0 B12R1.51 C#CCC(=O)CCC1CCCC1 1458a_100000211120_100000184674 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.51 C#CCC(=O)CCC1CCCC1 1458a_100011220946_100000760354 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.51 C#CCC(=O)CCC1CCCO1 1458a_100011247709_100000184674 [0,0,0,0,0,0|1,0,2]=3 3 B12R1.51 C#CCC(=O)CCC1OCCO1 1458a_100000082924_100000184674 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.51 C#CCC(=O)CCC1OCCO1 1458a_100011220946_100000740749 [0,0,0,0,0,0|2,0,2]=4 5 B12R1.51 C#CCC(=O)CCN1CCCO1 1458a_200015187630_100000184674 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.51 C#CCC(=O)NCC1CCCC1 1626a_100000737975_100011220946 [0,0,0,0,0,0|2,0,2]=4 7 B12R1.51 C#CCC(=O)NCC1CCCC1 527a_100000737975_100011220946 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.51 C#CCC(=O)NCC1OCCO1 1626a_100000036311_100011220946 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.51 C#CCC(=O)NCC1OCCO1 527a_100000036311_100011220946 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.51 C#CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011220946 [0,0,0,0,0,0|1,0,2]=3 11 B12R1.51 C#CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100011220946 [0,0,0,0,0,0|1,0,2]=3 12 B12R1.51 C#CCC(C)OCC1CCCO1 7a_100000685586_100000203698 [0,0,0,0,0,0|1,0,3]=4 13 B12R1.51 C=CCC(=O)CCC1CCCC1 1458a_100000210193_100000760354 [0,0,0,0,0,0|2,0,2]=4 14 B12R1.51 C=CCC(=O)CCC1CCCC1 1458a_100000211120_100000210623 [0,0,0,0,0,0|2,0,2]=4 15 B12R1.51 C=CCC(=O)CCC1CCCO1 1458a_100011247709_100000210623 [0,0,0,0,0,0|1,0,2]=3 16 B12R1.51 C=CCC(=O)CCC1OCCO1 1458a_100000082924_100000210623 [0,0,0,0,0,0|2,0,2]=4 17 B12R1.51 C=CCC(=O)CCC1OCCO1 1458a_100000210193_100000740749 [0,0,0,0,0,0|2,0,2]=4 18 B12R1.51 C=CCC(=O)CCN1CCCO1 1458a_200015187630_100000210623 [0,0,0,0,0,0|2,0,2]=4 19 B12R1.51 C=CCC(=O)NCC1CCCC1 11a_100000737975_100000210193 [0,0,0,0,0,0|2,0,2]=4 20 B12R1.51 C=CCC(=O)NCC1CCCC1 1626a_100000737975_100000210193 [0,0,0,0,0,0|2,0,2]=4 21 B12R1.51 C=CCC(=O)NCC1CCCC1 240690a_100000737975_100000210193 [0,0,0,0,0,0|2,0,2]=4 22 B12R1.51 C=CCC(=O)NCC1CCCC1 527a_100000737975_100000210193 [0,0,0,0,0,0|2,0,2]=4 23 B12R1.51 C=CCC(=O)NCC1OCCO1 11a_100000036311_100000210193 [0,0,0,0,0,0|2,0,2]=4 24 B12R1.51 C=CCC(=O)NCC1OCCO1 1626a_100000036311_100000210193 [0,0,0,0,0,0|2,0,2]=4 25 B12R1.51 C=CCC(=O)NCC1OCCO1 527a_100000036311_100000210193 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.51 C=CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210193 [0,0,0,0,0,0|1,0,2]=3 27 B12R1.51 C=CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210193 [0,0,0,0,0,0|1,0,2]=3 28 B12R1.51 C=CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210193 [0,0,0,0,0,0|1,0,2]=3 29 B12R1.51 C=CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210193 [0,0,0,0,0,0|1,0,2]=3 30 B12R1.51 C=CC[C@@H](C)OCC1CCCO1 7a_100000731007_100000203698 [0,0,0,0,0,0|1,0,3]=4 31 B12R1.51 CC#CC(=O)CCC1CCCC1 1458a_100000763181_100000760354 [0,0,0,0,0,0|2,0,2]=4 32 B12R1.51 CC#CC(=O)CCC1OCCO1 1458a_100000763181_100000740749 [0,0,0,0,0,0|2,0,2]=4 33 B12R1.51 CC(CC#N)OCC1CCCO1 7a_100000210270_100009813641 [0,0,0,0,0,0|2,0,2]=4 34 B12R1.51 CC(CCBr)OCC1CCCC1 34a_100012276601_100000740388 [0,0,0,0,0,0|3,0,1]=4 35 B12R1.51 CC(CCBr)OCC1OCCO1 34a_100012276601_100000755774 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.51 CC(CCO)NC[C@@H]1CCCO1 2230a_100020590478_100009893172 [0,0,0,0,0,0|3,0,1]=4 37 B12R1.51 CC(CCO)NC[C@@H]1CCCO1 34a_100020590478_100009893172 [0,0,0,0,0,0|3,0,1]=4 38 B12R1.51 CC(CCO)OCC1CCCC1 34a_100000742336_100009893172 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.51 CC(CCO)OCC1CCCC1 7a_100000742336_100009893172 [0,0,0,0,0,0|3,0,1]=4 40 B12R1.51 CC(CCO)OCC1CCCO1 34a_100000210270_100009893172 [0,0,0,0,0,0|2,0,1]=3 41 B12R1.51 CC(CCO)OCC1CCCO1 7a_100000210270_100009893172 [0,0,0,0,0,0|2,0,1]=3 42 B12R1.51 CC(CCO)OCC1COCO1 34a_100011216627_100009893172 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.51 CC(CCO)OCC1OCCO1 34a_100000087154_100009893172 [0,0,0,0,0,0|3,0,1]=4 44 B12R1.51 CC(CCO)OC[C@H]1CCCN1 34a_100000745186_100009893172 [0,0,0,0,0,0|3,0,1]=4 45 B12R1.51 CC(CCO)SCC1CCCO1 62a_100000203698_100009893172 [0,0,0,0,0,0|2,1,1]=4 46 B12R1.51 CC(CCO)SCC1CCCO1 62a_100009893172_100000203698 [0,0,0,0,0,0|2,1,1]=4 47 B12R1.51 CC=CC(=O)CCC1CCCC1 1458a_100000210699_100000760354 [0,0,0,0,0,0|2,0,2]=4 48 B12R1.51 CC=CC(=O)CCC1OCCO1 1458a_100000210699_100000740749 [0,0,0,0,0,0|2,0,2]=4 49 B12R1.51 CC=CC(=O)NCC1CCCC1 11a_100000737975_100000210699 [0,0,0,0,0,0|2,0,2]=4 50 B12R1.51 CC=CC(=O)NCC1CCCC1 1626a_100000737975_100000210699 [0,0,0,0,0,0|2,0,2]=4 51 B12R1.51 CC=CC(=O)NCC1CCCC1 240690a_100000737975_100000210699 [0,0,0,0,0,0|2,0,2]=4 52 B12R1.51 CC=CC(=O)NCC1OCCO1 11a_100000036311_100000210699 [0,0,0,0,0,0|2,0,2]=4 53 B12R1.51 CC=CC(=O)NCC1OCCO1 1626a_100000036311_100000210699 [0,0,0,0,0,0|2,0,2]=4 54 B12R1.51 CC=CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210699 [0,0,0,0,0,0|1,0,2]=3 55 B12R1.51 CC=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210699 [0,0,0,0,0,0|1,0,2]=3 56 B12R1.51 CC=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210699 [0,0,0,0,0,0|1,0,2]=3 57 B12R1.51 CCCC(=NNC1CCCC1)C 4a_100000737850_100000211909 [0,0,0,0,0,0|4,0,0]=4 58 B12R1.51 CCCC(=O)C=CC1=CCCC1 1458a_100016262312_100000210303 [0,0,0,0,0,0|2,0,2]=4 59 B12R1.51 CCCC(=O)CCC1CCCC1 1458a_100000211120_100000210303 [0,0,0,0,0,0|2,0,0]=2 60 B12R1.51 CCCC(=O)CCC1CCCC1 1458a_100000211992_100000760354 [0,0,0,0,0,0|2,0,0]=2 61 B12R1.51 CCCC(=O)CCC1CCCO1 1458a_100011247709_100000210303 [0,0,0,0,0,0|1,0,0]=1 62 B12R1.51 CCCC(=O)CCC1OCCO1 1458a_100000082924_100000210303 [0,0,0,0,0,0|2,0,0]=2 63 B12R1.51 CCCC(=O)CCC1OCCO1 1458a_100000211992_100000740749 [0,0,0,0,0,0|2,0,0]=2 64 B12R1.51 CCCC(=O)CCN1CCCC1 1458a_100000211992_100000004467 [0,0,0,0,0,0|3,0,0]=3 65 B12R1.51 CCCC(=O)CCN1CCCC1 1458a_100000738983_100000210303 [0,0,0,0,0,0|3,0,0]=3 66 B12R1.51 CCCC(=O)CCN1CCCO1 1458a_200015187630_100000210303 [0,0,0,0,0,0|2,0,0]=2 67 B12R1.51 CCCC(=O)CNC1=NCCC1 1458a_100000118783_100000210303 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.51 CCCC(=O)CNC1CCCC1 2230a_100000211070_100000747444 [0,0,0,0,0,0|3,0,0]=3 69 B12R1.51 CCCC(=O)CN[C@@H]1CCOC1 2230a_200015188469_100000747444 [0,0,0,0,0,0|4,0,0]=4 70 B12R1.51 CCCC(=O)CN[C@H]1CCOC1 2230a_100015188467_100000747444 [0,0,0,0,0,0|4,0,0]=4 71 B12R1.51 CCCC(=O)COC1CCCC1 1458a_100000741352_100000210303 [0,0,0,0,0,0|3,0,0]=3 72 B12R1.51 CCCC(=O)COC1CCCC1 7a_100000210269_100000747444 [0,0,0,0,0,0|3,0,0]=3 73 B12R1.51 CCCC(=O)COC1CCSC1 7a_100011232664_100000747444 [0,0,0,0,0,0|4,0,0]=4 74 B12R1.51 CCCC(=O)CSC1CCCC1 62a_100000747444_100000179811 [0,0,0,0,0,0|3,0,0]=3 75 B12R1.51 CCCC(=O)CSC1CCCC1 62a_100011217020_100000747444 [0,0,0,0,0,0|3,0,0]=3 76 B12R1.51 CCCC(=O)CSC1CCOC1 62a_100000747444_100000690089 [0,0,0,0,0,0|4,0,0]=4 77 B12R1.51 CCCC(=O)NCC1CCCC1 11a_100000737975_100000211992 [0,0,0,0,0,0|2,0,0]=2 78 B12R1.51 CCCC(=O)NCC1CCCC1 1626a_100000737975_100000211992 [0,0,0,0,0,0|2,0,0]=2 79 B12R1.51 CCCC(=O)NCC1CCCC1 240690a_100000737975_100000211992 [0,0,0,0,0,0|2,0,0]=2 80 B12R1.51 CCCC(=O)NCC1CCCC1 527a_100000737975_100000211992 [0,0,0,0,0,0|2,0,0]=2 81 B12R1.51 CCCC(=O)NCC1CCOC1 11a_100000737293_100000211992 [0,0,0,0,0,0|3,0,0]=3 82 B12R1.51 CCCC(=O)NCC1CCOC1 1626a_100000737293_100000211992 [0,0,0,0,0,0|3,0,0]=3 83 B12R1.51 CCCC(=O)NCC1CCOC1 240690a_100000737293_100000211992 [0,0,0,0,0,0|3,0,0]=3 84 B12R1.51 CCCC(=O)NCC1CCOC1 527a_100000737293_100000211992 [0,0,0,0,0,0|3,0,0]=3 85 B12R1.51 CCCC(=O)NCC1OCCO1 11a_100000036311_100000211992 [0,0,0,0,0,0|2,0,0]=2 86 B12R1.51 CCCC(=O)NCC1OCCO1 1626a_100000036311_100000211992 [0,0,0,0,0,0|2,0,0]=2 87 B12R1.51 CCCC(=O)NCC1OCCO1 527a_100000036311_100000211992 [0,0,0,0,0,0|2,0,0]=2 88 B12R1.51 CCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000211992 [0,0,0,0,0,0|1,0,0]=1 89 B12R1.51 CCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000211992 [0,0,0,0,0,0|1,0,0]=1 90 B12R1.51 CCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000211992 [0,0,0,0,0,0|1,0,0]=1 91 B12R1.51 CCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000211992 [0,0,0,0,0,0|1,0,0]=1 92 B12R1.51 CCCC(=O)NN=C1CCCC1 4a_100000189770_100000210133 [0,0,0,0,0,0|3,0,1]=4 93 B12R1.51 CCCC(=O)NNC1CCCC1 22a_100000737850_100000211992 [0,0,0,0,0,0|3,0,0]=3 94 B12R1.51 CCCC(=O)NNC1CCOC1 22a_100000690549_100000211992 [0,0,0,0,0,0|4,0,0]=4 95 B12R1.51 CCCC(=O)NNC1CCSC1 22a_200000731317_100000211992 [0,0,0,0,0,0|4,0,0]=4 96 B12R1.51 CCCC(=O)OCN1CC=CC1 269982a_100015195280_100000034017 [0,0,0,0,0,0|2,0,2]=4 97 B12R1.51 CCCC(=O)OCN1CCCC1 2230a_100000188435_100000034017 [0,0,0,0,0,0|2,0,0]=2 98 B12R1.51 CCCC(=O)OCN1CCCC1 269982a_100000188435_100000034017 [0,0,0,0,0,0|2,0,0]=2 99 B12R1.51 CCCC(=O)OCN1CCSC1 2230a_100011215254_100000034017 [0,0,0,0,0,0|3,0,0]=3 100 B12R1.51 CCCC(=O)OCN1CCSC1 269982a_100011215254_100000034017 [0,0,0,0,0,0|3,0,0]=3 101 B12R1.51 CCCC(C)COC1CCCO1 34a_100000085407_100011216630 [0,0,0,0,0,0|3,0,1]=4 102 B12R1.51 CCCC(C)NCC1CCCC1 2230a_100000737975_100000766640 [0,0,0,0,0,0|3,0,1]=4 103 B12R1.51 CCCC(C)NCC1CCCC1 2230a_100000741246_100000740388 [0,0,0,0,0,0|3,0,1]=4 104 B12R1.51 CCCC(C)NCC1CCCC1 269862a_100000741246_100000746403 [0,0,0,0,0,0|3,0,1]=4 105 B12R1.51 CCCC(C)NCC1CCCC1 270004a_100000737975_100000211909 [0,0,0,0,0,0|3,0,1]=4 106 B12R1.51 CCCC(C)NCC1CCCC1 34a_100000737975_100000766640 [0,0,0,0,0,0|3,0,1]=4 107 B12R1.51 CCCC(C)NCC1CCCO1 2230a_100000741246_100000203698 [0,0,0,0,0,0|2,0,1]=3 108 B12R1.51 CCCC(C)NCC1OCCO1 2230a_100000036311_100000766640 [0,0,0,0,0,0|3,0,1]=4 109 B12R1.51 CCCC(C)NCC1OCCO1 2230a_100000741246_100000755774 [0,0,0,0,0,0|3,0,1]=4 110 B12R1.51 CCCC(C)NCC1OCCO1 270004a_100000036311_100000211909 [0,0,0,0,0,0|3,0,1]=4 111 B12R1.51 CCCC(C)NCC1OCCO1 34a_100000036311_100000766640 [0,0,0,0,0,0|3,0,1]=4 112 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000766640 [0,0,0,0,0,0|2,0,1]=3 113 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000211909 [0,0,0,0,0,0|2,0,1]=3 114 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 34a_100020590478_100000766640 [0,0,0,0,0,0|2,0,1]=3 115 B12R1.51 CCCC(C)OCC1CCCC1 34a_100000742336_100000766640 [0,0,0,0,0,0|2,0,1]=3 116 B12R1.51 CCCC(C)OCC1CCCC1 34a_100000764384_100000740388 [0,0,0,0,0,0|2,0,1]=3 117 B12R1.51 CCCC(C)OCC1CCCC1 7a_100000742336_100000766640 [0,0,0,0,0,0|2,0,1]=3 118 B12R1.51 CCCC(C)OCC1CCCC1 7a_100000764384_100000740388 [0,0,0,0,0,0|2,0,1]=3 119 B12R1.51 CCCC(C)OCC1CCCO1 34a_100000210270_100000766640 [0,0,0,0,0,0|1,0,1]=2 120 B12R1.51 CCCC(C)OCC1CCCO1 7a_100000210270_100000766640 [0,0,0,0,0,0|1,0,1]=2 121 B12R1.51 CCCC(C)OCC1CCCO1 7a_100000764384_100000203698 [0,0,0,0,0,0|1,0,1]=2 122 B12R1.51 CCCC(C)OCC1CCNC1 34a_100000748654_100000766640 [0,0,0,0,0,0|3,0,1]=4 123 B12R1.51 CCCC(C)OCC1CCOC1 34a_100000740260_100000766640 [0,0,0,0,0,0|3,0,1]=4 124 B12R1.51 CCCC(C)OCC1CCOC1 34a_100000764384_100011261433 [0,0,0,0,0,0|3,0,1]=4 125 B12R1.51 CCCC(C)OCC1CCOC1 7a_100000764384_100000702531 [0,0,0,0,0,0|3,0,1]=4 126 B12R1.51 CCCC(C)OCC1COCO1 34a_100011216627_100000766640 [0,0,0,0,0,0|2,0,1]=3 127 B12R1.51 CCCC(C)OCC1OCCO1 34a_100000087154_100000766640 [0,0,0,0,0,0|2,0,1]=3 128 B12R1.51 CCCC(C)OCC1OCCO1 34a_100000764384_100000755774 [0,0,0,0,0,0|2,0,1]=3 129 B12R1.51 CCCC(C)OCC1OCCO1 7a_100000764384_100000755774 [0,0,0,0,0,0|2,0,1]=3 130 B12R1.51 CCCC(C)OC[C@H]1CCCN1 34a_100000745186_100000766640 [0,0,0,0,0,0|2,0,1]=3 131 B12R1.51 CCCC(C)SCC1CCCC1 62a_100000740388_100000766640 [0,0,0,0,0,0|2,1,1]=4 132 B12R1.51 CCCC(C)SCC1CCCC1 62a_100000766640_100000740388 [0,0,0,0,0,0|2,1,1]=4 133 B12R1.51 CCCC(C)SCC1CCCO1 62a_100000203698_100000766640 [0,0,0,0,0,0|1,1,1]=3 134 B12R1.51 CCCC(C)SCC1CCCO1 62a_100000766640_100000203698 [0,0,0,0,0,0|1,1,1]=3 135 B12R1.51 CCCC(C)SCC1OCCO1 62a_100000755774_100000766640 [0,0,0,0,0,0|2,1,1]=4 136 B12R1.51 CCCC(C)SCC1OCCO1 62a_100000766640_100000755774 [0,0,0,0,0,0|2,1,1]=4 137 B12R1.51 CCCN(C)CCC1CCCC1 2230a_100000747261_100000760354 [0,0,0,0,0,0|4,0,0]=4 138 B12R1.51 CCCN(C)CCC1CCCC1 269982a_100000747261_100000760354 [0,0,0,0,0,0|4,0,0]=4 139 B12R1.51 CCCN(C)CCC1OCCO1 2230a_100000747261_100000740749 [0,0,0,0,0,0|4,0,0]=4 140 B12R1.51 CCCN(C)CCC1OCCO1 269982a_100000747261_100000740749 [0,0,0,0,0,0|4,0,0]=4 141 B12R1.51 CCNC(=O)CCC1CCCC1 11a_100015525214_100000211120 [0,0,0,0,0,0|3,0,0]=3 142 B12R1.51 CCNC(=O)CCC1CCCC1 240690a_100015525214_100000211120 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.51 CCNC(=O)CCC1CCCC1 527a_100015525214_100000211120 [0,0,0,0,0,0|3,0,0]=3 144 B12R1.51 CCNC(=O)CCC1CCCO1 11a_100015525214_100011247709 [0,0,0,0,0,0|2,0,0]=2 145 B12R1.51 CCNC(=O)CCC1CCCO1 240690a_100015525214_100011247709 [0,0,0,0,0,0|2,0,0]=2 146 B12R1.51 CCNC(=O)CCC1CCCO1 527a_100015525214_100011247709 [0,0,0,0,0,0|2,0,0]=2 147 B12R1.51 CCNC(=O)CCN1CCCC1 2230a_100000188435_100000737597 [0,0,0,0,0,0|4,0,0]=4 148 B12R1.51 CCNC(=O)CCN1CCCC1 240690a_100015525214_100000738983 [0,0,0,0,0,0|4,0,0]=4 149 B12R1.51 CCNC(=O)CCN1CCCC1 269982a_100000188435_100000737597 [0,0,0,0,0,0|4,0,0]=4 150 B12R1.51 CCNC(=O)CCN1CCCO1 240690a_100015525214_200015187630 [0,0,0,0,0,0|3,0,0]=3 151 B12R1.51 CCNC(=O)CNC1CCCC1 2230a_100000211070_100000183381 [0,0,0,0,0,0|4,0,0]=4 152 B12R1.51 CCNC(=O)CNC1CCCC1 2230a_100016988866_100000179811 [0,0,0,0,0,0|4,0,0]=4 153 B12R1.51 CCNC(=O)CNC1CCCC1 270004a_100016988866_100000210133 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.51 CCNC(=O)CNC1CCCC1 34a_100000211070_100000183381 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.51 CCNC(=O)COC1CCCC1 11a_100015525214_100000741352 [0,0,0,0,0,0|4,0,0]=4 156 B12R1.51 CCNC(=O)COC1CCCC1 240690a_100015525214_100000741352 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.51 CCNC(=O)COC1CCCC1 34a_100000210269_100000183381 [0,0,0,0,0,0|4,0,0]=4 158 B12R1.51 CCNC(=O)COC1CCCC1 527a_100015525214_100000741352 [0,0,0,0,0,0|4,0,0]=4 159 B12R1.51 CCNC(=O)COC1CCCC1 7a_100000210269_100000183381 [0,0,0,0,0,0|4,0,0]=4 160 B12R1.51 CCNC(=O)COC1CCCO1 34a_100000085407_100000183381 [0,0,0,0,0,0|3,0,0]=3 161 B12R1.51 CCNC(=O)CSC1CCCC1 62a_100000183381_100000179811 [0,0,0,0,0,0|4,0,0]=4 162 B12R1.51 CCNC(=O)CSC1CCCC1 62a_100011217020_100000183381 [0,0,0,0,0,0|4,0,0]=4 163 B12R1.51 CCNC(=O)NCC1CCCC1 2708a_100000737975_100015525214 [0,0,0,0,0,0|3,0,0]=3 164 B12R1.51 CCNC(=O)NCC1CCCC1 2708a_100015525214_100000737975 [0,0,0,0,0,0|3,0,0]=3 165 B12R1.51 CCNC(=O)NCC1CCCC1 273464a_100000737975_100015525214 [0,0,0,0,0,0|3,0,0]=3 166 B12R1.51 CCNC(=O)NCC1CCCC1 273464a_100015525214_100000737975 [0,0,0,0,0,0|3,0,0]=3 167 B12R1.51 CCNC(=O)NCC1CCCC1 512a_100000737975_100015525214 [0,0,0,0,0,0|3,0,0]=3 168 B12R1.51 CCNC(=O)NCC1CCCC1 512a_100015525214_100000737975 [0,0,0,0,0,0|3,0,0]=3 169 B12R1.51 CCNC(=O)NCC1CCOC1 2708a_100000737293_100015525214 [0,0,0,0,0,0|4,0,0]=4 170 B12R1.51 CCNC(=O)NCC1CCOC1 2708a_100015525214_100000737293 [0,0,0,0,0,0|4,0,0]=4 171 B12R1.51 CCNC(=O)NCC1CCOC1 273464a_100000737293_100015525214 [0,0,0,0,0,0|4,0,0]=4 172 B12R1.51 CCNC(=O)NCC1CCOC1 273464a_100015525214_100000737293 [0,0,0,0,0,0|4,0,0]=4 173 B12R1.51 CCNC(=O)NCC1CCOC1 512a_100000737293_100015525214 [0,0,0,0,0,0|4,0,0]=4 174 B12R1.51 CCNC(=O)NCC1CCOC1 512a_100015525214_100000737293 [0,0,0,0,0,0|4,0,0]=4 175 B12R1.51 CCNC(=O)NCC1OCCO1 2708a_100000036311_100015525214 [0,0,0,0,0,0|3,0,0]=3 176 B12R1.51 CCNC(=O)NCC1OCCO1 2708a_100015525214_100000036311 [0,0,0,0,0,0|3,0,0]=3 177 B12R1.51 CCNC(=O)NCC1OCCO1 273464a_100000036311_100015525214 [0,0,0,0,0,0|3,0,0]=3 178 B12R1.51 CCNC(=O)NCC1OCCO1 273464a_100015525214_100000036311 [0,0,0,0,0,0|3,0,0]=3 179 B12R1.51 CCNC(=O)NCC1OCCO1 512a_100000036311_100015525214 [0,0,0,0,0,0|3,0,0]=3 180 B12R1.51 CCNC(=O)NC[C@@H]1CCCO1 2708a_100015525214_100020590478 [0,0,0,0,0,0|2,0,0]=2 181 B12R1.51 CCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100015525214 [0,0,0,0,0,0|2,0,0]=2 182 B12R1.51 CCNC(=O)NC[C@@H]1CCCO1 273464a_100015525214_100020590478 [0,0,0,0,0,0|2,0,0]=2 183 B12R1.51 CCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100015525214 [0,0,0,0,0,0|2,0,0]=2 184 B12R1.51 CCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100015525214 [0,0,0,0,0,0|2,0,0]=2 185 B12R1.51 CCNC(=O)NNC1CCCC1 273464a_100015525214_100000737850 [0,0,0,0,0,0|4,0,0]=4 186 B12R1.51 CCNC(=O)NNC1CCCC1 512a_100015525214_100000737850 [0,0,0,0,0,0|4,0,0]=4 187 B12R1.51 CCOC(=O)CCN1CCCC1 2230a_100000188435_100011206558 [0,0,0,0,0,0|4,0,0]=4 188 B12R1.51 CCOC(=O)CCN1CCCC1 269982a_100000188435_100011206558 [0,0,0,0,0,0|4,0,0]=4 189 B12R1.51 CCOC(=O)CNC1CCCC1 2230a_100000211070_100000188475 [0,0,0,0,0,0|4,0,0]=4 190 B12R1.51 CCOC(=O)CNC1CCCC1 34a_100000211070_100000188475 [0,0,0,0,0,0|4,0,0]=4 191 B12R1.51 CCOC(=O)COC1CCCC1 34a_100000210269_100000188475 [0,0,0,0,0,0|4,0,0]=4 192 B12R1.51 CCOC(=O)COC1CCCC1 7a_100000210269_100000188475 [0,0,0,0,0,0|4,0,0]=4 193 B12R1.51 CCOC(=O)COC1CCCO1 34a_100000085407_100000188475 [0,0,0,0,0,0|3,0,0]=3 194 B12R1.51 CCOC(=O)CSC1CCCC1 62a_100000188475_100000179811 [0,0,0,0,0,0|4,0,0]=4 195 B12R1.51 CCOC(=O)CSC1CCCC1 62a_100011217020_100000188475 [0,0,0,0,0,0|4,0,0]=4 196 B12R1.51 CNCC(=O)NCC1CCCO1 2230a_106832991635_100000182893 [0,0,0,0,0,0|2,0,0]=2 197 B12R1.51 CNCC(=O)NCC1CCCO1 7a_106832991635_100000182893 [0,0,0,0,0,0|2,0,0]=2 198 B12R1.51 CNNC(=O)CCC1CCCC1 22a_100016993582_100000211120 [0,0,0,0,0,0|4,0,0]=4 199 B12R1.51 CNNC(=O)CCC1CCCO1 22a_100016993582_100011247709 [0,0,0,0,0,0|3,0,0]=3 200 B12R1.51 CNNC(=O)CCC1OCCO1 22a_100016993582_100000082924 [0,0,0,0,0,0|4,0,0]=4 201 B12R1.51 CNNC(=O)NCC1CCCC1 273464a_100000737975_100016993582 [0,0,0,0,0,0|4,0,0]=4 202 B12R1.51 CNNC(=O)NCC1CCCC1 512a_100000737975_100016993582 [0,0,0,0,0,0|4,0,0]=4 203 B12R1.51 CNNC(=O)NCC1CCCC1 512a_100016993582_100000737975 [0,0,0,0,0,0|4,0,0]=4 204 B12R1.51 CNNC(=O)NCC1OCCO1 273464a_100000036311_100016993582 [0,0,0,0,0,0|4,0,0]=4 205 B12R1.51 CNNC(=O)NCC1OCCO1 512a_100000036311_100016993582 [0,0,0,0,0,0|4,0,0]=4 206 B12R1.51 CNNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100016993582 [0,0,0,0,0,0|3,0,0]=3 207 B12R1.51 CNNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100016993582 [0,0,0,0,0,0|3,0,0]=3 208 B12R1.51 COCC(=O)CCC1CCCC1 1458a_100000210968_100000760354 [0,0,0,0,0,0|3,0,0]=3 209 B12R1.51 COCC(=O)CCC1OCCO1 1458a_100000210968_100000740749 [0,0,0,0,0,0|3,0,0]=3 210 B12R1.51 COCC(=O)CCN1CCCC1 1458a_100000210968_100000004467 [0,0,0,0,0,0|4,0,0]=4 211 B12R1.51 COCC(=O)NCC1CCCC1 11a_100000737975_100000210968 [0,0,0,0,0,0|3,0,0]=3 212 B12R1.51 COCC(=O)NCC1CCCC1 1626a_100000737975_100000210968 [0,0,0,0,0,0|3,0,0]=3 213 B12R1.51 COCC(=O)NCC1CCCC1 240690a_100000737975_100000210968 [0,0,0,0,0,0|3,0,0]=3 214 B12R1.51 COCC(=O)NCC1CCCC1 527a_100000737975_100000210968 [0,0,0,0,0,0|3,0,0]=3 215 B12R1.51 COCC(=O)NCC1CCOC1 11a_100000737293_100000210968 [0,0,0,0,0,0|4,0,0]=4 216 B12R1.51 COCC(=O)NCC1CCOC1 1626a_100000737293_100000210968 [0,0,0,0,0,0|4,0,0]=4 217 B12R1.51 COCC(=O)NCC1CCOC1 240690a_100000737293_100000210968 [0,0,0,0,0,0|4,0,0]=4 218 B12R1.51 COCC(=O)NCC1CCOC1 527a_100000737293_100000210968 [0,0,0,0,0,0|4,0,0]=4 219 B12R1.51 COCC(=O)NCC1OCCO1 11a_100000036311_100000210968 [0,0,0,0,0,0|3,0,0]=3 220 B12R1.51 COCC(=O)NCC1OCCO1 1626a_100000036311_100000210968 [0,0,0,0,0,0|3,0,0]=3 221 B12R1.51 COCC(=O)NCC1OCCO1 527a_100000036311_100000210968 [0,0,0,0,0,0|3,0,0]=3 222 B12R1.51 COCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210968 [0,0,0,0,0,0|2,0,0]=2 223 B12R1.51 COCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210968 [0,0,0,0,0,0|2,0,0]=2 224 B12R1.51 COCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210968 [0,0,0,0,0,0|2,0,0]=2 225 B12R1.51 COCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210968 [0,0,0,0,0,0|2,0,0]=2 226 B12R1.51 COCC(=O)NNC1CCCC1 22a_100000737850_100000210968 [0,0,0,0,0,0|4,0,0]=4 227 B12R1.51 COCC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000765312 [0,0,0,0,0,0|3,0,1]=4 228 B12R1.51 COCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000749346 [0,0,0,0,0,0|3,0,1]=4 229 B12R1.51 COCC(C)NC[C@@H]1CCCO1 34a_100020590478_100000765312 [0,0,0,0,0,0|3,0,1]=4 230 B12R1.51 COCC(C)OCC1CCCC1 34a_100000742336_100000765312 [0,0,0,0,0,0|3,0,1]=4 231 B12R1.51 COCC(C)OCC1CCCC1 7a_100000742336_100000765312 [0,0,0,0,0,0|3,0,1]=4 232 B12R1.51 COCC(C)OCC1CCCO1 34a_100000210270_100000765312 [0,0,0,0,0,0|2,0,1]=3 233 B12R1.51 COCC(C)OCC1CCCO1 7a_100000210270_100000765312 [0,0,0,0,0,0|2,0,1]=3 234 B12R1.51 COCC(C)OCC1COCO1 34a_100011216627_100000765312 [0,0,0,0,0,0|3,0,1]=4 235 B12R1.51 COCC(C)OCC1OCCO1 34a_100000087154_100000765312 [0,0,0,0,0,0|3,0,1]=4 236 B12R1.51 COCC(C)OC[C@H]1CCCN1 34a_100000745186_100000765312 [0,0,0,0,0,0|3,0,1]=4 237 B12R1.51 COCC(C)SCC1CCCO1 62a_100000203698_100000765312 [0,0,0,0,0,0|2,1,1]=4 238 B12R1.51 COCC(C)SCC1CCCO1 62a_100000765312_100000203698 [0,0,0,0,0,0|2,1,1]=4 239 B12R1.51 COC[C@@H](C)NCC1CCCO1 2230a_100000764878_100000203698 [0,0,0,0,0,0|3,0,1]=4 240 B12R1.51 COC[C@@H](C)OCC1CCCC1 34a_100011934205_100000740388 [0,0,0,0,0,0|3,0,1]=4 241 B12R1.51 COC[C@@H](C)OCC1OCCO1 34a_100011934205_100000755774 [0,0,0,0,0,0|3,0,1]=4 242 B12R1.51 CSCC(=O)CCC1CCCC1 1458a_100000184570_100000760354 [0,0,0,0,0,0|3,0,0]=3 243 B12R1.51 CSCC(=O)CCC1OCCO1 1458a_100000184570_100000740749 [0,0,0,0,0,0|3,0,0]=3 244 B12R1.51 CSCC(=O)CCN1CCCC1 1458a_100000184570_100000004467 [0,0,0,0,0,0|4,0,0]=4 245 B12R1.51 CSCC(=O)NCC1CCCC1 11a_100000737975_100000184570 [0,0,0,0,0,0|3,0,0]=3 246 B12R1.51 CSCC(=O)NCC1CCCC1 1626a_100000737975_100000184570 [0,0,0,0,0,0|3,0,0]=3 247 B12R1.51 CSCC(=O)NCC1CCCC1 240690a_100000737975_100000184570 [0,0,0,0,0,0|3,0,0]=3 248 B12R1.51 CSCC(=O)NCC1CCCC1 527a_100000737975_100000184570 [0,0,0,0,0,0|3,0,0]=3 249 B12R1.51 CSCC(=O)NCC1CCCO1 62a_100000182893_200000210301 [0,0,0,0,0,0|2,0,0]=2 250 B12R1.51 CSCC(=O)NCC1CCCO1 62a_200000210301_100000182893 [0,0,0,0,0,0|2,0,0]=2 251 B12R1.51 CSCC(=O)NCC1CCOC1 11a_100000737293_100000184570 [0,0,0,0,0,0|4,0,0]=4 252 B12R1.51 CSCC(=O)NCC1CCOC1 1626a_100000737293_100000184570 [0,0,0,0,0,0|4,0,0]=4 253 B12R1.51 CSCC(=O)NCC1CCOC1 240690a_100000737293_100000184570 [0,0,0,0,0,0|4,0,0]=4 254 B12R1.51 CSCC(=O)NCC1CCOC1 527a_100000737293_100000184570 [0,0,0,0,0,0|4,0,0]=4 255 B12R1.51 CSCC(=O)NCC1OCCO1 11a_100000036311_100000184570 [0,0,0,0,0,0|3,0,0]=3 256 B12R1.51 CSCC(=O)NCC1OCCO1 1626a_100000036311_100000184570 [0,0,0,0,0,0|3,0,0]=3 257 B12R1.51 CSCC(=O)NCC1OCCO1 527a_100000036311_100000184570 [0,0,0,0,0,0|3,0,0]=3 258 B12R1.51 CSCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000184570 [0,0,0,0,0,0|2,0,0]=2 259 B12R1.51 CSCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000184570 [0,0,0,0,0,0|2,0,0]=2 260 B12R1.51 CSCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000184570 [0,0,0,0,0,0|2,0,0]=2 261 B12R1.51 CSCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000184570 [0,0,0,0,0,0|2,0,0]=2 262 B12R1.51 CSCC(=O)NNC1CCCC1 22a_100000737850_100000184570 [0,0,0,0,0,0|4,0,0]=4 263 B12R1.51 CSCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100011216314 [0,0,0,0,0,0|3,0,1]=4 264 B12R1.51 C[C@H](CCO)NCC1CCCO1 2230a_100000706166_100000203698 [0,0,0,0,0,0|3,0,1]=4 265 B12R1.51 N#CCC(=O)CCC1CCCC1 1458a_100000211120_100011214920 [0,0,0,0,0,0|3,0,1]=4 266 B12R1.51 N#CCC(=O)CCC1CCCC1 1458a_100051588842_100000760354 [0,0,0,0,0,0|3,0,1]=4 267 B12R1.51 N#CCC(=O)CCC1CCCO1 1458a_100011247709_100011214920 [0,0,0,0,0,0|2,0,1]=3 268 B12R1.51 N#CCC(=O)CCC1OCCO1 1458a_100000082924_100011214920 [0,0,0,0,0,0|3,0,1]=4 269 B12R1.51 N#CCC(=O)CCC1OCCO1 1458a_100051588842_100000740749 [0,0,0,0,0,0|3,0,1]=4 270 B12R1.51 N#CCC(=O)CCN1CCCO1 1458a_200015187630_100011214920 [0,0,0,0,0,0|3,0,1]=4 271 B12R1.51 N#CCC(=O)NCC1CCCC1 1626a_100000737975_100051588842 [0,0,0,0,0,0|3,0,1]=4 272 B12R1.51 N#CCC(=O)NCC1CCCC1 240690a_100000737975_100051588842 [0,0,0,0,0,0|3,0,1]=4 273 B12R1.51 N#CCC(=O)NCC1OCCO1 1626a_100000036311_100051588842 [0,0,0,0,0,0|3,0,1]=4 274 B12R1.51 N#CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100051588842 [0,0,0,0,0,0|2,0,1]=3 275 B12R1.51 N#CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100051588842 [0,0,0,0,0,0|2,0,1]=3 276 B12R1.51 O=C(C=CBr)NC[C@@H]1CCCO1 1626a_100020590478_100016273825 [0,0,0,0,0,0|2,0,2]=4 277 B12R1.51 O=C(C=CBr)NC[C@@H]1CCCO1 240690a_100020590478_100016273825 [0,0,0,0,0,0|2,0,2]=4 278 B12R1.51 O=C(C=CCl)NC[C@@H]1CCCO1 11a_100020590478_200016279998 [0,0,0,0,0,0|2,0,2]=4 279 B12R1.51 O=C(C=CCl)NC[C@@H]1CCCO1 1626a_100020590478_200016279998 [0,0,0,0,0,0|2,0,2]=4 280 B12R1.51 O=C(C=CCl)NC[C@@H]1CCCO1 240690a_100020590478_200016279998 [0,0,0,0,0,0|2,0,2]=4 281 B12R1.51 O=C(C=CI)NC[C@@H]1CCCO1 1626a_100020590478_100016256311 [0,0,0,0,0,0|2,0,2]=4 282 B12R1.51 O=C(CCF)CCC1CCCC1 1458a_100000211120_100011217306 [0,0,0,0,0,0|3,0,0]=3 283 B12R1.51 O=C(CCF)CCC1CCCO1 1458a_100011247709_100011217306 [0,0,0,0,0,0|2,0,0]=2 284 B12R1.51 O=C(CCF)CCC1OCCO1 1458a_100000082924_100011217306 [0,0,0,0,0,0|3,0,0]=3 285 B12R1.51 O=C(CCF)CCN1CCCC1 1458a_100000738983_100011217306 [0,0,0,0,0,0|4,0,0]=4 286 B12R1.51 O=C(CCF)CCN1CCCO1 1458a_200015187630_100011217306 [0,0,0,0,0,0|3,0,0]=3 287 B12R1.51 O=C(CCF)COC1CCCC1 1458a_100000741352_100011217306 [0,0,0,0,0,0|4,0,0]=4 288 B12R1.51 O=C(CCO)CCC1CCCC1 1458a_100000211120_100000211926 [0,0,0,0,0,0|3,0,0]=3 289 B12R1.51 O=C(CCO)CCC1CCCC1 1458a_100011216618_100000760354 [0,0,0,0,0,0|3,0,0]=3 290 B12R1.51 O=C(CCO)CCC1CCCO1 1458a_100011247709_100000211926 [0,0,0,0,0,0|2,0,0]=2 291 B12R1.51 O=C(CCO)CCC1OCCO1 1458a_100000082924_100000211926 [0,0,0,0,0,0|3,0,0]=3 292 B12R1.51 O=C(CCO)CCC1OCCO1 1458a_100011216618_100000740749 [0,0,0,0,0,0|3,0,0]=3 293 B12R1.51 O=C(CCO)CCN1CCCC1 1458a_100000738983_100000211926 [0,0,0,0,0,0|4,0,0]=4 294 B12R1.51 O=C(CCO)CCN1CCCC1 1458a_100011216618_100000004467 [0,0,0,0,0,0|4,0,0]=4 295 B12R1.51 O=C(CCO)CCN1CCCO1 1458a_200015187630_100000211926 [0,0,0,0,0,0|3,0,0]=3 296 B12R1.51 O=C(CCO)COC1CCCC1 1458a_100000741352_100000211926 [0,0,0,0,0,0|4,0,0]=4 297 B12R1.51 O=C(CCO)NCC1CCCC1 240690a_100000737975_100011216618 [0,0,0,0,0,0|3,0,0]=3 298 B12R1.51 O=C(CCO)NCC1CCOC1 240690a_100000737293_100011216618 [0,0,0,0,0,0|4,0,0]=4 299 B12R1.51 O=C(CCO)NC[C@@H]1CCCO1 240690a_100020590478_100011216618 [0,0,0,0,0,0|2,0,0]=2 300 B12R1.51 O=C(CCO)NNC1CCCC1 22a_100000737850_100011216618 [0,0,0,0,0,0|4,0,0]=4 301 B12R1.51 O=C(COC1CCCO1)NCO 34a_100000085407_100000185155 [0,0,0,0,0,0|4,0,0]=4 302 B12R1.51 [13CH3]SCC(=O)NCC1CCCO1 62a_100000182893_200025704644 [0,0,0,0,0,0|2,0,0]=2 303 B12R1.51 [13CH3]SCC(=O)NCC1CCCO1 62a_200025704644_100000182893 [0,0,0,0,0,0|2,0,0]=2 304 B11R1.4 BrCCCOCC1CCCC1 34a_100011217188_100000740388 [1,0,0,0,0,0|2,0,1]=4 305 B11R1.4 BrCCCOCC1OCCO1 34a_100011217188_100000755774 [1,0,0,0,0,0|2,0,1]=4 306 B11R1.4 C#CCCOCC1CCCO1 34a_100000210270_100000688953 [1,0,0,0,0,0|0,0,3]=4 307 B11R1.4 C#CCCOCC1CCCO1 7a_100000210270_100000688953 [1,0,0,0,0,0|0,0,3]=4 308 B11R1.4 C/C=C/COCC1CCCO1 34a_100000210270_100102629194 [1,0,0,0,0,0|0,0,3]=4 309 B11R1.4 C/C=C/COCC1CCCO1 7a_100000210270_100102629194 [1,0,0,0,0,0|0,0,3]=4 310 B11R1.4 C=CCCOCC1CCCO1 34a_100000210270_100000754431 [1,0,0,0,0,0|0,0,3]=4 311 B11R1.4 C=CCCOCC1CCCO1 7a_100000210270_100000754431 [1,0,0,0,0,0|0,0,3]=4 312 B11R1.4 CC#CCOCC1CCCO1 34a_100000210270_100000748600 [1,0,0,0,0,0|0,0,3]=4 313 B11R1.4 CC#CCOCC1CCCO1 7a_100000210270_100000748600 [1,0,0,0,0,0|0,0,3]=4 314 B11R1.4 CC/C=C\COC1CCCO1 34a_100000085407_100103147603 [1,0,0,0,0,0|2,0,1]=4 315 B11R1.4 CC=CCOCC1CCCO1 34a_100000210270_100000070051 [1,0,0,0,0,0|0,0,3]=4 316 B11R1.4 CC=CCOCC1CCCO1 7a_100000210270_100000070051 [1,0,0,0,0,0|0,0,3]=4 317 B11R1.4 CCCC=NNC1CCCC1 4a_100000737850_100000185831 [1,0,0,0,0,0|3,0,0]=4 318 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [1,0,0,0,0,0|2,0,1]=4 319 B11R1.4 CCCCNCC1CCCC1 2230a_100000102301_100000740388 [1,0,0,0,0,0|2,0,1]=4 320 B11R1.4 CCCCNCC1CCCC1 2230a_100000737975_100000210211 [1,0,0,0,0,0|2,0,1]=4 321 B11R1.4 CCCCNCC1CCCC1 269862a_100000102301_100000746403 [1,0,0,0,0,0|2,0,1]=4 322 B11R1.4 CCCCNCC1CCCC1 34a_100000737975_100000210210 [1,0,0,0,0,0|2,0,1]=4 323 B11R1.4 CCCCNCC1CCCC1 7a_106832991798_100000740388 [1,0,0,0,0,0|2,0,1]=4 324 B11R1.4 CCCCNCC1CCCO1 2230a_100000102301_100000203698 [1,0,0,0,0,0|1,0,1]=3 325 B11R1.4 CCCCNCC1CCCO1 7a_106832991798_100000203698 [1,0,0,0,0,0|1,0,1]=3 326 B11R1.4 CCCCNCC1OCCO1 2230a_100000036311_100000210211 [1,0,0,0,0,0|2,0,1]=4 327 B11R1.4 CCCCNCC1OCCO1 2230a_100000102301_100000755774 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.4 CCCCNCC1OCCO1 34a_100000036311_100000210210 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.4 CCCCNCC1OCCO1 7a_106832991798_100000755774 [1,0,0,0,0,0|2,0,1]=4 330 B11R1.4 CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210211 [1,0,0,0,0,0|1,0,1]=3 331 B11R1.4 CCCCNC[C@@H]1CCCO1 34a_100020590478_100000210210 [1,0,0,0,0,0|1,0,1]=3 332 B11R1.4 CCCCOCC1CCCC1 34a_100000210227_100000740388 [1,0,0,0,0,0|1,0,1]=3 333 B11R1.4 CCCCOCC1CCCC1 34a_100000742336_100000210210 [1,0,0,0,0,0|1,0,1]=3 334 B11R1.4 CCCCOCC1CCCC1 7a_100000210227_100000740388 [1,0,0,0,0,0|1,0,1]=3 335 B11R1.4 CCCCOCC1CCCC1 7a_100000742336_100000210211 [1,0,0,0,0,0|1,0,1]=3 336 B11R1.4 CCCCOCC1CCCO1 34a_100000210270_100000210210 [1,0,0,0,0,0|0,0,1]=2 337 B11R1.4 CCCCOCC1CCCO1 7a_100000210227_100000203698 [1,0,0,0,0,0|0,0,1]=2 338 B11R1.4 CCCCOCC1CCCO1 7a_100000210270_100000210211 [1,0,0,0,0,0|0,0,1]=2 339 B11R1.4 CCCCOCC1CCNC1 34a_100000748654_100000210210 [1,0,0,0,0,0|2,0,1]=4 340 B11R1.4 CCCCOCC1CCOC1 34a_100000210227_100011261433 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.4 CCCCOCC1CCOC1 34a_100000740260_100000210210 [1,0,0,0,0,0|2,0,1]=4 342 B11R1.4 CCCCOCC1CCOC1 7a_100000210227_100000702531 [1,0,0,0,0,0|2,0,1]=4 343 B11R1.4 CCCCOCC1COCO1 34a_100011216627_100000210210 [1,0,0,0,0,0|1,0,1]=3 344 B11R1.4 CCCCOCC1OCCO1 34a_100000087154_100000210210 [1,0,0,0,0,0|1,0,1]=3 345 B11R1.4 CCCCOCC1OCCO1 34a_100000210227_100000755774 [1,0,0,0,0,0|1,0,1]=3 346 B11R1.4 CCCCOCC1OCCO1 7a_100000210227_100000755774 [1,0,0,0,0,0|1,0,1]=3 347 B11R1.4 CCCCOCN1CCCC1 2230a_100000188435_100011995733 [1,0,0,0,0,0|2,0,1]=4 348 B11R1.4 CCCCOCN1CCCC1 269982a_100000188435_100011995733 [1,0,0,0,0,0|2,0,1]=4 349 B11R1.4 CCCCOC[C@H]1CCCN1 34a_100000745186_100000210210 [1,0,0,0,0,0|1,0,1]=3 350 B11R1.4 CCCCSCC1CCCC1 62a_100000210211_100000740388 [1,0,0,0,0,0|1,1,1]=4 351 B11R1.4 CCCCSCC1CCCC1 62a_100000740388_100000210210 [1,0,0,0,0,0|1,1,1]=4 352 B11R1.4 CCCCSCC1CCCO1 62a_100000203698_100000210210 [1,0,0,0,0,0|0,1,1]=3 353 B11R1.4 CCCCSCC1CCCO1 62a_100000210211_100000203698 [1,0,0,0,0,0|0,1,1]=3 354 B11R1.4 CCCCSCC1OCCO1 62a_100000210211_100000755774 [1,0,0,0,0,0|1,1,1]=4 355 B11R1.4 CCCCSCC1OCCO1 62a_100000755774_100000210210 [1,0,0,0,0,0|1,1,1]=4 356 B11R1.4 CCCNCCC1CCCC1 2230a_100000739158_100000210303 [1,0,0,0,0,0|3,0,0]=4 357 B11R1.4 CCCNCCC1CCCC1 34a_100000739158_100000210303 [1,0,0,0,0,0|3,0,0]=4 358 B11R1.4 CCCNCCC1OCCO1 2230a_100000034215_100000210303 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.4 CCCNCCC1OCCO1 34a_100000034215_100000210303 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.4 CCCOCCC1CCCC1 34a_100000210258_100000760354 [1,0,0,0,0,0|3,0,0]=4 361 B11R1.4 CCCOCCC1CCCC1 34a_100000749090_100000210303 [1,0,0,0,0,0|3,0,0]=4 362 B11R1.4 CCCOCCC1CCCC1 7a_100000749090_100000210303 [1,0,0,0,0,0|3,0,0]=4 363 B11R1.4 CCCOCCC1OCCO1 34a_100000210258_100000740749 [1,0,0,0,0,0|3,0,0]=4 364 B11R1.4 CCCSCCC1CCCC1 62a_100000210303_100000760354 [1,0,0,0,0,0|3,0,0]=4 365 B11R1.4 CCCSCCC1CCCC1 62a_100000760354_100000210303 [1,0,0,0,0,0|3,0,0]=4 366 B11R1.4 CCCSCCC1OCCO1 62a_100000210303_100000740749 [1,0,0,0,0,0|3,0,0]=4 367 B11R1.4 CCOCSCC1CCCO1 62a_100000203698_100000739092 [1,0,0,0,0,0|1,1,1]=4 368 B11R1.4 CCOCSCC1CCCO1 62a_100000739092_100000203698 [1,0,0,0,0,0|1,1,1]=4 369 B11R1.4 COCCNCC1CCCO1 2230a_100000209980_100000203698 [1,0,0,0,0,0|2,0,1]=4 370 B11R1.4 COCCNC[C@@H]1CCCO1 2230a_100020590478_100011201679 [1,0,0,0,0,0|2,0,1]=4 371 B11R1.4 COCCNC[C@@H]1CCCO1 34a_100020590478_100011201679 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.4 COCCOCC1CCCC1 34a_100000210237_100000740388 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.4 COCCOCC1CCCC1 34a_100000742336_100011201679 [1,0,0,0,0,0|2,0,1]=4 374 B11R1.4 COCCOCC1CCCC1 7a_100000742336_100000233755 [1,0,0,0,0,0|2,0,1]=4 375 B11R1.4 COCCOCC1CCCO1 34a_100000210270_100011201679 [1,0,0,0,0,0|1,0,1]=3 376 B11R1.4 COCCOCC1CCCO1 7a_100000210270_100000233755 [1,0,0,0,0,0|1,0,1]=3 377 B11R1.4 COCCOCC1COCO1 34a_100011216627_100011201679 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.4 COCCOCC1OCCO1 34a_100000087154_100011201679 [1,0,0,0,0,0|2,0,1]=4 379 B11R1.4 COCCOCC1OCCO1 34a_100000210237_100000755774 [1,0,0,0,0,0|2,0,1]=4 380 B11R1.4 COCCOC[C@H]1CCCN1 34a_100000745186_100011201679 [1,0,0,0,0,0|2,0,1]=4 381 B11R1.4 COCCSCC1CCCO1 62a_100000203698_100000233755 [1,0,0,0,0,0|1,1,1]=4 382 B11R1.4 COCCSCC1CCCO1 62a_100000233755_100000203698 [1,0,0,0,0,0|1,1,1]=4 383 B11R1.4 CSCCNCC1CCCO1 2230a_100020590264_100000203698 [1,0,0,0,0,0|2,0,1]=4 384 B11R1.4 CSCCNC[C@@H]1CCCO1 2230a_100020590478_100000751147 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.4 CSCCNC[C@@H]1CCCO1 34a_100020590478_100000212216 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.4 CSCCOCC1CCCC1 34a_100000230434_100000740388 [1,0,0,0,0,0|2,0,1]=4 387 B11R1.4 CSCCOCC1CCCC1 34a_100000742336_100000212216 [1,0,0,0,0,0|2,0,1]=4 388 B11R1.4 CSCCOCC1CCCC1 7a_100000230434_100000740388 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.4 CSCCOCC1CCCC1 7a_100000742336_100000212216 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.4 CSCCOCC1CCCO1 34a_100000210270_100000212216 [1,0,0,0,0,0|1,0,1]=3 391 B11R1.4 CSCCOCC1CCCO1 7a_100000210270_100000212216 [1,0,0,0,0,0|1,0,1]=3 392 B11R1.4 CSCCOCC1CCCO1 7a_100000230434_100000203698 [1,0,0,0,0,0|1,0,1]=3 393 B11R1.4 CSCCOCC1COCO1 34a_100011216627_100000212216 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.4 CSCCOCC1OCCO1 34a_100000087154_100000212216 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.4 CSCCOCC1OCCO1 34a_100000230434_100000755774 [1,0,0,0,0,0|2,0,1]=4 396 B11R1.4 CSCCOCC1OCCO1 7a_100000230434_100000755774 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.4 CSCCOC[C@H]1CCCN1 34a_100000745186_100000212216 [1,0,0,0,0,0|2,0,1]=4 398 B11R1.4 CSCCSCC1CCCO1 62a_100000203698_100000751147 [1,0,0,0,0,0|1,1,1]=4 399 B11R1.4 CSCCSCC1CCCO1 62a_100000212216_100000203698 [1,0,0,0,0,0|1,1,1]=4 400 B11R1.4 ClCCCOCC1CCCC1 34a_100000230001_100000740388 [1,0,0,0,0,0|2,0,1]=4 401 B11R1.4 ClCCCOCC1OCCO1 34a_100000230001_100000755774 [1,0,0,0,0,0|2,0,1]=4 402 B11R1.4 FCCCNCC1CCCO1 2230a_100015189416_100000203698 [1,0,0,0,0,0|2,0,1]=4 403 B11R1.4 FCCCNC[C@@H]1CCCO1 2230a_100020590478_100011934791 [1,0,0,0,0,0|2,0,1]=4 404 B11R1.4 FCCCNC[C@@H]1CCCO1 34a_100020590478_100011934791 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.4 FCCCOCC1CCCC1 34a_100000742336_100011934791 [1,0,0,0,0,0|2,0,1]=4 406 B11R1.4 FCCCOCC1CCCC1 34a_100000759539_100000740388 [1,0,0,0,0,0|2,0,1]=4 407 B11R1.4 FCCCOCC1CCCC1 7a_100000742336_100011934791 [1,0,0,0,0,0|2,0,1]=4 408 B11R1.4 FCCCOCC1CCCO1 34a_100000210270_100011934791 [1,0,0,0,0,0|1,0,1]=3 409 B11R1.4 FCCCOCC1CCCO1 7a_100000210270_100011934791 [1,0,0,0,0,0|1,0,1]=3 410 B11R1.4 FCCCOCC1COCO1 34a_100011216627_100011934791 [1,0,0,0,0,0|2,0,1]=4 411 B11R1.4 FCCCOCC1OCCO1 34a_100000087154_100011934791 [1,0,0,0,0,0|2,0,1]=4 412 B11R1.4 FCCCOCC1OCCO1 34a_100000759539_100000755774 [1,0,0,0,0,0|2,0,1]=4 413 B11R1.4 FCCCOC[C@H]1CCCN1 34a_100000745186_100011934791 [1,0,0,0,0,0|2,0,1]=4 414 B11R1.4 FCCCSCC1CCCO1 62a_100000203698_100011934791 [1,0,0,0,0,0|1,1,1]=4 415 B11R1.4 FCCCSCC1CCCO1 62a_100011934791_100000203698 [1,0,0,0,0,0|1,1,1]=4 416 B11R1.4 N#CCCOCC1CCCO1 7a_100000210270_100000184422 [1,0,0,0,0,0|1,0,2]=4 417 B11R1.4 NCCCOCC1CCCC1 34a_100000182051_100000740388 [1,0,0,0,0,0|2,0,1]=4 418 B11R1.4 NCCCOCC1OCCO1 34a_100000182051_100000755774 [1,0,0,0,0,0|2,0,1]=4 