0,0,0|2,0,0]=4 1240 B9R0.48 CCNC(=O)CCC(=O)C 1458a_100000199579_200000210301 [1,1,0,0,0,0|1,0,0]=3 1241 B9R0.48 CCNC(=O)CCC(=O)N 240690a_100015525214_100011215257 [1,1,0,0,0,0|2,0,0]=4 1242 B9R0.48 CCNC(=O)CCC(=O)N 527a_100015525214_100011215257 [1,1,0,0,0,0|2,0,0]=4 1243 B9R0.48 CCNC(=O)CCC(=O)[13CH3] 1458a_100000199579_200025704644 [1,1,0,0,0,0|1,0,0]=3 1244 B9R0.48 CCNC(=O)CNC(=O)C 11a_100015525214_100000194580 [1,1,0,0,0,0|2,0,0]=4 1245 B9R0.48 CCNC(=O)CNC(=O)C 11a_100016988866_100015343762 [1,1,0,0,0,0|2,0,0]=4 1246 B9R0.48 CCNC(=O)CNC(=O)C 1626a_100016988866_100015343762 [1,1,0,0,0,0|2,0,0]=4 1247 B9R0.48 CCNC(=O)CNC(=O)C 240690a_100015525214_100000194580 [1,1,0,0,0,0|2,0,0]=4 1248 B9R0.48 CCNC(=O)CNC(=O)C 240690a_100016988866_100015343762 [1,1,0,0,0,0|2,0,0]=4 1249 B9R0.48 CCNC(=O)CNC(=O)C 527a_100015525214_100000194580 [1,1,0,0,0,0|2,0,0]=4 1250 B9R0.48 CCNC(=O)CNC(=O)C 527a_100016988866_100103153847 [1,1,0,0,0,0|2,0,0]=4 1251 B9R0.48 CCNC(=O)COC(=O)C 240690a_100015525214_100000183556 [1,1,0,0,0,0|2,0,0]=4 1252 B9R0.48 CCNC(=O)COC(=O)C 527a_100015525214_100000183556 [1,1,0,0,0,0|2,0,0]=4 1253 B9R0.48 CCNC(=O)CSC(=O)C 11a_100015525214_100000049016 [1,1,0,0,0,0|2,0,0]=4 1254 B9R0.48 CCNC(=O)CSC(=O)C 240690a_100015525214_100000049016 [1,1,0,0,0,0|2,0,0]=4 1255 B9R0.48 CCOC(=O)C=CC(=O)C 1458a_100000210415_200000210301 [1,1,0,0,0,0|0,0,2]=4 1256 B9R0.48 CCOC(=O)C=CC(=O)[13CH3] 1458a_100000210415_200025704644 [1,1,0,0,0,0|0,0,2]=4 1257 B9R0.48 CCOC(=O)CCC(=O)C 1458a_100000183558_200000210301 [1,1,0,0,0,0|0,0,0]=2 1258 B9R0.48 CCOC(=O)CCC(=O)[13CH3] 1458a_100000183558_200025704644 [1,1,0,0,0,0|0,0,0]=2 1259 B9R0.48 CCOC(=O)CCN(C)C 2230a_100000745921_200000210301 [1,1,0,0,0,0|2,0,0]=4 1260 B9R0.48 CCOC(=O)CCN(C)C 2230a_100102631434_100011206558 [1,1,0,0,0,0|2,0,0]=4 1261 B9R0.48 CCOC(=O)CCN(C)C 269982a_100000745921_200000210301 [1,1,0,0,0,0|2,0,0]=4 1262 B9R0.48 CCOC(=O)CCN(C)C 269982a_100102631434_100011206558 [1,1,0,0,0,0|2,0,0]=4 1263 B9R0.48 CCOC(=O)CCN(C)[13CH3] 2230a_100000745921_200025704644 [1,1,0,0,0,0|2,0,0]=4 1264 B9R0.48 CCOC(=O)CCN(C)[13CH3] 269982a_100000745921_200025704644 [1,1,0,0,0,0|2,0,0]=4 1265 B9R0.48 CCOC(=O)CNC(=O)C 188690a_100000741813_100015343762 [1,1,0,0,0,0|1,0,0]=3 1266 B9R0.48 CCOC(=O)NCC(=O)C 1458a_100000190774_200000210301 [1,1,0,0,0,0|1,0,0]=3 1267 B9R0.48 CCOC(=O)NCC(=O)[13CH3] 1458a_100000190774_200025704644 [1,1,0,0,0,0|1,0,0]=3 1268 B9R0.48 CNCC(=O)COC(=O)C 34a_100102657272_100000036994 [1,1,0,0,0,0|2,0,0]=4 1269 B9R0.48 CNCC(=O)NCC(=O)O 269956a_100000183575_200000210301 [1,1,0,0,0,0|2,0,0]=4 1270 B9R0.48 CNNC(=O)CCC(=O)N 22a_100016993582_100011215257 [1,1,0,0,0,0|2,0,0]=4 1271 B9R0.48 CNNC(=O)CNC(=O)C 22a_100016993582_100000194580 [1,1,0,0,0,0|2,0,0]=4 1272 B9R0.48 CNNC(=O)COC(=O)C 22a_100016993582_100000183556 [1,1,0,0,0,0|2,0,0]=4 1273 B9R0.48 COCC(=O)CC=C(C)C 1458a_100000210968_100000761012 [1,1,0,0,0,0|1,0,1]=4 1274 B9R0.48 COCC(=O)CCC(C)C 1458a_100000210968_100000210312 [1,1,0,0,0,0|1,0,1]=4 1275 B9R0.48 COCC(=O)CCC(C)O 1458a_100000210968_100012276601 [1,1,0,0,0,0|0,0,2]=4 1276 B9R0.48 COCC(=O)COC(=O)C 34a_100138415774_100000036994 [1,1,0,0,0,0|1,0,0]=3 1277 B9R0.48 COCC(=O)NCC(=O)N 11a_100000711301_100000210968 [1,1,0,0,0,0|2,0,0]=4 1278 B9R0.48 COCC(=O)NCC(=O)N 240690a_100000711301_100000210968 [1,1,0,0,0,0|2,0,0]=4 1279 B9R0.48 COCC(=O)NCC(=O)N 527a_100000711301_100000210968 [1,1,0,0,0,0|2,0,0]=4 1280 B9R0.48 COCC(=O)NNC(=O)C 22a_100000189765_100000210968 [1,1,0,0,0,0|2,0,0]=4 1281 B9R0.48 COCC(=O)NNC(=O)C 22a_100000216845_100000070787 [1,1,0,0,0,0|2,0,0]=4 1282 B9R0.48 CSCC(=O)COC(=O)C 62a_100000036994_200000210301 [1,1,0,0,0,0|1,1,0]=4 1283 B9R0.48 CSCC(=O)COC(=O)C 62a_200000210301_100000036994 [1,1,0,0,0,0|1,1,0]=4 1284 B9R0.48 NC(=O)CCC(=O)CCF 1458a_100011215257_100011217306 [1,1,0,0,0,0|2,0,0]=4 1285 B9R0.48 NC(=O)CCC(=O)CCO 1458a_100011215257_100000211926 [1,1,0,0,0,0|2,0,0]=4 1286 B9R0.48 [13CH3]NCC(=O)NCC(=O)O 269956a_100000183575_200025704644 [1,1,0,0,0,0|2,0,0]=4 1287 B9R0.64 CCS(=O)(=O)CCC(=O)C 1458a_100000070787_100000756660 [1,1,0,0,0,0|2,0,0]=4 1288 B9R0.22 CNS(=O)(=O)CC(=O)OC 270084a_100102657272_100000736875 [0,1,0,0,1,0|2,0,0]=4 1289 B9R0.22 CNS(=O)(=O)CC(=O)OC 274078a_100102657272_100000736875 [0,1,0,0,1,0|2,0,0]=4 1290 B9R0.22 COC(=O)CC(C)(C)OC 7a_100015205050_200000210301 [0,1,0,0,1,0|1,0,1]=4 1291 B9R0.22 COC(=O)CC(C)(C)O[13CH3] 7a_100015205050_200025704644 [0,1,0,0,1,0|1,0,1]=4 1292 B9R0.26 CC[C@@H](CC(=O)OC)OC 7a_200015357724_200000210301 [0,1,0,0,1,0|1,0,1]=4 1293 B9R0.26 CC[C@@H](CC(=O)OC)O[13CH3] 7a_200015357724_200025704644 [0,1,0,0,1,0|1,0,1]=4 1294 B9R0.26 COC(=O)C[C@H](CCl)OC 7a_100000754131_200000210301 [0,1,0,0,1,0|1,0,1]=4 1295 B9R0.26 COC(=O)C[C@H](CCl)O[13CH3] 7a_100000754131_200025704644 [0,1,0,0,1,0|1,0,1]=4 1296 B9R0.27 C#CC(=O)C(C)C(=O)OC 1458a_100000211873_100000211248 [0,1,0,0,1,0|1,0,1]=4 1297 B9R0.27 C=CC(=O)C(C)C(=O)OC 1458a_100000185746_100000211248 [0,1,0,0,1,0|1,0,1]=4 1298 B9R0.27 CCC(=O)C(C)C(=O)CC 1458a_100000210414_100000742827 [0,1,0,0,1,0|2,0,0]=4 1299 B9R0.27 CCC(=O)C(C)C(=O)NC 1458a_100000210414_100000209862 [0,1,0,0,1,0|2,0,0]=4 1300 B9R0.27 CCC(=O)C(C)C(=O)OC 1458a_100000210414_100000211248 [0,1,0,0,1,0|1,0,0]=3 1301 B9R0.27 CCC(=O)C(C)C(=O)OC 1458a_100012027023_100000210202 [0,1,0,0,1,0|1,0,0]=3 1302 B9R0.27 CCC(=O)C(F)C(=O)NC 1458a_100000210414_100009813575 [0,1,0,0,1,0|2,0,0]=4 1303 B9R0.27 CNC(=O)C(C)C(=O)OC 11a_106832991635_100012027023 [0,1,0,0,1,0|1,0,0]=3 1304 B9R0.27 CNC(=O)C(C)C(=O)OC 1626a_100102657272_100012027023 [0,1,0,0,1,0|1,0,0]=3 1305 B9R0.27 CNC(=O)C(C)C(=O)OC 240690a_100102657272_100012027023 [0,1,0,0,1,0|1,0,0]=3 1306 B9R0.27 CNC(=O)C(C)C(=O)OC 527a_100102657272_100012027023 [0,1,0,0,1,0|1,0,0]=3 1307 B9R0.27 COC(=O)C(C)C(=O)CF 1458a_100012027023_100015361967 [0,1,0,0,1,0|2,0,0]=4 1308 B9R0.27 COC(=O)C(C)C(=O)CO 1458a_100000210174_100000211248 [0,1,0,0,1,0|2,0,0]=4 1309 B9R0.27 COC(=O)[C@@H](N)[C@@H](C)OC 34a_100000004424_200000210301 [0,1,0,0,1,0|1,0,1]=4 1310 B9R0.27 COC(=O)[C@@H](N)[C@@H](C)O[13CH3] 34a_100000004424_200025704644 [0,1,0,0,1,0|1,0,1]=4 1311 B11R0.109 C=C(C)C(=O)CCCC(=O)NC 1458a_100000185857_100000741757 [0,1,0,0,0,1|2,0,0]=4 1312 B11R0.109 C=C(C)C(=O)CCCC(=O)OC 1458a_100000185857_100011218270 [0,1,0,0,0,1|1,0,0]=3 1313 B11R0.109 C=C(C)C(=O)CCOC(=O)NC 1458a_100000185857_200011997002 [0,1,0,0,0,1|2,0,0]=4 1314 B11R0.109 C=C(C)C(=O)NCCC(=O)NC 11a_100000738227_100000185857 [0,1,0,0,0,1|2,0,0]=4 1315 B11R0.109 C=C(C)C(=O)NCCC(=O)OC 188690a_100000683876_100000185857 [0,1,0,0,0,1|1,0,0]=3 1316 B11R0.109 C=C(C)C(=O)OCCC(=O)CC 1458a_100000210414_100009816335 [0,1,0,0,0,1|2,0,0]=4 1317 B11R0.109 CCC(=O)CCCC(=O)N(C)C 1458a_100000210414_100000737642 [0,1,0,0,0,1|2,0,0]=4 1318 B11R0.109 CCC(=O)COCC(=O)C(=O)C 34a_100000725409_100011261029 [0,1,0,0,0,1|2,0,0]=4 1319 B11R0.109 CCC(=O)COCC(=O)C(C)C 34a_100000725409_100000753385 [0,1,0,0,0,1|2,0,0]=4 1320 B11R0.109 CCC(=O)COCC(=O)N(C)C 34a_100000725409_100000692301 [0,1,0,0,0,1|2,0,0]=4 1321 B11R0.109 CCC(=O)CSCC(=O)C(=O)C 62a_100000747405_100011261029 [0,1,0,0,0,1|2,0,0]=4 1322 B11R0.109 CCC(=O)CSCC(=O)C(=O)C 62a_100011261029_100000747405 [0,1,0,0,0,1|2,0,0]=4 1323 B11R0.109 CCC(=O)CSCC(=O)C(C)C 62a_100000747405_100000753385 [0,1,0,0,0,1|2,0,0]=4 1324 B11R0.109 CCC(=O)CSCC(=O)C(C)C 62a_100000753385_100000747405 [0,1,0,0,0,1|2,0,0]=4 1325 B11R0.109 CCC(=O)CSCC(=O)N(C)C 1458a_100000150165_100000210202 [0,1,0,0,0,1|2,0,0]=4 1326 B11R0.109 CCC(=O)CSCC(=O)N(C)C 62a_100000692301_100000747405 [0,1,0,0,0,1|2,0,0]=4 1327 B11R0.109 CCC(=O)CSCC(=O)N(C)C 62a_100000747405_100000692301 [0,1,0,0,0,1|2,0,0]=4 1328 B11R0.109 CCC(=O)NCCC(=O)N(C)C 11a_100000738053_100000210414 [0,1,0,0,0,1|2,0,0]=4 1329 B11R0.109 CCC(=O)NCCC(=O)N(C)C 240690a_100000738053_100000210414 [0,1,0,0,0,1|2,0,0]=4 1330 B11R0.109 CCC(=O)NCCC(=O)N(C)C 527a_100000738053_100000210414 [0,1,0,0,0,1|2,0,0]=4 1331 B11R0.109 CNC(=O)CCCC(=O)C(C)C 1458a_100000210198_100000741757 [0,1,0,0,0,1|2,0,0]=4 1332 B11R0.109 CNC(=O)CCCC(=O)C(C)F 1458a_100000062450_100000741757 [0,1,0,0,0,1|2,0,0]=4 1333 B11R0.109 CNC(=O)CCCC(=O)[C@@H](C)O 1458a_100000717761_100000741757 [0,1,0,0,0,1|2,0,0]=4 1334 B11R0.109 CNC(=O)CCCC(=O)[C@H](C)O 1458a_217856618621_100000741757 [0,1,0,0,0,1|2,0,0]=4 1335 B11R0.109 CNC(=O)CCNC(=O)C(C)C 11a_100000738227_100000210198 [0,1,0,0,0,1|2,0,0]=4 1336 B11R0.109 CNC(=O)CCNC(=O)C(C)C 240690a_100000738227_100000210198 [0,1,0,0,0,1|2,0,0]=4 1337 B11R0.109 CNC(=O)CCNC(=O)C(C)C 527a_100000738227_100000210198 [0,1,0,0,0,1|2,0,0]=4 1338 B11R0.109 CNC(=O)CCNC(=O)C(C)F 11a_100000738227_100000062450 [0,1,0,0,0,1|2,0,0]=4 1339 B11R0.109 CNC(=O)CCNC(=O)C(C)F 240690a_100000738227_100000062450 [0,1,0,0,0,1|2,0,0]=4 1340 B11R0.109 CNC(=O)CCNC(=O)C(C)F 527a_100000738227_100000062450 [0,1,0,0,0,1|2,0,0]=4 1341 B11R0.109 CNC(=O)CCNC(=O)[C@@H](C)O 240690a_100000738227_100000717761 [0,1,0,0,0,1|2,0,0]=4 1342 B11R0.109 CNC(=O)CCNC(=O)[C@H](C)O 240690a_100000738227_217856618621 [0,1,0,0,0,1|2,0,0]=4 1343 B11R0.109 CNC(=O)CNCC(=O)C(C)C 2230a_100000693194_100000753385 [0,1,0,0,0,1|2,0,0]=4 1344 B11R0.109 CNC(=O)CNCC(=O)N(C)C 2230a_100000693194_100000185267 [0,1,0,0,0,1|2,0,0]=4 1345 B11R0.109 CNC(=O)CNCC(=O)N(C)C 2230a_100015183351_100000183359 [0,1,0,0,0,1|2,0,0]=4 1346 B11R0.109 CNC(=O)COCC(=O)C(=O)C 34a_100000750040_100011261029 [0,1,0,0,0,1|2,0,0]=4 1347 B11R0.109 CNC(=O)COCC(=O)C(C)C 34a_100000750040_100000753385 [0,1,0,0,0,1|2,0,0]=4 1348 B11R0.109 CNC(=O)COCC(=O)N(C)C 34a_100000750040_100000692301 [0,1,0,0,0,1|2,0,0]=4 1349 B11R0.109 CNC(=O)CSCC(=O)C(=O)C 62a_100000183359_100011261029 [0,1,0,0,0,1|2,0,0]=4 1350 B11R0.109 CNC(=O)CSCC(=O)C(=O)C 62a_100011261029_100000183359 [0,1,0,0,0,1|2,0,0]=4 1351 B11R0.109 CNC(=O)CSCC(=O)C(C)C 62a_100000183359_100000753385 [0,1,0,0,0,1|2,0,0]=4 1352 B11R0.109 CNC(=O)CSCC(=O)C(C)C 62a_100000753385_100000183359 [0,1,0,0,0,1|2,0,0]=4 1353 B11R0.109 CNC(=O)CSCC(=O)N(C)C 11a_106832991635_100000150165 [0,1,0,0,0,1|2,0,0]=4 1354 B11R0.109 CNC(=O)CSCC(=O)N(C)C 1626a_100102657272_100000150165 [0,1,0,0,0,1|2,0,0]=4 1355 B11R0.109 CNC(=O)CSCC(=O)N(C)C 240690a_100102657272_100000150165 [0,1,0,0,0,1|2,0,0]=4 1356 B11R0.109 CNC(=O)CSCC(=O)N(C)C 62a_100000183359_100000692301 [0,1,0,0,0,1|2,0,0]=4 1357 B11R0.109 CNC(=O)CSCC(=O)N(C)C 62a_100000692301_100000183359 [0,1,0,0,0,1|2,0,0]=4 1358 B11R0.109 CNC(=O)NCCC(=O)N(C)C 2708a_100000738053_106832991635 [0,1,0,0,0,1|2,0,0]=4 1359 B11R0.109 CNC(=O)NCCC(=O)N(C)C 2708a_100102657272_100000738053 [0,1,0,0,0,1|2,0,0]=4 1360 B11R0.109 CNC(=O)NCCC(=O)N(C)C 273464a_100000738053_100102657272 [0,1,0,0,0,1|2,0,0]=4 1361 B11R0.109 CNC(=O)NCCC(=O)N(C)C 273464a_100102657272_100000738053 [0,1,0,0,0,1|2,0,0]=4 1362 B11R0.109 CNC(=O)NCCC(=O)N(C)C 512a_100000738053_100102657272 [0,1,0,0,0,1|2,0,0]=4 1363 B11R0.109 CNC(=O)NCCC(=O)N(C)C 512a_106832991638_100000738053 [0,1,0,0,0,1|2,0,0]=4 1364 B11R0.109 CNC(=O)OCCC(=O)C(C)C 1458a_100000210198_200011997002 [0,1,0,0,0,1|2,0,0]=4 1365 B11R0.109 CNC(=O)OCCC(=O)C(C)F 1458a_100000062450_200011997002 [0,1,0,0,0,1|2,0,0]=4 1366 B11R0.109 CNC(=O)OCCC(=O)[C@@H](C)O 1458a_100000717761_200011997002 [0,1,0,0,0,1|2,0,0]=4 1367 B11R0.109 CNC(=O)OCCC(=O)[C@H](C)O 1458a_217856618621_200011997002 [0,1,0,0,0,1|2,0,0]=4 1368 B11R0.109 COC(=O)CCCC(=O)C(C)C 1458a_100000210198_100011218270 [0,1,0,0,0,1|1,0,0]=3 1369 B11R0.109 COC(=O)CCCC(=O)C(C)C 1458a_100000239890_100000210206 [0,1,0,0,0,1|1,0,0]=3 1370 B11R0.109 COC(=O)CCCC(=O)C(C)F 1458a_100000062450_100011218270 [0,1,0,0,0,1|1,0,0]=3 1371 B11R0.109 COC(=O)CCCC(=O)C(O)O 1458a_100000233687_100011218270 [0,1,0,0,0,1|2,0,0]=4 1372 B11R0.109 COC(=O)CCCC(=O)N(C)C 11a_100102631434_100000239890 [0,1,0,0,0,1|1,0,0]=3 1373 B11R0.109 COC(=O)CCCC(=O)N(C)C 1626a_100102631434_100000239890 [0,1,0,0,0,1|1,0,0]=3 1374 B11R0.109 COC(=O)CCCC(=O)N(C)C 240690a_100102631434_100000239890 [0,1,0,0,0,1|1,0,0]=3 1375 B11R0.109 COC(=O)CCCC(=O)N(C)C 527a_100102631434_100000239890 [0,1,0,0,0,1|1,0,0]=3 1376 B11R0.109 COC(=O)CCCC(=O)[C@@H](C)O 1458a_100000717761_100011218270 [0,1,0,0,0,1|1,0,0]=3 1377 B11R0.109 COC(=O)CCCC(=O)[C@H](C)O 1458a_217856618621_100011218270 [0,1,0,0,0,1|1,0,0]=3 1378 B11R0.109 COC(=O)CCNC(=O)C(C)C 188690a_100000683876_100000210198 [0,1,0,0,0,1|1,0,0]=3 1379 B11R0.109 COC(=O)CCNC(=O)C(C)F 188690a_100000683876_100000062450 [0,1,0,0,0,1|1,0,0]=3 1380 B11R0.109 COC(=O)CCNC(=O)C(O)O 188690a_100000683876_100000233687 [0,1,0,0,0,1|2,0,0]=4 1381 B11R0.109 COC(=O)CCNC(=O)[C@@H](C)O 188690a_100000683876_100000717761 [0,1,0,0,0,1|1,0,0]=3 1382 B11R0.109 COC(=O)CCNC(=O)[C@H](C)O 188690a_100000683876_217856618621 [0,1,0,0,0,1|1,0,0]=3 1383 B11R0.109 COC(=O)CNCC(=O)N(C)C 2230a_100015183351_100000747449 [0,1,0,0,0,1|1,0,0]=3 1384 B11R0.109 COC(=O)CSCC(=O)C(=O)C 62a_100000747449_100011261029 [0,1,0,0,0,1|1,0,0]=3 1385 B11R0.109 COC(=O)CSCC(=O)C(=O)C 62a_100011261029_100000747449 [0,1,0,0,0,1|1,0,0]=3 1386 B11R0.109 COC(=O)CSCC(=O)C(C)C 1458a_100000191316_100000210206 [0,1,0,0,0,1|1,0,0]=3 1387 B11R0.109 COC(=O)CSCC(=O)C(C)C 62a_100000747449_100000753385 [0,1,0,0,0,1|1,0,0]=3 1388 B11R0.109 COC(=O)CSCC(=O)C(C)C 62a_100000753385_100000747449 [0,1,0,0,0,1|1,0,0]=3 1389 B11R0.109 COC(=O)CSCC(=O)N(C)C 11a_100102631434_100000191316 [0,1,0,0,0,1|1,0,0]=3 1390 B11R0.109 COC(=O)CSCC(=O)N(C)C 1626a_100102631434_100000191316 [0,1,0,0,0,1|1,0,0]=3 1391 B11R0.109 COC(=O)CSCC(=O)N(C)C 240690a_100102631434_100000191316 [0,1,0,0,0,1|1,0,0]=3 1392 B11R0.109 COC(=O)CSCC(=O)N(C)C 62a_100000692301_100000747449 [0,1,0,0,0,1|1,0,0]=3 1393 B11R0.109 COC(=O)CSCC(=O)N(C)C 62a_100000747449_100000692301 [0,1,0,0,0,1|1,0,0]=3 1394 B11R0.110 CCC(=O)CC(=O)CC(=O)OC 1458a_100000211351_100000747405 [0,1,0,0,0,1|1,0,0]=3 1395 B11R0.110 CCC(=O)CC(=O)NC(=O)OC 1458a_100000210414_100000010850 [0,1,0,0,0,1|1,0,1]=4 1396 B11R0.110 CCC(=O)CC(C)CC(=O)OC 1458a_100000732146_100000210202 [0,1,0,0,0,1|1,0,0]=3 1397 B11R0.110 CCC(=O)N[C@H](C)CC(=O)OC 188690a_100016994721_100000210414 [0,1,0,0,0,1|1,0,0]=3 1398 B11R0.110 CNC(=O)CC(=O)CC(=O)OC 1458a_100000211351_100000183359 [0,1,0,0,0,1|1,0,0]=3 1399 B11R0.110 CNC(=O)CC(C)CC(=O)OC 11a_106832991635_100000732146 [0,1,0,0,0,1|1,0,0]=3 1400 B11R0.110 CNC(=O)CC(C)CC(=O)OC 1626a_100102657272_100000732146 [0,1,0,0,0,1|1,0,0]=3 1401 B11R0.110 CNC(=O)CC(C)CC(=O)OC 240690a_100102657272_100000732146 [0,1,0,0,0,1|1,0,0]=3 1402 B11R0.110 CNC(=O)CC(C)CC(=O)OC 527a_100102657272_100000732146 [0,1,0,0,0,1|1,0,0]=3 1403 B11R0.110 CNC(=O)CN(C)CC(=O)NC 2230a_100000189611_100000183359 [0,1,0,0,0,1|2,0,0]=4 1404 B11R0.110 CNC(=O)CN(C)CC(=O)OC 2230a_100000189611_100000747449 [0,1,0,0,0,1|1,0,0]=3 1405 B11R0.110 CNC(=O)CN(C)CC(=O)OC 2230a_100000198492_100000183359 [0,1,0,0,0,1|1,0,0]=3 1406 B11R0.110 COC(=O)CC(=O)CC(=O)OC 1458a_100000211351_100000747449 [0,1,0,0,0,1|0,0,0]=2 1407 B11R0.110 COC(=O)CC(C)CC(=O)CF 1458a_100000732146_100015361967 [0,1,0,0,0,1|2,0,0]=4 1408 B11R0.110 COC(=O)CC(C)SC(C)OC 62a_100009817358_100009879195 [0,1,0,0,0,1|1,0,1]=4 1409 B11R0.110 COC(=O)CC(C)SC(C)OC 62a_100009879195_100009817358 [0,1,0,0,0,1|1,0,1]=4 1410 B11R0.110 COC(=O)CN(C)CC(=O)OC 2230a_100000198492_100000747449 [0,1,0,0,0,1|0,0,0]=2 1411 B11R0.110 COC(=O)CN(C)CC(=O)OC 2230a_100000750971_200000210301 [0,1,0,0,0,1|0,0,0]=2 1412 B11R0.110 COC(=O)CN([13CH3])CC(=O)OC 2230a_100000750971_200025704644 [0,1,0,0,0,1|0,0,0]=2 1413 B11R0.110 COC(=O)C[C@@H](C)NC(=O)CO 188690a_100016994721_100000210174 [0,1,0,0,0,1|2,0,0]=4 1414 B11R0.120 C#CC(=O)CCC(C)C(=O)OC 1458a_100000211873_100000034942 [0,1,0,0,0,1|1,0,1]=4 1415 B11R0.120 C=CC(=O)CCC(C)C(=O)OC 1458a_100000185746_100000034942 [0,1,0,0,0,1|1,0,1]=4 1416 B11R0.120 C=CC(=O)N(C)CCC(=O)OC 1626a_100025711912_100000185746 [0,1,0,0,0,1|1,0,1]=4 1417 B11R0.120 C=CC(=O)N(C)CCC(=O)OC 240690a_100025711912_200121576911 [0,1,0,0,0,1|1,0,1]=4 1418 B11R0.120 CCC(=O)C(C)NCC(=O)NC 2230a_100000693194_100000742827 [0,1,0,0,0,1|2,0,0]=4 1419 B11R0.120 CCC(=O)C(C)SCC(=O)NC 62a_100000183359_100000742827 [0,1,0,0,0,1|2,0,0]=4 1420 B11R0.120 CCC(=O)C(C)SCC(=O)NC 62a_100000742827_100000183359 [0,1,0,0,0,1|2,0,0]=4 1421 B11R0.120 CCC(=O)C(C)SCC(=O)OC 62a_100000742827_100000747449 [0,1,0,0,0,1|1,0,0]=3 1422 B11R0.120 CCC(=O)C(C)SCC(=O)OC 62a_100000747449_100000742827 [0,1,0,0,0,1|1,0,0]=3 1423 B11R0.120 CCC(=O)CCC(C)C(=O)OC 1458a_100000210414_100000034942 [0,1,0,0,0,1|1,0,0]=3 1424 B11R0.120 CCC(=O)COC(C)C(=O)NC 34a_100000725409_100000731044 [0,1,0,0,0,1|2,0,0]=4 1425 B11R0.120 CCC(=O)COC(C)C(=O)OC 34a_100000725409_100000211248 [0,1,0,0,0,1|1,0,0]=3 1426 B11R0.120 CCC(=O)COC(F)C(=O)NC 34a_100000725409_100009813575 [0,1,0,0,0,1|2,0,0]=4 1427 B11R0.120 CCC(=O)CSC(C)C(=O)CC 62a_100000742827_100000747405 [0,1,0,0,0,1|2,0,0]=4 1428 B11R0.120 CCC(=O)CSC(C)C(=O)CC 62a_100000747405_100000742827 [0,1,0,0,0,1|2,0,0]=4 1429 B11R0.120 CCC(=O)CSC(C)C(=O)NC 62a_100000209862_100000747405 [0,1,0,0,0,1|2,0,0]=4 1430 B11R0.120 CCC(=O)CSC(C)C(=O)NC 62a_100000747405_100000731044 [0,1,0,0,0,1|2,0,0]=4 1431 B11R0.120 CCC(=O)CSC(C)C(=O)OC 62a_100000211248_100000747405 [0,1,0,0,0,1|1,0,0]=3 1432 B11R0.120 CCC(=O)CSC(C)C(=O)OC 62a_100000747405_100000211248 [0,1,0,0,0,1|1,0,0]=3 1433 B11R0.120 CCC(=O)CSC(F)C(=O)NC 62a_100000747405_100009813575 [0,1,0,0,0,1|2,0,0]=4 1434 B11R0.120 CCC(=O)CSC(F)C(=O)NC 62a_100009813575_100000747405 [0,1,0,0,0,1|2,0,0]=4 1435 B11R0.120 CCC(=O)N(C)CCC(=O)NC 11a_100000750875_100000210414 [0,1,0,0,0,1|2,0,0]=4 1436 B11R0.120 CCC(=O)N(C)CCC(=O)NC 240690a_100000750875_100000210414 [0,1,0,0,0,1|2,0,0]=4 1437 B11R0.120 CCC(=O)N(C)CCC(=O)NC 527a_100000750875_100000210414 [0,1,0,0,0,1|2,0,0]=4 1438 B11R0.120 CCC(=O)N(C)CCC(=O)OC 11a_100025711912_100000210414 [0,1,0,0,0,1|1,0,0]=3 1439 B11R0.120 CCC(=O)N(C)CCC(=O)OC 1626a_100025711912_100000210414 [0,1,0,0,0,1|1,0,0]=3 1440 B11R0.120 CCC(=O)N(C)CCC(=O)OC 240690a_100025711912_100000210414 [0,1,0,0,0,1|1,0,0]=3 1441 B11R0.120 CCC(=O)N(C)CCC(=O)OC 527a_100025711912_100000210414 [0,1,0,0,0,1|1,0,0]=3 1442 B11R0.120 CCC(=O)NCC(C)C(=O)NC 11a_100015187722_100000210414 [0,1,0,0,0,1|2,0,0]=4 1443 B11R0.120 CCC(=O)NCC(C)C(=O)NC 240690a_100015187722_100000210414 [0,1,0,0,0,1|2,0,0]=4 1444 B11R0.120 CCC(=O)NCC(C)C(=O)NC 527a_100015187722_100000210414 [0,1,0,0,0,1|2,0,0]=4 1445 B11R0.120 CCC(=O)NCC(O)C(=O)OC 188690a_100000695228_100000210414 [0,1,0,0,0,1|1,0,0]=3 1446 B11R0.120 CNC(=O)C(C)SCC(=O)OC 62a_100000209862_100000747449 [0,1,0,0,0,1|1,0,0]=3 1447 B11R0.120 CNC(=O)C(C)SCC(=O)OC 62a_100000747449_100000731044 [0,1,0,0,0,1|1,0,0]=3 1448 B11R0.120 CNC(=O)C(F)SCC(=O)OC 62a_100000747449_100009813575 [0,1,0,0,0,1|1,0,0]=3 1449 B11R0.120 CNC(=O)C(F)SCC(=O)OC 62a_100009813575_100000747449 [0,1,0,0,0,1|1,0,0]=3 1450 B11R0.120 CNC(=O)CCN(C)C(=O)NC 2708a_100102657272_100000750875 [0,1,0,0,0,1|2,0,0]=4 1451 B11R0.120 CNC(=O)CCN(C)C(=O)NC 273464a_100102657272_100000750875 [0,1,0,0,0,1|2,0,0]=4 1452 B11R0.120 CNC(=O)CNC(=O)C(=O)OC 11a_100000693194_100000024059 [0,1,0,0,0,1|1,0,1]=4 1453 B11R0.120 CNC(=O)CNC(=O)C(=O)OC 240690a_100000693194_100000024059 [0,1,0,0,0,1|1,0,1]=4 1454 B11R0.120 CNC(=O)CNC(=O)C(=O)OC 527a_100000693194_100000024059 [0,1,0,0,0,1|1,0,1]=4 1455 B11R0.120 CNC(=O)CNC(C)C(=O)NC 2230a_100000693194_100000731044 [0,1,0,0,0,1|2,0,0]=4 1456 B11R0.120 CNC(=O)CNC(C)C(=O)OC 2230a_100000693194_100000211248 [0,1,0,0,0,1|1,0,0]=3 1457 B11R0.120 CNC(=O)CNC(F)C(=O)NC 2230a_100000693194_100009813575 [0,1,0,0,0,1|2,0,0]=4 1458 B11R0.120 CNC(=O)CN[C@H](C)C(=O)NC 2230a_100000684985_100000183359 [0,1,0,0,0,1|2,0,0]=4 1459 B11R0.120 CNC(=O)CN[C@H](C)C(=O)NC 34a_100000684985_100000183359 [0,1,0,0,0,1|2,0,0]=4 1460 B11R0.120 CNC(=O)COC(C)C(=O)NC 34a_100000750040_100000731044 [0,1,0,0,0,1|2,0,0]=4 1461 B11R0.120 CNC(=O)COC(C)C(=O)OC 34a_100000750040_100000211248 [0,1,0,0,0,1|1,0,0]=3 1462 B11R0.120 CNC(=O)COC(C)C(=O)OC 34a_100011215400_100000183359 [0,1,0,0,0,1|1,0,0]=3 1463 B11R0.120 CNC(=O)COC(F)C(=O)NC 34a_100000750040_100009813575 [0,1,0,0,0,1|2,0,0]=4 1464 B11R0.120 CNC(=O)CSC(C)C(=O)NC 62a_100000183359_100000731044 [0,1,0,0,0,1|2,0,0]=4 1465 B11R0.120 CNC(=O)CSC(C)C(=O)NC 62a_100000209862_100000183359 [0,1,0,0,0,1|2,0,0]=4 1466 B11R0.120 CNC(=O)CSC(C)C(=O)OC 62a_100000183359_100000211248 [0,1,0,0,0,1|1,0,0]=3 1467 B11R0.120 CNC(=O)CSC(C)C(=O)OC 62a_100000211248_100000183359 [0,1,0,0,0,1|1,0,0]=3 1468 B11R0.120 CNC(=O)CSC(F)C(=O)NC 62a_100000183359_100009813575 [0,1,0,0,0,1|2,0,0]=4 1469 B11R0.120 CNC(=O)CSC(F)C(=O)NC 62a_100009813575_100000183359 [0,1,0,0,0,1|2,0,0]=4 1470 B11R0.120 CNC(=O)NCC(C)C(=O)NC 2708a_100102657272_100015187722 [0,1,0,0,0,1|2,0,0]=4 1471 B11R0.120 CNC(=O)NCC(C)C(=O)NC 273464a_100015187722_100102657272 [0,1,0,0,0,1|2,0,0]=4 1472 B11R0.120 CNC(=O)NCC(C)C(=O)NC 512a_100015187722_100102657272 [0,1,0,0,0,1|2,0,0]=4 1473 B11R0.120 CNC(=O)NCC(C)C(=O)NC 512a_106832991638_100015187722 [0,1,0,0,0,1|2,0,0]=4 1474 B11R0.120 CNC(=O)[C@@H](C)NCC(=O)OC 2230a_100000684985_100000747449 [0,1,0,0,0,1|1,0,0]=3 1475 B11R0.120 CNC(=O)[C@@H](C)NCC(=O)OC 34a_100000684985_100000747449 [0,1,0,0,0,1|1,0,0]=3 1476 B11R0.120 COC(=O)C(C)CCC(=O)CO 1458a_100000210174_100000034942 [0,1,0,0,0,1|2,0,0]=4 1477 B11R0.120 COC(=O)C(C)CSC(C)OC 62a_100000698445_100009879195 [0,1,0,0,0,1|1,0,1]=4 1478 B11R0.120 COC(=O)C(C)CSC(C)OC 62a_100009879195_100000698445 [0,1,0,0,0,1|1,0,1]=4 1479 B11R0.120 COC(=O)C(C)NC[C@@H](C)OC 2230a_100020591295_100000211248 [0,1,0,0,0,1|1,0,1]=4 1480 B11R0.120 COC(=O)C(C)OCC(C)OC 34a_100000690652_100000211248 [0,1,0,0,0,1|1,0,1]=4 1481 B11R0.120 COC(=O)C(O)CNC(=O)CO 188690a_100000695228_100000210174 [0,1,0,0,0,1|2,0,0]=4 1482 B11R0.120 COC(=O)CCN(C)C(=O)CO 240690a_100025711912_100000210174 [0,1,0,0,0,1|2,0,0]=4 1483 B11R0.120 COC(=O)CCN(C)C(=O)CO 527a_100025711912_100000210174 [0,1,0,0,0,1|2,0,0]=4 1484 B11R0.120 COC(=O)CCN(C)C(C)OC 269982a_100025711912_100009879195 [0,1,0,0,0,1|1,0,1]=4 1485 B11R0.120 COC(=O)COC(C)C(=O)NN 34a_100000725659_100000747449 [0,1,0,0,0,1|2,0,0]=4 1486 B11R0.120 COC(=O)COC(C)C(=O)OC 34a_100011215400_100000747449 [0,1,0,0,0,1|0,0,0]=2 1487 B11R0.120 COC(=O)CSC(C)C(=O)OC 62a_100000211248_100000747449 [0,1,0,0,0,1|0,0,0]=2 1488 B11R0.120 COC(=O)CSC(C)C(=O)OC 62a_100000747449_100000211248 [0,1,0,0,0,1|0,0,0]=2 1489 B11R0.174 C#CC(=O)CCCC(=O)OCC 1458a_100000211873_100011215271 [0,1,0,0,0,1|1,0,1]=4 1490 B11R0.174 C#CC(=O)CCNC(=O)OCC 1458a_100000211873_200011445536 [0,1,0,0,0,1|1,0,1]=4 1491 B11R0.174 C#CCC(=O)CCCC(=O)OC 1458a_100000239890_100000184674 [0,1,0,0,0,1|1,0,1]=4 1492 B11R0.174 C#CCC(=O)CCCC(=O)OC 1458a_100011220946_100011218270 [0,1,0,0,0,1|1,0,1]=4 1493 B11R0.174 C#CCC(=O)CSCC(=O)OC 1458a_100000191316_100000184674 [0,1,0,0,0,1|1,0,1]=4 1494 B11R0.174 C#CCC(=O)NCCC(=O)OC 188690a_100000683876_100011220946 [0,1,0,0,0,1|1,0,1]=4 1495 B11R0.174 C=CC(=O)CCCC(=O)OCC 1458a_100000185746_100011215271 [0,1,0,0,0,1|1,0,1]=4 1496 B11R0.174 C=CC(=O)CCNC(=O)OCC 1458a_100000185746_200011445536 [0,1,0,0,0,1|1,0,1]=4 1497 B11R0.174 C=CC(=O)OCCC(=O)COC 1458a_100000210968_100009813456 [0,1,0,0,0,1|1,0,1]=4 1498 B11R0.174 C=CCC(=O)CCCC(=O)OC 1458a_100000210193_100011218270 [0,1,0,0,0,1|1,0,1]=4 1499 B11R0.174 C=CCC(=O)CCCC(=O)OC 1458a_100000239890_100000210623 [0,1,0,0,0,1|1,0,1]=4 1500 B11R0.174 C=CCC(=O)CSCC(=O)OC 1458a_100000191316_100000210623 [0,1,0,0,0,1|1,0,1]=4 1501 B11R0.174 C=CCC(=O)NCCC(=O)OC 188690a_100000683876_100000210193 [0,1,0,0,0,1|1,0,1]=4 1502 B11R0.174 C=COC(=O)CNCC(=O)NC 2230a_100000693194_100000036128 [0,1,0,0,0,1|1,0,1]=4 1503 B11R0.174 C=COC(=O)COCC(=O)CC 34a_100000725409_100000036128 [0,1,0,0,0,1|1,0,1]=4 1504 B11R0.174 C=COC(=O)COCC(=O)NC 34a_100000750040_100000036128 [0,1,0,0,0,1|1,0,1]=4 1505 B11R0.174 C=COC(=O)CSCC(=O)CC 62a_100000036128_100000747405 [0,1,0,0,0,1|1,0,1]=4 1506 B11R0.174 C=COC(=O)CSCC(=O)CC 62a_100000747405_100000036128 [0,1,0,0,0,1|1,0,1]=4 1507 B11R0.174 C=COC(=O)CSCC(=O)NC 62a_100000036128_100000183359 [0,1,0,0,0,1|1,0,1]=4 1508 B11R0.174 C=COC(=O)CSCC(=O)NC 62a_100000183359_100000036128 [0,1,0,0,0,1|1,0,1]=4 1509 B11R0.174 C=COC(=O)CSCC(=O)OC 62a_100000036128_100000747449 [0,1,0,0,0,1|0,0,1]=3 1510 B11R0.174 C=COC(=O)CSCC(=O)OC 62a_100000747449_100000036128 [0,1,0,0,0,1|0,0,1]=3 1511 B11R0.174 