419 B11R1.4 OCCCNC[C@@H]1CCCO1 2230a_100020590478_100000230001 [1,0,0,0,0,0|2,0,1]=4 420 B11R1.4 OCCCNC[C@@H]1CCCO1 34a_100020590478_100000230001 [1,0,0,0,0,0|2,0,1]=4 421 B11R1.4 OCCCOCC1CCCC1 34a_100000742336_100000230001 [1,0,0,0,0,0|2,0,1]=4 422 B11R1.4 OCCCOCC1CCCC1 7a_100000742336_100011215043 [1,0,0,0,0,0|2,0,1]=4 423 B11R1.4 OCCCOCC1CCCO1 34a_100000210270_100000230001 [1,0,0,0,0,0|1,0,1]=3 424 B11R1.4 OCCCOCC1CCCO1 7a_100000210270_100011215043 [1,0,0,0,0,0|1,0,1]=3 425 B11R1.4 OCCCOCC1COCO1 34a_100011216627_100000230001 [1,0,0,0,0,0|2,0,1]=4 426 B11R1.4 OCCCOCC1OCCO1 34a_100000087154_100000230001 [1,0,0,0,0,0|2,0,1]=4 427 B11R1.4 OCCCOC[C@H]1CCCN1 34a_100000745186_100000230001 [1,0,0,0,0,0|2,0,1]=4 428 B11R1.4 OCCCSCC1CCCO1 62a_100000203698_100011215043 [1,0,0,0,0,0|1,1,1]=4 429 B11R1.4 OCCCSCC1CCCO1 62a_100011215043_100000203698 [1,0,0,0,0,0|1,1,1]=4 430 B11R1.25 C=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000185746 [1,0,0,0,0,0|1,0,2]=4 431 B11R1.25 C=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_200121576911 [1,0,0,0,0,0|1,0,2]=4 432 B11R1.25 CC(CF)OCC1CCCO1 7a_100016041109_100000203698 [1,0,0,0,0,0|2,0,1]=4 433 B11R1.25 CC(CO)OCC1CCCO1 34a_100000210270_100012180447 [1,0,0,0,0,0|2,0,1]=4 434 B11R1.25 CC(CO)OCC1CCCO1 7a_100000210270_100012180447 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.25 CCC(=O)CCC1CCCC1 1458a_100000210414_100000760354 [1,0,0,0,0,0|2,0,0]=3 436 B11R1.25 CCC(=O)CCC1CCCC1 1458a_100000211120_100000210202 [1,0,0,0,0,0|2,0,0]=3 437 B11R1.25 CCC(=O)CCC1CCCO1 1458a_100011247709_100000210202 [1,0,0,0,0,0|1,0,0]=2 438 B11R1.25 CCC(=O)CCC1OCCO1 1458a_100000082924_100000210202 [1,0,0,0,0,0|2,0,0]=3 439 B11R1.25 CCC(=O)CCC1OCCO1 1458a_100000210414_100000740749 [1,0,0,0,0,0|2,0,0]=3 440 B11R1.25 CCC(=O)CCN1CCCC1 1458a_100000210414_100000004467 [1,0,0,0,0,0|3,0,0]=4 441 B11R1.25 CCC(=O)CCN1CCCC1 1458a_100000738983_100000210202 [1,0,0,0,0,0|3,0,0]=4 442 B11R1.25 CCC(=O)CCN1CCCO1 1458a_200015187630_100000210202 [1,0,0,0,0,0|2,0,0]=3 443 B11R1.25 CCC(=O)COC1CCCC1 1458a_100000741352_100000210202 [1,0,0,0,0,0|3,0,0]=4 444 B11R1.25 CCC(=O)COC1CCCC1 34a_100000725409_100000179811 [1,0,0,0,0,0|3,0,0]=4 445 B11R1.25 CCC(=O)COC1CCCC1 7a_100000210269_100000747405 [1,0,0,0,0,0|3,0,0]=4 446 B11R1.25 CCC(=O)CSC1CCCC1 62a_100000747405_100000179811 [1,0,0,0,0,0|3,0,0]=4 447 B11R1.25 CCC(=O)CSC1CCCC1 62a_100011217020_100000747405 [1,0,0,0,0,0|3,0,0]=4 448 B11R1.25 CCC(=O)NCC1CCCC1 11a_100000737975_100000210414 [1,0,0,0,0,0|2,0,0]=3 449 B11R1.25 CCC(=O)NCC1CCCC1 1626a_100000737975_100000210414 [1,0,0,0,0,0|2,0,0]=3 450 B11R1.25 CCC(=O)NCC1CCCC1 240690a_100000737975_100000210414 [1,0,0,0,0,0|2,0,0]=3 451 B11R1.25 CCC(=O)NCC1CCCC1 527a_100000737975_100000210414 [1,0,0,0,0,0|2,0,0]=3 452 B11R1.25 CCC(=O)NCC1CCOC1 11a_100000737293_100000210414 [1,0,0,0,0,0|3,0,0]=4 453 B11R1.25 CCC(=O)NCC1CCOC1 1626a_100000737293_100000210414 [1,0,0,0,0,0|3,0,0]=4 454 B11R1.25 CCC(=O)NCC1CCOC1 240690a_100000737293_100000210414 [1,0,0,0,0,0|3,0,0]=4 455 B11R1.25 CCC(=O)NCC1CCOC1 527a_100000737293_100000210414 [1,0,0,0,0,0|3,0,0]=4 456 B11R1.25 CCC(=O)NCC1OCCO1 11a_100000036311_100000210414 [1,0,0,0,0,0|2,0,0]=3 457 B11R1.25 CCC(=O)NCC1OCCO1 1626a_100000036311_100000210414 [1,0,0,0,0,0|2,0,0]=3 458 B11R1.25 CCC(=O)NCC1OCCO1 527a_100000036311_100000210414 [1,0,0,0,0,0|2,0,0]=3 459 B11R1.25 CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210414 [1,0,0,0,0,0|1,0,0]=2 460 B11R1.25 CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210414 [1,0,0,0,0,0|1,0,0]=2 461 B11R1.25 CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210414 [1,0,0,0,0,0|1,0,0]=2 462 B11R1.25 CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210414 [1,0,0,0,0,0|1,0,0]=2 463 B11R1.25 CCC(=O)NNC1CCCC1 22a_100000737850_100000210414 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.25 CCC(C)NCC1CCCO1 2230a_100000209981_100000203698 [1,0,0,0,0,0|2,0,1]=4 465 B11R1.25 CCC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000758301 [1,0,0,0,0,0|2,0,1]=4 466 B11R1.25 CCC(C)NC[C@@H]1CCCO1 34a_100020590478_100011215416 [1,0,0,0,0,0|2,0,1]=4 467 B11R1.25 CCC(C)OCC1CCCC1 34a_100000742336_100011215416 [1,0,0,0,0,0|2,0,1]=4 468 B11R1.25 CCC(C)OCC1CCCC1 7a_100000210228_100000740388 [1,0,0,0,0,0|2,0,1]=4 469 B11R1.25 CCC(C)OCC1CCCC1 7a_100000742336_100000758301 [1,0,0,0,0,0|2,0,1]=4 470 B11R1.25 CCC(C)OCC1CCCO1 34a_100000210270_100011215416 [1,0,0,0,0,0|1,0,1]=3 471 B11R1.25 CCC(C)OCC1CCCO1 7a_100000210228_100000203698 [1,0,0,0,0,0|1,0,1]=3 472 B11R1.25 CCC(C)OCC1CCCO1 7a_100000210270_100000758301 [1,0,0,0,0,0|1,0,1]=3 473 B11R1.25 CCC(C)OCC1COCO1 34a_100011216627_100011215416 [1,0,0,0,0,0|2,0,1]=4 474 B11R1.25 CCC(C)OCC1OCCO1 34a_100000087154_100011215416 [1,0,0,0,0,0|2,0,1]=4 475 B11R1.25 CCC(C)OCC1OCCO1 7a_100000210228_100000755774 [1,0,0,0,0,0|2,0,1]=4 476 B11R1.25 CCC(C)OC[C@H]1CCCN1 34a_100000745186_100011215416 [1,0,0,0,0,0|2,0,1]=4 477 B11R1.25 CCC(C)SCC1CCCO1 62a_100000203698_100000758301 [1,0,0,0,0,0|1,1,1]=4 478 B11R1.25 CCC(C)SCC1CCCO1 62a_100000758301_100000203698 [1,0,0,0,0,0|1,1,1]=4 479 B11R1.25 CNC(=O)CCC1CCCC1 11a_106832991635_100000211120 [1,0,0,0,0,0|3,0,0]=4 480 B11R1.25 CNC(=O)CCC1CCCC1 1626a_100102657272_100000211120 [1,0,0,0,0,0|3,0,0]=4 481 B11R1.25 CNC(=O)CCC1CCCC1 240690a_100102657272_100000211120 [1,0,0,0,0,0|3,0,0]=4 482 B11R1.25 CNC(=O)CCC1CCCC1 527a_100102657272_100000211120 [1,0,0,0,0,0|3,0,0]=4 483 B11R1.25 CNC(=O)CCC1CCCO1 11a_106832991635_100011247709 [1,0,0,0,0,0|2,0,0]=3 484 B11R1.25 CNC(=O)CCC1CCCO1 1626a_100102657272_100011247709 [1,0,0,0,0,0|2,0,0]=3 485 B11R1.25 CNC(=O)CCC1CCCO1 240690a_100102657272_100011247709 [1,0,0,0,0,0|2,0,0]=3 486 B11R1.25 CNC(=O)CCC1CCCO1 527a_100102657272_100011247709 [1,0,0,0,0,0|2,0,0]=3 487 B11R1.25 CNC(=O)CCN1CCCO1 240690a_100102657272_200015187630 [1,0,0,0,0,0|3,0,0]=4 488 B11R1.25 CNC(=O)COC1CCCO1 34a_100000085407_100000183359 [1,0,0,0,0,0|3,0,0]=4 489 B11R1.25 CNC(=O)NCC1CCCC1 2708a_100000737975_106832991635 [1,0,0,0,0,0|3,0,0]=4 490 B11R1.25 CNC(=O)NCC1CCCC1 2708a_100102657272_100000737975 [1,0,0,0,0,0|3,0,0]=4 491 B11R1.25 CNC(=O)NCC1CCCC1 273464a_100000737975_100102657272 [1,0,0,0,0,0|3,0,0]=4 492 B11R1.25 CNC(=O)NCC1CCCC1 273464a_100102657272_100000737975 [1,0,0,0,0,0|3,0,0]=4 493 B11R1.25 CNC(=O)NCC1CCCC1 512a_100000737975_100102657272 [1,0,0,0,0,0|3,0,0]=4 494 B11R1.25 CNC(=O)NCC1CCCC1 512a_106832991638_100000737975 [1,0,0,0,0,0|3,0,0]=4 495 B11R1.25 CNC(=O)NCC1OCCO1 2708a_100000036311_106832991635 [1,0,0,0,0,0|3,0,0]=4 496 B11R1.25 CNC(=O)NCC1OCCO1 2708a_100102657272_100000036311 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.25 CNC(=O)NCC1OCCO1 273464a_100000036311_100102657272 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.25 CNC(=O)NCC1OCCO1 273464a_100102657272_100000036311 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.25 CNC(=O)NCC1OCCO1 512a_100000036311_100102657272 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.25 CNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_106832991635 [1,0,0,0,0,0|2,0,0]=3 501 B11R1.25 CNC(=O)NC[C@@H]1CCCO1 2708a_100102657272_100020590478 [1,0,0,0,0,0|2,0,0]=3 502 B11R1.25 CNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100102657272 [1,0,0,0,0,0|2,0,0]=3 503 B11R1.25 CNC(=O)NC[C@@H]1CCCO1 273464a_100102657272_100020590478 [1,0,0,0,0,0|2,0,0]=3 504 B11R1.25 CNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100102657272 [1,0,0,0,0,0|2,0,0]=3 505 B11R1.25 COC(=O)COC1CCCO1 34a_100000085407_100000747449 [1,0,0,0,0,0|3,0,0]=4 506 B11R1.25 O=C(CF)CCC1CCCC1 1458a_100000211120_100015361967 [1,0,0,0,0,0|3,0,0]=4 507 B11R1.25 O=C(CF)CCC1CCCO1 1458a_100011247709_100015361967 [1,0,0,0,0,0|2,0,0]=3 508 B11R1.25 O=C(CF)CCC1OCCO1 1458a_100000082924_100015361967 [1,0,0,0,0,0|3,0,0]=4 509 B11R1.25 O=C(CF)CCN1CCCO1 1458a_200015187630_100015361967 [1,0,0,0,0,0|3,0,0]=4 510 B11R1.25 O=C(CO)CCC1CCCC1 1458a_100000210174_100000760354 [1,0,0,0,0,0|3,0,0]=4 511 B11R1.25 O=C(CO)CCC1OCCO1 1458a_100000210174_100000740749 [1,0,0,0,0,0|3,0,0]=4 512 B11R1.25 O=C(CO)NCC1CCCC1 240690a_100000737975_100000210174 [1,0,0,0,0,0|3,0,0]=4 513 B11R1.25 O=C(CO)NCC1CCCC1 527a_100000737975_100000210174 [1,0,0,0,0,0|3,0,0]=4 514 B11R1.25 O=C(CO)NCC1OCCO1 527a_100000036311_100000210174 [1,0,0,0,0,0|3,0,0]=4 515 B11R1.25 O=C(CO)NC[C@@H]1CCCO1 240690a_100020590478_100000210174 [1,0,0,0,0,0|2,0,0]=3 516 B11R1.25 O=C(CO)NC[C@@H]1CCCO1 527a_100020590478_100000210174 [1,0,0,0,0,0|2,0,0]=3 517 B13R1.33 C#CCC(=O)NC(C)C1CCCO1 1626a_100025754208_100011220946 [0,1,0,0,0,0|1,0,2]=4 518 B13R1.33 C#CCC(=O)NC(C)C1CCCO1 527a_100025754208_100011220946 [0,1,0,0,0,0|1,0,2]=4 519 B13R1.33 C=CCC(=O)NC(C)C1CCCO1 11a_100025754208_100000210193 [0,1,0,0,0,0|1,0,2]=4 520 B13R1.33 C=CCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000210193 [0,1,0,0,0,0|1,0,2]=4 521 B13R1.33 C=CCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000210193 [0,1,0,0,0,0|1,0,2]=4 522 B13R1.33 C=CCC(=O)NC(C)C1CCCO1 527a_100025754208_100000210193 [0,1,0,0,0,0|1,0,2]=4 523 B13R1.33 CC(NC(=O)CC#N)C1CCCO1 1626a_100025754208_100051588842 [0,1,0,0,0,0|2,0,1]=4 524 B13R1.33 CC(NC(=O)CC#N)C1CCCO1 240690a_100025754208_100051588842 [0,1,0,0,0,0|2,0,1]=4 525 B13R1.33 CC(NC(=O)CCO)C1CCCC1 240690a_100015185923_100011216618 [0,1,0,0,0,0|3,0,0]=4 526 B13R1.33 CC(NC(=O)CCO)C1CCCO1 240690a_100025754208_100011216618 [0,1,0,0,0,0|2,0,0]=3 527 B13R1.33 CC=CC(=O)NC(C)C1CCCO1 11a_100025754208_100000210699 [0,1,0,0,0,0|1,0,2]=4 528 B13R1.33 CC=CC(=O)NC(C)C1CCCO1 1626a_100025754208_100000210699 [0,1,0,0,0,0|1,0,2]=4 529 B13R1.33 CC=CC(=O)NC(C)C1CCCO1 240690a_100025754208_100000210699 [0,1,0,0,0,0|1,0,2]=4 530 B13R1.33 CCCC(=O)CC(=O)C1CCCC1 1458a_100000210718_100000747444 [0,1,0,0,0,0|2,0,1]=4 531 B13R1.33 CCCC(=O)CC(=O)C1CCCS1 1458a_100012002731_100000747444 [0,1,0,0,0,0|1,1,1]=4 532 B13R1.33 CCCC(=O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100000747444 [0,1,0,0,0,0|1,0,1]=3 533 B13R1.33 CCCC(=O)CC(C)N1CCCC1 1458a_100000211992_200015187269 [0,1,0,0,0,0|3,0,0]=4 534 B13R1.33 CCCC(=O)CN(C)C1CCCC1 1458a_100073796569_100000210303 [0,1,0,0,0,0|3,0,0]=4 535 B13R1.33 CCCC(=O)CN(C)C1CCCC1 2230a_100000207505_100000747444 [0,1,0,0,0,0|3,0,0]=4 536 B13R1.33 CCCC(=O)CN(C)C1CCCC1 269982a_100000207505_100000747444 [0,1,0,0,0,0|3,0,0]=4 537 B13R1.33 CCCC(=O)NC(C)C1CCCC1 11a_100015185923_100000211992 [0,1,0,0,0,0|2,0,0]=3 538 B13R1.33 CCCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000211992 [0,1,0,0,0,0|2,0,0]=3 539 B13R1.33 CCCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000211992 [0,1,0,0,0,0|2,0,0]=3 540 B13R1.33 CCCC(=O)NC(C)C1CCCC1 527a_100015185923_100000211992 [0,1,0,0,0,0|2,0,0]=3 541 B13R1.33 CCCC(=O)NC(C)C1CCCO1 11a_100025754208_100000211992 [0,1,0,0,0,0|1,0,0]=2 542 B13R1.33 CCCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000211992 [0,1,0,0,0,0|1,0,0]=2 543 B13R1.33 CCCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000211992 [0,1,0,0,0,0|1,0,0]=2 544 B13R1.33 CCCC(=O)NC(C)C1CCCO1 527a_100025754208_100000211992 [0,1,0,0,0,0|1,0,0]=2 545 B13R1.33 CCCC(C)NC(C)C1CCCO1 2230a_100025754208_100000766640 [0,1,0,0,0,0|2,0,1]=4 546 B13R1.33 CCCC(C)NC(C)C1CCCO1 270004a_100025754208_100000211909 [0,1,0,0,0,0|2,0,1]=4 547 B13R1.33 CCCC(C)NC(C)C1CCCO1 34a_100025754208_100000766640 [0,1,0,0,0,0|2,0,1]=4 548 B13R1.33 CCCC(C)OC(C)C1CCCC1 34a_100011216366_100000766640 [0,1,0,0,0,0|2,0,1]=4 549 B13R1.33 CCCC(C)OC(C)C1CCCC1 7a_100011216366_100000766640 [0,1,0,0,0,0|2,0,1]=4 550 B13R1.33 CCNC(=O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100000183381 [0,1,0,0,0,0|2,0,1]=4 551 B13R1.33 CCNC(=O)NC(C)C1CCCC1 2708a_100015185923_100015525214 [0,1,0,0,0,0|3,0,0]=4 552 B13R1.33 CCNC(=O)NC(C)C1CCCC1 2708a_100015525214_100015185923 [0,1,0,0,0,0|3,0,0]=4 553 B13R1.33 CCNC(=O)NC(C)C1CCCC1 273464a_100015185923_100015525214 [0,1,0,0,0,0|3,0,0]=4 554 B13R1.33 CCNC(=O)NC(C)C1CCCC1 273464a_100015525214_100015185923 [0,1,0,0,0,0|3,0,0]=4 555 B13R1.33 CCNC(=O)NC(C)C1CCCC1 512a_100015185923_100015525214 [0,1,0,0,0,0|3,0,0]=4 556 B13R1.33 CCNC(=O)NC(C)C1CCCC1 512a_100015525214_100015185923 [0,1,0,0,0,0|3,0,0]=4 557 B13R1.33 CCNC(=O)NC(C)C1CCCO1 2708a_100015525214_100025754208 [0,1,0,0,0,0|2,0,0]=3 558 B13R1.33 CCNC(=O)NC(C)C1CCCO1 2708a_100025754208_100015525214 [0,1,0,0,0,0|2,0,0]=3 559 B13R1.33 CCNC(=O)NC(C)C1CCCO1 273464a_100015525214_100025754208 [0,1,0,0,0,0|2,0,0]=3 560 B13R1.33 CCNC(=O)NC(C)C1CCCO1 273464a_100025754208_100015525214 [0,1,0,0,0,0|2,0,0]=3 561 B13R1.33 CCNC(=O)NC(C)C1CCCO1 512a_100015525214_100025754208 [0,1,0,0,0,0|2,0,0]=3 562 B13R1.33 CCNC(=O)NC(C)C1CCCO1 512a_100025754208_100015525214 [0,1,0,0,0,0|2,0,0]=3 563 B13R1.33 CCOC(=O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100000188475 [0,1,0,0,0,0|2,0,1]=4 564 B13R1.33 CCOC(=O)OC(C)N1CCCC1 269982a_100000188435_100000036008 [0,1,0,0,0,0|3,0,0]=4 565 B13R1.33 CNNC(=O)NC(C)C1CCCO1 273464a_100025754208_100016993582 [0,1,0,0,0,0|3,0,0]=4 566 B13R1.33 CNNC(=O)NC(C)C1CCCO1 512a_100016993582_100025754208 [0,1,0,0,0,0|3,0,0]=4 567 B13R1.33 CNNC(=O)NC(C)C1CCCO1 512a_100025754208_100016993582 [0,1,0,0,0,0|3,0,0]=4 568 B13R1.33 COCC(=O)NC(C)C1CCCC1 11a_100015185923_100000210968 [0,1,0,0,0,0|3,0,0]=4 569 B13R1.33 COCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000210968 [0,1,0,0,0,0|3,0,0]=4 570 B13R1.33 COCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000210968 [0,1,0,0,0,0|3,0,0]=4 571 B13R1.33 COCC(=O)NC(C)C1CCCC1 527a_100015185923_100000210968 [0,1,0,0,0,0|3,0,0]=4 572 B13R1.33 COCC(=O)NC(C)C1CCCO1 11a_100025754208_100000210968 [0,1,0,0,0,0|2,0,0]=3 573 B13R1.33 COCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000210968 [0,1,0,0,0,0|2,0,0]=3 574 B13R1.33 COCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000210968 [0,1,0,0,0,0|2,0,0]=3 575 B13R1.33 COCC(=O)NC(C)C1CCCO1 527a_100025754208_100000210968 [0,1,0,0,0,0|2,0,0]=3 576 B13R1.33 CSCC(=O)NC(C)C1CCCC1 11a_100015185923_100000184570 [0,1,0,0,0,0|3,0,0]=4 577 B13R1.33 CSCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000184570 [0,1,0,0,0,0|3,0,0]=4 578 B13R1.33 CSCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000184570 [0,1,0,0,0,0|3,0,0]=4 579 B13R1.33 CSCC(=O)NC(C)C1CCCC1 527a_100015185923_100000184570 [0,1,0,0,0,0|3,0,0]=4 580 B13R1.33 CSCC(=O)NC(C)C1CCCO1 11a_100025754208_100000184570 [0,1,0,0,0,0|2,0,0]=3 581 B13R1.33 CSCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000184570 [0,1,0,0,0,0|2,0,0]=3 582 B13R1.33 CSCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000184570 [0,1,0,0,0,0|2,0,0]=3 583 B13R1.33 CSCC(=O)NC(C)C1CCCO1 527a_100025754208_100000184570 [0,1,0,0,0,0|2,0,0]=3 584 B13R1.41 CCCC(=O)CCC1COS(=O)O1 1458a_100000211992_100009840081 [0,1,0,0,0,0|3,0,0]=4 585 B13R1.41 CCCC(=O)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000747444 [0,1,0,0,0,0|3,0,0]=4 586 B13R1.41 CCCC(=O)NCC1CCN(C1)C 240690a_100000742581_100000211992 [0,1,0,0,0,0|3,0,0]=4 587 B13R1.41 CCCC(=O)NCC1CCN(C1)C 527a_100000742581_100000211992 [0,1,0,0,0,0|3,0,0]=4 588 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 11a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 589 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 1626a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 590 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 240690a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 591 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 527a_100015423886_100000211992 [0,1,0,0,0,0|2,0,1]=4 592 B13R1.41 CCCC(=O)OCN1CCC(C1)O 2230a_100011215560_100000034017 [0,1,0,0,0,0|2,0,0]=3 593 B13R1.41 CCCC(=O)OCN1CCC(C1)O 269982a_100011215560_100000034017 [0,1,0,0,0,0|2,0,0]=3 594 B13R1.41 CCCC(=O)OCN1CC[C@@H](C1)F 2230a_100015203821_100000034017 [0,1,0,0,0,0|2,0,0]=3 595 B13R1.41 CCCC(=O)OCN1CC[C@@H](C1)F 269982a_100015203821_100000034017 [0,1,0,0,0,0|2,0,0]=3 596 B13R1.41 CCCC(=O)OCN1CC[C@@H](C1)F 34a_100015203821_100000034017 [0,1,0,0,0,0|2,0,0]=3 597 B13R1.41 CCCC(=O)OCN1CC[C@H](C1)C 2230a_100016987628_100000034017 [0,1,0,0,0,0|2,0,0]=3 598 B13R1.41 CCCC(=O)OCN1CC[C@H](C1)C 269982a_100016987628_100000034017 [0,1,0,0,0,0|2,0,0]=3 599 B13R1.41 CCCC(=O)OCN1CC[C@H](C1)C 34a_100016987628_100000034017 [0,1,0,0,0,0|2,0,0]=3 600 B13R1.41 CCCC(C)OC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000766640 [0,1,0,0,0,0|2,0,1]=4 601 B13R1.66 C#CCC(=O)N(C)CC1CCCO1 1626a_100102946541_100011220946 [0,1,0,0,0,0|1,0,2]=4 602 B13R1.66 C#CCC(=O)N(C)CC1CCCO1 527a_100102946541_100011220946 [0,1,0,0,0,0|1,0,2]=4 603 B13R1.66 C=CCC(=O)N(C)CC1CCCO1 11a_100102946541_100000210193 [0,1,0,0,0,0|1,0,2]=4 604 B13R1.66 C=CCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000210193 [0,1,0,0,0,0|1,0,2]=4 605 B13R1.66 C=CCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000210193 [0,1,0,0,0,0|1,0,2]=4 606 B13R1.66 C=CCC(=O)N(C)CC1CCCO1 527a_100102946541_100000210193 [0,1,0,0,0,0|1,0,2]=4 607 B13R1.66 CC/C=C(\C)/C(=O)CC1CCCO1 1458a_100016988807_100000203698 [0,1,0,0,0,0|2,0,1]=4 608 B13R1.66 CC=CC(=O)N(C)CC1CCCO1 11a_100102946541_100000210699 [0,1,0,0,0,0|1,0,2]=4 609 B13R1.66 CC=CC(=O)N(C)CC1CCCO1 1626a_100102946541_100000210699 [0,1,0,0,0,0|1,0,2]=4 610 B13R1.66 CC=CC(=O)N(C)CC1CCCO1 240690a_100102946541_100000210699 [0,1,0,0,0,0|1,0,2]=4 611 B13R1.66 CCCC(=O)N(C)CC1CCCO1 11a_100102946541_100000211992 [0,1,0,0,0,0|1,0,0]=2 612 B13R1.66 CCCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000211992 [0,1,0,0,0,0|1,0,0]=2 613 B13R1.66 CCCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000211992 [0,1,0,0,0,0|1,0,0]=2 614 B13R1.66 CCCC(=O)N(C)CC1CCCO1 527a_100102946541_100000211992 [0,1,0,0,0,0|1,0,0]=2 615 B13R1.66 CCCC(=O)N(C)CC1CCOC1 11a_100000684583_100000211992 [0,1,0,0,0,0|3,0,0]=4 616 B13R1.66 CCCC(=O)N(C)CC1CCOC1 1626a_100000684583_100000211992 [0,1,0,0,0,0|3,0,0]=4 617 B13R1.66 CCCC(=O)N(C)CC1CCOC1 240690a_100000684583_100000211992 [0,1,0,0,0,0|3,0,0]=4 618 B13R1.66 CCCC(=O)N(C)CC1CCOC1 527a_100000684583_100000211992 [0,1,0,0,0,0|3,0,0]=4 619 B13R1.66 CCCC(=O)N(C)CC1OCCO1 11a_200000032744_100000211992 [0,1,0,0,0,0|2,0,0]=3 620 B13R1.66 CCCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000211992 [0,1,0,0,0,0|2,0,0]=3 621 B13R1.66 CCCC(=O)N(C)CC1OCCO1 527a_200000032744_100000211992 [0,1,0,0,0,0|2,0,0]=3 622 B13R1.66 CCCC(C)C(=O)CC1CCCO1 1458a_100000210906_100000203698 [0,1,0,0,0,0|2,0,1]=4 623 B13R1.66 CCCC(C)N(C)CC1CCCO1 2230a_100102946541_100000766640 [0,1,0,0,0,0|2,0,1]=4 624 B13R1.66 CCCC(C)N(C)CC1CCCO1 269982a_100102946541_100000766640 [0,1,0,0,0,0|2,0,1]=4 625 B13R1.66 CCCC(C)N(C)CC1CCCO1 270004a_100102946541_100000211909 [0,1,0,0,0,0|2,0,1]=4 626 B13R1.66 CCCC(C)N(C)CC1CCCO1 34a_100102946541_100000766640 [0,1,0,0,0,0|2,0,1]=4 627 B13R1.66 CCC[C@H](O)C(=O)CC1CCCO1 1458a_100009822183_100000203698 [0,1,0,0,0,0|1,0,2]=4 628 B13R1.66 CCNC(=O)C(=O)CC1CCCC1 1458a_200011297158_100000740388 [0,1,0,0,0,0|3,0,0]=4 629 B13R1.66 CCNC(=O)C(=O)CC1CCCO1 1458a_200011297158_100000203698 [0,1,0,0,0,0|2,0,0]=3 630 B13R1.66 CCNC(=O)C(=O)CC1OCCO1 1458a_200011297158_100000755774 [0,1,0,0,0,0|3,0,0]=4 631 B13R1.66 CCNC(=O)C(C)OC1CCCO1 34a_100000085407_100000230173 [0,1,0,0,0,0|3,0,0]=4 632 B13R1.66 CCNC(=O)N(C)CC1CCCO1 2708a_100015525214_100102946541 [0,1,0,0,0,0|2,0,0]=3 633 B13R1.66 CCNC(=O)N(C)CC1CCCO1 273464a_100015525214_100102946541 [0,1,0,0,0,0|2,0,0]=3 634 B13R1.66 CCNC(=O)N(C)CC1OCCO1 2708a_100015525214_200000032744 [0,1,0,0,0,0|3,0,0]=4 635 B13R1.66 CCNC(=O)N(C)CC1OCCO1 273464a_100015525214_200000032744 [0,1,0,0,0,0|3,0,0]=4 636 B13R1.66 CCOC(=O)C(C)OC1CCCO1 34a_100000085407_100011216346 [0,1,0,0,0,0|3,0,0]=4 637 B13R1.66 CCOC(=O)C(F)OC1CCCO1 34a_100000085407_100000760018 [0,1,0,0,0,0|3,0,0]=4 638 B13R1.66 CN(CC1CCCO1)C(=O)CC#N 1626a_100102946541_100051588842 [0,1,0,0,0,0|2,0,1]=4 639 B13R1.66 CN(CC1CCCO1)C(=O)CC#N 240690a_100102946541_100051588842 [0,1,0,0,0,0|2,0,1]=4 640 B13R1.66 CN(CC1CCCO1)C(=O)CCO 240690a_100102946541_100011216618 [0,1,0,0,0,0|2,0,0]=3 641 B13R1.66 COCC(=O)N(C)CC1CCCO1 11a_100102946541_100000210968 [0,1,0,0,0,0|2,0,0]=3 642 B13R1.66 COCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000210968 [0,1,0,0,0,0|2,0,0]=3 643 B13R1.66 COCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000210968 [0,1,0,0,0,0|2,0,0]=3 644 B13R1.66 COCC(=O)N(C)CC1CCCO1 527a_100102946541_100000210968 [0,1,0,0,0,0|2,0,0]=3 645 B13R1.66 COCC(=O)N(C)CC1OCCO1 11a_200000032744_100000210968 [0,1,0,0,0,0|3,0,0]=4 646 B13R1.66 COCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000210968 [0,1,0,0,0,0|3,0,0]=4 647 B13R1.66 COCC(=O)N(C)CC1OCCO1 527a_200000032744_100000210968 [0,1,0,0,0,0|3,0,0]=4 648 B13R1.66 CSCC(=O)N(C)CC1CCCO1 11a_100102946541_100000184570 [0,1,0,0,0,0|2,0,0]=3 649 B13R1.66 CSCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000184570 [0,1,0,0,0,0|2,0,0]=3 650 B13R1.66 CSCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000184570 [0,1,0,0,0,0|2,0,0]=3 651 B13R1.66 CSCC(=O)N(C)CC1CCCO1 527a_100102946541_100000184570 [0,1,0,0,0,0|2,0,0]=3 652 B13R1.66 CSCC(=O)N(C)CC1OCCO1 11a_200000032744_100000184570 [0,1,0,0,0,0|3,0,0]=4 653 B13R1.66 CSCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000184570 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.66 CSCC(=O)N(C)CC1OCCO1 527a_200000032744_100000184570 [0,1,0,0,0,0|3,0,0]=4 655 B13R1.153 C#CCCC(=O)CCC1CCCC1 1458a_100000211120_100000753159 [0,1,0,0,0,0|2,0,1]=4 656 B13R1.153 C#CCCC(=O)CCC1CCCC1 1458a_100000692101_100000760354 [0,1,0,0,0,0|2,0,1]=4 657 B13R1.153 C#CCCC(=O)CCC1CCCO1 1458a_100011247709_100000753159 [0,1,0,0,0,0|1,0,1]=3 658 B13R1.153 C#CCCC(=O)CCC1OCCO1 1458a_100000082924_100000753159 [0,1,0,0,0,0|2,0,1]=4 659 B13R1.153 C#CCCC(=O)CCC1OCCO1 1458a_100000692101_100000740749 [0,1,0,0,0,0|2,0,1]=4 660 B13R1.153 C#CCCC(=O)CCN1CCCO1 1458a_200015187630_100000753159 [0,1,0,0,0,0|2,0,1]=4 661 B13R1.153 C#CCCC(=O)NCC1CCCC1 11a_100000737975_100000692101 [0,1,0,0,0,0|2,0,1]=4 662 B13R1.153 C#CCCC(=O)NCC1CCCC1 1626a_100000737975_100000692101 [0,1,0,0,0,0|2,0,1]=4 663 B13R1.153 C#CCCC(=O)NCC1CCCC1 240690a_100000737975_100000692101 [0,1,0,0,0,0|2,0,1]=4 664 B13R1.153 C#CCCC(=O)NCC1CCCC1 527a_100000737975_100000692101 [0,1,0,0,0,0|2,0,1]=4 665 B13R1.153 C#CCCC(=O)NCC1OCCO1 11a_100000036311_100000692101 [0,1,0,0,0,0|2,0,1]=4 666 B13R1.153 C#CCCC(=O)NCC1OCCO1 1626a_100000036311_100000692101 [0,1,0,0,0,0|2,0,1]=4 667 B13R1.153 C#CCCC(=O)NCC1OCCO1 527a_100000036311_100000692101 [0,1,0,0,0,0|2,0,1]=4 668 B13R1.153 C#CCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000692101 [0,1,0,0,0,0|1,0,1]=3 669 B13R1.153 C#CCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000692101 [0,1,0,0,0,0|1,0,1]=3 670 B13R1.153 C#CCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000692101 [0,1,0,0,0,0|1,0,1]=3 671 B13R1.153 C#CCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000692101 [0,1,0,0,0,0|1,0,1]=3 672 B13R1.153 C#CCNC(=O)CCC1CCCO1 11a_100000212058_100011247709 [0,1,0,0,0,0|1,0,2]=4 673 B13R1.153 C#CCNC(=O)CCC1CCCO1 1626a_100000212058_100011247709 [0,1,0,0,0,0|1,0,2]=4 674 B13R1.153 C#CCNC(=O)CCC1CCCO1 240690a_100000212058_100011247709 [0,1,0,0,0,0|1,0,2]=4 675 B13R1.153 C#CCNC(=O)CCC1CCCO1 527a_100000212058_100011247709 [0,1,0,0,0,0|1,0,2]=4 676 B13R1.153 C#CCNC(=O)NC[C@@H]1CCCO1 2708a_100000212058_100020590478 [0,1,0,0,0,0|1,0,2]=4 677 B13R1.153 C#CCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000212058 [0,1,0,0,0,0|1,0,2]=4 678 B13R1.153 C#CCNC(=O)NC[C@@H]1CCCO1 273464a_100000212058_100020590478 [0,1,0,0,0,0|1,0,2]=4 679 B13R1.153 C#CCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000212058 [0,1,0,0,0,0|1,0,2]=4 680 B13R1.153 C#CCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000212058 [0,1,0,0,0,0|1,0,2]=4 681 B13R1.153 C/C=C/CC(=O)CCC1CCCC1 1458a_100000211120_100102629194 [0,1,0,0,0,0|2,0,1]=4 682 B13R1.153 C/C=C/CC(=O)CCC1CCCO1 1458a_100011247709_100102629194 [0,1,0,0,0,0|1,0,1]=3 683 B13R1.153 C/C=C/CC(=O)CCC1OCCO1 1458a_100000082924_100102629194 [0,1,0,0,0,0|2,0,1]=4 684 B13R1.153 C/C=C/CC(=O)CCN1CCCO1 1458a_200015187630_100102629194 [0,1,0,0,0,0|2,0,1]=4 685 B13R1.153 C=CCCC(=O)CCC1CCCC1 1458a_100000211120_100000754431 [0,1,0,0,0,0|2,0,1]=4 686 B13R1.153 C=CCCC(=O)CCC1CCCC1 1458a_100000749702_100000760354 [0,1,0,0,0,0|2,0,1]=4 687 B13R1.153 C=CCCC(=O)CCC1CCCO1 1458a_100011247709_100000754431 [0,1,0,0,0,0|1,0,1]=3 688 B13R1.153 C=CCCC(=O)CCC1OCCO1 1458a_100000082924_100000754431 [0,1,0,0,0,0|2,0,1]=4 689 B13R1.153 C=CCCC(=O)CCC1OCCO1 1458a_100000749702_100000740749 [0,1,0,0,0,0|2,0,1]=4 690 B13R1.153 C=CCCC(=O)CCN1CCCO1 1458a_200015187630_100000754431 [0,1,0,0,0,0|2,0,1]=4 691 B13R1.153 C=CCCC(=O)NCC1CCCC1 11a_100000737975_100000749702 [0,1,0,0,0,0|2,0,1]=4 692 B13R1.153 C=CCCC(=O)NCC1CCCC1 1626a_100000737975_100000749702 [0,1,0,0,0,0|2,0,1]=4 693 B13R1.153 C=CCCC(=O)NCC1CCCC1 240690a_100000737975_100000749702 [0,1,0,0,0,0|2,0,1]=4 694 B13R1.153 C=CCCC(=O)NCC1CCCC1 527a_100000737975_100000749702 [0,1,0,0,0,0|2,0,1]=4 695 B13R1.153 C=CCCC(=O)NCC1OCCO1 11a_100000036311_100000749702 [0,1,0,0,0,0|2,0,1]=4 696 B13R1.153 C=CCCC(=O)NCC1OCCO1 1626a_100000036311_100000749702 [0,1,0,0,0,0|2,0,1]=4 697 B13R1.153 C=CCCC(=O)NCC1OCCO1 527a_100000036311_100000749702 [0,1,0,0,0,0|2,0,1]=4 698 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000749702 [0,1,0,0,0,0|1,0,1]=3 699 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000749702 [0,1,0,0,0,0|1,0,1]=3 700 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000749702 [0,1,0,0,0,0|1,0,1]=3 701 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000749702 [0,1,0,0,0,0|1,0,1]=3 702 B13R1.153 C=CCCC(C)OCC1CCCO1 7a_100000765329_100000203698 [0,1,0,0,0,0|1,0,2]=4 703 B13R1.153 C=CCNC(=O)CCC1CCCO1 1626a_100020586998_100011247709 [0,1,0,0,0,0|1,0,2]=4 704 B13R1.153 C=CCNC(=O)CCC1CCCO1 240690a_100020586998_100011247709 [0,1,0,0,0,0|1,0,2]=4 705 B13R1.153 C=CCNC(=O)CCC1CCCO1 527a_100020586998_100011247709 [0,1,0,0,0,0|1,0,2]=4 706 B13R1.153 C=CCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100020586998 [0,1,0,0,0,0|1,0,2]=4 707 B13R1.153 C=CCNC(=O)NC[C@@H]1CCCO1 273464a_100020586998_100020590478 [0,1,0,0,0,0|1,0,2]=4 708 B13R1.153 C=CCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100020586998 [0,1,0,0,0,0|1,0,2]=4 709 B13R1.153 C=CCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100020586998 [0,1,0,0,0,0|1,0,2]=4 710 B13R1.153 CC#CCC(=O)CCC1CCCC1 1458a_100000211120_100000748600 [0,1,0,0,0,0|2,0,1]=4 711 B13R1.153 CC#CCC(=O)CCC1CCCO1 1458a_100011247709_100000748600 [0,1,0,0,0,0|1,0,1]=3 712 B13R1.153 CC#CCC(=O)CCC1OCCO1 1458a_100000082924_100000748600 [0,1,0,0,0,0|2,0,1]=4 713 B13R1.153 CC#CCC(=O)CCN1CCCO1 1458a_200015187630_100000748600 [0,1,0,0,0,0|2,0,1]=4 714 B13R1.153 CC(CCCCl)OCC1CCCC1 34a_200000718107_100000740388 [0,1,0,0,0,0|2,0,1]=4 715 B13R1.153 CC(CCCCl)OCC1CCCC1 7a_200000718107_100000740388 [0,1,0,0,0,0|2,0,1]=4 716 B13R1.153 CC(CCCCl)OCC1CCCO1 7a_200000718107_100000203698 [0,1,0,0,0,0|1,0,1]=3 717 B13R1.153 CC(CCCCl)OCC1OCCO1 34a_200000718107_100000755774 [0,1,0,0,0,0|2,0,1]=4 718 B13R1.153 CC(CCCCl)OCC1OCCO1 7a_200000718107_100000755774 [0,1,0,0,0,0|2,0,1]=4 719 B13R1.153 CC=CCC(=O)CCC1CCCC1 1458a_100000211120_100000070051 [0,1,0,0,0,0|2,0,1]=4 720 B13R1.153 CC=CCC(=O)CCC1CCCC1 1458a_100121576822_100000760354 [0,1,0,0,0,0|2,0,1]=4 721 B13R1.153 CC=CCC(=O)CCC1CCCO1 1458a_100011247709_100000070051 [0,1,0,0,0,0|1,0,1]=3 722 B13R1.153 CC=CCC(=O)CCC1OCCO1 1458a_100000082924_100000070051 [0,1,0,0,0,0|2,0,1]=4 723 B13R1.153 CC=CCC(=O)CCC1OCCO1 1458a_100121576822_100000740749 [0,1,0,0,0,0|2,0,1]=4 724 B13R1.153 CC=CCC(=O)CCN1CCCO1 1458a_200015187630_100000070051 [0,1,0,0,0,0|2,0,1]=4 725 B13R1.153 CC=CCC(=O)NCC1CCCC1 11a_100000737975_100121576822 [0,1,0,0,0,0|2,0,1]=4 726 B13R1.153 CC=CCC(=O)NCC1CCCC1 1626a_100000737975_100121576822 [0,1,0,0,0,0|2,0,1]=4 727 B13R1.153 CC=CCC(=O)NCC1CCCC1 240690a_100000737975_100121576822 [0,1,0,0,0,0|2,0,1]=4 728 B13R1.153 CC=CCC(=O)NCC1CCCC1 527a_100000737975_100121576822 [0,1,0,0,0,0|2,0,1]=4 729 B13R1.153 CC=CCC(=O)NCC1OCCO1 11a_100000036311_100121576822 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.153 CC=CCC(=O)NCC1OCCO1 1626a_100000036311_100121576822 [0,1,0,0,0,0|2,0,1]=4 731 B13R1.153 CC=CCC(=O)NCC1OCCO1 527a_100000036311_100121576822 [0,1,0,0,0,0|2,0,1]=4 732 B13R1.153 CC=CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100121576822 [0,1,0,0,0,0|1,0,1]=3 733 B13R1.153 CC=CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100121576822 [0,1,0,0,0,0|1,0,1]=3 734 B13R1.153 CC=CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100121576822 [0,1,0,0,0,0|1,0,1]=3 735 B13R1.153 CC=CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100121576822 [0,1,0,0,0,0|1,0,1]=3 736 B13R1.153 CCC#CC(=O)CCC1CCCC1 1458a_100011827653_100000760354 [0,1,0,0,0,0|2,0,1]=4 737 B13R1.153 CCC#CC(=O)CCC1OCCO1 1458a_100011827653_100000740749 [0,1,0,0,0,0|2,0,1]=4 738 B13R1.153 CCC#CC(C)OCC1CCCO1 7a_100000033903_100000203698 [0,1,0,0,0,0|1,0,2]=4 739 B13R1.153 CCC=CC(=O)CCC1CCCC1 1458a_100000212282_100000760354 [0,1,0,0,0,0|2,0,1]=4 740 B13R1.153 CCC=CC(=O)CCC1OCCO1 1458a_100000212282_100000740749 [0,1,0,0,0,0|2,0,1]=4 741 B13R1.153 CCC=CC(=O)NCC1CCCC1 11a_100000737975_100000212282 [0,1,0,0,0,0|2,0,1]=4 742 B13R1.153 CCC=CC(=O)NCC1CCCC1 1626a_100000737975_100000212282 [0,1,0,0,0,0|2,0,1]=4 743 B13R1.153 CCC=CC(=O)NCC1CCCC1 240690a_100000737975_100000212282 [0,1,0,0,0,0|2,0,1]=4 744 B13R1.153 CCC=CC(=O)NCC1OCCO1 11a_100000036311_100000212282 [0,1,0,0,0,0|2,0,1]=4 745 B13R1.153 CCC=CC(=O)NCC1OCCO1 1626a_100000036311_100000212282 [0,1,0,0,0,0|2,0,1]=4 746 B13R1.153 CCC=CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000212282 [0,1,0,0,0,0|1,0,1]=3 747 B13R1.153 CCC=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000212282 [0,1,0,0,0,0|1,0,1]=3 748 B13R1.153 CCC=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000212282 [0,1,0,0,0,0|1,0,1]=3 749 B13R1.153 CCCCC(=O)CCC1CCCC1 1458a_100000210183_100000760354 [0,1,0,0,0,0|2,0,0]=3 750 B13R1.153 CCCCC(=O)CCC1CCCC1 1458a_100000211120_100000210211 [0,1,0,0,0,0|2,0,0]=3 751 B13R1.153 CCCCC(=O)CCC1CCCO1 1458a_100011247709_100000210211 [0,1,0,0,0,0|1,0,0]=2 752 B13R1.153 CCCCC(=O)CCC1OCCO1 1458a_100000082924_100000210211 [0,1,0,0,0,0|2,0,0]=3 753 B13R1.153 CCCCC(=O)CCC1OCCO1 1458a_100000210183_100000740749 [0,1,0,0,0,0|2,0,0]=3 754 B13R1.153 CCCCC(=O)CCN1CCCC1 1458a_100000210183_100000004467 [0,1,0,0,0,0|3,0,0]=4 755 B13R1.153 CCCCC(=O)CCN1CCCC1 1458a_100000738983_100000210211 [0,1,0,0,0,0|3,0,0]=4 756 B13R1.153 CCCCC(=O)CCN1CCCO1 1458a_200015187630_100000210211 [0,1,0,0,0,0|2,0,0]=3 757 B13R1.153 CCCCC(=O)COC1CCCC1 1458a_100000741352_100000210211 [0,1,0,0,0,0|3,0,0]=4 758 B13R1.153 CCCCC(=O)NCC1CCCC1 11a_100000737975_100000210183 [0,1,0,0,0,0|2,0,0]=3 759 B13R1.153 CCCCC(=O)NCC1CCCC1 1626a_100000737975_100000210183 [0,1,0,0,0,0|2,0,0]=3 760 B13R1.153 CCCCC(=O)NCC1CCCC1 240690a_100000737975_100000210183 [0,1,0,0,0,0|2,0,0]=3 761 B13R1.153 CCCCC(=O)NCC1CCCC1 527a_100000737975_100000210183 [0,1,0,0,0,0|2,0,0]=3 762 B13R1.153 CCCCC(=O)NCC1CCOC1 11a_100000737293_100000210183 [0,1,0,0,0,0|3,0,0]=4 763 B13R1.153 CCCCC(=O)NCC1CCOC1 1626a_100000737293_100000210183 [0,1,0,0,0,0|3,0,0]=4 764 B13R1.153 CCCCC(=O)NCC1CCOC1 240690a_100000737293_100000210183 [0,1,0,0,0,0|3,0,0]=4 765 B13R1.153 CCCCC(=O)NCC1CCOC1 527a_100000737293_100000210183 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.153 CCCCC(=O)NCC1OCCO1 11a_100000036311_100000210183 [0,1,0,0,0,0|2,0,0]=3 767 B13R1.153 CCCCC(=O)NCC1OCCO1 1626a_100000036311_100000210183 [0,1,0,0,0,0|2,0,0]=3 768 B13R1.153 CCCCC(=O)NCC1OCCO1 527a_100000036311_100000210183 [0,1,0,0,0,0|2,0,0]=3 769 B13R1.153 CCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210183 [0,1,0,0,0,0|1,0,0]=2 770 B13R1.153 CCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210183 [0,1,0,0,0,0|1,0,0]=2 771 B13R1.153 CCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210183 [0,1,0,0,0,0|1,0,0]=2 772 B13R1.153 CCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210183 [0,1,0,0,0,0|1,0,0]=2 773 B13R1.153 CCCCC(=O)NNC1CCCC1 22a_100000737850_100000210183 [0,1,0,0,0,0|3,0,0]=4 774 B13R1.153 CCCCC(C)NCC1CCCO1 2230a_100000126638_100000203698 [0,1,0,0,0,0|2,0,1]=4 775 B13R1.153 CCCCC(C)NC[C@@H]1CCCO1 2230a_100020590478_200011215066 [0,1,0,0,0,0|2,0,1]=4 776 B13R1.153 CCCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000210087 [0,1,0,0,0,0|2,0,1]=4 777 B13R1.153 CCCCC(C)NC[C@@H]1CCCO1 34a_100020590478_200011215066 [0,1,0,0,0,0|2,0,1]=4 778 B13R1.153 CCCCC(C)OCC1CCCC1 34a_100000687866_100000740388 [0,1,0,0,0,0|2,0,1]=4 779 B13R1.153 CCCCC(C)OCC1CCCC1 34a_100000742336_200011215066 [0,1,0,0,0,0|2,0,1]=4 780 B13R1.153 CCCCC(C)OCC1CCCC1 7a_100000687866_100000740388 [0,1,0,0,0,0|2,0,1]=4 781 B13R1.153 CCCCC(C)OCC1CCCC1 7a_100000742336_200011215066 [0,1,0,0,0,0|2,0,1]=4 782 B13R1.153 CCCCC(C)OCC1CCCO1 34a_100000210270_200011215066 [0,1,0,0,0,0|1,0,1]=3 783 B13R1.153 CCCCC(C)OCC1CCCO1 7a_100000210270_200011215066 [0,1,0,0,0,0|1,0,1]=3 784 B13R1.153 CCCCC(C)OCC1CCCO1 7a_100000687866_100000203698 [0,1,0,0,0,0|1,0,1]=3 785 B13R1.153 CCCCC(C)OCC1COCO1 34a_100011216627_200011215066 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.153 CCCCC(C)OCC1OCCO1 34a_100000087154_200011215066 [0,1,0,0,0,0|2,0,1]=4 787 B13R1.153 CCCCC(C)OCC1OCCO1 34a_100000687866_100000755774 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.153 CCCCC(C)OCC1OCCO1 7a_100000687866_100000755774 [0,1,0,0,0,0|2,0,1]=4 789 B13R1.153 CCCCC(C)OC[C@H]1CCCN1 34a_100000745186_200011215066 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.153 CCCCC(C)SCC1CCCO1 62a_100000203698_200011215066 [0,1,0,0,0,0|1,1,1]=4 791 B13R1.153 CCCCC(C)SCC1CCCO1 62a_200011215066_100000203698 [0,1,0,0,0,0|1,1,1]=4 792 B13R1.153 CCCNC(=O)CCC1CCCC1 11a_100020643023_100000211120 [0,1,0,0,0,0|2,0,0]=3 793 B13R1.153 CCCNC(=O)CCC1CCCC1 1626a_100020643023_100000211120 [0,1,0,0,0,0|2,0,0]=3 794 B13R1.153 CCCNC(=O)CCC1CCCC1 240690a_100020643023_100000211120 [0,1,0,0,0,0|2,0,0]=3 795 B13R1.153 CCCNC(=O)CCC1CCCC1 527a_100020643023_100000211120 [0,1,0,0,0,0|2,0,0]=3 796 B13R1.153 CCCNC(=O)CCC1CCCO1 11a_100020643023_100011247709 [0,1,0,0,0,0|1,0,0]=2 797 B13R1.153 CCCNC(=O)CCC1CCCO1 1626a_100020643023_100011247709 [0,1,0,0,0,0|1,0,0]=2 798 B13R1.153 CCCNC(=O)CCC1CCCO1 240690a_100020643023_100011247709 [0,1,0,0,0,0|1,0,0]=2 799 B13R1.153 CCCNC(=O)CCC1CCCO1 527a_100020643023_100011247709 [0,1,0,0,0,0|1,0,0]=2 800 B13R1.153 CCCNC(=O)CCN1CCCC1 240690a_100020643023_100000738983 [0,1,0,0,0,0|3,0,0]=4 801 B13R1.153 CCCNC(=O)CCN1CCCO1 240690a_100020643023_200015187630 [0,1,0,0,0,0|2,0,0]=3 802 B13R1.153 CCCNC(=O)CNC1CCCC1 2230a_100000174927_100000179811 [0,1,0,0,0,0|3,0,0]=4 803 B13R1.153 CCCNC(=O)CNC1CCCC1 2230a_100000211070_100000183358 [0,1,0,0,0,0|3,0,0]=4 804 B13R1.153 CCCNC(=O)CNC1CCCC1 270004a_100000174927_100000210133 [0,1,0,0,0,0|3,0,0]=4 805 B13R1.153 CCCNC(=O)CNC1CCCC1 34a_100000211070_100000183358 [0,1,0,0,0,0|3,0,0]=4 806 B13R1.153 CCCNC(=O)COC1CCCC1 11a_100020643023_100000741352 [0,1,0,0,0,0|3,0,0]=4 807 B13R1.153 CCCNC(=O)COC1CCCC1 1626a_100020643023_100000741352 [0,1,0,0,0,0|3,0,0]=4 808 B13R1.153 CCCNC(=O)COC1CCCC1 240690a_100020643023_100000741352 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.153 CCCNC(=O)COC1CCCC1 34a_100000210269_100000183358 [0,1,0,0,0,0|3,0,0]=4 810 B13R1.153 CCCNC(=O)COC1CCCC1 527a_100020643023_100000741352 [0,1,0,0,0,0|3,0,0]=4 811 B13R1.153 CCCNC(=O)COC1CCCC1 7a_100000210269_100000183358 [0,1,0,0,0,0|3,0,0]=4 812 B13R1.153 CCCNC(=O)COC1CCCO1 34a_100000085407_100000183358 [0,1,0,0,0,0|2,0,0]=3 813 B13R1.153 CCCNC(=O)CSC1CCCC1 62a_100000183358_100000179811 [0,1,0,0,0,0|3,0,0]=4 814 B13R1.153 CCCNC(=O)CSC1CCCC1 62a_100011217020_100000183358 [0,1,0,0,0,0|3,0,0]=4 815 B13R1.153 CCCNC(=O)NCC1CCCC1 2708a_100000737975_100020643023 [0,1,0,0,0,0|2,0,0]=3 816 B13R1.153 CCCNC(=O)NCC1CCCC1 2708a_100020643023_100000737975 [0,1,0,0,0,0|2,0,0]=3 817 B13R1.153 CCCNC(=O)NCC1CCCC1 273464a_100000737975_100020643023 [0,1,0,0,0,0|2,0,0]=3 818 B13R1.153 CCCNC(=O)NCC1CCCC1 273464a_100020643023_100000737975 [0,1,0,0,0,0|2,0,0]=3 819 B13R1.153 CCCNC(=O)NCC1CCCC1 512a_100000737975_100020643023 [0,1,0,0,0,0|2,0,0]=3 820 B13R1.153 CCCNC(=O)NCC1CCCC1 512a_100020643023_100000737975 [0,1,0,0,0,0|2,0,0]=3 821 B13R1.153 CCCNC(=O)NCC1CCOC1 2708a_100000737293_100020643023 [0,1,0,0,0,0|3,0,0]=4 822 B13R1.153 CCCNC(=O)NCC1CCOC1 2708a_100020643023_100000737293 [0,1,0,0,0,0|3,0,0]=4 823 B13R1.153 CCCNC(=O)NCC1CCOC1 273464a_100000737293_100020643023 [0,1,0,0,0,0|3,0,0]=4 824 B13R1.153 CCCNC(=O)NCC1CCOC1 273464a_100020643023_100000737293 [0,1,0,0,0,0|3,0,0]=4 825 B13R1.153 CCCNC(=O)NCC1CCOC1 512a_100000737293_100020643023 [0,1,0,0,0,0|3,0,0]=4 826 B13R1.153 CCCNC(=O)NCC1CCOC1 512a_100020643023_100000737293 [0,1,0,0,0,0|3,0,0]=4 827 B13R1.153 CCCNC(=O)NCC1OCCO1 2708a_100000036311_100020643023 [0,1,0,0,0,0|2,0,0]=3 828 B13R1.153 CCCNC(=O)NCC1OCCO1 2708a_100020643023_100000036311 [0,1,0,0,0,0|2,0,0]=3 829 B13R1.153 CCCNC(=O)NCC1OCCO1 273464a_100000036311_100020643023 [0,1,0,0,0,0|2,0,0]=3 830 B13R1.153 CCCNC(=O)NCC1OCCO1 273464a_100020643023_100000036311 [0,1,0,0,0,0|2,0,0]=3 831 B13R1.153 CCCNC(=O)NCC1OCCO1 512a_100000036311_100020643023 [0,1,0,0,0,0|2,0,0]=3 832 B13R1.153 CCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100020643023 [0,1,0,0,0,0|1,0,0]=2 833 B13R1.153 CCCNC(=O)NC[C@@H]1CCCO1 2708a_100020643023_100020590478 [0,1,0,0,0,0|1,0,0]=2 834 B13R1.153 CCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100020643023 [0,1,0,0,0,0|1,0,0]=2 835 B13R1.153 CCCNC(=O)NC[C@@H]1CCCO1 273464a_100020643023_100020590478 [0,1,0,0,0,0|1,0,0]=2 836 B13R1.153 CCCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100020643023 [0,1,0,0,0,0|1,0,0]=2 837 B13R1.153 CCCNC(=O)NNC1CCCC1 273464a_100020643023_100000737850 [0,1,0,0,0,0|3,0,0]=4 838 B13R1.153 CCCNC(=O)NNC1CCCC1 512a_100020643023_100000737850 [0,1,0,0,0,0|3,0,0]=4 839 B13R1.153 CCCOC(=O)CNC1CCCC1 2230a_100000211070_200011215008 [0,1,0,0,0,0|3,0,0]=4 840 B13R1.153 CCCOC(=O)CNC1CCCC1 34a_100000211070_200011215008 [0,1,0,0,0,0|3,0,0]=4 841 B13R1.153 CCCOC(=O)COC1CCCC1 34a_100000210269_200011215008 [0,1,0,0,0,0|3,0,0]=4 842 B13R1.153 CCCOC(=O)COC1CCCC1 7a_100000210269_200011215008 [0,1,0,0,0,0|3,0,0]=4 843 B13R1.153 CCCOC(=O)COC1CCCO1 34a_100000085407_200011215008 [0,1,0,0,0,0|2,0,0]=3 844 B13R1.153 CCCOC(=O)CSC1CCCC1 62a_100011217020_200011215008 [0,1,0,0,0,0|3,0,0]=4 845 B13R1.153 CCCOC(=O)CSC1CCCC1 62a_200011215008_100000179811 [0,1,0,0,0,0|3,0,0]=4 846 B13R1.153 CCCOC(=O)OCN1CCCC1 269982a_100000188435_200000139673 [0,1,0,0,0,0|2,0,0]=3 847 B13R1.153 CCCOC(=O)OCN1CCSC1 269982a_100011215254_200000139673 [0,1,0,0,0,0|3,0,0]=4 848 B13R1.153 CCNCC(=O)NCC1CCCO1 2230a_100015525214_100000182893 [0,1,0,0,0,0|1,0,0]=2 849 B13R1.153 CCNNC(=O)CCC1CCCC1 22a_100000756455_100000211120 [0,1,0,0,0,0|3,0,0]=4 850 B13R1.153 CCNNC(=O)CCC1CCCO1 22a_100000756455_100011247709 [0,1,0,0,0,0|2,0,0]=3 851 B13R1.153 CCNNC(=O)CCC1OCCO1 22a_100000756455_100000082924 [0,1,0,0,0,0|3,0,0]=4 852 B13R1.153 CCNNC(=O)NCC1CCCC1 273464a_100000737975_100000756455 [0,1,0,0,0,0|3,0,0]=4 853 B13R1.153 CCNNC(=O)NCC1CCCC1 512a_100000737975_100000756455 [0,1,0,0,0,0|3,0,0]=4 854 B13R1.153 CCNNC(=O)NCC1CCCC1 512a_100000756455_100000737975 [0,1,0,0,0,0|3,0,0]=4 855 B13R1.153 CCNNC(=O)NCC1OCCO1 273464a_100000036311_100000756455 [0,1,0,0,0,0|3,0,0]=4 856 B13R1.153 CCNNC(=O)NCC1OCCO1 512a_100000036311_100000756455 [0,1,0,0,0,0|3,0,0]=4 857 B13R1.153 CCNNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000756455 [0,1,0,0,0,0|2,0,0]=3 858 B13R1.153 CCNNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000756455 [0,1,0,0,0,0|2,0,0]=3 859 B13R1.153 CCOCC(=O)CCC1CCCC1 1458a_100000211967_100000760354 [0,1,0,0,0,0|2,0,0]=3 860 B13R1.153 CCOCC(=O)CCC1OCCO1 1458a_100000211967_100000740749 [0,1,0,0,0,0|2,0,0]=3 861 B13R1.153 CCOCC(=O)CCN1CCCC1 1458a_100000211967_100000004467 [0,1,0,0,0,0|3,0,0]=4 862 B13R1.153 CCOCC(=O)NCC1CCCC1 11a_100000737975_100000211967 [0,1,0,0,0,0|2,0,0]=3 863 B13R1.153 CCOCC(=O)NCC1CCCC1 1626a_100000737975_100000211967 [0,1,0,0,0,0|2,0,0]=3 864 B13R1.153 CCOCC(=O)NCC1CCCC1 240690a_100000737975_100000211967 [0,1,0,0,0,0|2,0,0]=3 865 B13R1.153 CCOCC(=O)NCC1CCCC1 527a_100000737975_100000211967 [0,1,0,0,0,0|2,0,0]=3 866 B13R1.153 CCOCC(=O)NCC1CCOC1 11a_100000737293_100000211967 [0,1,0,0,0,0|3,0,0]=4 867 B13R1.153 CCOCC(=O)NCC1CCOC1 1626a_100000737293_100000211967 [0,1,0,0,0,0|3,0,0]=4 868 B13R1.153 CCOCC(=O)NCC1CCOC1 240690a_100000737293_100000211967 [0,1,0,0,0,0|3,0,0]=4 869 B13R1.153 CCOCC(=O)NCC1CCOC1 527a_100000737293_100000211967 [0,1,0,0,0,0|3,0,0]=4 870 B13R1.153 CCOCC(=O)NCC1OCCO1 11a_100000036311_100000211967 [0,1,0,0,0,0|2,0,0]=3 871 B13R1.153 CCOCC(=O)NCC1OCCO1 1626a_100000036311_100000211967 [0,1,0,0,0,0|2,0,0]=3 872 B13R1.153 CCOCC(=O)NCC1OCCO1 527a_100000036311_100000211967 [0,1,0,0,0,0|2,0,0]=3 873 B13R1.153 CCOCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000211967 [0,1,0,0,0,0|1,0,0]=2 874 B13R1.153 CCOCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000211967 [0,1,0,0,0,0|1,0,0]=2 875 B13R1.153 CCOCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000211967 [0,1,0,0,0,0|1,0,0]=2 876 B13R1.153 CCOCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000211967 [0,1,0,0,0,0|1,0,0]=2 877 B13R1.153 CCOCC(=O)NNC1CCCC1 22a_100000737850_100000211967 [0,1,0,0,0,0|3,0,0]=4 878 B13R1.153 CCOCC(C)OCC1CCCC1 34a_100000718985_100000740388 [0,1,0,0,0,0|2,0,1]=4 879 B13R1.153 CCOCC(C)OCC1CCCC1 7a_100000718985_100000740388 [0,1,0,0,0,0|2,0,1]=4 880 B13R1.153 CCOCC(C)OCC1CCCO1 7a_100000718985_100000203698 [0,1,0,0,0,0|1,0,1]=3 881 B13R1.153 CCOCC(C)OCC1OCCO1 34a_100000718985_100000755774 [0,1,0,0,0,0|2,0,1]=4 882 B13R1.153 CCOCC(C)OCC1OCCO1 7a_100000718985_100000755774 [0,1,0,0,0,0|2,0,1]=4 883 B13R1.153 CCSCC(=O)CCC1CCCC1 1458a_100000230394_100000760354 [0,1,0,0,0,0|2,0,0]=3 884 B13R1.153 CCSCC(=O)CCC1OCCO1 1458a_100000230394_100000740749 [0,1,0,0,0,0|2,0,0]=3 885 B13R1.153 CCSCC(=O)CCN1CCCC1 1458a_100000230394_100000004467 [0,1,0,0,0,0|3,0,0]=4 886 B13R1.153 CCSCC(=O)NCC1CCCC1 11a_100000737975_100000230394 [0,1,0,0,0,0|2,0,0]=3 887 B13R1.153 CCSCC(=O)NCC1CCCC1 1626a_100000737975_100000230394 [0,1,0,0,0,0|2,0,0]=3 888 B13R1.153 CCSCC(=O)NCC1CCCC1 240690a_100000737975_100000230394 [0,1,0,0,0,0|2,0,0]=3 889 B13R1.153 CCSCC(=O)NCC1CCCC1 527a_100000737975_100000230394 [0,1,0,0,0,0|2,0,0]=3 890 B13R1.153 CCSCC(=O)NCC1CCCO1 62a_100000182893_100000210202 [0,1,0,0,0,0|1,0,0]=2 891 B13R1.153 CCSCC(=O)NCC1CCCO1 62a_100000210202_100000182893 [0,1,0,0,0,0|1,0,0]=2 892 B13R1.153 CCSCC(=O)NCC1CCOC1 11a_100000737293_100000230394 [0,1,0,0,0,0|3,0,0]=4 893 B13R1.153 CCSCC(=O)NCC1CCOC1 1626a_100000737293_100000230394 [0,1,0,0,0,0|3,0,0]=4 894 B13R1.153 CCSCC(=O)NCC1CCOC1 240690a_100000737293_100000230394 [0,1,0,0,0,0|3,0,0]=4 895 B13R1.153 CCSCC(=O)NCC1CCOC1 527a_100000737293_100000230394 [0,1,0,0,0,0|3,0,0]=4 896 B13R1.153 CCSCC(=O)NCC1OCCO1 11a_100000036311_100000230394 [0,1,0,0,0,0|2,0,0]=3 897 B13R1.153 CCSCC(=O)NCC1OCCO1 1626a_100000036311_100000230394 [0,1,0,0,0,0|2,0,0]=3 898 B13R1.153 CCSCC(=O)NCC1OCCO1 527a_100000036311_100000230394 [0,1,0,0,0,0|2,0,0]=3 899 B13R1.153 CCSCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000230394 [0,1,0,0,0,0|1,0,0]=2 900 B13R1.153 CCSCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000230394 [0,1,0,0,0,0|1,0,0]=2 901 B13R1.153 CCSCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000230394 [0,1,0,0,0,0|1,0,0]=2 902 B13R1.153 CCSCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000230394 [0,1,0,0,0,0|1,0,0]=2 903 B13R1.153 CCSCC(=O)NNC1CCCC1 22a_100000737850_100000230394 [0,1,0,0,0,0|3,0,0]=4 904 B13R1.153 CCSCC(C)NC[C@@H]1CCCO1 270004a_100020590478_200011216171 [0,1,0,0,0,0|2,0,1]=4 905 B13R1.153 COC=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100016268678 [0,1,0,0,0,0|1,0,2]=4 906 B13R1.153 COC=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100016268678 [0,1,0,0,0,0|1,0,2]=4 907 B13R1.153 COCCC(=O)CCC1CCCC1 1458a_100000211120_100000233755 [0,1,0,0,0,0|2,0,0]=3 908 B13R1.153 COCCC(=O)CCC1CCCC1 1458a_100000749529_100000760354 [0,1,0,0,0,0|2,0,0]=3 909 B13R1.153 COCCC(=O)CCC1CCCO1 1458a_100011247709_100000233755 [0,1,0,0,0,0|1,0,0]=2 910 B13R1.153 COCCC(=O)CCC1OCCO1 1458a_100000082924_100000233755 [0,1,0,0,0,0|2,0,0]=3 911 B13R1.153 COCCC(=O)CCC1OCCO1 1458a_100000749529_100000740749 [0,1,0,0,0,0|2,0,0]=3 912 B13R1.153 COCCC(=O)CCN1CCCC1 1458a_100000738983_100000233755 [0,1,0,0,0,0|3,0,0]=4 913 B13R1.153 COCCC(=O)CCN1CCCC1 1458a_100000749529_100000004467 [0,1,0,0,0,0|3,0,0]=4 914 B13R1.153 COCCC(=O)CCN1CCCO1 1458a_200015187630_100000233755 [0,1,0,0,0,0|2,0,0]=3 915 B13R1.153 COCCC(=O)COC1CCCC1 1458a_100000741352_100000233755 [0,1,0,0,0,0|3,0,0]=4 916 B13R1.153 COCCC(=O)NCC1CCCC1 11a_100000737975_100000749529 [0,1,0,0,0,0|2,0,0]=3 917 B13R1.153 COCCC(=O)NCC1CCCC1 1626a_100000737975_100000749529 [0,1,0,0,0,0|2,0,0]=3 918 B13R1.153 COCCC(=O)NCC1CCCC1 240690a_100000737975_100000749529 [0,1,0,0,0,0|2,0,0]=3 919 B13R1.153 COCCC(=O)NCC1CCCC1 527a_100000737975_100000749529 [0,1,0,0,0,0|2,0,0]=3 920 B13R1.153 COCCC(=O)NCC1CCOC1 11a_100000737293_100000749529 [0,1,0,0,0,0|3,0,0]=4 921 B13R1.153 COCCC(=O)NCC1CCOC1 1626a_100000737293_100000749529 [0,1,0,0,0,0|3,0,0]=4 922 B13R1.153 COCCC(=O)NCC1CCOC1 240690a_100000737293_100000749529 [0,1,0,0,0,0|3,0,0]=4 923 B13R1.153 COCCC(=O)NCC1CCOC1 527a_100000737293_100000749529 [0,1,0,0,0,0|3,0,0]=4 924 B13R1.153 COCCC(=O)NCC1OCCO1 11a_100000036311_100000749529 [0,1,0,0,0,0|2,0,0]=3 925 B13R1.153 COCCC(=O)NCC1OCCO1 1626a_100000036311_100000749529 [0,1,0,0,0,0|2,0,0]=3 926 B13R1.153 COCCC(=O)NCC1OCCO1 527a_100000036311_100000749529 [0,1,0,0,0,0|2,0,0]=3 927 B13R1.153 COCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000749529 [0,1,0,0,0,0|1,0,0]=2 928 B13R1.153 COCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000749529 [0,1,0,0,0,0|1,0,0]=2 929 B13R1.153 COCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000749529 [0,1,0,0,0,0|1,0,0]=2 930 B13R1.153 COCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000749529 [0,1,0,0,0,0|1,0,0]=2 931 B13R1.153 COCCC(=O)NNC1CCCC1 22a_100000737850_100000749529 [0,1,0,0,0,0|3,0,0]=4 932 B13R1.153 COCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000742357 [0,1,0,0,0,0|2,0,1]=4 933 B13R1.153 CSCCC(=O)CCC1CCCC1 1458a_100000174002_100000760354 [0,1,0,0,0,0|2,0,0]=3 934 B13R1.153 CSCCC(=O)CCC1CCCC1 1458a_100000211120_100000751147 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.153 CSCCC(=O)CCC1CCCO1 1458a_100011247709_100000751147 [0,1,0,0,0,0|1,0,0]=2 936 B13R1.153 CSCCC(=O)CCC1OCCO1 1458a_100000082924_100000751147 [0,1,0,0,0,0|2,0,0]=3 937 B13R1.153 CSCCC(=O)CCC1OCCO1 1458a_100000174002_100000740749 [0,1,0,0,0,0|2,0,0]=3 938 B13R1.153 CSCCC(=O)CCN1CCCC1 1458a_100000174002_100000004467 [0,1,0,0,0,0|3,0,0]=4 939 B13R1.153 CSCCC(=O)CCN1CCCC1 1458a_100000738983_100000751147 [0,1,0,0,0,0|3,0,0]=4 940 B13R1.153 CSCCC(=O)CCN1CCCO1 1458a_200015187630_100000751147 [0,1,0,0,0,0|2,0,0]=3 941 B13R1.153 CSCCC(=O)COC1CCCC1 1458a_100000741352_100000751147 [0,1,0,0,0,0|3,0,0]=4 942 B13R1.153 CSCCC(=O)NCC1CCCC1 11a_100000737975_100000174002 [0,1,0,0,0,0|2,0,0]=3 943 B13R1.153 CSCCC(=O)NCC1CCCC1 1626a_100000737975_100000174002 [0,1,0,0,0,0|2,0,0]=3 944 B13R1.153 CSCCC(=O)NCC1CCCC1 240690a_100000737975_100000174002 [0,1,0,0,0,0|2,0,0]=3 945 B13R1.153 CSCCC(=O)NCC1CCCC1 527a_100000737975_100000174002 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.153 CSCCC(=O)NCC1CCOC1 11a_100000737293_100000174002 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.153 CSCCC(=O)NCC1CCOC1 1626a_100000737293_100000174002 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.153 CSCCC(=O)NCC1CCOC1 240690a_100000737293_100000174002 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.153 CSCCC(=O)NCC1CCOC1 527a_100000737293_100000174002 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.153 CSCCC(=O)NCC1OCCO1 11a_100000036311_100000174002 [0,1,0,0,0,0|2,0,0]=3 951 B13R1.153 CSCCC(=O)NCC1OCCO1 1626a_100000036311_100000174002 [0,1,0,0,0,0|2,0,0]=3 952 B13R1.153 CSCCC(=O)NCC1OCCO1 527a_100000036311_100000174002 [0,1,0,0,0,0|2,0,0]=3 953 B13R1.153 CSCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000174002 [0,1,0,0,0,0|1,0,0]=2 954 B13R1.153 CSCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000174002 [0,1,0,0,0,0|1,0,0]=2 955 B13R1.153 CSCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000174002 [0,1,0,0,0,0|1,0,0]=2 956 B13R1.153 CSCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000174002 [0,1,0,0,0,0|1,0,0]=2 957 B13R1.153 CSCCC(=O)NNC1CCCC1 22a_100000737850_100000174002 [0,1,0,0,0,0|3,0,0]=4 958 B13R1.153 CSCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100011217047 [0,1,0,0,0,0|2,0,1]=4 959 B13R1.153 N#CCCC(=O)CCC1CCCC1 1458a_100000211120_100011215226 [0,1,0,0,0,0|2,0,1]=4 960 B13R1.153 N#CCCC(=O)CCC1CCCC1 1458a_100011934036_100000760354 [0,1,0,0,0,0|2,0,1]=4 961 B13R1.153 N#CCCC(=O)CCC1CCCO1 1458a_100011247709_100011215226 [0,1,0,0,0,0|1,0,1]=3 962 B13R1.153 N#CCCC(=O)CCC1OCCO1 1458a_100000082924_100011215226 [0,1,0,0,0,0|2,0,1]=4 963 B13R1.153 N#CCCC(=O)CCC1OCCO1 1458a_100011934036_100000740749 [0,1,0,0,0,0|2,0,1]=4 964 B13R1.153 N#CCCC(=O)CCN1CCCO1 1458a_200015187630_100011215226 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.153 N#CCCC(=O)NCC1CCCC1 11a_100000737975_100011934036 [0,1,0,0,0,0|2,0,1]=4 966 B13R1.153 N#CCCC(=O)NCC1CCCC1 1626a_100000737975_100011934036 [0,1,0,0,0,0|2,0,1]=4 967 B13R1.153 N#CCCC(=O)NCC1CCCC1 240690a_100000737975_100011934036 [0,1,0,0,0,0|2,0,1]=4 968 B13R1.153 N#CCCC(=O)NCC1CCCC1 527a_100000737975_100011934036 [0,1,0,0,0,0|2,0,1]=4 969 B13R1.153 N#CCCC(=O)NCC1OCCO1 11a_100000036311_100011934036 [0,1,0,0,0,0|2,0,1]=4 970 B13R1.153 N#CCCC(=O)NCC1OCCO1 1626a_100000036311_100011934036 [0,1,0,0,0,0|2,0,1]=4 971 B13R1.153 N#CCCC(=O)NCC1OCCO1 527a_100000036311_100011934036 [0,1,0,0,0,0|2,0,1]=4 972 B13R1.153 N#CCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100011934036 [0,1,0,0,0,0|1,0,1]=3 973 B13R1.153 N#CCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011934036 [0,1,0,0,0,0|1,0,1]=3 974 B13R1.153 N#CCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011934036 [0,1,0,0,0,0|1,0,1]=3 975 B13R1.153 N#CCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100011934036 [0,1,0,0,0,0|1,0,1]=3 976 B13R1.153 N#CCNC(=O)CCC1CCCO1 1626a_100000734998_100011247709 [0,1,0,0,0,0|2,0,1]=4 977 B13R1.153 N#CCNC(=O)CCC1CCCO1 527a_100000734998_100011247709 [0,1,0,0,0,0|2,0,1]=4 978 B13R1.153 N#CCNC(=O)NC[C@@H]1CCCO1 2708a_100000734998_100020590478 [0,1,0,0,0,0|2,0,1]=4 979 B13R1.153 N#CCNC(=O)NC[C@@H]1CCCO1 273464a_100000734998_100020590478 [0,1,0,0,0,0|2,0,1]=4 980 B13R1.153 N#CCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000734998 [0,1,0,0,0,0|2,0,1]=4 981 B13R1.153 N#CCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000734998 [0,1,0,0,0,0|2,0,1]=4 982 B13R1.153 O=C(CCC1CCCC1)NCCF 11a_100000724931_100000211120 [0,1,0,0,0,0|3,0,0]=4 983 B13R1.153 O=C(CCC1CCCC1)NCCF 1626a_100000724931_100000211120 [0,1,0,0,0,0|3,0,0]=4 984 B13R1.153 O=C(CCC1CCCC1)NCCF 240690a_100000724931_100000211120 [0,1,0,0,0,0|3,0,0]=4 985 B13R1.153 O=C(CCC1CCCC1)NCCF 527a_100000724931_100000211120 [0,1,0,0,0,0|3,0,0]=4 986 B13R1.153 O=C(CCC1CCCC1)NCCO 240690a_100000210304_100000211120 [0,1,0,0,0,0|3,0,0]=4 987 B13R1.153 O=C(CCC1CCCC1)NCCO 527a_100000210304_100000211120 [0,1,0,0,0,0|3,0,0]=4 988 B13R1.153 O=C(CCC1CCCO1)NCCF 11a_100000724931_100011247709 [0,1,0,0,0,0|2,0,0]=3 989 B13R1.153 O=C(CCC1CCCO1)NCCF 1626a_100000724931_100011247709 [0,1,0,0,0,0|2,0,0]=3 990 B13R1.153 O=C(CCC1CCCO1)NCCF 240690a_100000724931_100011247709 [0,1,0,0,0,0|2,0,0]=3 991 B13R1.153 O=C(CCC1CCCO1)NCCF 527a_100000724931_100011247709 [0,1,0,0,0,0|2,0,0]=3 992 B13R1.153 O=C(CCC1CCCO1)NCCO 240690a_100000210304_100011247709 [0,1,0,0,0,0|2,0,0]=3 993 B13R1.153 O=C(CCC1CCCO1)NCCO 527a_100000210304_100011247709 [0,1,0,0,0,0|2,0,0]=3 994 B13R1.153 O=C(CCCF)CCC1CCCC1 1458a_100000211120_100011934791 [0,1,0,0,0,0|2,0,0]=3 995 B13R1.153 O=C(CCCF)CCC1CCCO1 1458a_100011247709_100011934791 [0,1,0,0,0,0|1,0,0]=2 996 B13R1.153 O=C(CCCF)CCC1OCCO1 1458a_100000082924_100011934791 [0,1,0,0,0,0|2,0,0]=3 997 B13R1.153 O=C(CCCF)CCN1CCCC1 1458a_100000738983_100011934791 [0,1,0,0,0,0|3,0,0]=4 998 B13R1.153 O=C(CCCF)CCN1CCCO1 1458a_200015187630_100011934791 [0,1,0,0,0,0|2,0,0]=3 999 B13R1.153 O=C(CCCF)COC1CCCC1 1458a_100000741352_100011934791 [0,1,0,0,0,0|3,0,0]=4 1000 B13R1.153 O=C(CCCO)CCC1CCCC1 1458a_100000211120_100011215043 [0,1,0,0,0,0|2,0,0]=3 1001 B13R1.153 O=C(CCCO)CCC1CCCO1 1458a_100011247709_100011215043 [0,1,0,0,0,0|1,0,0]=2 1002 B13R1.153 O=C(CCCO)CCC1OCCO1 1458a_100000082924_100011215043 [0,1,0,0,0,0|2,0,0]=3 1003 B13R1.153 O=C(CCCO)CCN1CCCC1 1458a_100000738983_100011215043 [0,1,0,0,0,0|3,0,0]=4 1004 B13R1.153 O=C(CCCO)CCN1CCCO1 1458a_200015187630_100011215043 [0,1,0,0,0,0|2,0,0]=3 1005 B13R1.153 O=C(CCCO)COC1CCCC1 1458a_100000741352_100011215043 [0,1,0,0,0,0|3,0,0]=4 1006 B13R1.153 O=C(CCN1CCCO1)NCCF 240690a_100000724931_200015187630 [0,1,0,0,0,0|3,0,0]=4 1007 B13R1.153 O=C(CCN1CCCO1)NCCO 240690a_100000210304_200015187630 [0,1,0,0,0,0|3,0,0]=4 1008 B13R1.153 O=C(CSCF)NCC1CCCO1 62a_100000182893_100015361967 [0,1,0,0,0,0|2,0,0]=3 1009 B13R1.153 O=C(CSCF)NCC1CCCO1 62a_100015361967_100000182893 [0,1,0,0,0,0|2,0,0]=3 1010 B13R1.153 O=C(NCCF)NCC1CCCC1 2708a_100000737975_100000724931 [0,1,0,0,0,0|3,0,0]=4 1011 B13R1.153 O=C(NCCF)NCC1CCCC1 273464a_100000724931_100000737975 [0,1,0,0,0,0|3,0,0]=4 1012 B13R1.153 O=C(NCCF)NCC1CCCC1 273464a_100000737975_100000724931 [0,1,0,0,0,0|3,0,0]=4 1013 B13R1.153 O=C(NCCF)NCC1CCCC1 512a_100000737975_100000724931 [0,1,0,0,0,0|3,0,0]=4 1014 B13R1.153 O=C(NCCF)NCC1OCCO1 2708a_100000036311_100000724931 [0,1,0,0,0,0|3,0,0]=4 1015 B13R1.153 O=C(NCCF)NCC1OCCO1 273464a_100000036311_100000724931 [0,1,0,0,0,0|3,0,0]=4 1016 B13R1.153 O=C(NCCF)NCC1OCCO1 273464a_100000724931_100000036311 [0,1,0,0,0,0|3,0,0]=4 1017 B13R1.153 O=C(NCCF)NCC1OCCO1 512a_100000036311_100000724931 [0,1,0,0,0,0|3,0,0]=4 1018 B13R1.153 O=C(NCCF)NC[C@@H]1CCCO1 2708a_100020590478_100000724931 [0,1,0,0,0,0|2,0,0]=3 1019 B13R1.153 O=C(NCCF)NC[C@@H]1CCCO1 273464a_100000724931_100020590478 [0,1,0,0,0,0|2,0,0]=3 1020 B13R1.153 O=C(NCCF)NC[C@@H]1CCCO1 273464a_100020590478_100000724931 [0,1,0,0,0,0|2,0,0]=3 1021 B13R1.153 O=C(NCCF)NC[C@@H]1CCCO1 512a_100020590478_100000724931 [0,1,0,0,0,0|2,0,0]=3 1022 B13R1.153 O=C(NCCO)NCC1CCCC1 2708a_100000737975_100000210304 [0,1,0,0,0,0|3,0,0]=4 1023 B13R1.153 O=C(NCCO)NCC1CCCC1 273464a_100000210304_100000737975 [0,1,0,0,0,0|3,0,0]=4 1024 B13R1.153 O=C(NCCO)NCC1CCCC1 273464a_100000737975_100000210304 [0,1,0,0,0,0|3,0,0]=4 1025 B13R1.153 O=C(NCCO)NCC1CCCC1 512a_100000737975_100000210304 [0,1,0,0,0,0|3,0,0]=4 1026 B13R1.153 O=C(NCCO)NCC1OCCO1 2708a_100000036311_100000210304 [0,1,0,0,0,0|3,0,0]=4 1027 B13R1.153 O=C(NCCO)NCC1OCCO1 273464a_100000036311_100000210304 [0,1,0,0,0,0|3,0,0]=4 1028 B13R1.153 O=C(NCCO)NCC1OCCO1 273464a_100000210304_100000036311 [0,1,0,0,0,0|3,0,0]=4 1029 B13R1.153 O=C(NCCO)NCC1OCCO1 512a_100000036311_100000210304 [0,1,0,0,0,0|3,0,0]=4 1030 B13R1.153 O=C(NCCO)NC[C@@H]1CCCO1 2708a_100020590478_100000210304 [0,1,0,0,0,0|2,0,0]=3 1031 B13R1.153 O=C(NCCO)NC[C@@H]1CCCO1 273464a_100000210304_100020590478 [0,1,0,0,0,0|2,0,0]=3 1032 B13R1.153 O=C(NCCO)NC[C@@H]1CCCO1 273464a_100020590478_100000210304 [0,1,0,0,0,0|2,0,0]=3 1033 B13R1.153 O=C(NCCO)NC[C@@H]1CCCO1 512a_100020590478_100000210304 [0,1,0,0,0,0|2,0,0]=3 1034 B13R1.153 [N-]=[N+]=NCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000751907 [0,1,0,0,0,0|3,0,0]=4 1035 B13R1.153 [N-]=[N+]=NCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000751907 [0,1,0,0,0,0|3,0,0]=4 1036 B13R1.444 CCCC(=O)CCC1CCCN1C 1458a_100000211992_100000005710 [0,1,0,0,0,0|2,0,0]=3 1037 B13R1.444 CCCC(=O)CCC1CCOC1=O 1458a_100000117037_100000210303 [0,1,0,0,0,0|3,0,0]=4 1038 B13R1.444 CCCC(=O)CCN1CCCC1=O 1458a_100000211992_100000742232 [0,1,0,0,0,0|3,0,0]=4 1039 B13R1.444 CCCC(=O)CCN1CCCC1=O 1458a_100000751031_100000210303 [0,1,0,0,0,0|3,0,0]=4 1040 B13R1.444 CCCC(=O)COC1CCCC1C 7a_100011216460_100000747444 [0,1,0,0,0,0|3,0,0]=4 1041 B13R1.444 CCCC(=O)CSC1CCCC1=O 62a_100000211823_100000747444 [0,1,0,0,0,0|3,0,0]=4 1042 B13R1.444 CCCC(=O)CSC1CCCC1=O 62a_100000747444_100000211823 [0,1,0,0,0,0|3,0,0]=4 1043 B13R1.444 CCCC(=O)CS[C@@H]1CCC[C@H]1O 62a_100000747444_200016002552 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.444 CCCC(=O)CS[C@@H]1CCC[C@H]1O 62a_200016002552_100000747444 [0,1,0,0,0,0|3,0,0]=4 1045 B13R1.444 CCCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000211992 [0,1,0,0,0,0|2,0,0]=3 1046 B13R1.444 CCCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000211992 [0,1,0,0,0,0|2,0,0]=3 1047 B13R1.444 CCCC(=O)OCN1CCC[C@@H]1C 2230a_100020605311_100000034017 [0,1,0,0,0,0|2,0,0]=3 1048 B13R1.444 CCCC(=O)OCN1CCC[C@@H]1C 269982a_100020605311_100000034017 [0,1,0,0,0,0|2,0,0]=3 1049 B13R1.444 CCCC(=O)OCN1CCC[C@H]1C 2230a_100015189458_100000034017 [0,1,0,0,0,0|2,0,0]=3 1050 B13R1.444 CCCC(=O)OCN1CCC[C@H]1C 269982a_100015189458_100000034017 [0,1,0,0,0,0|2,0,0]=3 1051 B13R1.444 CCCC(=O)OCN1CCC[C@H]1C 34a_100015189458_100000034017 [0,1,0,0,0,0|2,0,0]=3 1052 B13R1.444 CCCC(=O)OCN1CCSC1C 2230a_200011216479_100000034017 [0,1,0,0,0,0|3,0,0]=4 1053 B13R1.444 CCCC(=O)OCN1CCSC1C 269982a_200011216479_100000034017 [0,1,0,0,0,0|3,0,0]=4 1054 B13R1.444 CCCC(=O)OCN1CCSC1C 34a_200011216479_100000034017 [0,1,0,0,0,0|3,0,0]=4 1055 B13R1.444 CCCC(C)OCC1CCCN1C 34a_100000743107_100000766640 [0,1,0,0,0,0|2,0,1]=4 1056 B13R1.444 CCNC(=O)NC[C@@H]1CCCN1C 2708a_100009821018_100015525214 [0,1,0,0,0,0|3,0,0]=4 1057 B13R1.444 CCNC(=O)NC[C@@H]1CCCN1C 2708a_100015525214_100009821018 [0,1,0,0,0,0|3,0,0]=4 1058 B13R1.444 CCNC(=O)NC[C@@H]1CCCN1C 273464a_100009821018_100015525214 [0,1,0,0,0,0|3,0,0]=4 1059 B13R1.444 CCNC(=O)NC[C@@H]1CCCN1C 273464a_100015525214_100009821018 [0,1,0,0,0,0|3,0,0]=4 1060 B13R1.444 CCNC(=O)NC[C@@H]1CCCN1C 512a_100009821018_100015525214 [0,1,0,0,0,0|3,0,0]=4 1061 B13R1.444 CCNC(=O)NC[C@@H]1CCCN1C 512a_100015525214_100009821018 [0,1,0,0,0,0|3,0,0]=4 1062 B13R1.444 CN1CCCC1CCC(=O)CCO 1458a_100011216618_100000005710 [0,1,0,0,0,0|3,0,0]=4 1063 B13R1.444 CN1CCC[C@H]1CNC(=O)CCO 240690a_100009821018_100011216618 [0,1,0,0,0,0|3,0,0]=4 1064 B13R1.444 COCC(=O)CCC1CCCN1C 1458a_100000210968_100000005710 [0,1,0,0,0,0|3,0,0]=4 1065 B13R1.444 COCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000210968 [0,1,0,0,0,0|3,0,0]=4 1066 B13R1.444 COCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000210968 [0,1,0,0,0,0|3,0,0]=4 1067 B13R1.444 CSCC(=O)CCC1CCCN1C 1458a_100000184570_100000005710 [0,1,0,0,0,0|3,0,0]=4 1068 B13R1.444 CSCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000184570 [0,1,0,0,0,0|3,0,0]=4 1069 B13R1.444 CSCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000184570 [0,1,0,0,0,0|3,0,0]=4 1070 B13R1.554 C#CC(C)C(=O)CCC1CCCO1 1458a_100011247709_200000035995 [0,1,0,0,0,0|1,0,2]=4 1071 B13R1.554 C/C=C(\C)/C(=O)NC[C@@H]1CCCO1 11a_100020590478_100020587367 [0,1,0,0,0,0|1,0,2]=4 1072 B13R1.554 C/C=C(\C)/C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100020587367 [0,1,0,0,0,0|1,0,2]=4 1073 B13R1.554 C=CC(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100011216780 [0,1,0,0,0,0|1,0,2]=4 1074 B13R1.554 C=CC(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011216780 [0,1,0,0,0,0|1,0,2]=4 1075 B13R1.554 C=CC(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011216780 [0,1,0,0,0,0|1,0,2]=4 1076 B13R1.554 C=CC(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100011216780 [0,1,0,0,0,0|1,0,2]=4 1077 B13R1.554 CC(C#N)C(=O)CCC1CCCO1 1458a_100011247709_100000703298 [0,1,0,0,0,0|2,0,1]=4 1078 B13R1.554 CC(C#N)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000753662 [0,1,0,0,0,0|2,0,1]=4 1079 B13R1.554 CC(C#N)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000753662 [0,1,0,0,0,0|2,0,1]=4 1080 B13R1.554 CC(C#N)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000753662 [0,1,0,0,0,0|2,0,1]=4 1081 B13R1.554 CC(C#N)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000753662 [0,1,0,0,0,0|2,0,1]=4 1082 B13R1.554 CCC(=O)C(C)OCC1CCCO1 1458a_100000746140_100000210202 [0,1,0,0,0,0|1,0,2]=4 1083 B13R1.554 CCC(=O)C(C)OCC1CCCO1 7a_100000210270_100000742827 [0,1,0,0,0,0|1,0,2]=4 1084 B13R1.554 CCC(C)C(=O)CCC1CCCC1 1458a_100000211120_100000758301 [0,1,0,0,0,0|2,0,0]=3 1085 B13R1.554 CCC(C)C(=O)CCC1CCCC1 1458a_100011192722_100000760354 [0,1,0,0,0,0|2,0,0]=3 1086 B13R1.554 CCC(C)C(=O)CCC1CCCO1 1458a_100011247709_100000758301 [0,1,0,0,0,0|1,0,0]=2 1087 B13R1.554 CCC(C)C(=O)CCC1OCCO1 1458a_100000082924_100000758301 [0,1,0,0,0,0|2,0,0]=3 1088 B13R1.554 CCC(C)C(=O)CCC1OCCO1 1458a_100011192722_100000740749 [0,1,0,0,0,0|2,0,0]=3 1089 B13R1.554 CCC(C)C(=O)CCN1CCCC1 1458a_100000738983_100000758301 [0,1,0,0,0,0|3,0,0]=4 1090 B13R1.554 CCC(C)C(=O)CCN1CCCC1 1458a_100011192722_100000004467 [0,1,0,0,0,0|3,0,0]=4 1091 B13R1.554 CCC(C)C(=O)CCN1CCCO1 1458a_200015187630_100000758301 [0,1,0,0,0,0|2,0,0]=3 1092 B13R1.554 CCC(C)C(=O)COC1CCCC1 1458a_100000741352_100000758301 [0,1,0,0,0,0|3,0,0]=4 1093 B13R1.554 CCC(C)C(=O)NCC1CCCC1 11a_100000737975_100011192722 [0,1,0,0,0,0|2,0,0]=3 1094 B13R1.554 CCC(C)C(=O)NCC1CCCC1 1626a_100000737975_100011192722 [0,1,0,0,0,0|2,0,0]=3 1095 B13R1.554 CCC(C)C(=O)NCC1CCCC1 240690a_100000737975_100011192722 [0,1,0,0,0,0|2,0,0]=3 1096 B13R1.554 CCC(C)C(=O)NCC1CCCC1 527a_100000737975_100011192722 [0,1,0,0,0,0|2,0,0]=3 1097 B13R1.554 CCC(C)C(=O)NCC1CCOC1 11a_100000737293_100011192722 [0,1,0,0,0,0|3,0,0]=4 1098 B13R1.554 CCC(C)C(=O)NCC1CCOC1 1626a_100000737293_100011192722 [0,1,0,0,0,0|3,0,0]=4 1099 B13R1.554 CCC(C)C(=O)NCC1CCOC1 240690a_100000737293_100011192722 [0,1,0,0,0,0|3,0,0]=4 1100 B13R1.554 CCC(C)C(=O)NCC1CCOC1 527a_100000737293_100011192722 [0,1,0,0,0,0|3,0,0]=4 1101 B13R1.554 CCC(C)C(=O)NCC1OCCO1 11a_100000036311_100011192722 [0,1,0,0,0,0|2,0,0]=3 1102 B13R1.554 CCC(C)C(=O)NCC1OCCO1 1626a_100000036311_100011192722 [0,1,0,0,0,0|2,0,0]=3 1103 B13R1.554 CCC(C)C(=O)NCC1OCCO1 527a_100000036311_100011192722 [0,1,0,0,0,0|2,0,0]=3 1104 B13R1.554 CCC(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100011192722 [0,1,0,0,0,0|1,0,0]=2 1105 B13R1.554 CCC(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011192722 [0,1,0,0,0,0|1,0,0]=2 1106 B13R1.554 CCC(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011192722 [0,1,0,0,0,0|1,0,0]=2 1107 B13R1.554 CCC(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100011192722 [0,1,0,0,0,0|1,0,0]=2 1108 B13R1.554 CCC(C)C(=O)NNC1CCCC1 22a_100000737850_100011192722 [0,1,0,0,0,0|3,0,0]=4 1109 B13R1.554 CCC(C)C(C)NC[C@@H]1CCCO1 269862a_100020590478_100000210599 [0,1,0,0,0,0|2,0,1]=4 1110 B13R1.554 CCC(C)C(C)NC[C@@H]1CCCO1 270004a_100020590478_100000210599 [0,1,0,0,0,0|2,0,1]=4 1111 B13R1.554 CCC(C)C(C)OCC1CCCC1 7a_100011215189_100000740388 [0,1,0,0,0,0|2,0,1]=4 1112 B13R1.554 CCC(C)C(C)OCC1CCCO1 7a_100011215189_100000203698 [0,1,0,0,0,0|1,0,1]=3 1113 B13R1.554 CCC(C)C(C)OCC1OCCO1 7a_100011215189_100000755774 [0,1,0,0,0,0|2,0,1]=4 1114 B13R1.554 CCC(O)C(=O)CCC1CCCC1 1458a_100011196387_100000760354 [0,1,0,0,0,0|2,0,0]=3 1115 B13R1.554 CCC(O)C(=O)CCC1OCCO1 1458a_100011196387_100000740749 [0,1,0,0,0,0|2,0,0]=3 1116 B13R1.554 CCC(O)C(=O)CCN1CCCC1 1458a_100011196387_100000004467 [0,1,0,0,0,0|3,0,0]=4 1117 B13R1.554 CCC(O)C(=O)NCC1CCCC1 240690a_100000737975_100011196387 [0,1,0,0,0,0|2,0,0]=3 1118 B13R1.554 CCC(O)C(=O)NCC1CCOC1 240690a_100000737293_100011196387 [0,1,0,0,0,0|3,0,0]=4 1119 B13R1.554 CCC(O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011196387 [0,1,0,0,0,0|1,0,0]=2 1120 B13R1.554 CCC(O)C(=O)NNC1CCCC1 22a_100000737850_100011196387 [0,1,0,0,0,0|3,0,0]=4 1121 B13R1.554 CCN(C)C(=O)CCC1CCCC1 11a_100000225621_100000211120 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.554 CCN(C)C(=O)CCC1CCCC1 1626a_100000225621_100000211120 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.554 CCN(C)C(=O)CCC1CCCC1 240690a_100000225621_100000211120 [0,1,0,0,0,0|3,0,0]=4 1124 B13R1.554 CCN(C)C(=O)CCC1CCCC1 527a_100000225621_100000211120 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.554 CCN(C)C(=O)CCC1CCCO1 11a_100000225621_100011247709 [0,1,0,0,0,0|2,0,0]=3 1126 B13R1.554 CCN(C)C(=O)CCC1CCCO1 1626a_100000225621_100011247709 [0,1,0,0,0,0|2,0,0]=3 1127 B13R1.554 CCN(C)C(=O)CCC1CCCO1 240690a_100000225621_100011247709 [0,1,0,0,0,0|2,0,0]=3 1128 B13R1.554 CCN(C)C(=O)CCC1CCCO1 527a_100000225621_100011247709 [0,1,0,0,0,0|2,0,0]=3 1129 B13R1.554 CCN(C)C(=O)CCN1CCCO1 240690a_100000225621_200015187630 [0,1,0,0,0,0|3,0,0]=4 1130 B13R1.554 CCN(C)C(=O)COC1CCCO1 34a_100000085407_100000738999 [0,1,0,0,0,0|3,0,0]=4 1131 B13R1.554 CCN(C)C(=O)NCC1CCCC1 2708a_100000737975_100000225621 [0,1,0,0,0,0|3,0,0]=4 1132 B13R1.554 CCN(C)C(=O)NCC1CCCC1 273464a_100000737975_100000225621 [0,1,0,0,0,0|3,0,0]=4 1133 B13R1.554 CCN(C)C(=O)NCC1OCCO1 2708a_100000036311_100000225621 [0,1,0,0,0,0|3,0,0]=4 1134 B13R1.554 CCN(C)C(=O)NCC1OCCO1 273464a_100000036311_100000225621 [0,1,0,0,0,0|3,0,0]=4 1135 B13R1.554 CCN(C)C(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000225621 [0,1,0,0,0,0|2,0,0]=3 1136 B13R1.554 CCN(C)C(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000225621 [0,1,0,0,0,0|2,0,0]=3 1137 B13R1.554 CNC(=O)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011218921 [0,1,0,0,0,0|2,0,1]=4 1138 B13R1.554 CNC(=O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011218921 [0,1,0,0,0,0|2,0,1]=4 1139 B13R1.554 CNC(=O)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100011218921 [0,1,0,0,0,0|2,0,1]=4 1140 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000024059 [0,1,0,0,0,0|2,0,1]=4 1141 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000024059 [0,1,0,0,0,0|2,0,1]=4 1142 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000024059 [0,1,0,0,0,0|2,0,1]=4 1143 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000024059 [0,1,0,0,0,0|2,0,1]=4 1144 B13R1.554 COC(C)C(=O)CCC1CCCC1 1458a_100000743197_100000760354 [0,1,0,0,0,0|3,0,0]=4 1145 B13R1.554 COC(C)C(=O)CCC1OCCO1 1458a_100000743197_100000740749 [0,1,0,0,0,0|3,0,0]=4 1146 B13R1.554 COC(C)C(=O)NCC1CCCC1 11a_100000737975_100000743197 [0,1,0,0,0,0|3,0,0]=4 1147 B13R1.554 COC(C)C(=O)NCC1CCCC1 1626a_100000737975_100000743197 [0,1,0,0,0,0|3,0,0]=4 1148 B13R1.554 COC(C)C(=O)NCC1CCCC1 240690a_100000737975_100000743197 [0,1,0,0,0,0|3,0,0]=4 1149 B13R1.554 COC(C)C(=O)NCC1CCCC1 527a_100000737975_100000743197 [0,1,0,0,0,0|3,0,0]=4 1150 B13R1.554 COC(C)C(=O)NCC1OCCO1 11a_100000036311_100000743197 [0,1,0,0,0,0|3,0,0]=4 1151 B13R1.554 COC(C)C(=O)NCC1OCCO1 1626a_100000036311_100000743197 [0,1,0,0,0,0|3,0,0]=4 1152 B13R1.554 COC(C)C(=O)NCC1OCCO1 527a_100000036311_100000743197 [0,1,0,0,0,0|3,0,0]=4 1153 B13R1.554 COC(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000743197 [0,1,0,0,0,0|2,0,0]=3 1154 B13R1.554 COC(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000743197 [0,1,0,0,0,0|2,0,0]=3 1155 B13R1.554 COC(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000743197 [0,1,0,0,0,0|2,0,0]=3 1156 B13R1.554 COC(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000743197 [0,1,0,0,0,0|2,0,0]=3 1157 B13R1.554 CSC(C)C(=O)CCC1CCCC1 1458a_100000149566_100000760354 [0,1,0,0,0,0|3,0,0]=4 1158 B13R1.554 CSC(C)C(=O)CCC1OCCO1 1458a_100000149566_100000740749 [0,1,0,0,0,0|3,0,0]=4 1159 B13R1.554 CSC(C)C(=O)NCC1CCCC1 11a_100000737975_100000149566 [0,1,0,0,0,0|3,0,0]=4 1160 B13R1.554 CSC(C)C(=O)NCC1CCCC1 1626a_100000737975_100000149566 [0,1,0,0,0,0|3,0,0]=4 1161 B13R1.554 CSC(C)C(=O)NCC1CCCC1 240690a_100000737975_100000149566 [0,1,0,0,0,0|3,0,0]=4 1162 B13R1.554 CSC(C)C(=O)NCC1CCCC1 527a_100000737975_100000149566 [0,1,0,0,0,0|3,0,0]=4 1163 B13R1.554 CSC(C)C(=O)NCC1OCCO1 11a_100000036311_100000149566 [0,1,0,0,0,0|3,0,0]=4 1164 B13R1.554 CSC(C)C(=O)NCC1OCCO1 1626a_100000036311_100000149566 [0,1,0,0,0,0|3,0,0]=4 1165 B13R1.554 CSC(C)C(=O)NCC1OCCO1 527a_100000036311_100000149566 [0,1,0,0,0,0|3,0,0]=4 1166 B13R1.554 CSC(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000149566 [0,1,0,0,0,0|2,0,0]=3 1167 B13R1.554 CSC(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000149566 [0,1,0,0,0,0|2,0,0]=3 1168 B13R1.554 CSC(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000149566 [0,1,0,0,0,0|2,0,0]=3 1169 B13R1.554 CSC(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000149566 [0,1,0,0,0,0|2,0,0]=3 1170 B13R1.554 O=C(CCC1CCCC1)C(O)CO 1458a_100011215603_100000760354 [0,1,0,0,0,0|3,0,0]=4 1171 B13R1.554 O=C(CCC1OCCO1)C(O)CO 1458a_100011215603_100000740749 [0,1,0,0,0,0|3,0,0]=4 1172 B13R1.554 O=C(NCC1CCCC1)C(O)CO 240690a_100000737975_100011215603 [0,1,0,0,0,0|3,0,0]=4 1173 B13R1.554 O=C(NC[C@@H]1CCCO1)C(O)CO 240690a_100020590478_100011215603 [0,1,0,0,0,0|2,0,0]=3 1174 B13R1.593 C=C(C)CC(=O)CCC1CCCC1 1458a_100000211120_100000748629 [0,1,0,0,0,0|2,0,1]=4 1175 B13R1.593 C=C(C)CC(=O)CCC1CCCO1 1458a_100011247709_100000748629 [0,1,0,0,0,0|1,0,1]=3 1176 B13R1.593 C=C(C)CC(=O)CCC1OCCO1 1458a_100000082924_100000748629 [0,1,0,0,0,0|2,0,1]=4 1177 B13R1.593 C=C(C)CC(=O)CCN1CCCO1 1458a_200015187630_100000748629 [0,1,0,0,0,0|2,0,1]=4 1178 B13R1.593 C=C(F)CC(=O)CCC1CCCO1 1458a_100011247709_100009893438 [0,1,0,0,0,0|1,0,2]=4 1179 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)C 11a_100020590478_100000211388 [0,1,0,0,0,0|1,0,2]=4 1180 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)C 1626a_100020590478_100000211388 [0,1,0,0,0,0|1,0,2]=4 1181 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)C 240690a_100020590478_100000211388 [0,1,0,0,0,0|1,0,2]=4 1182 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)Cl 11a_100020590478_200042562850 [0,1,0,0,0,0|1,0,2]=4 1183 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)Cl 1626a_100020590478_200042562850 [0,1,0,0,0,0|1,0,2]=4 1184 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)Cl 240690a_100020590478_200042562850 [0,1,0,0,0,0|1,0,2]=4 1185 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)I 11a_100020590478_100025716642 [0,1,0,0,0,0|1,0,2]=4 1186 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)I 1626a_100020590478_100025716642 [0,1,0,0,0,0|1,0,2]=4 1187 B13R1.593 CC(=O)CC(=O)NCC1CCCO1 1458a_100000070787_100000182893 [0,1,0,0,0,0|1,0,1]=3 1188 B13R1.593 CC(C)CC(=O)CCC1CCCC1 1458a_100000210554_100000760354 [0,1,0,0,0,0|2,0,0]=3 1189 B13R1.593 CC(C)CC(=O)CCC1CCCC1 1458a_100000211120_100000210624 [0,1,0,0,0,0|2,0,0]=3 1190 B13R1.593 CC(C)CC(=O)CCC1CCCO1 1458a_100011247709_100000210624 [0,1,0,0,0,0|1,0,0]=2 1191 B13R1.593 CC(C)CC(=O)CCC1OCCO1 1458a_100000082924_100000210624 [0,1,0,0,0,0|2,0,0]=3 1192 B13R1.593 CC(C)CC(=O)CCC1OCCO1 1458a_100000210554_100000740749 [0,1,0,0,0,0|2,0,0]=3 1193 B13R1.593 CC(C)CC(=O)CCN1CCCC1 1458a_100000210554_100000004467 [0,1,0,0,0,0|3,0,0]=4 1194 B13R1.593 CC(C)CC(=O)CCN1CCCC1 1458a_100000738983_100000210624 [0,1,0,0,0,0|3,0,0]=4 1195 B13R1.593 CC(C)CC(=O)CCN1CCCO1 1458a_200015187630_100000210624 [0,1,0,0,0,0|2,0,0]=3 1196 B13R1.593 CC(C)CC(=O)COC1CCCC1 1458a_100000741352_100000210624 [0,1,0,0,0,0|3,0,0]=4 1197 B13R1.593 CC(C)CC(=O)NCC1CCCC1 11a_100000737975_100000210554 [0,1,0,0,0,0|2,0,0]=3 1198 B13R1.593 CC(C)CC(=O)NCC1CCCC1 1626a_100000737975_100000210554 [0,1,0,0,0,0|2,0,0]=3 1199 B13R1.593 CC(C)CC(=O)NCC1CCCC1 240690a_100000737975_100000210554 [0,1,0,0,0,0|2,0,0]=3 1200 B13R1.593 CC(C)CC(=O)NCC1CCCC1 527a_100000737975_100000210554 [0,1,0,0,0,0|2,0,0]=3 1201 B13R1.593 CC(C)CC(=O)NCC1CCOC1 11a_100000737293_100000210554 [0,1,0,0,0,0|3,0,0]=4 1202 B13R1.593 CC(C)CC(=O)NCC1CCOC1 1626a_100000737293_100000210554 [0,1,0,0,0,0|3,0,0]=4 1203 B13R1.593 CC(C)CC(=O)NCC1CCOC1 240690a_100000737293_100000210554 [0,1,0,0,0,0|3,0,0]=4 1204 B13R1.593 CC(C)CC(=O)NCC1CCOC1 527a_100000737293_100000210554 [0,1,0,0,0,0|3,0,0]=4 1205 B13R1.593 CC(C)CC(=O)NCC1OCCO1 11a_100000036311_100000210554 [0,1,0,0,0,0|2,0,0]=3 1206 B13R1.593 CC(C)CC(=O)NCC1OCCO1 1626a_100000036311_100000210554 [0,1,0,0,0,0|2,0,0]=3 1207 B13R1.593 CC(C)CC(=O)NCC1OCCO1 527a_100000036311_100000210554 [0,1,0,0,0,0|2,0,0]=3 1208 B13R1.593 CC(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210554 [0,1,0,0,0,0|1,0,0]=2 1209 B13R1.593 CC(C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210554 [0,1,0,0,0,0|1,0,0]=2 1210 B13R1.593 CC(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210554 [0,1,0,0,0,0|1,0,0]=2 1211 B13R1.593 CC(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210554 [0,1,0,0,0,0|1,0,0]=2 1212 B13R1.593 CC(C)CC(=O)NNC1CCCC1 22a_100000737850_100000210554 [0,1,0,0,0,0|3,0,0]=4 1213 B13R1.593 CC(C)CC(C)NCC1CCCO1 2230a_100000692259_100000203698 [0,1,0,0,0,0|2,0,1]=4 1214 B13R1.593 CC(C)CC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000731052 [0,1,0,0,0,0|2,0,1]=4 1215 B13R1.593 CC(C)CC(C)NC[C@@H]1CCCO1 34a_100020590478_100000731052 [0,1,0,0,0,0|2,0,1]=4 1216 B13R1.593 CC(C)CC(C)OCC1CCCC1 34a_100000211805_100000740388 [0,1,0,0,0,0|2,0,1]=4 1217 B13R1.593 CC(C)CC(C)OCC1CCCC1 34a_100000742336_100000731052 [0,1,0,0,0,0|2,0,1]=4 1218 B13R1.593 CC(C)CC(C)OCC1CCCC1 7a_100000211805_100000740388 [0,1,0,0,0,0|2,0,1]=4 1219 B13R1.593 CC(C)CC(C)OCC1CCCC1 7a_100000742336_100000731052 [0,1,0,0,0,0|2,0,1]=4 1220 B13R1.593 CC(C)CC(C)OCC1CCCO1 34a_100000210270_100000731052 [0,1,0,0,0,0|1,0,1]=3 1221 B13R1.593 CC(C)CC(C)OCC1CCCO1 7a_100000210270_100000731052 [0,1,0,0,0,0|1,0,1]=3 1222 B13R1.593 CC(C)CC(C)OCC1CCCO1 7a_100000211805_100000203698 [0,1,0,0,0,0|1,0,1]=3 1223 B13R1.593 CC(C)CC(C)OCC1COCO1 34a_100011216627_100000731052 [0,1,0,0,0,0|2,0,1]=4 1224 B13R1.593 CC(C)CC(C)OCC1OCCO1 34a_100000087154_100000731052 [0,1,0,0,0,0|2,0,1]=4 1225 B13R1.593 CC(C)CC(C)OCC1OCCO1 34a_100000211805_100000755774 [0,1,0,0,0,0|2,0,1]=4 1226 B13R1.593 CC(C)CC(C)OCC1OCCO1 7a_100000211805_100000755774 [0,1,0,0,0,0|2,0,1]=4 1227 B13R1.593 CC(C)CC(C)OC[C@H]1CCCN1 34a_100000745186_100000731052 [0,1,0,0,0,0|2,0,1]=4 1228 B13R1.593 CC(C)CC(C)SCC1CCCO1 62a_100000203698_100000731052 [0,1,0,0,0,0|1,1,1]=4 1229 B13R1.593 CC(C)CC(C)SCC1CCCO1 62a_100000731052_100000203698 [0,1,0,0,0,0|1,1,1]=4 1230 B13R1.593 CC(C)NC(=O)CCC1CCCC1 11a_100138425928_100000211120 [0,1,0,0,0,0|3,0,0]=4 1231 B13R1.593 CC(C)NC(=O)CCC1CCCC1 1626a_100138425928_100000211120 [0,1,0,0,0,0|3,0,0]=4 1232 B13R1.593 CC(C)NC(=O)CCC1CCCC1 240690a_100138425928_100000211120 [0,1,0,0,0,0|3,0,0]=4 1233 B13R1.593 CC(C)NC(=O)CCC1CCCC1 527a_100138425928_100000211120 [0,1,0,0,0,0|3,0,0]=4 1234 B13R1.593 CC(C)NC(=O)CCC1CCCO1 11a_100138425928_100011247709 [0,1,0,0,0,0|2,0,0]=3 1235 B13R1.593 CC(C)NC(=O)CCC1CCCO1 1626a_100138425928_100011247709 [0,1,0,0,0,0|2,0,0]=3 1236 B13R1.593 CC(C)NC(=O)CCC1CCCO1 240690a_100138425928_100011247709 [0,1,0,0,0,0|2,0,0]=3 1237 B13R1.593 CC(C)NC(=O)CCC1CCCO1 527a_100138425928_100011247709 [0,1,0,0,0,0|2,0,0]=3 1238 B13R1.593 CC(C)NC(=O)CCN1CCCO1 240690a_100138425928_200015187630 [0,1,0,0,0,0|3,0,0]=4 1239 B13R1.593 CC(C)NC(=O)COC1CCCO1 34a_100000085407_100000183996 [0,1,0,0,0,0|3,0,0]=4 1240 B13R1.593 CC(C)NC(=O)NCC1CCCC1 2708a_100000737975_100138425928 [0,1,0,0,0,0|3,0,0]=4 1241 B13R1.593 CC(C)NC(=O)NCC1CCCC1 2708a_100138425928_100000737975 [0,1,0,0,0,0|3,0,0]=4 1242 B13R1.593 CC(C)NC(=O)NCC1CCCC1 273464a_100138425928_100000737975 [0,1,0,0,0,0|3,0,0]=4 1243 B13R1.593 CC(C)NC(=O)NCC1CCCC1 512a_100000737975_100138425928 [0,1,0,0,0,0|3,0,0]=4 1244 B13R1.593 CC(C)NC(=O)NCC1CCCC1 512a_100138425928_100000737975 [0,1,0,0,0,0|3,0,0]=4 1245 B13R1.593 CC(C)NC(=O)NCC1OCCO1 2708a_100000036311_100138425928 [0,1,0,0,0,0|3,0,0]=4 1246 B13R1.593 CC(C)NC(=O)NCC1OCCO1 2708a_100138425928_100000036311 [0,1,0,0,0,0|3,0,0]=4 1247 B13R1.593 CC(C)NC(=O)NCC1OCCO1 273464a_100138425928_100000036311 [0,1,0,0,0,0|3,0,0]=4 1248 B13R1.593 CC(C)NC(=O)NCC1OCCO1 512a_100000036311_100138425928 [0,1,0,0,0,0|3,0,0]=4 1249 B13R1.593 CC(C)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100138425928 [0,1,0,0,0,0|2,0,0]=3 1250 B13R1.593 CC(C)NC(=O)NC[C@@H]1CCCO1 2708a_100138425928_100020590478 [0,1,0,0,0,0|2,0,0]=3 1251 B13R1.593 CC(C)NC(=O)NC[C@@H]1CCCO1 273464a_100138425928_100020590478 [0,1,0,0,0,0|2,0,0]=3 1252 B13R1.593 CC(C)NC(=O)NC[C@@H]1CCCO1 512a_100020590478_100138425928 [0,1,0,0,0,0|2,0,0]=3 1253 B13R1.593 CC(C)OC(=O)COC1CCCO1 34a_100000085407_100011215430 [0,1,0,0,0,0|3,0,0]=4 1254 B13R1.593 CC(C)OC(=O)OCN1CCCC1 269982a_100000188435_100010125566 [0,1,0,0,0,0|3,0,0]=4 1255 B13R1.593 CC(O)CC(=O)CCC1CCCC1 1458a_100000211120_100011218427 [0,1,0,0,0,0|2,0,0]=3 1256 B13R1.593 CC(O)CC(=O)CCC1CCCO1 1458a_100011247709_100011218427 [0,1,0,0,0,0|1,0,0]=2 1257 B13R1.593 CC(O)CC(=O)CCC1OCCO1 1458a_100000082924_100011218427 [0,1,0,0,0,0|2,0,0]=3 1258 B13R1.593 CC(O)CC(=O)CCN1CCCC1 1458a_100000738983_100011218427 [0,1,0,0,0,0|3,0,0]=4 1259 B13R1.593 CC(O)CC(=O)CCN1CCCO1 1458a_200015187630_100011218427 [0,1,0,0,0,0|2,0,0]=3 1260 B13R1.593 CC(O)CC(=O)COC1CCCC1 1458a_100000741352_100011218427 [0,1,0,0,0,0|3,0,0]=4 1261 B13R1.593 CN(C)CC(=O)CCC1CCCC1 1458a_100000750896_100000760354 [0,1,0,0,0,0|3,0,0]=4 1262 B13R1.593 CN(C)CC(=O)CCC1OCCO1 1458a_100000750896_100000740749 [0,1,0,0,0,0|3,0,0]=4 1263 B13R1.593 CN(C)CC(=O)NCC1CCCC1 11a_100000737975_100000750896 [0,1,0,0,0,0|3,0,0]=4 1264 B13R1.593 CN(C)CC(=O)NCC1CCCC1 240690a_100000737975_100000750896 [0,1,0,0,0,0|3,0,0]=4 1265 B13R1.593 CN(C)CC(=O)NCC1CCCC1 527a_100000737975_100000750896 [0,1,0,0,0,0|3,0,0]=4 1266 B13R1.593 CN(C)CC(=O)NCC1CCCO1 2230a_100102631434_100000182893 [0,1,0,0,0,0|2,0,0]=3 1267 B13R1.593 CN(C)CC(=O)NCC1CCCO1 269982a_100102631434_100000182893 [0,1,0,0,0,0|2,0,0]=3 1268 B13R1.593 CN(C)CC(=O)NCC1OCCO1 11a_100000036311_100000750896 [0,1,0,0,0,0|3,0,0]=4 1269 B13R1.593 CN(C)CC(=O)NCC1OCCO1 527a_100000036311_100000750896 [0,1,0,0,0,0|3,0,0]=4 1270 B13R1.593 CN(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000750896 [0,1,0,0,0,0|2,0,0]=3 1271 B13R1.593 CN(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000750896 [0,1,0,0,0,0|2,0,0]=3 1272 B13R1.593 CN(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000750896 [0,1,0,0,0,0|2,0,0]=3 1273 B13R1.593 C[C@@H](O)CC(=O)CCC1CCCC1 1458a_100011933948_100000760354 [0,1,0,0,0,0|2,0,0]=3 1274 B13R1.593 C[C@@H](O)CC(=O)CCC1OCCO1 1458a_100011933948_100000740749 [0,1,0,0,0,0|2,0,0]=3 1275 B13R1.593 C[C@@H](O)CC(=O)CCN1CCCC1 1458a_100011933948_100000004467 [0,1,0,0,0,0|3,0,0]=4 1276 B13R1.593 C[C@@H](O)CC(=O)NCC1CCCC1 240690a_100000737975_100011933948 [0,1,0,0,0,0|2,0,0]=3 1277 B13R1.593 C[C@@H](O)CC(=O)NCC1CCOC1 240690a_100000737293_100011933948 [0,1,0,0,0,0|3,0,0]=4 1278 B13R1.593 C[C@@H](O)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011933948 [0,1,0,0,0,0|1,0,0]=2 1279 B13R1.593 C[C@@H](O)CC(=O)NNC1CCCC1 22a_100000737850_100011933948 [0,1,0,0,0,0|3,0,0]=4 1280 B13R1.593 C[S+](C)CC(=O)CCC1CCCC1 1458a_200159257847_100000760354 [0,1,0,0,0,0|3,0,0]=4 1281 B13R1.593 C[S+](C)CC(=O)CCC1OCCO1 1458a_200159257847_100000740749 [0,1,0,0,0,0|3,0,0]=4 1282 B13R1.593 C[S+](C)CC(=O)NCC1CCCC1 11a_100000737975_200159257847 [0,1,0,0,0,0|3,0,0]=4 1283 B13R1.593 C[S+](C)CC(=O)NCC1CCCC1 1626a_100000737975_200159257847 [0,1,0,0,0,0|3,0,0]=4 1284 B13R1.593 C[S+](C)CC(=O)NCC1CCCC1 240690a_100000737975_200159257847 [0,1,0,0,0,0|3,0,0]=4 1285 B13R1.593 C[S+](C)CC(=O)NCC1CCCC1 527a_100000737975_200159257847 [0,1,0,0,0,0|3,0,0]=4 1286 B13R1.593 C[S+](C)CC(=O)NCC1OCCO1 11a_100000036311_200159257847 [0,1,0,0,0,0|3,0,0]=4 1287 B13R1.593 C[S+](C)CC(=O)NCC1OCCO1 1626a_100000036311_200159257847 [0,1,0,0,0,0|3,0,0]=4 1288 B13R1.593 C[S+](C)CC(=O)NCC1OCCO1 527a_100000036311_200159257847 [0,1,0,0,0,0|3,0,0]=4 1289 B13R1.593 C[S+](C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_200159257847 [0,1,0,0,0,0|2,0,0]=3 1290 B13R1.593 C[S+](C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_200159257847 [0,1,0,0,0,0|2,0,0]=3 1291 B13R1.593 C[S+](C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_200159257847 [0,1,0,0,0,0|2,0,0]=3 1292 B13R1.593 C[S+](C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_200159257847 [0,1,0,0,0,0|2,0,0]=3 1293 B13R1.593 NC(=O)CC(=O)CCC1CCCO1 1458a_100011247709_100000187820 [0,1,0,0,0,0|2,0,1]=4 1294 B13R1.593 NC(=O)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100134613110 [0,1,0,0,0,0|2,0,1]=4 1295 B13R1.593 NC(=O)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100134613110 [0,1,0,0,0,0|2,0,1]=4 1296 B13R1.593 O=C(CCC1CCCC1)CC(F)F 1458a_100000211120_100011934356 [0,1,0,0,0,0|3,0,0]=4 1297 B13R1.593 O=C(CCC1CCCO1)CC(F)F 1458a_100011247709_100011934356 [0,1,0,0,0,0|2,0,0]=3 1298 B13R1.593 O=C(CCC1CCCO1)C[N+](=O)[O-] 1458a_100011247709_100000761209 [0,1,0,0,0,0|3,0,0]=4 1299 B13R1.593 O=C(CCC1OCCO1)CC(F)F 1458a_100000082924_100011934356 [0,1,0,0,0,0|3,0,0]=4 1300 B13R1.593 O=C(CCN1CCCO1)CC(F)F 1458a_200015187630_100011934356 [0,1,0,0,0,0|3,0,0]=4 1301 B13R1.593 O=C([O-])CC(=O)CCC1CCCO1 1458a_100011247709_100020667443 [0,1,0,0,0,0|2,0,1]=4 1302 B13R1.694 C#CC(CCC)OCC1CCCC1 34a_200011217317_100000740388 [0,1,0,0,0,0|2,0,1]=4 1303 B13R1.694 C#CC(CCC)OCC1CCCC1 7a_200011217317_100000740388 [0,1,0,0,0,0|2,0,1]=4 1304 B13R1.694 C#CC(CCC)OCC1CCCO1 7a_200011217317_100000203698 [0,1,0,0,0,0|1,0,1]=3 1305 B13R1.694 C#CC(CCC)OCC1OCCO1 34a_200011217317_100000755774 [0,1,0,0,0,0|2,0,1]=4 1306 B13R1.694 C#CC(CCC)OCC1OCCO1 7a_200011217317_100000755774 [0,1,0,0,0,0|2,0,1]=4 1307 B13R1.694 C=CC(CCC)OCC1CCCC1 34a_100011216692_100000740388 [0,1,0,0,0,0|2,0,1]=4 1308 B13R1.694 C=CC(CCC)OCC1CCCC1 7a_100011216692_100000740388 [0,1,0,0,0,0|2,0,1]=4 1309 B13R1.694 C=CC(CCC)OCC1CCCO1 7a_100011216692_100000203698 [0,1,0,0,0,0|1,0,1]=3 1310 B13R1.694 C=CC(CCC)OCC1OCCO1 34a_100011216692_100000755774 [0,1,0,0,0,0|2,0,1]=4 1311 B13R1.694 C=CC(CCC)OCC1OCCO1 7a_100011216692_100000755774 [0,1,0,0,0,0|2,0,1]=4 1312 B13R1.694 CCC(COC)OCC1CCCO1 7a_200011214946_100000203698 [0,1,0,0,0,0|2,0,1]=4 1313 B13R1.694 CCCC(C#N)OCC1CCCC1 34a_100000686963_100000740388 [0,1,0,0,0,0|2,0,1]=4 1314 B13R1.694 CCCC(C#N)OCC1CCCC1 7a_100000686963_100000740388 [0,1,0,0,0,0|2,0,1]=4 1315 B13R1.694 CCCC(C#N)OCC1CCCO1 7a_100000686963_100000203698 [0,1,0,0,0,0|1,0,1]=3 1316 B13R1.694 CCCC(C#N)OCC1OCCO1 34a_100000686963_100000755774 [0,1,0,0,0,0|2,0,1]=4 1317 B13R1.694 CCCC(C#N)OCC1OCCO1 7a_100000686963_100000755774 [0,1,0,0,0,0|2,0,1]=4 1318 B13R1.694 CCCC(CC)NCC1CCCO1 2230a_100000747048_100000203698 [0,1,0,0,0,0|2,0,1]=4 1319 B13R1.694 CCCC(CC)NC[C@@H]1CCCO1 270004a_100020590478_100000687865 [0,1,0,0,0,0|2,0,1]=4 1320 B13R1.694 CCCC(CC)OCC1CCCC1 34a_100000687864_100000740388 [0,1,0,0,0,0|2,0,1]=4 1321 B13R1.694 CCCC(CC)OCC1CCCC1 7a_100000687864_100000740388 [0,1,0,0,0,0|2,0,1]=4 1322 B13R1.694 CCCC(CC)OCC1CCCC1 7a_100000742336_100011219200 [0,1,0,0,0,0|2,0,1]=4 1323 B13R1.694 CCCC(CC)OCC1CCCO1 7a_100000210270_100011219200 [0,1,0,0,0,0|1,0,1]=3 1324 B13R1.694 CCCC(CC)OCC1CCCO1 7a_100000687864_100000203698 [0,1,0,0,0,0|1,0,1]=3 1325 B13R1.694 CCCC(CC)OCC1OCCO1 34a_100000687864_100000755774 [0,1,0,0,0,0|2,0,1]=4 1326 B13R1.694 CCCC(CC)OCC1OCCO1 7a_100000687864_100000755774 [0,1,0,0,0,0|2,0,1]=4 1327 B13R1.694 CCCC(CC)SCC1CCCO1 62a_100000203698_100011219200 [0,1,0,0,0,0|1,1,1]=4 1328 B13R1.694 CCCC(CC)SCC1CCCO1 62a_100011219200_100000203698 [0,1,0,0,0,0|1,1,1]=4 1329 B13R1.694 CCC[C@@H](CO)NCC1CCCO1 2230a_100000732646_100000203698 [0,1,0,0,0,0|1,0,2]=4 1330 B13R1.1330 CC(C)(CCBr)OCC1CCCO1 7a_100000702414_100000203698 [0,1,0,0,0,0|2,0,1]=4 1331 B13R1.1330 CCCC(C)(C)OCC1CCCC1 7a_100000748436_100000740388 [0,1,0,0,0,0|2,0,1]=4 1332 B13R1.1330 CCCC(C)(C)OCC1CCCO1 7a_100000748436_100000203698 [0,1,0,0,0,0|1,0,1]=3 1333 B13R1.1330 CCCC(C)(C)OCC1OCCO1 7a_100000748436_100000755774 [0,1,0,0,0,0|2,0,1]=4 1334 B13R1.1330 CCCS(=O)(=O)NCC1CCCC1 270084a_100000737975_100000211391 [0,1,0,0,0,0|3,0,0]=4 1335 B13R1.1330 CCCS(=O)(=O)NCC1CCCC1 274078a_100000737975_100000211391 [0,1,0,0,0,0|3,0,0]=4 1336 B13R1.1330 CCCS(=O)(=O)NCC1CCCC1 40a_100000737975_100000054278 [0,1,0,0,0,0|3,0,0]=4 1337 B13R1.1330 CCCS(=O)(=O)NCC1OCCO1 270084a_100000036311_100000211391 [0,1,0,0,0,0|3,0,0]=4 1338 B13R1.1330 CCCS(=O)(=O)NCC1OCCO1 274078a_100000036311_100000211391 [0,1,0,0,0,0|3,0,0]=4 1339 B13R1.1330 CCCS(=O)(=O)NCC1OCCO1 40a_100000036311_100000054278 [0,1,0,0,0,0|3,0,0]=4 1340 B13R1.1330 CCCS(=O)(=O)NC[C@@H]1CCCO1 270084a_100020590478_100000211391 [0,1,0,0,0,0|2,0,0]=3 1341 B13R1.1330 CCCS(=O)(=O)NC[C@@H]1CCCO1 274078a_100020590478_100000211391 [0,1,0,0,0,0|2,0,0]=3 1342 B13R1.1330 CCCS(=O)(=O)NC[C@@H]1CCCO1 40a_100020590478_100000054278 [0,1,0,0,0,0|2,0,0]=3 1343 B13R1.1330 O=S(=O)(CCBr)NC[C@@H]1CCCO1 270084a_100020590478_100000731045 [0,1,0,0,0,0|3,0,0]=4 1344 B13R1.1330 O=S(=O)(CCBr)NC[C@@H]1CCCO1 274078a_100020590478_100000731045 [0,1,0,0,0,0|3,0,0]=4 1345 B13R1.1330 O=S(=O)(CCCl)NC[C@@H]1CCCO1 270084a_100020590478_100000184613 [0,1,0,0,0,0|3,0,0]=4 1346 B13R1.1330 O=S(=O)(CCCl)NC[C@@H]1CCCO1 274078a_100020590478_100000184613 [0,1,0,0,0,0|3,0,0]=4 1347 B13R1.1483 CC1(OCCO1)CCC(=O)CCO 1458a_100011216618_100000758764 [0,1,0,0,0,0|3,0,0]=4 1348 B13R1.1483 CC1(OCCO1)CNC(=O)CCO 240690a_100000691740_100011216618 [0,1,0,0,0,0|3,0,0]=4 1349 B13R1.1483 CCCC(=O)CCC1(OCCO1)C 1458a_100000211992_100000758764 [0,1,0,0,0,0|2,0,0]=3 1350 B13R1.1483 CCCC(=O)COC1(CCCC1)C 7a_100000751722_100000747444 [0,1,0,0,0,0|3,0,0]=4 1351 B13R1.1483 CCCC(=O)NCC1(CCCC1)O 11a_100000737848_100000211992 [0,1,0,0,0,0|2,0,0]=3 1352 B13R1.1483 CCCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000211992 [0,1,0,0,0,0|2,0,0]=3 1353 B13R1.1483 CCCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000211992 [0,1,0,0,0,0|2,0,0]=3 1354 B13R1.1483 CCCC(=O)NCC1(CCCC1)O 527a_100000737848_100000211992 [0,1,0,0,0,0|2,0,0]=3 1355 B13R1.1483 CCCC(=O)NCC1(OCCO1)C 11a_100000691740_100000211992 [0,1,0,0,0,0|2,0,0]=3 1356 B13R1.1483 CCCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000211992 [0,1,0,0,0,0|2,0,0]=3 1357 B13R1.1483 CCCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000211992 [0,1,0,0,0,0|2,0,0]=3 1358 B13R1.1483 CCCC(=O)NCC1(OCCO1)C 527a_100000691740_100000211992 [0,1,0,0,0,0|2,0,0]=3 1359 B13R1.1483 CCCC(C)OCC1(CCCC1)N 34a_100000749328_100000766640 [0,1,0,0,0,0|2,0,1]=4 1360 B13R1.1483 CCCC(C)OC[C@@]1(CCCN1)C 34a_100016195882_100000766640 [0,1,0,0,0,0|2,0,1]=4 1361 B13R1.1483 CCNC(=O)NCC1(CCCC1)O 2708a_100000737848_100015525214 [0,1,0,0,0,0|3,0,0]=4 1362 B13R1.1483 CCNC(=O)NCC1(CCCC1)O 2708a_100015525214_100000737848 [0,1,0,0,0,0|3,0,0]=4 1363 B13R1.1483 CCNC(=O)NCC1(CCCC1)O 273464a_100015525214_100000737848 [0,1,0,0,0,0|3,0,0]=4 1364 B13R1.1483 CCNC(=O)NCC1(CCCC1)O 512a_100000737848_100015525214 [0,1,0,0,0,0|3,0,0]=4 1365 B13R1.1483 CCNC(=O)NCC1(CCCC1)O 512a_100015525214_100000737848 [0,1,0,0,0,0|3,0,0]=4 1366 B13R1.1483 CCNC(=O)NCC1(OCCO1)C 2708a_100000691740_100015525214 [0,1,0,0,0,0|3,0,0]=4 1367 B13R1.1483 CCNC(=O)NCC1(OCCO1)C 2708a_100015525214_100000691740 [0,1,0,0,0,0|3,0,0]=4 1368 B13R1.1483 CCNC(=O)NCC1(OCCO1)C 273464a_100000691740_100015525214 [0,1,0,0,0,0|3,0,0]=4 1369 B13R1.1483 CCNC(=O)NCC1(OCCO1)C 273464a_100015525214_100000691740 [0,1,0,0,0,0|3,0,0]=4 1370 B13R1.1483 CCNC(=O)NCC1(OCCO1)C 512a_100000691740_100015525214 [0,1,0,0,0,0|3,0,0]=4 1371 B13R1.1483 CCNC(=O)NCC1(OCCO1)C 512a_100015525214_100000691740 [0,1,0,0,0,0|3,0,0]=4 1372 B13R1.1483 COCC(=O)CCC1(OCCO1)C 1458a_100000210968_100000758764 [0,1,0,0,0,0|3,0,0]=4 1373 B13R1.1483 COCC(=O)NCC1(CCCC1)O 11a_100000737848_100000210968 [0,1,0,0,0,0|3,0,0]=4 1374 B13R1.1483 COCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000210968 [0,1,0,0,0,0|3,0,0]=4 1375 B13R1.1483 COCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000210968 [0,1,0,0,0,0|3,0,0]=4 1376 B13R1.1483 COCC(=O)NCC1(CCCC1)O 527a_100000737848_100000210968 [0,1,0,0,0,0|3,0,0]=4 1377 B13R1.1483 COCC(=O)NCC1(OCCO1)C 11a_100000691740_100000210968 [0,1,0,0,0,0|3,0,0]=4 1378 B13R1.1483 COCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000210968 [0,1,0,0,0,0|3,0,0]=4 1379 B13R1.1483 COCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000210968 [0,1,0,0,0,0|3,0,0]=4 1380 B13R1.1483 COCC(=O)NCC1(OCCO1)C 527a_100000691740_100000210968 [0,1,0,0,0,0|3,0,0]=4 1381 B13R1.1483 CSCC(=O)CCC1(OCCO1)C 1458a_100000184570_100000758764 [0,1,0,0,0,0|3,0,0]=4 1382 B13R1.1483 CSCC(=O)NCC1(CCCC1)O 11a_100000737848_100000184570 [0,1,0,0,0,0|3,0,0]=4 1383 B13R1.1483 CSCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000184570 [0,1,0,0,0,0|3,0,0]=4 1384 B13R1.1483 CSCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000184570 [0,1,0,0,0,0|3,0,0]=4 1385 B13R1.1483 CSCC(=O)NCC1(CCCC1)O 527a_100000737848_100000184570 [0,1,0,0,0,0|3,0,0]=4 1386 B13R1.1483 CSCC(=O)NCC1(OCCO1)C 11a_100000691740_100000184570 [0,1,0,0,0,0|3,0,0]=4 1387 B13R1.1483 CSCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000184570 [0,1,0,0,0,0|3,0,0]=4 1388 B13R1.1483 CSCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000184570 [0,1,0,0,0,0|3,0,0]=4 1389 B13R1.1483 CSCC(=O)NCC1(OCCO1)C 527a_100000691740_100000184570 [0,1,0,0,0,0|3,0,0]=4 1390 B13R1.1483 O=C(CCO)NCC1(CCCC1)O 240690a_100000737848_100011216618 [0,1,0,0,0,0|3,0,0]=4 1391 B11R0.4 C#CCC(=O)CCCCCCO 1458a_100011220946_100000766143 [0,0,1,0,0,0|1,0,2]=4 1392 B11R0.4 C#CCC(=O)CCCCCCO 1458a_100011996774_100000184674 [0,0,1,0,0,0|1,0,2]=4 1393 B11R0.4 C#CCC(=O)NCCOCCC 1626a_100161115042_100011220946 [0,0,1,0,0,0|1,0,2]=4 1394 B11R0.4 C#CCC(=O)NCCOCCC 527a_100161115042_100011220946 [0,0,1,0,0,0|1,0,2]=4 1395 B11R0.4 C#CCCCCCC(=O)CCC 1458a_100000211992_100012094781 [0,0,1,0,0,0|2,0,1]=4 1396 B11R0.4 C#CCCCCCC(=O)CCC 1458a_100000694772_100000210303 [0,0,1,0,0,0|2,0,1]=4 1397 B11R0.4 C#CCCCCNC(=O)CCC 11a_100000706060_100000211992 [0,0,1,0,0,0|2,0,1]=4 1398 B11R0.4 C#CCCCCNC(=O)CCC 1626a_100000706060_100000211992 [0,0,1,0,0,0|2,0,1]=4 1399 B11R0.4 C#CCCCCNC(=O)CCC 240690a_100000706060_100000211992 [0,0,1,0,0,0|2,0,1]=4 1400 B11R0.4 C#CCCCCNC(=O)CCC 527a_100000706060_100000211992 [0,0,1,0,0,0|2,0,1]=4 1401 B11R0.4 C#CCCNCOC(=O)CCC 34a_100000755551_100000034017 [0,0,1,0,0,0|2,0,1]=4 1402 B11R0.4 C#CCCOCOC(=O)CCC 34a_100011215631_100000034017 [0,0,1,0,0,0|2,0,1]=4 1403 B11R0.4 C#CCCSCOC(=O)CCC 62a_100000688953_100000034017 [0,0,1,0,0,0|2,0,1]=4 1404 B11R0.4 C#CCOCCNC(=O)CCC 11a_100000700922_100000211992 [0,0,1,0,0,0|1,0,2]=4 1405 B11R0.4 