CC#CC(=O)CCCC(=O)NC 1458a_100000763181_100000741757 [0,1,0,0,0,1|2,0,0]=4 1512 B11R0.174 CC#CC(=O)CCCC(=O)OC 1458a_100000763181_100011218270 [0,1,0,0,0,1|1,0,0]=3 1513 B11R0.174 CC#CC(=O)CCOC(=O)NC 1458a_100000763181_200011997002 [0,1,0,0,0,1|2,0,0]=4 1514 B11R0.174 CC=CC(=O)CCCC(=O)NC 1458a_100000210699_100000741757 [0,1,0,0,0,1|2,0,0]=4 1515 B11R0.174 CC=CC(=O)CCCC(=O)OC 1458a_100000210699_100011218270 [0,1,0,0,0,1|1,0,0]=3 1516 B11R0.174 CC=CC(=O)CCOC(=O)NC 1458a_100000210699_200011997002 [0,1,0,0,0,1|2,0,0]=4 1517 B11R0.174 CC=CC(=O)NCCC(=O)NC 11a_100000738227_100000210699 [0,1,0,0,0,1|2,0,0]=4 1518 B11R0.174 CC=CC(=O)NCCC(=O)NC 240690a_100000738227_100000210699 [0,1,0,0,0,1|2,0,0]=4 1519 B11R0.174 CC=CC(=O)NCCC(=O)OC 188690a_100000683876_100000210699 [0,1,0,0,0,1|1,0,0]=3 1520 B11R0.174 CCC(=O)COCC(=O)NCO 34a_100000725409_100000185155 [0,1,0,0,0,1|2,0,0]=4 1521 B11R0.174 CCC(=O)CSCC(=O)NCO 62a_100000185155_100000747405 [0,1,0,0,0,1|2,0,0]=4 1522 B11R0.174 CCC(=O)CSCC(=O)NCO 62a_100000747405_100000185155 [0,1,0,0,0,1|2,0,0]=4 1523 B11R0.174 CCCC(=O)CCCC(=O)NC 1458a_100000211992_100000741757 [0,1,0,0,0,1|2,0,0]=4 1524 B11R0.174 CCCC(=O)CCCC(=O)OC 1458a_100000211992_100011218270 [0,1,0,0,0,1|1,0,0]=3 1525 B11R0.174 CCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210303 [0,1,0,0,0,1|1,0,0]=3 1526 B11R0.174 CCCC(=O)CCOC(=O)NC 1458a_100000211992_200011997002 [0,1,0,0,0,1|2,0,0]=4 1527 B11R0.174 CCCC(=O)CNCC(=O)NC 2230a_100000693194_100000747444 [0,1,0,0,0,1|2,0,0]=4 1528 B11R0.174 CCCC(=O)CSCC(=O)CC 62a_100000747405_100000747444 [0,1,0,0,0,1|2,0,0]=4 1529 B11R0.174 CCCC(=O)CSCC(=O)CC 62a_100000747444_100000747405 [0,1,0,0,0,1|2,0,0]=4 1530 B11R0.174 CCCC(=O)CSCC(=O)NC 62a_100000183359_100000747444 [0,1,0,0,0,1|2,0,0]=4 1531 B11R0.174 CCCC(=O)CSCC(=O)NC 62a_100000747444_100000183359 [0,1,0,0,0,1|2,0,0]=4 1532 B11R0.174 CCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210303 [0,1,0,0,0,1|1,0,0]=3 1533 B11R0.174 CCCC(=O)CSCC(=O)OC 62a_100000747444_100000747449 [0,1,0,0,0,1|1,0,0]=3 1534 B11R0.174 CCCC(=O)CSCC(=O)OC 62a_100000747449_100000747444 [0,1,0,0,0,1|1,0,0]=3 1535 B11R0.174 CCCC(=O)NCCC(=O)NC 11a_100000738227_100000211992 [0,1,0,0,0,1|2,0,0]=4 1536 B11R0.174 CCCC(=O)NCCC(=O)NC 240690a_100000738227_100000211992 [0,1,0,0,0,1|2,0,0]=4 1537 B11R0.174 CCCC(=O)NCCC(=O)NC 527a_100000738227_100000211992 [0,1,0,0,0,1|2,0,0]=4 1538 B11R0.174 CCCC(=O)NCCC(=O)OC 188690a_100000683876_100000211992 [0,1,0,0,0,1|1,0,0]=3 1539 B11R0.174 CCNC(=O)CCCC(=O)CC 1458a_100000199580_100000210202 [0,1,0,0,0,1|2,0,0]=4 1540 B11R0.174 CCNC(=O)CCCC(=O)NC 11a_106832991635_100000199580 [0,1,0,0,0,1|2,0,0]=4 1541 B11R0.174 CCNC(=O)CCCC(=O)NC 1626a_100102657272_100000199580 [0,1,0,0,0,1|2,0,0]=4 1542 B11R0.174 CCNC(=O)CCCC(=O)NC 240690a_100102657272_100000199580 [0,1,0,0,0,1|2,0,0]=4 1543 B11R0.174 CCNC(=O)CCCC(=O)NC 527a_100102657272_100000199580 [0,1,0,0,0,1|2,0,0]=4 1544 B11R0.174 CCNC(=O)CCCC(=O)OC 11a_100015525214_100000239890 [0,1,0,0,0,1|1,0,0]=3 1545 B11R0.174 CCNC(=O)CCCC(=O)OC 240690a_100015525214_100000239890 [0,1,0,0,0,1|1,0,0]=3 1546 B11R0.174 CCNC(=O)CCCC(=O)OC 527a_100015525214_100000239890 [0,1,0,0,0,1|1,0,0]=3 1547 B11R0.174 CCNC(=O)CCNC(=O)CC 11a_100025743525_100000210414 [0,1,0,0,0,1|2,0,0]=4 1548 B11R0.174 CCNC(=O)CCNC(=O)CC 1626a_100025743525_100000210414 [0,1,0,0,0,1|2,0,0]=4 1549 B11R0.174 CCNC(=O)CCNC(=O)CC 240690a_100025743525_100000210414 [0,1,0,0,0,1|2,0,0]=4 1550 B11R0.174 CCNC(=O)CCNC(=O)CC 527a_100025743525_100000210414 [0,1,0,0,0,1|2,0,0]=4 1551 B11R0.174 CCNC(=O)CCNC(=O)NC 2708a_100102657272_100025743525 [0,1,0,0,0,1|2,0,0]=4 1552 B11R0.174 CCNC(=O)CCNC(=O)NC 273464a_100025743525_100102657272 [0,1,0,0,0,1|2,0,0]=4 1553 B11R0.174 CCNC(=O)CCNC(=O)NC 273464a_100102657272_100025743525 [0,1,0,0,0,1|2,0,0]=4 1554 B11R0.174 CCNC(=O)CCNC(=O)NC 512a_100025743525_100102657272 [0,1,0,0,0,1|2,0,0]=4 1555 B11R0.174 CCNC(=O)CCNC(=O)NC 512a_106832991638_100025743525 [0,1,0,0,0,1|2,0,0]=4 1556 B11R0.174 CCNC(=O)CNCC(=O)NC 2230a_100000693194_100000183381 [0,1,0,0,0,1|2,0,0]=4 1557 B11R0.174 CCNC(=O)CNCC(=O)NC 2230a_100016988866_100000183359 [0,1,0,0,0,1|2,0,0]=4 1558 B11R0.174 CCNC(=O)CNCC(=O)OC 2230a_100016988866_100000747449 [0,1,0,0,0,1|1,0,0]=3 1559 B11R0.174 CCNC(=O)COCC(=O)CC 34a_100000725409_100000183381 [0,1,0,0,0,1|2,0,0]=4 1560 B11R0.174 CCNC(=O)COCC(=O)NC 34a_100000750040_100000183381 [0,1,0,0,0,1|2,0,0]=4 1561 B11R0.174 CCNC(=O)CSCC(=O)CC 62a_100000183381_100000747405 [0,1,0,0,0,1|2,0,0]=4 1562 B11R0.174 CCNC(=O)CSCC(=O)CC 62a_100000747405_100000183381 [0,1,0,0,0,1|2,0,0]=4 1563 B11R0.174 CCNC(=O)CSCC(=O)NC 62a_100000183359_100000183381 [0,1,0,0,0,1|2,0,0]=4 1564 B11R0.174 CCNC(=O)CSCC(=O)NC 62a_100000183381_100000183359 [0,1,0,0,0,1|2,0,0]=4 1565 B11R0.174 CCNC(=O)CSCC(=O)OC 11a_100015525214_100000191316 [0,1,0,0,0,1|1,0,0]=3 1566 B11R0.174 CCNC(=O)CSCC(=O)OC 240690a_100015525214_100000191316 [0,1,0,0,0,1|1,0,0]=3 1567 B11R0.174 CCNC(=O)CSCC(=O)OC 62a_100000183381_100000747449 [0,1,0,0,0,1|1,0,0]=3 1568 B11R0.174 CCNC(=O)CSCC(=O)OC 62a_100000747449_100000183381 [0,1,0,0,0,1|1,0,0]=3 1569 B11R0.174 CCNC(=O)NCCC(=O)NC 2708a_100015525214_100000738227 [0,1,0,0,0,1|2,0,0]=4 1570 B11R0.174 CCNC(=O)NCCC(=O)NC 273464a_100000738227_100015525214 [0,1,0,0,0,1|2,0,0]=4 1571 B11R0.174 CCNC(=O)NCCC(=O)NC 273464a_100015525214_100000738227 [0,1,0,0,0,1|2,0,0]=4 1572 B11R0.174 CCNC(=O)NCCC(=O)NC 512a_100000738227_100015525214 [0,1,0,0,0,1|2,0,0]=4 1573 B11R0.174 CCNC(=O)NCCC(=O)NC 512a_100015525214_100000738227 [0,1,0,0,0,1|2,0,0]=4 1574 B11R0.174 CCOC(=O)CCCC(=O)CC 1458a_100000210414_100011215271 [0,1,0,0,0,1|1,0,0]=3 1575 B11R0.174 CCOC(=O)CCCC(=O)CC 1458a_100000210991_100000210202 [0,1,0,0,0,1|1,0,0]=3 1576 B11R0.174 CCOC(=O)CCCC(=O)CF 1458a_100000210991_100015361967 [0,1,0,0,0,1|2,0,0]=4 1577 B11R0.174 CCOC(=O)CCCC(=O)CO 1458a_100000210174_100011215271 [0,1,0,0,0,1|2,0,0]=4 1578 B11R0.174 CCOC(=O)CCCC(=O)NC 11a_106832991635_100000210991 [0,1,0,0,0,1|1,0,0]=3 1579 B11R0.174 CCOC(=O)CCCC(=O)NC 1626a_100102657272_100000210991 [0,1,0,0,0,1|1,0,0]=3 1580 B11R0.174 CCOC(=O)CCCC(=O)NC 240690a_100102657272_100000210991 [0,1,0,0,0,1|1,0,0]=3 1581 B11R0.174 CCOC(=O)CCCC(=O)NC 527a_100102657272_100000210991 [0,1,0,0,0,1|1,0,0]=3 1582 B11R0.174 CCOC(=O)CCNC(=O)CC 188690a_100000746078_100000210414 [0,1,0,0,0,1|1,0,0]=3 1583 B11R0.174 CCOC(=O)CCNC(=O)CO 188690a_100000746078_100000210174 [0,1,0,0,0,1|2,0,0]=4 1584 B11R0.174 CCOC(=O)CCSC(C)OC 62a_100000765890_100009879195 [0,1,0,0,0,1|1,0,1]=4 1585 B11R0.174 CCOC(=O)CCSC(C)OC 62a_100009879195_100000765890 [0,1,0,0,0,1|1,0,1]=4 1586 B11R0.174 CCOC(=O)CNCC(=O)NC 2230a_100000693194_100000188475 [0,1,0,0,0,1|1,0,0]=3 1587 B11R0.174 CCOC(=O)CNC[C@@H](C)OC 2230a_100020591295_100000188475 [0,1,0,0,0,1|1,0,1]=4 1588 B11R0.174 CCOC(=O)COCC(=O)CC 34a_100000725409_100000188475 [0,1,0,0,0,1|1,0,0]=3 1589 B11R0.174 CCOC(=O)COCC(=O)NC 34a_100000750040_100000188475 [0,1,0,0,0,1|1,0,0]=3 1590 B11R0.174 CCOC(=O)COCC(C)OC 34a_100000690652_100000188475 [0,1,0,0,0,1|1,0,1]=4 1591 B11R0.174 CCOC(=O)CSCC(=O)CC 62a_100000188475_100000747405 [0,1,0,0,0,1|1,0,0]=3 1592 B11R0.174 CCOC(=O)CSCC(=O)CC 62a_100000747405_100000188475 [0,1,0,0,0,1|1,0,0]=3 1593 B11R0.174 CCOC(=O)CSCC(=O)NC 62a_100000183359_100000188475 [0,1,0,0,0,1|1,0,0]=3 1594 B11R0.174 CCOC(=O)CSCC(=O)NC 62a_100000188475_100000183359 [0,1,0,0,0,1|1,0,0]=3 1595 B11R0.174 CCOC(=O)CSCC(=O)OC 62a_100000188475_100000747449 [0,1,0,0,0,1|0,0,0]=2 1596 B11R0.174 CCOC(=O)CSCC(=O)OC 62a_100000747449_100000188475 [0,1,0,0,0,1|0,0,0]=2 1597 B11R0.174 CCOC(=O)NCCC(=O)CC 1458a_100000210414_200011445536 [0,1,0,0,0,1|1,0,0]=3 1598 B11R0.174 CCOC(=O)NCCC(=O)CO 1458a_100000210174_200011445536 [0,1,0,0,0,1|2,0,0]=4 1599 B11R0.174 CNC(=O)CCCC(=O)CCO 1458a_100011216618_100000741757 [0,1,0,0,0,1|2,0,0]=4 1600 B11R0.174 CNC(=O)CCCC(=O)COC 1458a_100000210968_100000741757 [0,1,0,0,0,1|1,0,0]=3 1601 B11R0.174 CNC(=O)CCCC(=O)CSC 1458a_100000184570_100000741757 [0,1,0,0,0,1|1,1,0]=4 1602 B11R0.174 CNC(=O)CCNC(=O)CCO 240690a_100000738227_100011216618 [0,1,0,0,0,1|2,0,0]=4 1603 B11R0.174 CNC(=O)CCNC(=O)COC 11a_100000738227_100000210968 [0,1,0,0,0,1|1,0,0]=3 1604 B11R0.174 CNC(=O)CCNC(=O)COC 240690a_100000738227_100000210968 [0,1,0,0,0,1|1,0,0]=3 1605 B11R0.174 CNC(=O)CCNC(=O)COC 527a_100000738227_100000210968 [0,1,0,0,0,1|1,0,0]=3 1606 B11R0.174 CNC(=O)CCNC(=O)CSC 11a_100000738227_100000184570 [0,1,0,0,0,1|1,1,0]=4 1607 B11R0.174 CNC(=O)CCNC(=O)CSC 240690a_100000738227_100000184570 [0,1,0,0,0,1|1,1,0]=4 1608 B11R0.174 CNC(=O)CCNC(=O)CSC 527a_100000738227_100000184570 [0,1,0,0,0,1|1,1,0]=4 1609 B11R0.174 CNC(=O)CNCC(=O)NCO 2230a_100000693194_100000185155 [0,1,0,0,0,1|2,0,0]=4 1610 B11R0.174 CNC(=O)COCC(=O)NCO 34a_100000750040_100000185155 [0,1,0,0,0,1|2,0,0]=4 1611 B11R0.174 CNC(=O)CSCC(=O)NCO 62a_100000183359_100000185155 [0,1,0,0,0,1|2,0,0]=4 1612 B11R0.174 CNC(=O)CSCC(=O)NCO 62a_100000185155_100000183359 [0,1,0,0,0,1|2,0,0]=4 1613 B11R0.174 CNC(=O)OCCC(=O)CCO 1458a_100011216618_200011997002 [0,1,0,0,0,1|2,0,0]=4 1614 B11R0.174 CNC(=O)OCCC(=O)COC 1458a_100000210968_200011997002 [0,1,0,0,0,1|1,0,0]=3 1615 B11R0.174 CNC(=O)OCCC(=O)CSC 1458a_100000184570_200011997002 [0,1,0,0,0,1|1,1,0]=4 1616 B11R0.174 CNCC(=O)NCCC(=O)OC 2230a_106832991635_100000230212 [0,1,0,0,0,1|1,0,0]=3 1617 B11R0.174 CNCC(=O)NCCC(=O)OC 34a_100102657272_100000230212 [0,1,0,0,0,1|1,0,0]=3 1618 B11R0.174 CNCC(=O)NCCC(=O)OC 7a_106832991635_100000230212 [0,1,0,0,0,1|1,0,0]=3 1619 B11R0.174 CNNC(=O)CCCC(=O)OC 22a_100016993582_100000239890 [0,1,0,0,0,1|1,0,0]=3 1620 B11R0.174 CNNC(=O)CSCC(=O)OC 22a_100016993582_100000191316 [0,1,0,0,0,1|1,0,0]=3 1621 B11R0.174 CNNC(=O)NCCC(=O)NC 273464a_100000738227_100016993582 [0,1,0,0,0,1|2,0,0]=4 1622 B11R0.174 CNNC(=O)NCCC(=O)NC 512a_100000738227_100016993582 [0,1,0,0,0,1|2,0,0]=4 1623 B11R0.174 CNNC(=O)NCCC(=O)NC 512a_100016993582_100000738227 [0,1,0,0,0,1|2,0,0]=4 1624 B11R0.174 COC(=O)CCCC(=O)C=CBr 1458a_100016273825_100011218270 [0,1,0,0,0,1|1,0,1]=4 1625 B11R0.174 COC(=O)CCCC(=O)C=CCl 1458a_200016279998_100011218270 [0,1,0,0,0,1|1,0,1]=4 1626 B11R0.174 COC(=O)CCCC(=O)C=CI 1458a_100016256311_100011218270 [0,1,0,0,0,1|1,0,1]=4 1627 B11R0.174 COC(=O)CCCC(=O)CC#N 1458a_100000239890_100011214920 [0,1,0,0,0,1|1,0,1]=4 1628 B11R0.174 COC(=O)CCCC(=O)CC#N 1458a_100051588842_100011218270 [0,1,0,0,0,1|1,0,1]=4 1629 B11R0.174 COC(=O)CCCC(=O)CCF 1458a_100000239890_100011217306 [0,1,0,0,0,1|1,0,0]=3 1630 B11R0.174 COC(=O)CCCC(=O)CCO 1458a_100000239890_100000211926 [0,1,0,0,0,1|1,0,0]=3 1631 B11R0.174 COC(=O)CCCC(=O)CCO 1458a_100011216618_100011218270 [0,1,0,0,0,1|1,0,0]=3 1632 B11R0.174 COC(=O)CCCC(=O)CSC 1458a_100000184570_100011218270 [0,1,0,0,0,1|0,1,0]=3 1633 B11R0.174 COC(=O)CCNC(=O)CSC 188690a_100000683876_100000184570 [0,1,0,0,0,1|0,1,0]=3 1634 B11R0.174 COC(=O)CCNC(=O)CSC 62a_100000230212_200000210301 [0,1,0,0,0,1|0,1,0]=3 1635 B11R0.174 COC(=O)CCNC(=O)CSC 62a_200000210301_100000230212 [0,1,0,0,0,1|0,1,0]=3 1636 B11R0.174 COC(=O)CCNC(=O)CS[13CH3] 62a_100000230212_200025704644 [0,1,0,0,0,1|0,1,0]=3 1637 B11R0.174 COC(=O)CCNC(=O)CS[13CH3] 62a_200025704644_100000230212 [0,1,0,0,0,1|0,1,0]=3 1638 B11R0.174 COC(=O)CSCC(=O)CC#N 1458a_100000191316_100011214920 [0,1,0,0,0,1|1,0,1]=4 1639 B11R0.174 COC(=O)CSCC(=O)CCF 1458a_100000191316_100011217306 [0,1,0,0,0,1|1,0,0]=3 1640 B11R0.174 COC(=O)CSCC(=O)CCO 1458a_100000191316_100000211926 [0,1,0,0,0,1|1,0,0]=3 1641 B11R0.174 COC(=O)CSCC(=O)NCO 62a_100000185155_100000747449 [0,1,0,0,0,1|1,0,0]=3 1642 B11R0.174 COC(=O)CSCC(=O)NCO 62a_100000747449_100000185155 [0,1,0,0,0,1|1,0,0]=3 1643 B11R0.174 COCC(=O)CCCC(=O)OC 1458a_100000210968_100011218270 [0,1,0,0,0,1|0,0,0]=2 1644 B11R0.174 COCC(=O)NCCC(=O)OC 188690a_100000683876_100000210968 [0,1,0,0,0,1|0,0,0]=2 1645 B11R0.174 COCC(=O)NCCC(=O)OC 34a_100138415774_100000230212 [0,1,0,0,0,1|0,0,0]=2 1646 B11R0.174 COCC(=O)NN=CC(=O)OC 4a_100000216845_200011823558 [0,1,0,0,0,1|1,0,1]=4 1647 B11R0.174 COCC(C)SCCC(=O)OC 62a_100000204255_100000765312 [0,1,0,0,0,1|1,0,1]=4 1648 B11R0.174 COCC(C)SCCC(=O)OC 62a_100000765312_100000204255 [0,1,0,0,0,1|1,0,1]=4 1649 B11R0.174 COCC(N)COCC(=O)OC 34a_100000724102_100000747449 [0,1,0,0,0,1|1,0,1]=4 1650 B11R0.174 COCC(O)CNCC(=O)OC 2230a_100000756049_100000747449 [0,1,0,0,0,1|0,0,2]=4 1651 B11R0.174 COCC(O)CNCC(=O)OC 34a_100000756049_100000747449 [0,1,0,0,0,1|0,0,2]=4 1652 B11R0.174 COCC(O)CSCC(=O)OC 62a_100000747449_100011215053 [0,1,0,0,0,1|0,0,2]=4 1653 B11R0.174 COCC(O)CSCC(=O)OC 62a_100011215053_100000747449 [0,1,0,0,0,1|0,0,2]=4 1654 B11R0.174 COCN(C)CCCC(=O)OC 269982a_100000739225_100000766300 [0,1,0,0,0,1|2,0,0]=4 1655 B11R0.174 COC[C@@H](C)NCCC(=O)OC 2230a_100000764878_100000204255 [0,1,0,0,0,1|1,0,1]=4 1656 B11R0.174 COC[C@@H](C)OCCC(=O)OC 34a_100011934205_100000742370 [0,1,0,0,0,1|1,0,1]=4 1657 B11R0.200 CCC(COCC(=O)OC)OC 34a_100011934954_100000747449 [0,1,0,0,0,1|1,0,1]=4 1658 B11R0.200 CCC(COCC(=O)OC)OC 7a_100011934954_100000747449 [0,1,0,0,0,1|1,0,1]=4 1659 B11R0.200 COC(=O)COCC(OC)OC 34a_100011216393_100000747449 [0,1,0,0,0,1|0,0,2]=4 1660 B11R0.200 COC(=O)CSCC(OC)OC 62a_100000747449_100000751394 [0,1,0,0,0,1|0,0,2]=4 1661 B11R0.200 COC(=O)CSCC(OC)OC 62a_100000751394_100000747449 [0,1,0,0,0,1|0,0,2]=4 1662 B11R0.320 COC(=O)CNCC(C)(C)OC 2230a_100000763424_100000747449 [0,1,0,0,0,1|1,0,1]=4 1663 B11R0.320 COC(=O)CSCC(C)(C)OC 62a_100000701081_100000747449 [0,1,0,0,0,1|1,0,1]=4 1664 B11R0.320 COC(=O)CSCC(C)(C)OC 62a_100000747449_100000701081 [0,1,0,0,0,1|1,0,1]=4 1665 B11R0.9 COCC(=O)CCC(OC)OC 1458a_100000210968_100000139399 [0,2,0,0,0,0|0,0,2]=4 1666 B11R0.90 CCN(CCC(=O)OC)C(=O)C 11a_100000229097_100015343762 [0,2,0,0,0,0|2,0,0]=4 1667 B11R0.90 CCN(CCC(=O)OC)C(=O)C 1626a_100000229097_100015343762 [0,2,0,0,0,0|2,0,0]=4 1668 B11R0.90 CCN(CCC(=O)OC)C(=O)C 240690a_100000229097_100015343762 [0,2,0,0,0,0|2,0,0]=4 1669 B11R0.90 CCN(CCC(=O)OC)C(=O)C 527a_100000229097_100103153847 [0,2,0,0,0,0|2,0,0]=4 1670 B11R0.134 CCN(CC=O)CCC(=O)OC 2230a_100000229097_200015260668 [0,2,0,0,0,0|2,0,0]=4 1671 B11R0.134 CCN(CC=O)CCC(=O)OC 269982a_100000229097_200015260668 [0,2,0,0,0,0|2,0,0]=4 1672 B11R0.134 CCN(CCC(=O)OC)COC 2230a_100000229097_100000766300 [0,2,0,0,0,0|2,0,0]=4 1673 B11R0.134 CCN(CCC(=O)OC)COC 269982a_100000229097_100000766300 [0,2,0,0,0,0|2,0,0]=4 1674 B11R0.43 C#CCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000184674 [0,2,0,0,0,0|1,0,1]=4 1675 B11R0.43 C=CCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000210623 [0,2,0,0,0,0|1,0,1]=4 1676 B11R0.43 CC=CC(=O)N(C)CC(=O)OC 11a_100000198492_100000210699 [0,2,0,0,0,0|2,0,0]=4 1677 B11R0.43 CC=CC(=O)N(C)CC(=O)OC 1626a_100000198492_100000210699 [0,2,0,0,0,0|2,0,0]=4 1678 B11R0.43 CC=CC(=O)N(C)CC(=O)OC 240690a_100000198492_100000210699 [0,2,0,0,0,0|2,0,0]=4 1679 B11R0.43 CCCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000210303 [0,2,0,0,0,0|1,0,0]=3 1680 B11R0.43 CCCC(=O)N(C)CC(=O)OC 11a_100000198492_100000211992 [0,2,0,0,0,0|2,0,0]=4 1681 B11R0.43 CCCC(=O)N(C)CC(=O)OC 1626a_100000198492_100000211992 [0,2,0,0,0,0|2,0,0]=4 1682 B11R0.43 CCCC(=O)N(C)CC(=O)OC 240690a_100000198492_100000211992 [0,2,0,0,0,0|2,0,0]=4 1683 B11R0.43 CCCC(=O)N(C)CC(=O)OC 527a_100000198492_100000211992 [0,2,0,0,0,0|2,0,0]=4 1684 B11R0.43 CCNC(=O)C(=O)CC(=O)OC 1458a_200011297158_100000747449 [0,2,0,0,0,0|1,0,1]=4 1685 B11R0.43 CCNC(=O)C(C)CC(=O)OC 240690a_100015525214_100000037256 [0,2,0,0,0,0|1,0,0]=3 1686 B11R0.43 CCNC(=O)C(C)CC(=O)OC 527a_100015525214_100000037256 [0,2,0,0,0,0|1,0,0]=3 1687 B11R0.43 CCOC(=O)[C@@H](C)NC(=O)CC 188690a_100016988386_100000210414 [0,2,0,0,0,0|2,0,0]=4 1688 B11R0.43 CNC(=O)CN(C)C(=O)COC 11a_100000189611_100000210968 [0,2,0,0,0,0|2,0,0]=4 1689 B11R0.43 CNC(=O)CN(C)C(=O)COC 240690a_100000189611_100000210968 [0,2,0,0,0,0|2,0,0]=4 1690 B11R0.43 CNC(=O)CN(C)C(=O)COC 527a_100000189611_100000210968 [0,2,0,0,0,0|2,0,0]=4 1691 B11R0.43 CNNC(=O)C(C)CC(=O)OC 22a_100016993582_100000037256 [0,2,0,0,0,0|1,0,0]=3 1692 B11R0.43 CO/N=C(\C)/C(=O)CC(=O)OC 1458a_100160996864_100000747449 [0,2,0,0,0,0|1,0,1]=4 1693 B11R0.43 COC(=O)CC(C)C(=O)CC#N 1458a_100000037256_100011214920 [0,2,0,0,0,0|1,0,1]=4 1694 B11R0.43 COC(=O)CC(C)C(=O)CCF 1458a_100000037256_100011217306 [0,2,0,0,0,0|1,0,0]=3 1695 B11R0.43 COC(=O)CC(C)C(=O)CCO 1458a_100000037256_100000211926 [0,2,0,0,0,0|1,0,0]=3 1696 B11R0.43 COC(=O)CN(C)C(=O)CCO 240690a_100000198492_100011216618 [0,2,0,0,0,0|2,0,0]=4 1697 B11R0.43 COC(=O)CN(C)C(=O)CSC 11a_100000198492_100000184570 [0,2,0,0,0,0|1,1,0]=4 1698 B11R0.43 COC(=O)CN(C)C(=O)CSC 1626a_100000198492_100000184570 [0,2,0,0,0,0|1,1,0]=4 1699 B11R0.43 COC(=O)CN(C)C(=O)CSC 240690a_100000198492_100000184570 [0,2,0,0,0,0|1,1,0]=4 1700 B11R0.43 COC(=O)CN(C)C(=O)CSC 527a_100000198492_100000184570 [0,2,0,0,0,0|1,1,0]=4 1701 B11R0.43 COCC(=O)N(C)CC(=O)OC 11a_100000198492_100000210968 [0,2,0,0,0,0|1,0,0]=3 1702 B11R0.43 COCC(=O)N(C)CC(=O)OC 1626a_100000198492_100000210968 [0,2,0,0,0,0|1,0,0]=3 1703 B11R0.43 COCC(=O)N(C)CC(=O)OC 240690a_100000198492_100000210968 [0,2,0,0,0,0|1,0,0]=3 1704 B11R0.43 COCC(=O)N(C)CC(=O)OC 527a_100000198492_100000210968 [0,2,0,0,0,0|1,0,0]=3 1705 B11R0.66 CCC(=O)N(C)C(C)C(=O)OC 11a_100000725243_100000210414 [0,2,0,0,0,0|2,0,0]=4 1706 B11R0.66 CCC(=O)N(C)C(C)C(=O)OC 240690a_100000725243_100000210414 [0,2,0,0,0,0|2,0,0]=4 1707 B11R0.66 CCC(=O)N(C)C(C)C(=O)OC 527a_100000725243_100000210414 [0,2,0,0,0,0|2,0,0]=4 1708 B11R0.66 CCC(=O)[C@@H](C)N(C)C(=O)OC 1458a_200021015837_100000210202 [0,2,0,0,0,0|2,0,0]=4 1709 B11R0.66 CNC(=O)C(=O)C(C)C(=O)OC 1458a_100011218921_100000211248 [0,2,0,0,0,0|1,0,1]=4 1710 B11R0.66 CNC(=O)[C@@H](C)N(C)C(=O)OC 11a_106832991635_200021015837 [0,2,0,0,0,0|2,0,0]=4 1711 B11R0.66 CNC(=O)[C@@H](C)N(C)C(=O)OC 1626a_100102657272_200021015837 [0,2,0,0,0,0|2,0,0]=4 1712 B11R0.66 CNC(=O)[C@@H](C)N(C)C(=O)OC 240690a_100102657272_200021015837 [0,2,0,0,0,0|2,0,0]=4 1713 B11R0.66 CNC(=O)[C@@H](C)N(C)C(=O)OC 527a_100102657272_200021015837 [0,2,0,0,0,0|2,0,0]=4 1714 B11R0.88 CCC(=O)N[C@H](CC)C(=O)OC 188690a_100020627782_100000210414 [0,2,0,0,0,0|2,0,0]=4 1715 B11R0.88 CCC(=O)N[C@H](CO)C(=O)OC 188690a_100000003586_100000210414 [0,2,0,0,0,0|2,0,0]=4 1716 B11R0.88 COC(=O)C[C@H](OC)C(=O)OC 34a_100015190871_200000210301 [0,2,0,0,0,0|0,0,0]=2 1717 B11R0.88 COC(=O)C[C@H](O[13CH3])C(=O)OC 34a_100015190871_200025704644 [0,2,0,0,0,0|0,0,0]=2 1718 B11R0.92 C=C(C)C(=O)N(C)CC(=O)OC 11a_100000198492_100000185857 [0,2,0,0,0,0|2,0,0]=4 1719 B11R0.92 C=C(C)C(=O)N(C)CC(=O)OC 1626a_100000198492_100000185857 [0,2,0,0,0,0|2,0,0]=4 1720 B11R0.92 C=C(CC(=O)OC)C(=O)N(C)C 1626a_100102631434_100000040833 [0,2,0,0,0,0|1,0,1]=4 1721 B11R0.92 COC(=O)CC(=O)C(=O)N(C)C 1458a_100011218876_100000747449 [0,2,0,0,0,0|1,0,1]=4 1722 B11R0.92 COC(=O)CC(C)C(=O)C(C)C 1458a_100000037256_100000210206 [0,2,0,0,0,0|1,0,0]=3 1723 B11R0.92 COC(=O)CC(C)C(=O)N(C)C 1626a_100102631434_100000037256 [0,2,0,0,0,0|1,0,0]=3 1724 B11R0.92 COC(=O)CC(C)C(=O)N(C)C 240690a_100102631434_100000037256 [0,2,0,0,0,0|1,0,0]=3 1725 B11R0.92 COC(=O)CC(C)C(=O)N(C)C 527a_100102631434_100000037256 [0,2,0,0,0,0|1,0,0]=3 1726 B11R0.92 COC(=O)CN(C)C(=O)C(C)C 11a_100000198492_100000210198 [0,2,0,0,0,0|2,0,0]=4 1727 B11R0.92 COC(=O)CN(C)C(=O)C(C)C 1626a_100000198492_100000210198 [0,2,0,0,0,0|2,0,0]=4 1728 B11R0.92 COC(=O)CN(C)C(=O)C(C)C 240690a_100000198492_100000210198 [0,2,0,0,0,0|2,0,0]=4 1729 B11R0.92 COC(=O)CN(C)C(=O)C(C)C 527a_100000198492_100000210198 [0,2,0,0,0,0|2,0,0]=4 1730 B11R0.92 COC(=O)CN(C)C(=O)C(C)F 11a_100000198492_100000062450 [0,2,0,0,0,0|2,0,0]=4 1731 B11R0.92 COC(=O)CN(C)C(=O)C(C)F 1626a_100000198492_100000062450 [0,2,0,0,0,0|2,0,0]=4 1732 B11R0.92 COC(=O)CN(C)C(=O)C(C)F 240690a_100000198492_100000062450 [0,2,0,0,0,0|2,0,0]=4 1733 B11R0.92 COC(=O)CN(C)C(=O)C(C)F 527a_100000198492_100000062450 [0,2,0,0,0,0|2,0,0]=4 1734 B11R0.92 COC(=O)CN(C)C(=O)[C@@H](C)O 240690a_100000198492_100000717761 [0,2,0,0,0,0|2,0,0]=4 1735 B11R0.92 COC(=O)CN(C)C(=O)[C@H](C)O 1626a_100000198492_217856618621 [0,2,0,0,0,0|2,0,0]=4 1736 B11R0.92 COC(=O)CN(C)C(=O)[C@H](C)O 240690a_100000198492_217856618621 [0,2,0,0,0,0|2,0,0]=4 1737 B11R0.117 C=C(C)C(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000185857 [0,2,0,0,0,0|2,0,0]=4 1738 B11R0.117 COC(=O)[C@@H](C)NC(=O)C(C)C 188690a_100000687819_100000210198 [0,2,0,0,0,0|2,0,0]=4 1739 B11R0.117 COC(=O)[C@@H](C)NC(=O)C(C)F 188690a_100000687819_100000062450 [0,2,0,0,0,0|2,0,0]=4 1740 B11R0.117 COC(=O)[C@@H](C)NC(=O)[C@@H](C)O 188690a_100000687819_100000717761 [0,2,0,0,0,0|2,0,0]=4 1741 B11R0.117 COC(=O)[C@@H](C)NC(=O)[C@H](C)O 188690a_100000687819_217856618621 [0,2,0,0,0,0|2,0,0]=4 1742 B11R0.187 C#CC(=O)C(C)CC(=O)OCC 1458a_100000211873_100009817359 [0,2,0,0,0,0|1,0,1]=4 1743 B11R0.187 C=C(CC(=O)OCC)C(=O)NC 1626a_100102657272_200000043866 [0,2,0,0,0,0|1,0,1]=4 1744 B11R0.187 C=CC(=O)C(C)CC(=O)OCC 1458a_100000185746_100009817359 [0,2,0,0,0,0|1,0,1]=4 1745 B11R0.187 CC=CC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210699 [0,2,0,0,0,0|2,0,0]=4 1746 B11R0.187 CCCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000211992 [0,2,0,0,0,0|2,0,0]=4 1747 B11R0.187 CCOC(=O)CC(=O)C(=O)NC 1458a_100011218921_100000188475 [0,2,0,0,0,0|1,0,1]=4 1748 B11R0.187 CCOC(=O)CC(C)C(=O)CC 1458a_100000210414_100009817359 [0,2,0,0,0,0|1,0,0]=3 1749 B11R0.187 CCOC(=O)CC(C)C(=O)CO 1458a_100000210174_100009817359 [0,2,0,0,0,0|2,0,0]=4 1750 B11R0.187 CCOC(=O)CN(C)C(=O)CC 11a_100000220588_100000210414 [0,2,0,0,0,0|2,0,0]=4 1751 B11R0.187 CCOC(=O)CN(C)C(=O)CC 1626a_100000220588_100000210414 [0,2,0,0,0,0|2,0,0]=4 1752 B11R0.187 CCOC(=O)CN(C)C(=O)CC 240690a_100000220588_100000210414 [0,2,0,0,0,0|2,0,0]=4 1753 B11R0.187 CCOC(=O)CN(C)C(=O)CC 527a_100000220588_100000210414 [0,2,0,0,0,0|2,0,0]=4 1754 B11R0.187 CNC(=O)[C@@H](C)NC(=O)COC 11a_100000684985_100000210968 [0,2,0,0,0,0|2,0,0]=4 1755 B11R0.187 CNC(=O)[C@@H](C)NC(=O)COC 240690a_100000684985_100000210968 [0,2,0,0,0,0|2,0,0]=4 1756 B11R0.187 CNC(=O)[C@@H](C)NC(=O)COC 527a_100000684985_100000210968 [0,2,0,0,0,0|2,0,0]=4 1757 B11R0.187 COC(=O)[C@@H](C)NC(=O)CSC 188690a_100000687819_100000184570 [0,2,0,0,0,0|1,1,0]=4 1758 B11R0.187 COCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210968 [0,2,0,0,0,0|1,0,0]=3 1759 B11R0.256 CCC(=O)C(C)(C)CC(=O)OC 1458a_100000720384_100000210202 [0,2,0,0,0,0|1,0,0]=3 1760 B11R0.256 CCC(=O)CC(C)(C)C(=O)OC 1458a_100000106591_100000210202 [0,2,0,0,0,0|1,0,0]=3 1761 B11R0.256 CCC(=O)NC(C)(C)C(=O)OC 188690a_100000737553_100000210414 [0,2,0,0,0,0|2,0,0]=4 1762 B11R0.256 CNC(=O)C(C)(C)CC(=O)OC 1626a_100102657272_100000720384 [0,2,0,0,0,0|1,0,0]=3 1763 B11R0.256 CNC(=O)C(C)(C)CC(=O)OC 240690a_100102657272_100000720384 [0,2,0,0,0,0|1,0,0]=3 1764 B11R0.256 CNC(=O)C(C)(C)CC(=O)OC 527a_100102657272_100000720384 [0,2,0,0,0,0|1,0,0]=3 1765 B11R0.256 CNC(=O)CC(C)(C)C(=O)OC 11a_106832991635_100000106591 [0,2,0,0,0,0|1,0,0]=3 1766 B11R0.256 CNC(=O)CC(C)(C)C(=O)OC 1626a_100102657272_100000106591 [0,2,0,0,0,0|1,0,0]=3 1767 B11R0.256 CNC(=O)CC(C)(C)C(=O)OC 240690a_100102657272_100000106591 [0,2,0,0,0,0|1,0,0]=3 1768 B11R0.256 CNC(=O)CC(C)(C)C(=O)OC 527a_100102657272_100000106591 [0,2,0,0,0,0|1,0,0]=3 1769 B11R0.256 COC(=O)C(C)(C)CC(=O)CF 1458a_100000106591_100015361967 [0,2,0,0,0,0|2,0,0]=4 1770 B11R0.256 COC(=O)CC(C)(C)C(=O)CF 1458a_100000720384_100015361967 [0,2,0,0,0,0|2,0,0]=4 1771 B11R0.89 COC(=O)CCC(=O)C(F)(F)F 1458a_100000187943_200000243211 [0,2,0,0,0,0|2,0,0]=4 1772 B11R0.89 COC(=O)CNC(=O)C(C)(C)C 188690a_100000185156_106744555173 [0,2,0,0,0,0|2,0,0]=4 1773 B11R0.89 COC(=O)CNC(=O)C(C)(C)F 188690a_100000185156_100000765255 [0,2,0,0,0,0|2,0,0]=4 1774 B11R0.89 COC(=O)CNC(=O)C(C)(C)O 188690a_100000185156_100000242741 [0,2,0,0,0,0|2,0,0]=4 1775 B11R0.141 C=C(C)C(=O)NCC(=O)OCC 188690a_100000741813_100000185857 [0,2,0,0,0,0|2,0,0]=4 1776 B11R0.141 CCCC(=O)CCC(=O)N(C)C 1458a_100011200748_100000210303 [0,2,0,0,0,0|2,0,0]=4 1777 B11R0.141 CCNC(=O)CCC(=O)C(C)C 1458a_100000199579_100000210206 [0,2,0,0,0,0|2,0,0]=4 1778 B11R0.141 CCNC(=O)CCC(=O)N(C)C 11a_100015525214_100011200748 [0,2,0,0,0,0|2,0,0]=4 1779 B11R0.141 CCNC(=O)CCC(=O)N(C)C 11a_100102631434_100000199579 [0,2,0,0,0,0|2,0,0]=4 1780 B11R0.141 CCNC(=O)CCC(=O)N(C)C 1626a_100102631434_100000199579 [0,2,0,0,0,0|2,0,0]=4 1781 B11R0.141 CCNC(=O)CCC(=O)N(C)C 240690a_100015525214_100011200748 [0,2,0,0,0,0|2,0,0]=4 1782 B11R0.141 CCNC(=O)CCC(=O)N(C)C 240690a_100102631434_100000199579 [0,2,0,0,0,0|2,0,0]=4 1783 B11R0.141 CCNC(=O)CCC(=O)N(C)C 527a_100015525214_100011200748 [0,2,0,0,0,0|2,0,0]=4 1784 B11R0.141 CCOC(=O)CCC(=O)C(C)C 1458a_100000183558_100000210206 [0,2,0,0,0,0|1,0,0]=3 1785 B11R0.141 CCOC(=O)CCC(=O)N(C)C 11a_100102631434_100000183558 [0,2,0,0,0,0|1,0,0]=3 1786 B11R0.141 CCOC(=O)CCC(=O)N(C)C 1626a_100102631434_100000183558 [0,2,0,0,0,0|1,0,0]=3 1787 B11R0.141 CCOC(=O)CCC(=O)N(C)C 240690a_100102631434_100000183558 [0,2,0,0,0,0|1,0,0]=3 1788 B11R0.141 CCOC(=O)CNC(=O)C(C)C 188690a_100000741813_100000210198 [0,2,0,0,0,0|2,0,0]=4 1789 B11R0.141 CCOC(=O)CNC(=O)C(C)F 188690a_100000741813_100000062450 [0,2,0,0,0,0|2,0,0]=4 1790 B11R0.141 CCOC(=O)CNC(=O)[C@@H](C)O 188690a_100000741813_100000717761 [0,2,0,0,0,0|2,0,0]=4 1791 B11R0.141 CCOC(=O)CNC(=O)[C@H](C)O 188690a_100000741813_217856618621 [0,2,0,0,0,0|2,0,0]=4 1792 B11R0.141 CCOC(=O)NCC(=O)C(C)C 1458a_100000190774_100000210206 [0,2,0,0,0,0|2,0,0]=4 1793 B11R0.141 CCOC(=O)NCC(=O)N(C)C 11a_100102631434_100000190774 [0,2,0,0,0,0|2,0,0]=4 1794 B11R0.141 CCOC(=O)NCC(=O)N(C)C 1626a_100102631434_100000190774 [0,2,0,0,0,0|2,0,0]=4 1795 B11R0.141 CCOC(=O)NCC(=O)N(C)C 240690a_100102631434_100000190774 [0,2,0,0,0,0|2,0,0]=4 1796 B11R0.141 CCOC(=O)NCC(=O)N(C)C 527a_100102631434_100000190774 [0,2,0,0,0,0|2,0,0]=4 1797 B11R0.141 CN(C)C(=O)CCC(=O)CCF 1458a_100011200748_100011217306 [0,2,0,0,0,0|2,0,0]=4 1798 B11R0.141 CN(C)C(=O)CCC(=O)CCO 1458a_100011200748_100000211926 [0,2,0,0,0,0|2,0,0]=4 1799 B11R0.141 CNNC(=O)CCC(=O)N(C)C 22a_100016993582_100011200748 [0,2,0,0,0,0|2,0,0]=4 1800 B11R0.141 COCC(=O)COC(=O)C(C)C 1458a_100000210968_100000139345 [0,2,0,0,0,0|2,0,0]=4 1801 B11R0.141 COCC(=O)NCC(=O)N(C)C 11a_100015183351_100000210968 [0,2,0,0,0,0|2,0,0]=4 1802 B11R0.141 COCC(=O)NCC(=O)N(C)C 240690a_100015183351_100000210968 [0,2,0,0,0,0|2,0,0]=4 1803 B11R0.141 COCC(=O)NCC(=O)N(C)C 527a_100015183351_100000210968 [0,2,0,0,0,0|2,0,0]=4 1804 B11R0.150 CC(C)C(=O)CCC(=O)N(C)C 1458a_100011200748_100000210206 [0,2,0,0,0,0|2,0,0]=4 1805 B11R0.150 CN(C)C(=O)CCC(=O)N(C)C 11a_100102631434_100011200748 [0,2,0,0,0,0|2,0,0]=4 1806 B11R0.150 CN(C)C(=O)CCC(=O)N(C)C 1626a_100102631434_100011200748 [0,2,0,0,0,0|2,0,0]=4 1807 B11R0.150 CN(C)C(=O)CCC(=O)N(C)C 240690a_100102631434_100011200748 [0,2,0,0,0,0|2,0,0]=4 1808 B11R0.150 CN(C)C(=O)CCC(=O)N(C)C 527a_100102631434_100011200748 [0,2,0,0,0,0|2,0,0]=4 1809 B11R0.201 COC(=O)CCS(=O)(=O)N(C)C 270084a_100102631434_100000205946 [0,2,0,0,0,0|2,0,0]=4 1810 B11R0.201 COC(=O)CCS(=O)(=O)N(C)C 274078a_100102631434_100000205946 [0,2,0,0,0,0|2,0,0]=4 1811 B11R0.62 C#CCC(=O)CCC(=O)OCC 1458a_100000183558_100000184674 [0,2,0,0,0,0|1,0,1]=4 1812 B11R0.62 C=CCC(=O)CCC(=O)OCC 1458a_100000183558_100000210623 [0,2,0,0,0,0|1,0,1]=4 1813 B11R0.62 CC=CC(=O)NCC(=O)OCC 188690a_100000741813_100000210699 [0,2,0,0,0,0|2,0,0]=4 1814 B11R0.62 CCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210303 [0,2,0,0,0,0|2,0,0]=4 1815 B11R0.62 CCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210303 [0,2,0,0,0,0|1,0,0]=3 1816 B11R0.62 CCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210303 [0,2,0,0,0,0|2,0,0]=4 1817 B11R0.62 CCCC(=O)NCC(=O)OCC 188690a_100000741813_100000211992 [0,2,0,0,0,0|2,0,0]=4 1818 B11R0.62 CCCC(=O)OCC(=O)COC 1458a_100000210968_100000034017 [0,2,0,0,0,0|2,0,0]=4 1819 B11R0.62 CCNC(=O)CCC(=O)CCF 1458a_100000199579_100011217306 [0,2,0,0,0,0|2,0,0]=4 1820 B11R0.62 CCNC(=O)CCC(=O)CCO 1458a_100000199579_100000211926 [0,2,0,0,0,0|2,0,0]=4 1821 B11R0.62 CCNC(=O)CCC(=O)NCC 11a_100015525214_100000199579 [0,2,0,0,0,0|2,0,0]=4 1822 B11R0.62 CCNC(=O)CCC(=O)NCC 240690a_100015525214_100000199579 [0,2,0,0,0,0|2,0,0]=4 1823 B11R0.62 CCNC(=O)CCC(=O)NNC 22a_100016993582_100000199579 [0,2,0,0,0,0|2,0,0]=4 1824 B11R0.62 CCNC(=O)CCC(=O)OCC 11a_100015525214_100000183558 [0,2,0,0,0,0|1,0,0]=3 1825 B11R0.62 CCNC(=O)CCC(=O)OCC 240690a_100015525214_100000183558 [0,2,0,0,0,0|1,0,0]=3 1826 B11R0.62 CCNC(=O)CNC(=O)COC 11a_100016988866_100000210968 [0,2,0,0,0,0|2,0,0]=4 1827 B11R0.62 CCNC(=O)CNC(=O)COC 1626a_100016988866_100000210968 [0,2,0,0,0,0|2,0,0]=4 1828 B11R0.62 CCNC(=O)CNC(=O)COC 240690a_100016988866_100000210968 [0,2,0,0,0,0|2,0,0]=4 1829 B11R0.62 CCNC(=O)CNC(=O)COC 527a_100016988866_100000210968 [0,2,0,0,0,0|2,0,0]=4 1830 B11R0.62 CCNC(=O)CNC(=O)OCC 11a_100015525214_100000190774 [0,2,0,0,0,0|2,0,0]=4 1831 B11R0.62 CCNC(=O)CNC(=O)OCC 240690a_100015525214_100000190774 [0,2,0,0,0,0|2,0,0]=4 1832 B11R0.62 CCNC(=O)CNC(=O)OCC 527a_100015525214_100000190774 [0,2,0,0,0,0|2,0,0]=4 1833 B11R0.62 CCOC(=O)CCC(=O)CC#N 1458a_100000183558_100011214920 [0,2,0,0,0,0|1,0,1]=4 1834 B11R0.62 CCOC(=O)CCC(=O)CCF 1458a_100000183558_100011217306 [0,2,0,0,0,0|1,0,0]=3 1835 B11R0.62 CCOC(=O)CCC(=O)CCO 1458a_100000183558_100000211926 [0,2,0,0,0,0|1,0,0]=3 1836 B11R0.62 CCOC(=O)CCC(C)OCC 34a_100121572206_100000748298 [0,2,0,0,0,0|1,0,1]=4 1837 B11R0.62 CCOC(=O)CCN(C)COC 2230a_100000745921_100000766300 [0,2,0,0,0,0|2,0,0]=4 1838 B11R0.62 CCOC(=O)CCN(C)COC 269982a_100000745921_100000766300 [0,2,0,0,0,0|2,0,0]=4 1839 B11R0.62 CCOC(=O)CNC(=O)CNC 2230a_106832991635_100011215850 [0,2,0,0,0,0|2,0,0]=4 1840 B11R0.62 CCOC(=O)CNC(=O)CNC 34a_100102657272_100011215850 [0,2,0,0,0,0|2,0,0]=4 1841 B11R0.62 CCOC(=O)CNC(=O)CNC 7a_106832991635_100011215850 [0,2,0,0,0,0|2,0,0]=4 1842 B11R0.62 CCOC(=O)CNC(=O)COC 188690a_100000741813_100000210968 [0,2,0,0,0,0|1,0,0]=3 1843 B11R0.62 CCOC(=O)CNC(=O)COC 34a_100138415774_100011215850 [0,2,0,0,0,0|1,0,0]=3 1844 B11R0.62 CCOC(=O)CNC(=O)CSC 188690a_100000741813_100000184570 [0,2,0,0,0,0|1,1,0]=4 1845 B11R0.62 CCOC(=O)CNC(=O)CSC 62a_100011215850_200000210301 [0,2,0,0,0,0|1,1,0]=4 1846 B11R0.62 CCOC(=O)CNC(=O)CSC 62a_200000210301_100011215850 [0,2,0,0,0,0|1,1,0]=4 1847 B11R0.62 CCOC(=O)CNC(=O)CS[13CH3] 62a_100011215850_200025704644 [0,2,0,0,0,0|1,1,0]=4 1848 B11R0.62 CCOC(=O)CNC(=O)CS[13CH3] 62a_200025704644_100011215850 [0,2,0,0,0,0|1,1,0]=4 1849 B11R0.62 CCOC(=O)NCC(=O)CCF 1458a_100000190774_100011217306 [0,2,0,0,0,0|2,0,0]=4 1850 B11R0.62 CCOC(=O)NCC(=O)CCO 1458a_100000190774_100000211926 [0,2,0,0,0,0|2,0,0]=4 1851 B11R0.62 CCOC(=O)NCC(=O)NNC 22a_100016993582_100000190774 [0,2,0,0,0,0|2,0,0]=4 1852 B11R0.62 COCC(=O)NNC(=O)COC 22a_100000216845_100000210968 [0,2,0,0,0,0|2,0,0]=4 1853 B11R0.70 C#CCCC(=O)CCC(=O)NC 1458a_100011309844_100000753159 [0,2,0,0,0,0|2,0,0]=4 1854 B11R0.70 C#CCCC(=O)CCC(=O)OC 1458a_100000187943_100000753159 [0,2,0,0,0,0|1,0,0]=3 1855 B11R0.70 C#CCCC(=O)CNC(=O)OC 1458a_100000215747_100000753159 [0,2,0,0,0,0|2,0,0]=4 1856 B11R0.70 C#CCNC(=O)CCC(=O)NC 11a_100000212058_100011309844 [0,2,0,0,0,0|2,0,0]=4 1857 B11R0.70 C#CCNC(=O)CCC(=O)NC 1626a_100000212058_100011309844 [0,2,0,0,0,0|2,0,0]=4 1858 B11R0.70 C#CCNC(=O)CCC(=O)NC 240690a_100000212058_100011309844 [0,2,0,0,0,0|2,0,0]=4 1859 B11R0.70 C#CCNC(=O)CCC(=O)NC 527a_100000212058_100011309844 [0,2,0,0,0,0|2,0,0]=4 1860 B11R0.70 C#CCNC(=O)CCC(=O)OC 11a_100000212058_100000187943 [0,2,0,0,0,0|1,0,0]=3 1861 B11R0.70 C#CCNC(=O)CCC(=O)OC 1626a_100000212058_100000187943 [0,2,0,0,0,0|1,0,0]=3 1862 B11R0.70 C#CCNC(=O)CCC(=O)OC 240690a_100000212058_100000187943 [0,2,0,0,0,0|1,0,0]=3 1863 B11R0.70 C#CCNC(=O)CCC(=O)OC 527a_100000212058_100000187943 [0,2,0,0,0,0|1,0,0]=3 1864 B11R0.70 C#CCNC(=O)CNC(=O)OC 11a_100000212058_100000215747 [0,2,0,0,0,0|2,0,0]=4 1865 B11R0.70 C#CCNC(=O)CNC(=O)OC 1626a_100000212058_100000215747 [0,2,0,0,0,0|2,0,0]=4 1866 B11R0.70 C#CCNC(=O)CNC(=O)OC 240690a_100000212058_100000215747 [0,2,0,0,0,0|2,0,0]=4 1867 B11R0.70 C#CCNC(=O)CNC(=O)OC 527a_100000212058_100000215747 [0,2,0,0,0,0|2,0,0]=4 1868 B11R0.70 C/C=C/CC(=O)CCC(=O)NC 1458a_100011309844_100102629194 [0,2,0,0,0,0|2,0,0]=4 1869 B11R0.70 C/C=C/CC(=O)CCC(=O)OC 1458a_100000187943_100102629194 [0,2,0,0,0,0|1,0,0]=3 1870 B11R0.70 C/C=C/CC(=O)CNC(=O)OC 1458a_100000215747_100102629194 [0,2,0,0,0,0|2,0,0]=4 1871 B11R0.70 C=CCCC(=O)CCC(=O)NC 1458a_100011309844_100000754431 [0,2,0,0,0,0|2,0,0]=4 1872 B11R0.70 C=CCCC(=O)CCC(=O)OC 1458a_100000187943_100000754431 [0,2,0,0,0,0|1,0,0]=3 1873 B11R0.70 C=CCCC(=O)CNC(=O)OC 1458a_100000215747_100000754431 [0,2,0,0,0,0|2,0,0]=4 1874 B11R0.70 C=CCCC(=O)NCC(=O)OC 188690a_100000185156_100000749702 [0,2,0,0,0,0|2,0,0]=4 1875 B11R0.70 C=CCNC(=O)CCC(=O)NC 1626a_100020586998_100011309844 [0,2,0,0,0,0|2,0,0]=4 1876 B11R0.70 C=CCNC(=O)CCC(=O)NC 240690a_100020586998_100011309844 [0,2,0,0,0,0|2,0,0]=4 1877 B11R0.70 C=CCNC(=O)CCC(=O)NC 527a_100020586998_100011309844 [0,2,0,0,0,0|2,0,0]=4 1878 B11R0.70 C=CCNC(=O)CCC(=O)OC 1626a_100020586998_100000187943 [0,2,0,0,0,0|1,0,0]=3 1879 B11R0.70 C=CCNC(=O)CCC(=O)OC 240690a_100020586998_100000187943 [0,2,0,0,0,0|1,0,0]=3 1880 B11R0.70 C=CCNC(=O)CCC(=O)OC 527a_100020586998_100000187943 [0,2,0,0,0,0|1,0,0]=3 1881 B11R0.70 C=CCNC(=O)CNC(=O)OC 1626a_100020586998_100000215747 [0,2,0,0,0,0|2,0,0]=4 1882 B11R0.70 C=CCNC(=O)CNC(=O)OC 240690a_100020586998_100000215747 [0,2,0,0,0,0|2,0,0]=4 1883 B11R0.70 C=CCNC(=O)CNC(=O)OC 527a_100020586998_100000215747 [0,2,0,0,0,0|2,0,0]=4 1884 B11R0.70 C=CCOC(=O)NCC(=O)CC 1458a_100000216761_100000210202 [0,2,0,0,0,0|2,0,0]=4 1885 B11R0.70 C=CCOC(=O)NCC(=O)NC 11a_106832991635_100000216761 [0,2,0,0,0,0|2,0,0]=4 1886 B11R0.70 C=CCOC(=O)NCC(=O)NC 1626a_100102657272_100000216761 [0,2,0,0,0,0|2,0,0]=4 1887 B11R0.70 C=CCOC(=O)NCC(=O)NC 240690a_100102657272_100000216761 [0,2,0,0,0,0|2,0,0]=4 1888 B11R0.70 C=CCOC(=O)NCC(=O)NC 527a_100102657272_100000216761 [0,2,0,0,0,0|2,0,0]=4 1889 B11R0.70 CC#CCC(=O)CCC(=O)NC 1458a_100011309844_100000748600 [0,2,0,0,0,0|2,0,0]=4 1890 B11R0.70 CC#CCC(=O)CCC(=O)OC 1458a_100000187943_100000748600 [0,2,0,0,0,0|1,0,0]=3 1891 B11R0.70 CC#CCC(=O)CNC(=O)OC 1458a_100000215747_100000748600 [0,2,0,0,0,0|2,0,0]=4 1892 B11R0.70 CC=CCC(=O)CCC(=O)NC 1458a_100011309844_100000070051 [0,2,0,0,0,0|2,0,0]=4 1893 B11R0.70 CC=CCC(=O)CCC(=O)OC 1458a_100000187943_100000070051 [0,2,0,0,0,0|1,0,0]=3 1894 B11R0.70 CC=CCC(=O)CNC(=O)OC 1458a_100000215747_100000070051 [0,2,0,0,0,0|2,0,0]=4 1895 B11R0.70 CC=CCC(=O)NCC(=O)OC 188690a_100000185156_100121576822 [0,2,0,0,0,0|2,0,0]=4 1896 B11R0.70 CCC(=O)NCC(=O)CCOC 1458a_100000194589_100000233755 [0,2,0,0,0,0|2,0,0]=4 1897 B11R0.70 CCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210211 [0,2,0,0,0,0|2,0,0]=4 1898 B11R0.70 CCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210211 [0,2,0,0,0,0|1,0,0]=3 1899 B11R0.70 CCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210211 [0,2,0,0,0,0|2,0,0]=4 1900 B11R0.70 CCCCC(=O)NCC(=O)OC 188690a_100000185156_100000210183 [0,2,0,0,0,0|2,0,0]=4 1901 B11R0.70 CCCNC(=O)CCC(=O)CC 1458a_100000199543_100000210202 [0,2,0,0,0,0|2,0,0]=4 1902 B11R0.70 CCCNC(=O)CCC(=O)NC 11a_100020643023_100011309844 [0,2,0,0,0,0|2,0,0]=4 1903 B11R0.70 CCCNC(=O)CCC(=O)NC 11a_106832991635_100000199543 [0,2,0,0,0,0|2,0,0]=4 1904 B11R0.70 CCCNC(=O)CCC(=O)NC 1626a_100020643023_100011309844 [0,2,0,0,0,0|2,0,0]=4 1905 B11R0.70 CCCNC(=O)CCC(=O)NC 1626a_100102657272_100000199543 [0,2,0,0,0,0|2,0,0]=4 1906 B11R0.70 CCCNC(=O)CCC(=O)NC 240690a_100020643023_100011309844 [0,2,0,0,0,0|2,0,0]=4 1907 B11R0.70 CCCNC(=O)CCC(=O)NC 240690a_100102657272_100000199543 [0,2,0,0,0,0|2,0,0]=4 1908 B11R0.70 CCCNC(=O)CCC(=O)NC 527a_100020643023_100011309844 [0,2,0,0,0,0|2,0,0]=4 1909 B11R0.70 CCCNC(=O)CCC(=O)NC 527a_100102657272_100000199543 [0,2,0,0,0,0|2,0,0]=4 1910 B11R0.70 CCCNC(=O)CCC(=O)OC 11a_100020643023_100000187943 [0,2,0,0,0,0|1,0,0]=3 1911 B11R0.70 CCCNC(=O)CCC(=O)OC 1626a_100020643023_100000187943 [0,2,0,0,0,0|1,0,0]=3 1912 B11R0.70 CCCNC(=O)CCC(=O)OC 240690a_100020643023_100000187943 [0,2,0,0,0,0|1,0,0]=3 1913 B11R0.70 CCCNC(=O)CCC(=O)OC 527a_100020643023_100000187943 [0,2,0,0,0,0|1,0,0]=3 1914 B11R0.70 CCCNC(=O)CNC(=O)OC 11a_100020643023_100000215747 [0,2,0,0,0,0|2,0,0]=4 1915 B11R0.70 CCCNC(=O)CNC(=O)OC 1626a_100020643023_100000215747 [0,2,0,0,0,0|2,0,0]=4 1916 B11R0.70 CCCNC(=O)CNC(=O)OC 240690a_100020643023_100000215747 [0,2,0,0,0,0|2,0,0]=4 1917 B11R0.70 CCCNC(=O)CNC(=O)OC 527a_100020643023_100000215747 [0,2,0,0,0,0|2,0,0]=4 1918 B11R0.70 CCCOC(=O)OCC(=O)CC 1458a_100000210414_200000139673 [0,2,0,0,0,0|2,0,0]=4 1919 B11R0.70 CCNCC(=O)CCC(=O)OC 2230a_100015525214_100000691467 [0,2,0,0,0,0|1,0,0]=3 1920 B11R0.70 CCNCC(=O)NCC(=O)OC 2230a_100015525214_100000182966 [0,2,0,0,0,0|2,0,0]=4 1921 B11R0.70 CCNN=C(C)CCC(=O)OC 4a_100000756455_100000756497 [0,2,0,0,0,0|2,0,0]=4 1922 B11R0.70 CCNNC(=O)CCC(=O)NC 22a_100000756455_100011309844 [0,2,0,0,0,0|2,0,0]=4 1923 B11R0.70 CCNNC(=O)CNC(=O)OC 22a_100000756455_100000215747 [0,2,0,0,0,0|2,0,0]=4 1924 B11R0.70 CCOCC(=O)CCC(=O)OC 34a_100121572206_100000691467 [0,2,0,0,0,0|0,0,0]=2 1925 B11R0.70 CCOCC(=O)NCC(=O)NC 11a_100000693194_100000211967 [0,2,0,0,0,0|2,0,0]=4 1926 B11R0.70 CCOCC(=O)NCC(=O)NC 240690a_100000693194_100000211967 [0,2,0,0,0,0|2,0,0]=4 1927 B11R0.70 CCOCC(=O)NCC(=O)NC 527a_100000693194_100000211967 [0,2,0,0,0,0|2,0,0]=4 1928 B11R0.70 CCOCC(=O)NCC(=O)OC 188690a_100000185156_100000211967 [0,2,0,0,0,0|1,0,0]=3 1929 B11R0.70 CCOCC(=O)NCC(=O)OC 34a_100121572206_100000182966 [0,2,0,0,0,0|1,0,0]=3 1930 B11R0.70 CCOCN(C)CCC(=O)OC 269982a_100025711912_100000739092 [0,2,0,0,0,0|2,0,0]=4 1931 B11R0.70 CCS(=O)CCC(=O)CCOC 1458a_100011387550_100000233755 [0,2,0,0,0,0|2,0,0]=4 1932 B11R0.70 CCSCC(=O)CCC(=O)OC 62a_100000210202_100000691467 [0,2,0,0,0,0|0,1,0]=3 1933 B11R0.70 CCSCC(=O)CCC(=O)OC 62a_100000691467_100000210202 [0,2,0,0,0,0|0,1,0]=3 1934 B11R0.70 CCSCC(=O)NCC(=O)OC 188690a_100000185156_100000230394 [0,2,0,0,0,0|1,1,0]=4 1935 B11R0.70 CCSCC(=O)NCC(=O)OC 62a_100000182966_100000210202 [0,2,0,0,0,0|1,1,0]=4 1936 B11R0.70 CCSCC(=O)NCC(=O)OC 62a_100000210202_100000182966 [0,2,0,0,0,0|1,1,0]=4 1937 B11R0.70 CNC(=O)CCC(=O)CCC#N 1458a_100011309844_100011215226 [0,2,0,0,0,0|2,0,0]=4 1938 B11R0.70 CNC(=O)CCC(=O)CCCF 1458a_100011309844_100011934791 [0,2,0,0,0,0|2,0,0]=4 1939 B11R0.70 CNC(=O)CCC(=O)CCCO 1458a_100011309844_100011215043 [0,2,0,0,0,0|2,0,0]=4 1940 B11R0.70 CNC(=O)CCC(=O)CCOC 1458a_100011309844_100000233755 [0,2,0,0,0,0|1,0,0]=3 1941 B11R0.70 CNC(=O)CCC(=O)CCSC 1458a_100011309844_100000751147 [0,2,0,0,0,0|1,1,0]=4 1942 B11R0.70 CNC(=O)CCC(=O)NCC#N 1626a_100000734998_100011309844 [0,2,0,0,0,0|2,0,0]=4 1943 B11R0.70 CNC(=O)CCC(=O)NCC#N 527a_100000734998_100011309844 [0,2,0,0,0,0|2,0,0]=4 1944 B11R0.70 CNC(=O)CCC(=O)NCCF 11a_100000724931_100011309844 [0,2,0,0,0,0|2,0,0]=4 1945 B11R0.70 CNC(=O)CCC(=O)NCCF 1626a_100000724931_100011309844 [0,2,0,0,0,0|2,0,0]=4 1946 B11R0.70 CNC(=O)CCC(=O)NCCF 240690a_100000724931_100011309844 [0,2,0,0,0,0|2,0,0]=4 1947 B11R0.70 CNC(=O)CCC(=O)NCCF 527a_100000724931_100011309844 [0,2,0,0,0,0|2,0,0]=4 1948 B11R0.70 CNC(=O)CCC(=O)NCCO 240690a_100000210304_100011309844 [0,2,0,0,0,0|2,0,0]=4 1949 B11R0.70 CNC(=O)CCC(=O)NCCO 527a_100000210304_100011309844 [0,2,0,0,0,0|2,0,0]=4 1950 B11R0.70 CNC(=O)CNC(=O)C=COC 240690a_100000693194_100016268678 [0,2,0,0,0,0|2,0,0]=4 1951 B11R0.70 CNC(=O)CNC(=O)CCOC 11a_100000693194_100000749529 [0,2,0,0,0,0|2,0,0]=4 1952 B11R0.70 CNC(=O)CNC(=O)CCOC 240690a_100000693194_100000749529 [0,2,0,0,0,0|2,0,0]=4 1953 B11R0.70 CNC(=O)CNC(=O)CCOC 527a_100000693194_100000749529 [0,2,0,0,0,0|2,0,0]=4 1954 B11R0.70 COC(=O)CCC(=O)CCC#N 1458a_100000187943_100011215226 [0,2,0,0,0,0|1,0,0]=3 1955 B11R0.70 COC(=O)CCC(=O)CCCF 1458a_100000187943_100011934791 [0,2,0,0,0,0|1,0,0]=3 1956 B11R0.70 COC(=O)CCC(=O)CCCO 1458a_100000187943_100011215043 [0,2,0,0,0,0|1,0,0]=3 1957 B11R0.70 COC(=O)CCC(=O)CCSC 1458a_100000187943_100000751147 [0,2,0,0,0,0|0,1,0]=3 1958 B11R0.70 COC(=O)CCC(=O)CSCF 62a_100000691467_100015361967 [0,2,0,0,0,0|0,1,0]=3 1959 B11R0.70 COC(=O)CCC(=O)CSCF 62a_100015361967_100000691467 [0,2,0,0,0,0|0,1,0]=3 1960 B11R0.70 COC(=O)CCC(=O)NCC#N 1626a_100000734998_100000187943 [0,2,0,0,0,0|1,0,0]=3 1961 B11R0.70 COC(=O)CCC(=O)NCC#N 527a_100000734998_100000187943 [0,2,0,0,0,0|1,0,0]=3 1962 B11R0.70 COC(=O)CCC(=O)NCCF 11a_100000724931_100000187943 [0,2,0,0,0,0|1,0,0]=3 1963 B11R0.70 COC(=O)CCC(=O)NCCF 1626a_100000724931_100000187943 [0,2,0,0,0,0|1,0,0]=3 1964 B11R0.70 COC(=O)CCC(=O)NCCF 240690a_100000724931_100000187943 [0,2,0,0,0,0|1,0,0]=3 1965 B11R0.70 COC(=O)CCC(=O)NCCF 527a_100000724931_100000187943 [0,2,0,0,0,0|1,0,0]=3 1966 B11R0.70 COC(=O)CCC(=O)NCCO 240690a_100000210304_100000187943 [0,2,0,0,0,0|1,0,0]=3 1967 B11R0.70 COC(=O)CCC(=O)NCCO 527a_100000210304_100000187943 [0,2,0,0,0,0|1,0,0]=3 1968 B11R0.70 COC(=O)CNC(=O)CCSC 188690a_100000185156_100000174002 [0,2,0,0,0,0|1,1,0]=4 1969 B11R0.70 COC(=O)CNC(=O)CSCF 62a_100000182966_100015361967 [0,2,0,0,0,0|1,1,0]=4 1970 B11R0.70 COC(=O)CNC(=O)CSCF 62a_100015361967_100000182966 [0,2,0,0,0,0|1,1,0]=4 1971 B11R0.70 COC(=O)NCC(=O)CCC#N 1458a_100000215747_100011215226 [0,2,0,0,0,0|2,0,0]=4 1972 B11R0.70 COC(=O)NCC(=O)CCCF 1458a_100000215747_100011934791 [0,2,0,0,0,0|2,0,0]=4 1973 B11R0.70 COC(=O)NCC(=O)CCCO 1458a_100000215747_100011215043 [0,2,0,0,0,0|2,0,0]=4 1974 B11R0.70 COC(=O)NCC(=O)CCSC 1458a_100000215747_100000751147 [0,2,0,0,0,0|1,1,0]=4 1975 B11R0.70 COC(=O)NCC(=O)NCC#N 1626a_100000734998_100000215747 [0,2,0,0,0,0|2,0,0]=4 1976 B11R0.70 COC(=O)NCC(=O)NCC#N 527a_100000734998_100000215747 [0,2,0,0,0,0|2,0,0]=4 1977 B11R0.70 COC(=O)NCC(=O)NCCF 11a_100000724931_100000215747 [0,2,0,0,0,0|2,0,0]=4 1978 B11R0.70 COC(=O)NCC(=O)NCCF 1626a_100000724931_100000215747 [0,2,0,0,0,0|2,0,0]=4 1979 B11R0.70 COC(=O)NCC(=O)NCCF 240690a_100000724931_100000215747 [0,2,0,0,0,0|2,0,0]=4 1980 B11R0.70 COC(=O)NCC(=O)NCCF 527a_100000724931_100000215747 [0,2,0,0,0,0|2,0,0]=4 1981 B11R0.70 COC(=O)NCC(=O)NCCO 240690a_100000210304_100000215747 [0,2,0,0,0,0|2,0,0]=4 1982 B11R0.70 COC(=O)NCC(=O)NCCO 527a_100000210304_100000215747 [0,2,0,0,0,0|2,0,0]=4 1983 B11R0.70 COCCC(=O)CCC(=O)OC 1458a_100000187943_100000233755 [0,2,0,0,0,0|0,0,0]=2 1984 B11R0.70 COCCC(=O)CNC(=O)OC 1458a_100000215747_100000233755 [0,2,0,0,0,0|1,0,0]=3 1985 B11R0.70 COCCC(=O)NCC(=O)OC 188690a_100000185156_100000749529 [0,2,0,0,0,0|1,0,0]=3 1986 B11R0.70 COCCN(C)CCC(=O)OC 2230a_100000743101_100000204255 [0,2,0,0,0,0|2,0,0]=4 1987 B11R0.70 COCCN(C)CCC(=O)OC 269982a_100000743101_100000204255 [0,2,0,0,0,0|2,0,0]=4 1988 B11R0.70 COCCN(C)CCC(=O)OC 269982a_100025711912_100000233755 [0,2,0,0,0,0|2,0,0]=4 1989 B11R0.100 CCNS(=O)(=O)CCC(=O)OC 270084a_100015525214_100000205946 [0,2,0,0,0,0|2,0,0]=4 1990 B11R0.100 CCNS(=O)(=O)CCC(=O)OC 274078a_100015525214_100000205946 [0,2,0,0,0,0|2,0,0]=4 1991 B11R0.107 C#CC(=O)CCC(=O)OC(C)C 1458a_100000211873_100000760027 [0,2,0,0,0,0|1,0,1]=4 1992 B11R0.107 C=C(C)CC(=O)CCC(=O)NC 1458a_100011309844_100000748629 [0,2,0,0,0,0|2,0,0]=4 1993 B11R0.107 C=C(C)CC(=O)CCC(=O)OC 1458a_100000187943_100000748629 [0,2,0,0,0,0|1,0,0]=3 1994 B11R0.107 C=C(C)CC(=O)CNC(=O)OC 1458a_100000215747_100000748629 [0,2,0,0,0,0|2,0,0]=4 1995 B11R0.107 C=C(F)CC(=O)CCC(=O)OC 1458a_100000187943_100009893438 [0,2,0,0,0,0|1,0,1]=4 1996 B11R0.107 C=CC(=O)CCC(=O)OC(C)C 1458a_100000185746_100000760027 [0,2,0,0,0,0|1,0,1]=4 1997 B11R0.107 CC(C)OC(=O)CCC(=O)CO 1458a_100000210174_100000760027 [0,2,0,0,0,0|2,0,0]=4 1998 B11R0.107 CCC(=O)CCC(=O)NC(C)C 1458a_100000210414_100000737564 [0,2,0,0,0,0|2,0,0]=4 1999 B11R0.107 CCC(=O)CCC(=O)NN(C)C 1458a_100011219620_100000210202 [0,2,0,0,0,0|2,0,0]=4 2000 B11R0.107 CCC(=O)CCC(=O)OC(C)C 1458a_100000210414_100000760027 [0,2,0,0,0,0|1,0,0]=3 2001 B11R0.107 CCC(=O)COC(=O)OC(C)C 1458a_100000210414_100000003507 [0,2,0,0,0,0|2,0,0]=4 2002 B11R0.107 CNC(=O)CCC(=O)CC(C)C 1458a_100011309844_100000210624 [0,2,0,0,0,0|2,0,0]=4 2003 B11R0.107 CNC(=O)CCC(=O)CC(C)O 1458a_100011309844_100011218427 [0,2,0,0,0,0|2,0,0]=4 2004 B11R0.107 CNC(=O)CCC(=O)CC(F)F 1458a_100011309844_100011934356 [0,2,0,0,0,0|2,0,0]=4 2005 B11R0.107 CNC(=O)CCC(=O)NC(C)C 11a_100138425928_100011309844 [0,2,0,0,0,0|2,0,0]=4 2006 B11R0.107 CNC(=O)CCC(=O)NC(C)C 1626a_100138425928_100011309844 [0,2,0,0,0,0|2,0,0]=4 2007 B11R0.107 CNC(=O)CCC(=O)NC(C)C 240690a_100138425928_100011309844 [0,2,0,0,0,0|2,0,0]=4 2008 B11R0.107 CNC(=O)CCC(=O)NC(C)C 527a_100138425928_100011309844 [0,2,0,0,0,0|2,0,0]=4 2009 B11R0.107 CNC(=O)CCC(=O)NN(C)C 240690a_100102657272_100011219620 [0,2,0,0,0,0|2,0,0]=4 2010 B11R0.107 COC(=O)CCC(=O)CC(=O)C 1458a_100000070787_100000691467 [0,2,0,0,0,0|1,0,0]=3 2011 B11R0.107 COC(=O)CCC(=O)CC(=O)N 1458a_100000187943_100000187820 [0,2,0,0,0,0|1,0,1]=4 2012 B11R0.107 COC(=O)CCC(=O)CC(=O)[O-] 1458a_100000187943_100020667443 [0,2,0,0,0,0|1,0,1]=4 2013 B11R0.107 COC(=O)CCC(=O)CC(C)C 1458a_100000187943_100000210624 [0,2,0,0,0,0|1,0,0]=3 2014 B11R0.107 COC(=O)CCC(=O)CC(C)O 1458a_100000187943_100011218427 [0,2,0,0,0,0|1,0,0]=3 2015 B11R0.107 COC(=O)CCC(=O)CC(F)F 1458a_100000187943_100011934356 [0,2,0,0,0,0|1,0,0]=3 2016 B11R0.107 COC(=O)CCC(=O)CN(C)C 2230a_100102631434_100000691467 [0,2,0,0,0,0|1,0,0]=3 2017 B11R0.107 COC(=O)CCC(=O)CN(C)C 269982a_100102631434_100000691467 [0,2,0,0,0,0|1,0,0]=3 2018 B11R0.107 COC(=O)CCC(=O)C[N+](=O)[O-] 1458a_100000187943_100000761209 [0,2,0,0,0,0|2,0,0]=4 2019 B11R0.107 COC(=O)CCC(=O)NC(C)C 11a_100138425928_100000187943 [0,2,0,0,0,0|1,0,0]=3 2020 B11R0.107 COC(=O)CCC(=O)NC(C)C 1626a_100138425928_100000187943 [0,2,0,0,0,0|1,0,0]=3 2021 B11R0.107 COC(=O)CCC(=O)NC(C)C 240690a_100138425928_100000187943 [0,2,0,0,0,0|1,0,0]=3 2022 B11R0.107 COC(=O)CCC(=O)NC(C)C 527a_100138425928_100000187943 [0,2,0,0,0,0|1,0,0]=3 2023 B11R0.107 COC(=O)CNC(=O)C=C(C)C 188690a_100000185156_100000211388 [0,2,0,0,0,0|2,0,0]=4 2024 B11R0.107 COC(=O)CNC(=O)CC(=O)C 1458a_100000070787_100000182966 [0,2,0,0,0,0|2,0,0]=4 2025 B11R0.107 COC(=O)CNC(=O)CC(C)C 188690a_100000185156_100000210554 [0,2,0,0,0,0|2,0,0]=4 2026 B11R0.107 COC(=O)CNC(=O)CN(C)C 188690a_100000185156_100000750896 [0,2,0,0,0,0|2,0,0]=4 2027 B11R0.107 COC(=O)CNC(=O)CN(C)C 2230a_100102631434_100000182966 [0,2,0,0,0,0|2,0,0]=4 2028 B11R0.107 COC(=O)CNC(=O)CN(C)C 269982a_100102631434_100000182966 [0,2,0,0,0,0|2,0,0]=4 2029 B11R0.107 COC(=O)CNC(=O)C[C@@H](C)O 188690a_100000185156_100011933948 [0,2,0,0,0,0|2,0,0]=4 2030 B11R0.107 COC(=O)CNC(=O)C[S+](C)C 188690a_100000185156_200159257847 [0,2,0,0,0,0|1,1,0]=4 2031 B11R0.107 COC(=O)NCC(=O)CC(C)C 1458a_100000215747_100000210624 [0,2,0,0,0,0|2,0,0]=4 2032 B11R0.107 COC(=O)NCC(=O)CC(C)O 1458a_100000215747_100011218427 [0,2,0,0,0,0|2,0,0]=4 2033 B11R0.107 COC(=O)NCC(=O)CC(F)F 1458a_100000215747_100011934356 [0,2,0,0,0,0|2,0,0]=4 2034 B11R0.107 COC(=O)NCC(=O)NC(C)C 11a_100138425928_100000215747 [0,2,0,0,0,0|2,0,0]=4 2035 B11R0.107 COC(=O)NCC(=O)NC(C)C 1626a_100138425928_100000215747 [0,2,0,0,0,0|2,0,0]=4 2036 B11R0.107 COC(=O)NCC(=O)NC(C)C 240690a_100138425928_100000215747 [0,2,0,0,0,0|2,0,0]=4 2037 B11R0.107 COC(=O)NCC(=O)NC(C)C 527a_100138425928_100000215747 [0,2,0,0,0,0|2,0,0]=4 2038 B11R0.170 CCS(=O)(=O)CCC(=O)COC 1458a_100000210968_100000756660 [0,2,0,0,0,0|2,0,0]=4 2039 B9R1.1 COC1CCC(=O)CC1 34a_100000764474_200000210301 [1,0,0,1,0,0|1,0,1]=4 2040 B9R1.1 COC1CCC(=O)CC1 7a_100000764474_200000210301 [1,0,0,1,0,0|1,0,1]=4 2041 B9R1.1 COC1CCC(=O)NC1 34a_100000079199_200000210301 [1,0,0,1,0,0|1,0,1]=4 2042 B9R1.1 [13CH3]OC1CCC(=O)CC1 34a_100000764474_200025704644 [1,0,0,1,0,0|1,0,1]=4 2043 B9R1.1 [13CH3]OC1CCC(=O)CC1 7a_100000764474_200025704644 [1,0,0,1,0,0|1,0,1]=4 2044 B9R1.1 [13CH3]OC1CCC(=O)NC1 34a_100000079199_200025704644 [1,0,0,1,0,0|1,0,1]=4 2045 B9R1.7 COCC1CNC(=O)C1 34a_100016041077_200000210301 [1,0,0,1,0,0|1,0,1]=4 2046 B9R1.7 COCC1COC(=O)O1 34a_100138415774_100000073702 [1,0,0,1,0,0|1,0,1]=4 2047 B9R1.7 COC[C@H]1COC(=O)N1 34a_100138415774_100015307671 [1,0,0,1,0,0|1,0,1]=4 2048 B9R1.7 [13CH3]OCC1CNC(=O)C1 34a_100016041077_200025704644 [1,0,0,1,0,0|1,0,1]=4 2049 B9R1.11 CCC(=O)C1CC=CC1 1458a_100000759439_100000210202 [1,0,0,1,0,0|2,0,0]=4 2050 B9R1.11 CCC(=O)C1CCOC1 1458a_100000210414_100000690089 [1,0,0,1,0,0|1,0,1]=4 2051 B9R1.11 CCC(=O)C1CCOC1 1458a_100011219752_100000210202 [1,0,0,1,0,0|1,0,1]=4 2052 B9R1.11 CNC(=O)C1CC=CC1 11a_106832991635_100000759439 [1,0,0,1,0,0|2,0,0]=4 2053 B9R1.11 CNC(=O)C1CC=CC1 1626a_100102657272_100000759439 [1,0,0,1,0,0|2,0,0]=4 2054 B9R1.11 CNC(=O)C1CC=CC1 240690a_100102657272_100000759439 [1,0,0,1,0,0|2,0,0]=4 2055 B9R1.11 CNC(=O)C1CC=CC1 527a_100102657272_100000759439 [1,0,0,1,0,0|2,0,0]=4 2056 B9R1.11 CNC(=O)C1CCOC1 11a_106832991635_100011219752 [1,0,0,1,0,0|1,0,1]=4 2057 B9R1.11 CNC(=O)C1CCOC1 1626a_100102657272_100011219752 [1,0,0,1,0,0|1,0,1]=4 2058 B9R1.11 CNC(=O)C1CCOC1 240690a_100102657272_100011219752 [1,0,0,1,0,0|1,0,1]=4 2059 B9R1.11 CNC(=O)C1CCOC1 527a_100102657272_100011219752 [1,0,0,1,0,0|1,0,1]=4 2060 B9R1.79 CCC(=O)CC1COC1 1458a_100000210414_100010264016 [1,0,0,1,0,0|1,0,1]=4 2061 B9R1.79 CCC(=O)CC1COC1 1458a_100000687760_100000210202 [1,0,0,1,0,0|1,0,1]=4 2062 B9R1.79 CNC(=O)CC1COC1 11a_106832991635_100000687760 [1,0,0,1,0,0|1,0,1]=4 2063 B9R1.79 CNC(=O)CC1COC1 1626a_100102657272_100000687760 [1,0,0,1,0,0|1,0,1]=4 2064 B9R1.80 CCC(=O)CCC1CO1 1458a_100000210414_100000732470 [1,0,0,1,0,0|1,0,1]=4 2065 B9R1.81 COC(=O)[C@@H]1CCN1C 2230a_102516456887_200000210301 [1,0,0,1,0,0|1,0,1]=4 2066 B9R1.81 COC(=O)[C@@H]1CCN1C 269982a_102516456887_200000210301 [1,0,0,1,0,0|1,0,1]=4 2067 B9R1.81 COC(=O)[C@@H]1CCN1[13CH3] 2230a_102516456887_200025704644 [1,0,0,1,0,0|1,0,1]=4 2068 B9R1.81 COC(=O)[C@@H]1CCN1[13CH3] 269982a_102516456887_200025704644 [1,0,0,1,0,0|1,0,1]=4 2069 B9R1.88 CCN1CC1C(=O)OC 2230a_200009830135_100000210202 [1,0,0,1,0,0|2,0,0]=4 2070 B9R1.35 CC(=O)C1CCC(=O)N1 1458a_100000210400_200000210301 [1,0,0,1,0,0|2,0,0]=4 2071 B9R1.35 CC(=O)C1CNC(=O)C1 1458a_100000747279_200000210301 [1,0,0,1,0,0|1,0,0]=3 2072 B9R1.35 CC(=O)C1CNC(=O)N1 1458a_100000033324_200000210301 [1,0,0,1,0,0|2,0,0]=4 2073 B9R1.35 CC(=O)N1CNC(=O)C1 11a_200000708111_100015343762 [1,0,0,1,0,0|2,0,0]=4 2074 B9R1.35 CC(=O)N1CNC(=O)C1 1626a_200000708111_100015343762 [1,0,0,1,0,0|2,0,0]=4 2075 B9R1.35 CC(=O)N1CNC(=O)C1 240690a_200000708111_100015343762 [1,0,0,1,0,0|2,0,0]=4 2076 B9R1.35 CC(=O)N1CNC(=O)C1 527a_200000708111_100103153847 [1,0,0,1,0,0|2,0,0]=4 2077 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000210301 [1,0,0,1,0,0|2,0,0]=4 2078 B9R1.35 CC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_200000210301 [1,0,0,1,0,0|1,1,0]=4 2079 B9R1.35 [13CH3]C(=O)C1CCC(=O)N1 1458a_100000210400_200025704644 [1,0,0,1,0,0|2,0,0]=4 2080 B9R1.35 [13CH3]C(=O)C1CNC(=O)C1 1458a_100000747279_200025704644 [1,0,0,1,0,0|1,0,0]=3 2081 B9R1.35 [13CH3]C(=O)C1CNC(=O)N1 1458a_100000033324_200025704644 [1,0,0,1,0,0|2,0,0]=4 2082 B9R1.35 [13CH3]C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200025704644 [1,0,0,1,0,0|2,0,0]=4 2083 B9R1.35 [13CH3]C(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_200025704644 [1,0,0,1,0,0|1,1,0]=4 2084 B9R1.82 C=C1CC(C1)C(=O)CC 1458a_100000065620_100000210202 [1,0,0,1,0,0|2,0,0]=4 2085 B9R1.82 C=C1CC(C1)C(=O)NC 11a_106832991635_100000065620 [1,0,0,1,0,0|2,0,0]=4 2086 B9R1.82 C=C1CC(C1)C(=O)NC 1626a_100102657272_100000065620 [1,0,0,1,0,0|2,0,0]=4 2087 B9R1.82 C=C1CC(C1)C(=O)NC 240690a_100102657272_100000065620 [1,0,0,1,0,0|2,0,0]=4 2088 B9R1.82 C=C1CC(C1)C(=O)NC 527a_100102657272_100000065620 [1,0,0,1,0,0|2,0,0]=4 2089 B9R1.82 CCC(=O)[C@@H]1CC(=O)N1 1458a_100016090685_100000210202 [1,0,0,1,0,0|2,0,0]=4 2090 B9R1.82 CNC(=O)[C@@H]1CC(=O)N1 527a_100102657272_100016090685 [1,0,0,1,0,0|2,0,0]=4 2091 B9R1.82 COC(=O)C1CN(C1)C 269982a_100015188540_200000210301 [1,0,0,1,0,0|2,0,0]=4 2092 B9R1.82 COC(=O)C1CN(C1)[13CH3] 269982a_100015188540_200025704644 [1,0,0,1,0,0|2,0,0]=4 2093 B9R1.95 COC1CC(C1)C(=O)C 1458a_100011999411_200000210301 [1,0,0,1,0,0|1,0,1]=4 2094 B9R1.95 COC1CC(C1)C(=O)[13CH3] 1458a_100011999411_200025704644 [1,0,0,1,0,0|1,0,1]=4 2095 B11R1.22 CCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210202 [0,0,0,1,0,1|2,0,0]=4 2096 B11R1.22 CNC(=O)C1CCC(=O)NC1 11a_106832991635_100000740907 [0,0,0,1,0,1|2,0,0]=4 2097 B11R1.22 CNC(=O)C1CCC(=O)NC1 1626a_100102657272_100000740907 [0,0,0,1,0,1|2,0,0]=4 2098 B11R1.22 CNC(=O)C1CCC(=O)NC1 240690a_100102657272_100000740907 [0,0,0,1,0,1|2,0,0]=4 2099 B11R1.22 CNC(=O)C1CCC(=O)NC1 527a_100102657272_100000740907 [0,0,0,1,0,1|2,0,0]=4 2100 B11R1.39 C#CC(=O)CC1COC(=O)O1 1458a_100000211873_100000073702 [0,0,0,1,0,1|1,0,1]=4 2101 B11R1.39 C#CC(=O)C[C@H]1COC(=O)N1 1458a_100000211873_100015307671 [0,0,0,1,0,1|1,0,1]=4 2102 B11R1.39 C=CC(=O)CC1COC(=O)O1 1458a_100000185746_100000073702 [0,0,0,1,0,1|1,0,1]=4 2103 B11R1.39 C=CC(=O)C[C@H]1COC(=O)N1 1458a_100000185746_100015307671 [0,0,0,1,0,1|1,0,1]=4 2104 B11R1.39 CCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210202 [0,0,0,1,0,1|2,0,0]=4 2105 B11R1.39 CCC(=O)CC1CNC(=O)O1 1458a_100000210414_100000181169 [0,0,0,1,0,1|2,0,0]=4 2106 B11R1.39 CCC(=O)CC1COC(=O)O1 1458a_100000210414_100000073702 [0,0,0,1,0,1|1,0,0]=3 2107 B11R1.39 CCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000210414_100015189358 [0,0,0,1,0,1|2,0,0]=4 2108 B11R1.39 CCC(=O)C[C@H]1COC(=O)N1 1458a_100000210414_100015307671 [0,0,0,1,0,1|1,0,0]=3 2109 B11R1.39 CCC(=O)NC1CNC(=O)C1 11a_100000697751_100000210414 [0,0,0,1,0,1|2,0,0]=4 2110 B11R1.39 CCC(=O)NC1CNC(=O)C1 1626a_100000697751_100000210414 [0,0,0,1,0,1|2,0,0]=4 2111 B11R1.39 CCC(=O)NC1CNC(=O)C1 240690a_100000697751_100000210414 [0,0,0,1,0,1|2,0,0]=4 2112 B11R1.39 CCC(=O)NC1CNC(=O)C1 527a_100000697751_100000210414 [0,0,0,1,0,1|2,0,0]=4 2113 B11R1.39 CNC(=O)CC1CCC(=O)N1 1626a_100102657272_100000026770 [0,0,0,1,0,1|2,0,0]=4 2114 B11R1.39 CNC(=O)CC1CCC(=O)N1 240690a_100102657272_100000026770 [0,0,0,1,0,1|2,0,0]=4 2115 B11R1.39 CNC(=O)CN1CNC(=O)C1 2230a_200000708111_100000183359 [0,0,0,1,0,1|2,0,0]=4 2116 B11R1.39 CNC(=O)NC1CNC(=O)C1 2708a_100000697751_106832991635 [0,0,0,1,0,1|2,0,0]=4 2117 B11R1.39 CNC(=O)NC1CNC(=O)C1 2708a_100102657272_100000697751 [0,0,0,1,0,1|2,0,0]=4 2118 B11R1.39 CNC(=O)NC1CNC(=O)C1 273464a_100000697751_100102657272 [0,0,0,1,0,1|2,0,0]=4 2119 B11R1.39 CNC(=O)NC1CNC(=O)C1 273464a_100102657272_100000697751 [0,0,0,1,0,1|2,0,0]=4 2120 B11R1.39 CNC(=O)NC1CNC(=O)C1 512a_100000697751_100102657272 [0,0,0,1,0,1|2,0,0]=4 2121 B11R1.39 CNC(=O)NC1CNC(=O)C1 512a_106832991638_100000697751 [0,0,0,1,0,1|2,0,0]=4 2122 B11R1.39 COC(=O)CN1CNC(=O)C1 2230a_200000708111_100000747449 [0,0,0,1,0,1|1,0,0]=3 2123 B11R1.39 O=C(CO)CC1COC(=O)O1 1458a_100000210174_100000073702 [0,0,0,1,0,1|2,0,0]=4 2124 B11R1.39 O=C(CO)C[C@H]1COC(=O)N1 1458a_100000210174_100015307671 [0,0,0,1,0,1|2,0,0]=4 2125 B11R1.44 COC(=O)C1CCC(C1)OC 34a_100010257243_200000210301 [0,0,0,1,0,1|1,0,1]=4 2126 B11R1.44 COC(=O)C1CCC(C1)OC 7a_100010257243_200000210301 [0,0,0,1,0,1|1,0,1]=4 2127 B11R1.44 COC(=O)C1CCC(C1)O[13CH3] 34a_100010257243_200025704644 [0,0,0,1,0,1|1,0,1]=4 2128 B11R1.44 COC(=O)C1CCC(C1)O[13CH3] 7a_100010257243_200025704644 [0,0,0,1,0,1|1,0,1]=4 2129 B11R1.223 CCC(=O)CCC1CCC1=O 1458a_100000210414_200016118888 [0,0,0,1,0,1|2,0,0]=4 2130 B11R1.223 CCC(=O)COC1CCC1=O 34a_100000725409_100009892977 [0,0,0,1,0,1|2,0,0]=4 2131 B11R1.223 CCC(=O)CSC1CCC1=O 62a_100000747405_100009892977 [0,0,0,1,0,1|2,0,0]=4 2132 B11R1.223 CCC(=O)CSC1CCC1=O 62a_100009892977_100000747405 [0,0,0,1,0,1|2,0,0]=4 2133 B11R1.223 CNC(=O)COC1CCC1=O 34a_100000750040_100009892977 [0,0,0,1,0,1|2,0,0]=4 2134 B11R1.223 CNC(=O)CSC1CCC1=O 62a_100000183359_100009892977 [0,0,0,1,0,1|2,0,0]=4 2135 B11R1.223 CNC(=O)CSC1CCC1=O 62a_100009892977_100000183359 [0,0,0,1,0,1|2,0,0]=4 2136 B11R1.223 COC(=O)CSC1CCC1=O 62a_100000747449_100009892977 [0,0,0,1,0,1|1,0,0]=3 2137 B11R1.223 COC(=O)CSC1CCC1=O 62a_100009892977_100000747449 [0,0,0,1,0,1|1,0,0]=3 2138 B11R1.236 COC(=O)CNC[C@@H]1CCO1 2230a_100020831831_100000747449 [0,0,0,1,0,1|1,0,1]=4 2139 B11R1.236 COC(=O)CNC[C@@H]1CCO1 34a_100020831831_100000747449 [0,0,0,1,0,1|1,0,1]=4 2140 B11R1.236 COC(=O)COCC1CCO1 34a_100000039022_100000747449 [0,0,0,1,0,1|1,0,1]=4 2141 B11R1.236 COC(=O)CSCC1CCO1 62a_100000103362_100000747449 [0,0,0,1,0,1|1,0,1]=4 2142 B11R1.236 COC(=O)CSCC1CCO1 62a_100000747449_100000103362 [0,0,0,1,0,1|1,0,1]=4 2143 B11R1.264 COC(=O)CN1CC(C1)OC 269982a_100000755009_100000747449 [0,0,0,1,0,1|1,0,1]=4 2144 B11R1.851 C=CC(=O)N1CC1C(=O)OC 240690a_200009830135_200121576911 [0,0,0,1,0,1|1,0,1]=4 2145 B11R1.851 CCC(=O)C1CC1C(=O)OC 1458a_100000750770_100000210202 [0,0,0,1,0,1|1,0,0]=3 2146 B11R1.851 CCC(=O)N1CC1C(=O)OC 240690a_200009830135_100000210414 [0,0,0,1,0,1|1,0,0]=3 2147 B11R1.851 CNC(=O)C1CC1C(=O)OC 11a_106832991635_100000750770 [0,0,0,1,0,1|1,0,0]=3 2148 B11R1.851 CNC(=O)C1CC1C(=O)OC 240690a_100102657272_100000750770 [0,0,0,1,0,1|1,0,0]=3 2149 B11R1.851 COC(=O)C1CC1C(=O)CF 1458a_100000750770_100015361967 [0,0,0,1,0,1|2,0,0]=4 2150 B11R1.851 COC(=O)C1CN1C(=O)CO 240690a_200009830135_100000210174 [0,0,0,1,0,1|2,0,0]=4 2151 B11R1.865 CCC(=O)[C@H]1CCC(=O)N1C 1458a_100010979499_100000210202 [0,0,0,1,0,1|2,0,0]=4 2152 B11R1.865 CNC(=O)[C@H]1CCC(=O)N1C 11a_106832991635_100010979499 [0,0,0,1,0,1|2,0,0]=4 2153 B11R1.865 CNC(=O)[C@H]1CCC(=O)N1C 1626a_100102657272_100010979499 [0,0,0,1,0,1|2,0,0]=4 2154 B11R1.865 CNC(=O)[C@H]1CCC(=O)N1C 240690a_100102657272_100010979499 [0,0,0,1,0,1|2,0,0]=4 2155 B11R1.865 CNC(=O)[C@H]1CCC(=O)N1C 527a_100102657272_100010979499 [0,0,0,1,0,1|2,0,0]=4 2156 B11R1.1029 COC(=O)CSCC1(CO1)C 62a_100000747449_100000760498 [0,0,0,1,0,1|1,0,1]=4 2157 B11R1.1029 COC(=O)CSCC1(CO1)C 62a_100000760498_100000747449 [0,0,0,1,0,1|1,0,1]=4 2158 B11R1.23 CCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210202 [0,1,0,1,0,0|2,0,0]=4 2159 B11R1.23 CCC(=O)N1CCOC(=O)C1 11a_100000131268_100000210414 [0,1,0,1,0,0|2,0,0]=4 2160 B11R1.23 CCC(=O)N1CCOC(=O)C1 240690a_100000131268_100000210414 [0,1,0,1,0,0|2,0,0]=4 2161 B11R1.23 CCC(=O)N1CCOC(=O)C1 527a_100000131268_100000210414 [0,1,0,1,0,0|2,0,0]=4 2162 B11R1.23 CNC(=O)C1CCNC(=O)C1 11a_106832991635_100000132800 [0,1,0,1,0,0|2,0,0]=4 2163 B11R1.23 CNC(=O)C1CCNC(=O)C1 1626a_100102657272_100000132800 [0,1,0,1,0,0|2,0,0]=4 2164 B11R1.23 CNC(=O)C1CCNC(=O)C1 240690a_100102657272_100000132800 [0,1,0,1,0,0|2,0,0]=4 2165 B11R1.23 CNC(=O)C1CCNC(=O)C1 527a_100102657272_100000132800 [0,1,0,1,0,0|2,0,0]=4 2166 B11R1.23 CNC(=O)N1CCOC(=O)C1 2708a_100102657272_100000131268 [0,1,0,1,0,0|2,0,0]=4 2167 B11R1.226 CCC(=O)C1CC(=O)N(C1)C 1458a_100000187535_100000210202 [0,1,0,1,0,0|2,0,0]=4 2168 B11R1.226 CNC(=O)C1CC(=O)N(C1)C 11a_106832991635_100000187535 [0,1,0,1,0,0|2,0,0]=4 2169 B11R1.226 CNC(=O)C1CC(=O)N(C1)C 1626a_100102657272_100000187535 [0,1,0,1,0,0|2,0,0]=4 2170 B11R1.226 CNC(=O)C1CC(=O)N(C1)C 240690a_100102657272_100000187535 [0,1,0,1,0,0|2,0,0]=4 2171 B11R1.226 CNC(=O)C1CC(=O)N(C1)C 527a_100102657272_100000187535 [0,1,0,1,0,0|2,0,0]=4 2172 B11R1.228 CCC(=O)CN1CCOC1=O 1458a_100011227918_100000210202 [0,1,0,1,0,0|2,0,0]=4 2173 B11R1.228 CCC(=O)N[C@@H]1CONC1=O 11a_100000765999_100000210414 [0,1,0,1,0,0|2,0,0]=4 2174 B11R1.228 CNC(=O)CN1CCOC1=O 11a_106832991635_100011227918 [0,1,0,1,0,0|2,0,0]=4 2175 B11R1.228 CNC(=O)CN1CCOC1=O 1626a_100102657272_100011227918 [0,1,0,1,0,0|2,0,0]=4 2176 B11R1.228 CNC(=O)CN1CCOC1=O 240690a_100102657272_100011227918 [0,1,0,1,0,0|2,0,0]=4 2177 B11R1.228 CNC(=O)CN1CCOC1=O 527a_100102657272_100011227918 [0,1,0,1,0,0|2,0,0]=4 2178 B11R1.228 CNC(=O)N[C@@H]1CONC1=O 2708a_100102657272_100000765999 [0,1,0,1,0,0|2,0,0]=4 2179 B11R1.228 CNC(=O)N[C@@H]1CONC1=O 273464a_100000765999_100102657272 [0,1,0,1,0,0|2,0,0]=4 2180 B11R1.228 CNC(=O)N[C@@H]1CONC1=O 273464a_100102657272_100000765999 [0,1,0,1,0,0|2,0,0]=4 2181 B11R1.228 CNC(=O)N[C@@H]1CONC1=O 512a_100000765999_100102657272 [0,1,0,1,0,0|2,0,0]=4 2182 B11R1.228 CNC(=O)N[C@@H]1CONC1=O 512a_106832991638_100000765999 [0,1,0,1,0,0|2,0,0]=4 2183 B11R1.1082 COC(=O)[C@@]1(C[C@@H](C1)OC)C 7a_100015912854_200000210301 [0,1,0,1,0,0|1,0,1]=4 2184 B11R1.1082 COC(=O)[C@@]1(C[C@@H](C1)O[13CH3])C 7a_100015912854_200025704644 [0,1,0,1,0,0|1,0,1]=4 2185 B11R1.314 CC(C)C(=O)C1CNC(=O)C1 1458a_100000747279_100000210206 [0,1,0,1,0,0|2,0,0]=4 2186 B11R1.314 CN(C)C(=O)C1CNC(=O)C1 11a_100102631434_100000747279 [0,1,0,1,0,0|2,0,0]=4 2187 B11R1.314 CN(C)C(=O)C1CNC(=O)C1 1626a_100102631434_100000747279 [0,1,0,1,0,0|2,0,0]=4 2188 B11R1.314 CN(C)C(=O)C1CNC(=O)C1 240690a_100102631434_100000747279 [0,1,0,1,0,0|2,0,0]=4 2189 B11R1.314 CN(C)C(=O)C1CNC(=O)C1 527a_100102631434_100000747279 [0,1,0,1,0,0|2,0,0]=4 2190 B11R1.524 CNC(=O)CNC(=O)C1CO1 11a_100000693194_100000701028 [0,1,0,1,0,0|2,0,0]=4 2191 B11R1.524 CNC(=O)CNC(=O)C1CO1 240690a_100000693194_100000701028 [0,1,0,1,0,0|2,0,0]=4 2192 B11R1.524 CNC(=O)CNC(=O)C1CO1 527a_100000693194_100000701028 [0,1,0,1,0,0|2,0,0]=4 2193 B11R1.524 COC(=O)CNC(=O)C1CC1 188690a_100000185156_100000210395 [0,1,0,1,0,0|2,0,0]=4 2194 B11R1.524 COC(=O)CNC(=O)C1CO1 188690a_100000185156_100000701028 [0,1,0,1,0,0|1,0,0]=3 2195 B11R1.15 CCCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210303 [0,1,0,1,0,0|2,0,0]=4 2196 B11R1.15 CCNC(=O)C1CNC(=O)C1 11a_100015525214_100000747279 [0,1,0,1,0,0|2,0,0]=4 2197 B11R1.15 CCNC(=O)C1CNC(=O)C1 240690a_100015525214_100000747279 [0,1,0,1,0,0|2,0,0]=4 2198 B11R1.15 CCNC(=O)C1CNC(=O)C1 527a_100015525214_100000747279 [0,1,0,1,0,0|2,0,0]=4 2199 B11R1.15 CNNC(=O)C1CNC(=O)C1 22a_100016993582_100000747279 [0,1,0,1,0,0|2,0,0]=4 2200 B11R1.15 COCC(=O)N1CNC(=O)C1 11a_200000708111_100000210968 [0,1,0,1,0,0|2,0,0]=4 2201 B11R1.15 COCC(=O)N1CNC(=O)C1 1626a_200000708111_100000210968 [0,1,0,1,0,0|2,0,0]=4 2202 B11R1.15 COCC(=O)N1CNC(=O)C1 240690a_200000708111_100000210968 [0,1,0,1,0,0|2,0,0]=4 2203 B11R1.15 COCC(=O)N1CNC(=O)C1 527a_200000708111_100000210968 [0,1,0,1,0,0|2,0,0]=4 2204 B11R1.15 O=C1CC(CN1)C(=O)CCF 1458a_100000747279_100011217306 [0,1,0,1,0,0|2,0,0]=4 2205 B11R1.15 O=C1CC(CN1)C(=O)CCO 1458a_100000747279_100000211926 [0,1,0,1,0,0|2,0,0]=4 2206 B11R1.121 CCOC1CC(C1)C(=O)OC 34a_100121572206_100009897219 [0,1,0,1,0,0|1,0,1]=4 2207 B11R1.121 CCOC1CC(C1)C(=O)OC 7a_100000076263_100000210202 [0,1,0,1,0,0|1,0,1]=4 2208 B11R1.121 COC(=O)C1CC(C1)CO[13CH3] 34a_100009884387_200025704644 [0,1,0,1,0,0|1,0,1]=4 2209 B11R1.121 COC(=O)C1CC(C1)CO[13CH3] 7a_100009884387_200025704644 [0,1,0,1,0,0|1,0,1]=4 2210 B11R1.121 COC(=O)C1CC(C1)OCF 7a_100000076263_100015361967 [0,1,0,1,0,0|1,0,1]=4 2211 B11R1.121 COCC1CC(C1)C(=O)OC 34a_100009884387_200000210301 [0,1,0,1,0,0|1,0,1]=4 2212 B11R1.121 COCC1CC(C1)C(=O)OC 7a_100009884387_200000210301 [0,1,0,1,0,0|1,0,1]=4 2213 B11R1.121 COCN1CC(C1)C(=O)OC 269982a_100015188540_100000766300 [0,1,0,1,0,0|2,0,0]=4 2214 B11R1.225 C=C1C[C@H](N(C1)C)C(=O)OC 2230a_100025771018_200000210301 [0,1,0,1,0,0|2,0,0]=4 2215 B11R1.225 C=C1C[C@H](N(C1)[13CH3])C(=O)OC 2230a_100025771018_200025704644 [0,1,0,1,0,0|2,0,0]=4 2216 B11R1.822 CCOC(=O)C1CC(C1)OC 7a_100000093532_200000210301 [0,1,0,1,0,0|1,0,1]=4 2217 B11R1.822 CCOC(=O)C1CC(C1)O[13CH3] 7a_100000093532_200025704644 [0,1,0,1,0,0|1,0,1]=4 2218 B7R0.2 C=C(C)CC(=O)CC 1458a_100000210414_100000748629 [1,0,0,0,1,0|2,0,0]=4 2219 B7R0.2 CCC(=O)CC(=O)C 1458a_100000070787_100000747405 [1,0,0,0,1,0|1,0,0]=3 2220 B7R0.2 CCC(=O)CC(=O)N 1458a_100000210414_100000187820 [1,0,0,0,1,0|2,0,0]=4 2221 B7R0.2 CCC(=O)CC(=O)N 1458a_100134613110_100000210202 [1,0,0,0,1,0|2,0,0]=4 2222 B7R0.2 CCC(=O)CC(=O)[O-] 1458a_100000210414_100020667443 [1,0,0,0,1,0|1,0,1]=4 2223 B7R0.2 CNC(=O)CC(=O)C 1458a_100000070787_100000183359 [1,0,0,0,1,0|1,0,0]=3 2224 B7R0.2 CNC(=O)CC(=O)N 240690a_100102657272_100134613110 [1,0,0,0,1,0|2,0,0]=4 2225 B7R0.2 CNC(=O)CC(=O)N 527a_100102657272_100134613110 [1,0,0,0,1,0|2,0,0]=4 2226 B7R0.2 COC(=O)CC(=O)C 1458a_100000070787_100000747449 [1,0,0,0,1,0|0,0,0]=2 2227 B7R0.2 COC(=O)CC(=O)C 1458a_100000211351_200000210301 [1,0,0,0,1,0|0,0,0]=2 2228 B7R0.2 COC(=O)CC(=O)[13CH3] 1458a_100000211351_200025704644 [1,0,0,0,1,0|0,0,0]=2 2229 B7R0.2 COC(=O)CN(C)C 2230a_100000198492_200000210301 [1,0,0,0,1,0|2,0,0]=4 2230 B7R0.2 COC(=O)CN(C)C 2230a_100102631434_100000747449 [1,0,0,0,1,0|2,0,0]=4 2231 B7R0.2 COC(=O)CN(C)C 269982a_100102631434_100000747449 [1,0,0,0,1,0|2,0,0]=4 2232 B7R0.2 COC(=O)CN(C)[13CH3] 2230a_100000198492_200025704644 [1,0,0,0,1,0|2,0,0]=4 2233 B7R0.10 CCC(=O)C(=O)NC 1458a_100011218921_100000210202 [0,0,0,0,2,0|2,0,0]=4 2234 B7R0.10 CNC(=O)C(=O)NC 1626a_100102657272_100011218921 [0,0,0,0,2,0|2,0,0]=4 2235 B7R0.10 CNC(=O)C(=O)NC 240690a_100102657272_100011218921 [0,0,0,0,2,0|2,0,0]=4 2236 B7R0.10 CNC(=O)C(=O)NC 527a_100102657272_100011218921 [0,0,0,0,2,0|2,0,0]=4 2237 B7R0.10 CNC(=O)C(=O)OC 11a_106832991635_100000024059 [0,0,0,0,2,0|1,0,0]=3 2238 B7R0.10 CNC(=O)C(=O)OC 1626a_100102657272_100000024059 [0,0,0,0,2,0|1,0,0]=3 2239 B7R0.10 CNC(=O)C(=O)OC 240690a_100102657272_100000024059 [0,0,0,0,2,0|1,0,0]=3 2240 B7R0.10 CNC(=O)C(=O)OC 527a_100102657272_100000024059 [0,0,0,0,2,0|1,0,0]=3 2241 B7R0.10 COC(=O)C(C)OC 34a_100011215400_200000210301 [0,0,0,0,2,0|1,0,1]=4 2242 B7R0.10 COC(=O)C(C)OC 34a_100138415774_100000211248 [0,0,0,0,2,0|1,0,1]=4 2243 B7R0.10 COC(=O)C(C)O[13CH3] 34a_100011215400_200025704644 [0,0,0,0,2,0|1,0,1]=4 2244 B11R0.106 C#CC(=O)CCCCC(=O)OC 1458a_100000211873_100000204269 [0,0,0,0,0,2|1,0,1]=4 2245 B11R0.106 C#CC(=O)CCOCC(=O)OC 1458a_100000211873_100000090808 [0,0,0,0,0,2|1,0,1]=4 2246 B11R0.106 C=CC(=O)CCCCC(=O)OC 1458a_100000185746_100000204269 [0,0,0,0,0,2|1,0,1]=4 2247 B11R0.106 C=CC(=O)CCOCC(=O)OC 1458a_100000185746_100000090808 [0,0,0,0,0,2|1,0,1]=4 2248 B11R0.106 CCC(=O)CCCCC(=O)OC 1458a_100000210414_100000204269 [0,0,0,0,0,2|1,0,0]=3 2249 B11R0.106 CCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210202 [0,0,0,0,0,2|1,0,0]=3 2250 B11R0.106 CCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210202 [0,0,0,0,0,2|1,0,0]=3 2251 B11R0.106 CCC(=O)CCOCC(=O)OC 1458a_100000210414_100000090808 [0,0,0,0,0,2|1,0,0]=3 2252 B11R0.106 CCC(=O)COCCC(=O)NC 34a_100000725409_100012179268 [0,0,0,0,0,2|2,0,0]=4 2253 B11R0.106 CCC(=O)COCCC(=O)OC 34a_100000725409_100000742370 [0,0,0,0,0,2|1,0,0]=3 2254 B11R0.106 CCC(=O)CSCCC(=O)NC 62a_100000737683_100000747405 [0,0,0,0,0,2|2,0,0]=4 2255 B11R0.106 CCC(=O)CSCCC(=O)NC 62a_100000747405_100000737683 [0,0,0,0,0,2|2,0,0]=4 2256 B11R0.106 CCC(=O)CSCCC(=O)OC 62a_100000204255_100000747405 [0,0,0,0,0,2|1,0,0]=3 2257 B11R0.106 CCC(=O)CSCCC(=O)OC 62a_100000747405_100000204255 [0,0,0,0,0,2|1,0,0]=3 2258 B11R0.106 CCC(=O)CSCOC(=O)OC 62a_100000747405_100000139417 [0,0,0,0,0,2|1,0,0]=3 2259 B11R0.106 CCC(=O)NCCCC(=O)NC 11a_100000740002_100000210414 [0,0,0,0,0,2|2,0,0]=4 2260 B11R0.106 CCC(=O)NCCCC(=O)NC 240690a_100000740002_100000210414 [0,0,0,0,0,2|2,0,0]=4 2261 B11R0.106 CCC(=O)NCCCC(=O)NC 527a_100000740002_100000210414 [0,0,0,0,0,2|2,0,0]=4 2262 B11R0.106 CCC(=O)NCCCC(=O)OC 188690a_100000184769_100000210414 [0,0,0,0,0,2|1,0,0]=3 2263 B11R0.106 CCC(=O)NCCNC(=O)CC 11a_100132302217_100000210414 [0,0,0,0,0,2|2,0,0]=4 2264 B11R0.106 CCC(=O)NCCNC(=O)CC 1626a_100132302217_100000210414 [0,0,0,0,0,2|2,0,0]=4 2265 B11R0.106 CCC(=O)NCCNC(=O)CC 240690a_100132302217_100000210414 [0,0,0,0,0,2|2,0,0]=4 2266 B11R0.106 CCC(=O)NCCNC(=O)CC 527a_100132302217_100000210414 [0,0,0,0,0,2|2,0,0]=4 2267 B11R0.106 CCC(=O)NCCNC(=O)NC 11a_100015205895_100000210414 [0,0,0,0,0,2|2,0,0]=4 2268 B11R0.106 CCC(=O)NCCNC(=O)NC 240690a_100015205895_100000210414 [0,0,0,0,0,2|2,0,0]=4 2269 B11R0.106 CCC(=O)NCCNC(=O)NC 2708a_100102657272_100132302217 [0,0,0,0,0,2|2,0,0]=4 2270 B11R0.106 CCC(=O)NCCNC(=O)NC 2708a_100132302217_106832991635 [0,0,0,0,0,2|2,0,0]=4 2271 B11R0.106 CCC(=O)NCCNC(=O)NC 273464a_100102657272_100132302217 [0,0,0,0,0,2|2,0,0]=4 2272 B11R0.106 CCC(=O)NCCNC(=O)NC 273464a_100132302217_100102657272 [0,0,0,0,0,2|2,0,0]=4 2273 B11R0.106 CCC(=O)NCCNC(=O)NC 512a_100132302217_100102657272 [0,0,0,0,0,2|2,0,0]=4 2274 B11R0.106 CCC(=O)NCCNC(=O)NC 512a_106832991638_100132302217 [0,0,0,0,0,2|2,0,0]=4 2275 B11R0.106 CCC(=O)NCCNC(=O)NC 527a_100015205895_100000210414 [0,0,0,0,0,2|2,0,0]=4 2276 B11R0.106 CCC(=O)NN=CCC(=O)OC 4a_100000183195_200011552997 [0,0,0,0,0,2|1,0,1]=4 2277 B11R0.106 CNC(=O)CCCCC(=O)OC 11a_106832991635_100000695723 [0,0,0,0,0,2|1,0,0]=3 2278 B11R0.106 CNC(=O)CCCCC(=O)OC 1626a_100102657272_100000695723 [0,0,0,0,0,2|1,0,0]=3 2279 B11R0.106 CNC(=O)CCCCC(=O)OC 240690a_100102657272_100000695723 [0,0,0,0,0,2|1,0,0]=3 2280 B11R0.106 CNC(=O)CCCCC(=O)OC 527a_100102657272_100000695723 [0,0,0,0,0,2|1,0,0]=3 2281 B11R0.106 CNC(=O)CCCNC(=O)NC 2708a_100000740002_106832991635 [0,0,0,0,0,2|2,0,0]=4 2282 B11R0.106 CNC(=O)CCCNC(=O)NC 2708a_100102657272_100000740002 [0,0,0,0,0,2|2,0,0]=4 2283 B11R0.106 CNC(=O)CCCNC(=O)NC 273464a_100000740002_100102657272 [0,0,0,0,0,2|2,0,0]=4 2284 B11R0.106 CNC(=O)CCCNC(=O)NC 273464a_100102657272_100000740002 [0,0,0,0,0,2|2,0,0]=4 2285 B11R0.106 CNC(=O)CCCNC(=O)NC 512a_100000740002_100102657272 [0,0,0,0,0,2|2,0,0]=4 2286 B11R0.106 CNC(=O)CCCNC(=O)NC 512a_106832991638_100000740002 [0,0,0,0,0,2|2,0,0]=4 2287 B11R0.106 CNC(=O)CCCNC(=O)OC 11a_106832991635_100000753017 [0,0,0,0,0,2|1,0,0]=3 2288 B11R0.106 CNC(=O)CCCNC(=O)OC 1626a_100102657272_100000753017 [0,0,0,0,0,2|1,0,0]=3 2289 B11R0.106 CNC(=O)CCCNC(=O)OC 240690a_100102657272_100000753017 [0,0,0,0,0,2|1,0,0]=3 2290 B11R0.106 CNC(=O)CCCNC(=O)OC 527a_100102657272_100000753017 [0,0,0,0,0,2|1,0,0]=3 2291 B11R0.106 CNC(=O)CCNCC(=O)NC 2230a_100000693194_100000737683 [0,0,0,0,0,2|2,0,0]=4 2292 B11R0.106 CNC(=O)CCNCC(=O)NC 2230a_100000738227_100000183359 [0,0,0,0,0,2|2,0,0]=4 2293 B11R0.106 CNC(=O)CCNCC(=O)NC 34a_100000738227_100000183359 [0,0,0,0,0,2|2,0,0]=4 2294 B11R0.106 CNC(=O)CCNCC(=O)OC 2230a_100000738227_100000747449 [0,0,0,0,0,2|1,0,0]=3 2295 B11R0.106 CNC(=O)CCNCC(=O)OC 34a_100000738227_100000747449 [0,0,0,0,0,2|1,0,0]=3 2296 B11R0.106 CNC(=O)CCOCC(=O)NC 34a_100000750040_100012179268 [0,0,0,0,0,2|2,0,0]=4 2297 B11R0.106 CNC(=O)CCOCC(=O)NC 34a_100000754576_100000183359 [0,0,0,0,0,2|2,0,0]=4 2298 B11R0.106 CNC(=O)CCOCC(=O)OC 34a_100000754576_100000747449 [0,0,0,0,0,2|1,0,0]=3 2299 B11R0.106 CNC(=O)CCSCC(=O)NC 62a_100000183359_100000737683 [0,0,0,0,0,2|2,0,0]=4 2300 B11R0.106 CNC(=O)CCSCC(=O)NC 62a_100000737683_100000183359 [0,0,0,0,0,2|2,0,0]=4 2301 B11R0.106 CNC(=O)CCSCC(=O)OC 62a_100000737683_100000747449 [0,0,0,0,0,2|1,0,0]=3 2302 B11R0.106 CNC(=O)CCSCC(=O)OC 62a_100000747449_100000737683 [0,0,0,0,0,2|1,0,0]=3 2303 B11R0.106 CNC(=O)CNCCC(=O)OC 2230a_100000693194_100000204255 [0,0,0,0,0,2|1,0,0]=3 2304 B11R0.106 CNC(=O)COCCC(=O)OC 34a_100000750040_100000742370 [0,0,0,0,0,2|1,0,0]=3 2305 B11R0.106 CNC(=O)CSCCC(=O)OC 62a_100000183359_100000204255 [0,0,0,0,0,2|1,0,0]=3 2306 B11R0.106 CNC(=O)CSCCC(=O)OC 62a_100000204255_100000183359 [0,0,0,0,0,2|1,0,0]=3 2307 B11R0.106 CNC(=O)CSCOC(=O)OC 62a_100000183359_100000139417 [0,0,0,0,0,2|1,0,0]=3 2308 B11R0.106 CNC(=O)NCCNC(=O)NC 2708a_100102657272_100015205895 [0,0,0,0,0,2|2,0,0]=4 2309 B11R0.106 CNC(=O)NCCNC(=O)NC 273464a_100015205895_100102657272 [0,0,0,0,0,2|2,0,0]=4 2310 B11R0.106 CNC(=O)NCCNC(=O)NC 273464a_100102657272_100015205895 [0,0,0,0,0,2|2,0,0]=4 2311 B11R0.106 CNC(=O)NCCNC(=O)NC 512a_100015205895_100102657272 [0,0,0,0,0,2|2,0,0]=4 2312 B11R0.106 CNC(=O)NCCNC(=O)NC 512a_106832991638_100015205895 [0,0,0,0,0,2|2,0,0]=4 2313 B11R0.106 COC(=O)CCCCC(=O)CF 1458a_100000695723_100015361967 [0,0,0,0,0,2|2,0,0]=4 2314 B11R0.106 COC(=O)CCCCC(=O)CO 1458a_100000210174_100000204269 [0,0,0,0,0,2|2,0,0]=4 2315 B11R0.106 COC(=O)CCCNC(=O)CO 188690a_100000184769_100000210174 [0,0,0,0,0,2|2,0,0]=4 2316 B11R0.106 COC(=O)CCCSC(C)OC 62a_100009879195_100011218270 [0,0,0,0,0,2|1,0,1]=4 2317 B11R0.106 COC(=O)CCCSC(C)OC 62a_100011218270_100009879195 [0,0,0,0,0,2|1,0,1]=4 2318 B11R0.106 COC(=O)CCNC[C@@H](C)OC 2230a_100020591295_100000204255 [0,0,0,0,0,2|1,0,1]=4 2319 B11R0.106 COC(=O)CCOCC(C)OC 34a_100000690652_100000742370 [0,0,0,0,0,2|1,0,1]=4 2320 B11R0.106 COC(=O)CCSCC(=O)OC 62a_100000204255_100000747449 [0,0,0,0,0,2|0,0,0]=2 2321 B11R0.106 COC(=O)CCSCC(=O)OC 62a_100000747449_100000204255 [0,0,0,0,0,2|0,0,0]=2 2322 B11R0.106 COC(=O)COCCC(=O)CO 1458a_100000210174_100000090808 [0,0,0,0,0,2|2,0,0]=4 2323 B11R0.106 COC(=O)COCCC(C)OC 7a_100000764861_100000747449 [0,0,0,0,0,2|1,0,1]=4 2324 B11R0.106 COC(=O)CSCOC(=O)OC 62a_100000747449_100000139417 [0,0,0,0,0,2|0,0,0]=2 2325 B11R0.106 COC(=O)NCCCC(=O)CF 1458a_100000753017_100015361967 [0,0,0,0,0,2|2,0,0]=4