C#CCOCCNC(=O)CCC 1626a_100000700922_100000211992 [0,0,1,0,0,0|1,0,2]=4 1406 B11R0.4 C#CCOCCNC(=O)CCC 240690a_100000700922_100000211992 [0,0,1,0,0,0|1,0,2]=4 1407 B11R0.4 C#CCOCCNC(=O)CCC 527a_100000700922_100000211992 [0,0,1,0,0,0|1,0,2]=4 1408 B11R0.4 C=CCC(=O)CCCCCCO 1458a_100000210193_100000766143 [0,0,1,0,0,0|1,0,2]=4 1409 B11R0.4 C=CCC(=O)CCCCCCO 1458a_100011996774_100000210623 [0,0,1,0,0,0|1,0,2]=4 1410 B11R0.4 C=CCC(=O)NCCCCCO 240690a_100000762737_100000210193 [0,0,1,0,0,0|1,0,2]=4 1411 B11R0.4 C=CCC(=O)NCCOCCC 1626a_100161115042_100000210193 [0,0,1,0,0,0|1,0,2]=4 1412 B11R0.4 C=CCC(=O)NCCOCCC 240690a_100161115042_100000210193 [0,0,1,0,0,0|1,0,2]=4 1413 B11R0.4 C=CCC(=O)NCCOCCC 527a_100161115042_100000210193 [0,0,1,0,0,0|1,0,2]=4 1414 B11R0.4 C=CCCCCCC(=O)CCC 1458a_100000211992_100000700193 [0,0,1,0,0,0|2,0,1]=4 1415 B11R0.4 C=CCCCCCC(=O)CCC 1458a_100011934241_100000210303 [0,0,1,0,0,0|2,0,1]=4 1416 B11R0.4 C=CCCCCNC(=O)CCC 11a_100000703577_100000211992 [0,0,1,0,0,0|2,0,1]=4 1417 B11R0.4 C=CCCCCNC(=O)CCC 1626a_100000703577_100000211992 [0,0,1,0,0,0|2,0,1]=4 1418 B11R0.4 C=CCCCCNC(=O)CCC 240690a_100000703577_100000211992 [0,0,1,0,0,0|2,0,1]=4 1419 B11R0.4 C=CCCCCNC(=O)CCC 527a_100000703577_100000211992 [0,0,1,0,0,0|2,0,1]=4 1420 B11R0.4 C=CCCNCOC(=O)CCC 2230a_100015191253_100000034017 [0,0,1,0,0,0|2,0,1]=4 1421 B11R0.4 C=CCCOCOC(=O)CCC 34a_100011205117_100000034017 [0,0,1,0,0,0|2,0,1]=4 1422 B11R0.4 C=CCCSCOC(=O)CCC 62a_100000754431_100000034017 [0,0,1,0,0,0|2,0,1]=4 1423 B11R0.4 CC#CC(=O)CCCCCCO 1458a_100000763181_100000766143 [0,0,1,0,0,0|1,0,2]=4 1424 B11R0.4 CC(CCBr)OCCCCCO 34a_100012276601_100000746330 [0,0,1,0,0,0|2,0,1]=4 1425 B11R0.4 CC=CC(=O)CCCCCCO 1458a_100000210699_100000766143 [0,0,1,0,0,0|1,0,2]=4 1426 B11R0.4 CC=CC(=O)NCCCCCO 240690a_100000762737_100000210699 [0,0,1,0,0,0|1,0,2]=4 1427 B11R0.4 CC=CC(=O)NCCOCCC 1626a_100161115042_100000210699 [0,0,1,0,0,0|1,0,2]=4 1428 B11R0.4 CC=CC(=O)NCCOCCC 240690a_100161115042_100000210699 [0,0,1,0,0,0|1,0,2]=4 1429 B11R0.4 CCCC(=O)CCCCCC#N 1458a_100000211992_100009813376 [0,0,1,0,0,0|2,0,1]=4 1430 B11R0.4 CCCC(=O)CCCCCCF 1458a_100000211992_100015922095 [0,0,1,0,0,0|2,0,0]=3 1431 B11R0.4 CCCC(=O)CCCCCCO 1458a_100000211992_100000766143 [0,0,1,0,0,0|1,0,0]=2 1432 B11R0.4 CCCC(=O)CCCCCCO 1458a_100011996774_100000210303 [0,0,1,0,0,0|1,0,0]=2 1433 B11R0.4 CCCC(=O)CCCCCOC 1458a_100011935119_100000210303 [0,0,1,0,0,0|3,0,0]=4 1434 B11R0.4 CCCC(=O)CNCCCCO 2230a_100000750430_100000747444 [0,0,1,0,0,0|2,0,0]=3 1435 B11R0.4 CCCC(=O)COCCCCCl 7a_100000210776_100000747444 [0,0,1,0,0,0|3,0,0]=4 1436 B11R0.4 CCCC(=O)COCCCCF 7a_100011995726_100000747444 [0,0,1,0,0,0|3,0,0]=4 1437 B11R0.4 CCCC(=O)CSCCCCF 62a_100000729493_100000747444 [0,0,1,0,0,0|3,0,0]=4 1438 B11R0.4 CCCC(=O)CSCCCCF 62a_100000747444_100000729493 [0,0,1,0,0,0|3,0,0]=4 1439 B11R0.4 CCCC(=O)CSCCCCO 62a_100000210776_100000747444 [0,0,1,0,0,0|2,0,0]=3 1440 B11R0.4 CCCC(=O)CSCCCCO 62a_100000747444_100000210776 [0,0,1,0,0,0|2,0,0]=3 1441 B11R0.4 CCCC(=O)NCCCCC#N 11a_100000751965_100000211992 [0,0,1,0,0,0|2,0,1]=4 1442 B11R0.4 CCCC(=O)NCCCCC#N 1626a_100000751965_100000211992 [0,0,1,0,0,0|2,0,1]=4 1443 B11R0.4 CCCC(=O)NCCCCC#N 240690a_100000751965_100000211992 [0,0,1,0,0,0|2,0,1]=4 1444 B11R0.4 CCCC(=O)NCCCCC#N 527a_100000751965_100000211992 [0,0,1,0,0,0|2,0,1]=4 1445 B11R0.4 CCCC(=O)NCCCCCO 240690a_100000762737_100000211992 [0,0,1,0,0,0|1,0,0]=2 1446 B11R0.4 CCCC(=O)NCCCOCC 11a_100000210961_100000211992 [0,0,1,0,0,0|3,0,0]=4 1447 B11R0.4 CCCC(=O)NCCCOCC 1626a_100000210961_100000211992 [0,0,1,0,0,0|3,0,0]=4 1448 B11R0.4 CCCC(=O)NCCCOCC 240690a_100000210961_100000211992 [0,0,1,0,0,0|3,0,0]=4 1449 B11R0.4 CCCC(=O)NCCCOCC 527a_100000210961_100000211992 [0,0,1,0,0,0|3,0,0]=4 1450 B11R0.4 CCCC(=O)NCCOCCO 240690a_100000211614_100000211992 [0,0,1,0,0,0|2,0,0]=3 1451 B11R0.4 CCCC(=O)NCCSCCO 240690a_100011219999_100000211992 [0,0,1,0,0,0|2,0,0]=3 1452 B11R0.4 CCCC(=O)NCCSCCO 527a_100011219999_100000211992 [0,0,1,0,0,0|2,0,0]=3 1453 B11R0.4 CCCC(=O)OCNCCCF 2230a_100015189416_100000034017 [0,0,1,0,0,0|2,0,0]=3 1454 B11R0.4 CCCC(=O)OCNCCCF 34a_100015189416_100000034017 [0,0,1,0,0,0|2,0,0]=3 1455 B11R0.4 CCCC(=O)OCNCCOC 2230a_100000209980_100000034017 [0,0,1,0,0,0|3,0,0]=4 1456 B11R0.4 CCCC(=O)OCNCCSC 2230a_100020590264_100000034017 [0,0,1,0,0,0|3,0,0]=4 1457 B11R0.4 CCCC(=O)OCOCCCBr 34a_100011217188_100000034017 [0,0,1,0,0,0|2,0,0]=3 1458 B11R0.4 CCCC(=O)OCOCCCCl 34a_100000230001_100000034017 [0,0,1,0,0,0|2,0,0]=3 1459 B11R0.4 CCCC(=O)OCOCCCF 34a_100000759539_100000034017 [0,0,1,0,0,0|2,0,0]=3 1460 B11R0.4 CCCC(=O)OCOCCCN 34a_100000182051_100000034017 [0,0,1,0,0,0|2,0,0]=3 1461 B11R0.4 CCCC(=O)OCOCCOC 34a_100000210237_100000034017 [0,0,1,0,0,0|3,0,0]=4 1462 B11R0.4 CCCC(=O)OCOCCON 34a_100000700252_100000034017 [0,0,1,0,0,0|3,0,0]=4 1463 B11R0.4 CCCC(=O)OCOCCSC 34a_100000230434_100000034017 [0,0,1,0,0,0|3,0,0]=4 1464 B11R0.4 CCCC(=O)OCSCCC#N 62a_100011215226_100000034017 [0,0,1,0,0,0|2,0,1]=4 1465 B11R0.4 CCCC(=O)OCSCCCF 62a_100011934791_100000034017 [0,0,1,0,0,0|2,0,0]=3 1466 B11R0.4 CCCC(=O)OCSCCCO 62a_100011215043_100000034017 [0,0,1,0,0,0|1,0,0]=2 1467 B11R0.4 CCCC(=O)OCSCCOC 62a_100000233755_100000034017 [0,0,1,0,0,0|3,0,0]=4 1468 B11R0.4 CCCC(=O)OCSCCSC 62a_100000212216_100000034017 [0,0,1,0,0,0|3,0,0]=4 1469 B11R0.4 CCCC(=O)OCSCOCC 62a_100000739092_100000034017 [0,0,1,0,0,0|3,0,0]=4 1470 B11R0.4 CCCC(C)NCCCCCO 2230a_100000741246_100000746330 [0,0,1,0,0,0|2,0,1]=4 1471 B11R0.4 CCCC(C)NCCCCCO 2230a_100000762737_100000766640 [0,0,1,0,0,0|2,0,1]=4 1472 B11R0.4 CCCC(C)NCCCCCO 270004a_100000762737_100000211909 [0,0,1,0,0,0|2,0,1]=4 1473 B11R0.4 CCCC(C)NCCCCCO 34a_100000762737_100000766640 [0,0,1,0,0,0|2,0,1]=4 1474 B11R0.4 CCCC(C)OCCCCCBr 34a_100000746331_100000766640 [0,0,1,0,0,0|2,0,1]=4 1475 B11R0.4 CCCC(C)OCCCCCBr 7a_100000746331_100000766640 [0,0,1,0,0,0|2,0,1]=4 1476 B11R0.4 CCCC(C)OCCCCCCl 34a_100000746330_100000766640 [0,0,1,0,0,0|2,0,1]=4 1477 B11R0.4 CCCC(C)OCCCCCCl 7a_100000746330_100000766640 [0,0,1,0,0,0|2,0,1]=4 1478 B11R0.4 CCCC(C)OCCCCCF 34a_100000764384_100000729378 [0,0,1,0,0,0|2,0,1]=4 1479 B11R0.4 CCCC(C)OCCCCCF 7a_100000764384_100000729378 [0,0,1,0,0,0|2,0,1]=4 1480 B11R0.4 CCCC(C)OCCCCCI 34a_200012148887_100000766640 [0,0,1,0,0,0|2,0,1]=4 1481 B11R0.4 CCCC(C)OCCCCCI 7a_200012148887_100000766640 [0,0,1,0,0,0|2,0,1]=4 1482 B11R0.4 CCCC(C)OCCCCCN 34a_100000762737_100000766640 [0,0,1,0,0,0|2,0,1]=4 1483 B11R0.4 CCCC(C)OCCCCCO 34a_100000764384_100000746330 [0,0,1,0,0,0|1,0,1]=3 1484 B11R0.4 CCCC(C)OCCCCCO 7a_100000764384_100000746330 [0,0,1,0,0,0|1,0,1]=3 1485 B11R0.4 CCCC(C)OCCOCCBr 34a_100000692535_100000766640 [0,0,1,0,0,0|2,0,1]=4 1486 B11R0.4 CCCC(C)OCCOCCBr 7a_100000692535_100000766640 [0,0,1,0,0,0|2,0,1]=4 1487 B11R0.4 CCCC(C)OCCOCCCl 34a_100011215305_100000766640 [0,0,1,0,0,0|2,0,1]=4 1488 B11R0.4 CCCC(C)OCCOCCCl 7a_100011215305_100000766640 [0,0,1,0,0,0|2,0,1]=4 1489 B11R0.4 CCCC(C)OCCOCCF 34a_200015357709_100000766640 [0,0,1,0,0,0|2,0,1]=4 1490 B11R0.4 CCCC(C)OCCOCCF 7a_200015357709_100000766640 [0,0,1,0,0,0|2,0,1]=4 1491 B11R0.4 CCCC(C)OCCOCCI 34a_100012149058_100000766640 [0,0,1,0,0,0|2,0,1]=4 1492 B11R0.4 CCCC(C)OCCOCCI 7a_100012149058_100000766640 [0,0,1,0,0,0|2,0,1]=4 1493 B11R0.4 CCCC(C)OCCOCCN 34a_100000211614_100000766640 [0,0,1,0,0,0|2,0,1]=4 1494 B11R0.4 CCCC(C)OCCOCCO 34a_100000764384_100000692535 [0,0,1,0,0,0|2,0,1]=4 1495 B11R0.4 CCCC(C)OCCOCCO 7a_100000764384_100011215305 [0,0,1,0,0,0|2,0,1]=4 1496 B11R0.4 CCCC(C)SCCCCCO 62a_100000746330_100000766640 [0,0,1,0,0,0|1,1,1]=4 1497 B11R0.4 CCCC(C)SCCCCCO 62a_100000766640_100000746330 [0,0,1,0,0,0|1,1,1]=4 1498 B11R0.4 CCCCCC#CC(=O)CCC 1458a_100011215388_100000210303 [0,0,1,0,0,0|2,0,1]=4 1499 B11R0.4 CCCCCC=CC(=O)CCC 1458a_100016263427_100000210303 [0,0,1,0,0,0|2,0,1]=4 1500 B11R0.4 CCCCCCCC(=O)CCC 1458a_100000211969_100000210303 [0,0,1,0,0,0|2,0,0]=3 1501 B11R0.4 CCCCCCCC(=O)CCC 1458a_100000211992_100000210614 [0,0,1,0,0,0|2,0,0]=3 1502 B11R0.4 CCCCCCCC(=O)CCF 1458a_100000211969_100011217306 [0,0,1,0,0,0|3,0,0]=4 1503 B11R0.4 CCCCCCCC(=O)CCO 1458a_100000211969_100000211926 [0,0,1,0,0,0|3,0,0]=4 1504 B11R0.4 CCCCCCCC(=O)CCO 1458a_100011216618_100000210614 [0,0,1,0,0,0|3,0,0]=4 1505 B11R0.4 CCCCCCCC(=O)COC 1458a_100000210968_100000210614 [0,0,1,0,0,0|3,0,0]=4 1506 B11R0.4 CCCCCCCC(=O)CSC 1458a_100000184570_100000210614 [0,0,1,0,0,0|3,0,0]=4 1507 B11R0.4 CCCCCCCC(=O)NCC 11a_100015525214_100000211969 [0,0,1,0,0,0|3,0,0]=4 1508 B11R0.4 CCCCCCCC(=O)NCC 240690a_100015525214_100000211969 [0,0,1,0,0,0|3,0,0]=4 1509 B11R0.4 CCCCCCCC(=O)NCC 527a_100015525214_100000211969 [0,0,1,0,0,0|3,0,0]=4 1510 B11R0.4 CCCCCCNC(=O)CCC 11a_100000210581_100000211992 [0,0,1,0,0,0|2,0,0]=3 1511 B11R0.4 CCCCCCNC(=O)CCC 1626a_100000210581_100000211992 [0,0,1,0,0,0|2,0,0]=3 1512 B11R0.4 CCCCCCNC(=O)CCC 240690a_100000210581_100000211992 [0,0,1,0,0,0|2,0,0]=3 1513 B11R0.4 CCCCCCNC(=O)CCC 527a_100000210581_100000211992 [0,0,1,0,0,0|2,0,0]=3 1514 B11R0.4 CCCCCCNC(=O)CCO 240690a_100000210581_100011216618 [0,0,1,0,0,0|3,0,0]=4 1515 B11R0.4 CCCCCCNC(=O)CNC 2230a_106832991635_100000230325 [0,0,1,0,0,0|3,0,0]=4 1516 B11R0.4 CCCCCCNC(=O)CNC 34a_100102657272_100000230325 [0,0,1,0,0,0|3,0,0]=4 1517 B11R0.4 CCCCCCNC(=O)CNC 7a_106832991635_100000230325 [0,0,1,0,0,0|3,0,0]=4 1518 B11R0.4 CCCCCCNC(=O)COC 11a_100000210581_100000210968 [0,0,1,0,0,0|3,0,0]=4 1519 B11R0.4 CCCCCCNC(=O)COC 1626a_100000210581_100000210968 [0,0,1,0,0,0|3,0,0]=4 1520 B11R0.4 CCCCCCNC(=O)COC 240690a_100000210581_100000210968 [0,0,1,0,0,0|3,0,0]=4 1521 B11R0.4 CCCCCCNC(=O)COC 34a_100138415774_100000230325 [0,0,1,0,0,0|3,0,0]=4 1522 B11R0.4 CCCCCCNC(=O)COC 527a_100000210581_100000210968 [0,0,1,0,0,0|3,0,0]=4 1523 B11R0.4 CCCCCCNC(=O)CSC 11a_100000210581_100000184570 [0,0,1,0,0,0|3,0,0]=4 1524 B11R0.4 CCCCCCNC(=O)CSC 1626a_100000210581_100000184570 [0,0,1,0,0,0|3,0,0]=4 1525 B11R0.4 CCCCCCNC(=O)CSC 240690a_100000210581_100000184570 [0,0,1,0,0,0|3,0,0]=4 1526 B11R0.4 CCCCCCNC(=O)CSC 527a_100000210581_100000184570 [0,0,1,0,0,0|3,0,0]=4 1527 B11R0.4 CCCCCCNC(=O)CSC 62a_100000230325_200000210301 [0,0,1,0,0,0|3,0,0]=4 1528 B11R0.4 CCCCCCNC(=O)CS[13CH3] 62a_100000230325_200025704644 [0,0,1,0,0,0|3,0,0]=4 1529 B11R0.4 CCCCCCNC(=O)NCC 2708a_100000210581_100015525214 [0,0,1,0,0,0|3,0,0]=4 1530 B11R0.4 CCCCCCNC(=O)NCC 2708a_100015525214_100000210581 [0,0,1,0,0,0|3,0,0]=4 1531 B11R0.4 CCCCCCNC(=O)NCC 273464a_100000210581_100015525214 [0,0,1,0,0,0|3,0,0]=4 1532 B11R0.4 CCCCCCNC(=O)NCC 273464a_100015525214_100000210581 [0,0,1,0,0,0|3,0,0]=4 1533 B11R0.4 CCCCCCNC(=O)NCC 512a_100000210581_100015525214 [0,0,1,0,0,0|3,0,0]=4 1534 B11R0.4 CCCCCCNC(=O)NCC 512a_100015525214_100000210581 [0,0,1,0,0,0|3,0,0]=4 1535 B11R0.4 CCCCCCOC(C)CCC 34a_100000210259_100000766640 [0,0,1,0,0,0|2,0,1]=4 1536 B11R0.4 CCCCCCOC(C)CCC 34a_100000764384_100000210314 [0,0,1,0,0,0|2,0,1]=4 1537 B11R0.4 CCCCCCOC(C)CCC 7a_100000210259_100000766640 [0,0,1,0,0,0|2,0,1]=4 1538 B11R0.4 CCCCCCOC(C)CCC 7a_100000764384_100000210314 [0,0,1,0,0,0|2,0,1]=4 1539 B11R0.4 CCCCCNCC(=O)CCC 2230a_100000209983_100000747444 [0,0,1,0,0,0|3,0,0]=4 1540 B11R0.4 CCCCCNNC(=O)CCC 22a_100000694160_100000211992 [0,0,1,0,0,0|3,0,0]=4 1541 B11R0.4 CCCCCOCC(=O)CCC 7a_100000210253_100000747444 [0,0,1,0,0,0|3,0,0]=4 1542 B11R0.4 CCCCCSCC(=O)CCC 62a_100000210326_100000747444 [0,0,1,0,0,0|3,0,0]=4 1543 B11R0.4 CCCCCSCC(=O)CCC 62a_100000747444_100000210326 [0,0,1,0,0,0|3,0,0]=4 1544 B11R0.4 CCCCNCOC(=O)CCC 2230a_100000102301_100000034017 [0,0,1,0,0,0|2,0,0]=3 1545 B11R0.4 CCCCOCCC(=O)CCC 1458a_100000211992_100000743108 [0,0,1,0,0,0|3,0,0]=4 1546 B11R0.4 CCCCOCOC(=O)CCC 34a_100000210227_100000034017 [0,0,1,0,0,0|2,0,0]=3 1547 B11R0.4 CCCCSCOC(=O)CCC 62a_100000210211_100000034017 [0,0,1,0,0,0|2,0,0]=3 1548 B11R0.4 CCCCSCOC(=O)OCC 62a_100000210211_100000075025 [0,0,1,0,0,0|3,0,0]=4 1549 B11R0.4 CCCN(C)CCCCCCO 2230a_100000747261_100000766143 [0,0,1,0,0,0|3,0,0]=4 1550 B11R0.4 CCCN(C)CCCCCCO 269982a_100000747261_100000766143 [0,0,1,0,0,0|3,0,0]=4 1551 B11R0.4 CCCOC/C=C/C(=O)OCC 34a_100000210258_100016267167 [0,0,1,0,0,0|2,0,1]=4 1552 B11R0.4 CCCOCCCC(=O)OCC 34a_100000210258_100009991533 [0,0,1,0,0,0|2,0,0]=3 1553 B11R0.4 CCCOCCCC(=O)OCC 7a_100012001163_100000210303 [0,0,1,0,0,0|2,0,0]=3 1554 B11R0.4 CCCOCCCC(C)CCC 34a_100011713154_100000210303 [0,0,1,0,0,0|2,0,1]=4 1555 B11R0.4 CCCOCCCC(C)CCC 7a_100011713154_100000210303 [0,0,1,0,0,0|2,0,1]=4 1556 B11R0.4 CCCOCCNC(=O)CC#N 1626a_100161115042_100051588842 [0,0,1,0,0,0|2,0,1]=4 1557 B11R0.4 CCCOCCNC(=O)CC#N 240690a_100161115042_100051588842 [0,0,1,0,0,0|2,0,1]=4 1558 B11R0.4 CCCOCCNC(=O)CCC 1626a_100161115042_100000211992 [0,0,1,0,0,0|1,0,0]=2 1559 B11R0.4 CCCOCCNC(=O)CCC 240690a_100161115042_100000211992 [0,0,1,0,0,0|1,0,0]=2 1560 B11R0.4 CCCOCCNC(=O)CCC 527a_100161115042_100000211992 [0,0,1,0,0,0|1,0,0]=2 1561 B11R0.4 CCCOCCNC(=O)CCO 240690a_100161115042_100011216618 [0,0,1,0,0,0|2,0,0]=3 1562 B11R0.4 CCCOCCNC(=O)COC 1626a_100161115042_100000210968 [0,0,1,0,0,0|2,0,0]=3 1563 B11R0.4 CCCOCCNC(=O)COC 240690a_100161115042_100000210968 [0,0,1,0,0,0|2,0,0]=3 1564 B11R0.4 CCCOCCNC(=O)COC 527a_100161115042_100000210968 [0,0,1,0,0,0|2,0,0]=3 1565 B11R0.4 CCCOCCNC(=O)CSC 1626a_100161115042_100000184570 [0,0,1,0,0,0|2,0,0]=3 1566 B11R0.4 CCCOCCNC(=O)CSC 240690a_100161115042_100000184570 [0,0,1,0,0,0|2,0,0]=3 1567 B11R0.4 CCCOCCNC(=O)CSC 527a_100161115042_100000184570 [0,0,1,0,0,0|2,0,0]=3 1568 B11R0.4 CCCOCCNC(=O)NCC 2708a_100015525214_100161115042 [0,0,1,0,0,0|2,0,0]=3 1569 B11R0.4 CCCOCCNC(=O)NCC 2708a_100161115042_100015525214 [0,0,1,0,0,0|2,0,0]=3 1570 B11R0.4 CCCOCCNC(=O)NCC 273464a_100015525214_100161115042 [0,0,1,0,0,0|2,0,0]=3 1571 B11R0.4 CCCOCCNC(=O)NCC 273464a_100161115042_100015525214 [0,0,1,0,0,0|2,0,0]=3 1572 B11R0.4 CCCOCCNC(=O)NCC 512a_100015525214_100161115042 [0,0,1,0,0,0|2,0,0]=3 1573 B11R0.4 CCCOCCNC(=O)NCC 512a_100161115042_100015525214 [0,0,1,0,0,0|2,0,0]=3 1574 B11R0.4 CCCOCCNC(=O)NNC 273464a_100161115042_100016993582 [0,0,1,0,0,0|3,0,0]=4 1575 B11R0.4 CCCOCCNC(=O)NNC 512a_100016993582_100161115042 [0,0,1,0,0,0|3,0,0]=4 1576 B11R0.4 CCCOCCNC(=O)NNC 512a_100161115042_100016993582 [0,0,1,0,0,0|3,0,0]=4 1577 B11R0.4 CCCOCCNC(=O)OCC 34a_100000158857_100000210303 [0,0,1,0,0,0|2,0,0]=3 1578 B11R0.4 CCCOCCNC(C)CCC 2230a_100000741246_100011215938 [0,0,1,0,0,0|2,0,1]=4 1579 B11R0.4 CCCOCCNC(C)CCC 2230a_100161115042_100000766640 [0,0,1,0,0,0|2,0,1]=4 1580 B11R0.4 CCCOCCNC(C)CCC 270004a_100161115042_100000211909 [0,0,1,0,0,0|2,0,1]=4 1581 B11R0.4 CCCOCCNC(C)CCC 34a_100161115042_100000766640 [0,0,1,0,0,0|2,0,1]=4 1582 B11R0.4 CCCOCCOC(C)CCBr 34a_100012276601_100011215938 [0,0,1,0,0,0|2,0,1]=4 1583 B11R0.4 CCCOCCOC(C)CCC 34a_100000752267_100000766640 [0,0,1,0,0,0|1,0,1]=3 1584 B11R0.4 CCCOCCOC(C)CCC 34a_100000764384_100011215938 [0,0,1,0,0,0|1,0,1]=3 1585 B11R0.4 CCCOCCOC(C)CCC 7a_100000752267_100000766640 [0,0,1,0,0,0|1,0,1]=3 1586 B11R0.4 CCCOCCOC(C)CCC 7a_100000764384_100011215938 [0,0,1,0,0,0|1,0,1]=3 1587 B11R0.4 CCCOCCOC(C)CCO 34a_100000752267_100009893172 [0,0,1,0,0,0|2,0,1]=4 1588 B11R0.4 CCCOCCOC(C)CCO 7a_100000752267_100009893172 [0,0,1,0,0,0|2,0,1]=4 1589 B11R0.4 CCCOCCOC(C)COC 34a_100000752267_100000765312 [0,0,1,0,0,0|2,0,1]=4 1590 B11R0.4 CCCOCCOC(C)COC 7a_100000752267_100000765312 [0,0,1,0,0,0|2,0,1]=4 1591 B11R0.4 CCCOCCO[C@H](C)COC 34a_100011934205_100011215938 [0,0,1,0,0,0|2,0,1]=4 1592 B11R0.4 CCCOCCSC(C)CCC 62a_100000766640_100011215938 [0,0,1,0,0,0|1,1,1]=4 1593 B11R0.4 CCCOCCSC(C)CCC 62a_100011215938_100000766640 [0,0,1,0,0,0|1,1,1]=4 1594 B11R0.4 CCCSCCCC(=O)OCC 62a_100000210303_100009991533 [0,0,1,0,0,0|2,1,0]=4 1595 B11R0.4 CCCSCCCC(=O)OCC 62a_100009991533_100000210303 [0,0,1,0,0,0|2,1,0]=4 1596 B11R0.4 CCCSCCNC(=O)CCC 11a_100020603323_100000211992 [0,0,1,0,0,0|1,1,0]=3 1597 B11R0.4 CCCSCCNC(=O)CCC 240690a_100020603323_100000211992 [0,0,1,0,0,0|1,1,0]=3 1598 B11R0.4 CCCSCCNC(=O)CCC 527a_100020603323_100000211992 [0,0,1,0,0,0|1,1,0]=3 1599 B11R0.4 CCCSCCNC(=O)CCO 240690a_100020603323_100011216618 [0,0,1,0,0,0|2,1,0]=4 1600 B11R0.4 CCCSCCNC(=O)COC 11a_100020603323_100000210968 [0,0,1,0,0,0|2,1,0]=4 1601 B11R0.4 CCCSCCNC(=O)COC 240690a_100020603323_100000210968 [0,0,1,0,0,0|2,1,0]=4 1602 B11R0.4 CCCSCCNC(=O)COC 527a_100020603323_100000210968 [0,0,1,0,0,0|2,1,0]=4 1603 B11R0.4 CCCSCCNC(=O)CSC 11a_100020603323_100000184570 [0,0,1,0,0,0|2,1,0]=4 1604 B11R0.4 CCCSCCNC(=O)CSC 240690a_100020603323_100000184570 [0,0,1,0,0,0|2,1,0]=4 1605 B11R0.4 CCCSCCNC(=O)CSC 527a_100020603323_100000184570 [0,0,1,0,0,0|2,1,0]=4 1606 B11R0.4 CCCSCCNC(=O)NCC 2708a_100015525214_100020603323 [0,0,1,0,0,0|2,1,0]=4 1607 B11R0.4 CCCSCCNC(=O)NCC 2708a_100020603323_100015525214 [0,0,1,0,0,0|2,1,0]=4 1608 B11R0.4 CCCSCCNC(=O)NCC 273464a_100015525214_100020603323 [0,0,1,0,0,0|2,1,0]=4 1609 B11R0.4 CCCSCCNC(=O)NCC 273464a_100020603323_100015525214 [0,0,1,0,0,0|2,1,0]=4 1610 B11R0.4 CCCSCCNC(=O)NCC 512a_100015525214_100020603323 [0,0,1,0,0,0|2,1,0]=4 1611 B11R0.4 CCCSCCNC(=O)NCC 512a_100020603323_100015525214 [0,0,1,0,0,0|2,1,0]=4 1612 B11R0.4 CCCSCCNC(=O)OCC 62a_100000210303_200011445536 [0,0,1,0,0,0|2,1,0]=4 1613 B11R0.4 CCCSCCOC(C)CCC 34a_200000230433_100000766640 [0,0,1,0,0,0|1,1,1]=4 1614 B11R0.4 CCCSCCOC(C)CCC 7a_200000230433_100000766640 [0,0,1,0,0,0|1,1,1]=4 1615 B11R0.4 CCNC(=O)CCCCCCO 240690a_100015525214_100011996774 [0,0,1,0,0,0|2,0,0]=3 1616 B11R0.4 CCNC(=O)CCNCCCO 34a_100025743525_100000230001 [0,0,1,0,0,0|3,0,0]=4 1617 B11R0.4 CCNC(=O)CCSCCCO 62a_100000737597_100011215043 [0,0,1,0,0,0|3,0,0]=4 1618 B11R0.4 CCNC(=O)CCSCCCO 62a_100011215043_100000737597 [0,0,1,0,0,0|3,0,0]=4 1619 B11R0.4 CCNC(=O)CNCCCCO 2230a_100000750430_100000183381 [0,0,1,0,0,0|3,0,0]=4 1620 B11R0.4 CCNC(=O)CNCCCCO 2230a_100016988866_100000210776 [0,0,1,0,0,0|3,0,0]=4 1621 B11R0.4 CCNC(=O)CNCCCCO 34a_100000750430_100000183381 [0,0,1,0,0,0|3,0,0]=4 1622 B11R0.4 CCNC(=O)CSCCCCO 62a_100000183381_100000210776 [0,0,1,0,0,0|3,0,0]=4 1623 B11R0.4 CCNC(=O)CSCCCCO 62a_100000210776_100000183381 [0,0,1,0,0,0|3,0,0]=4 1624 B11R0.4 CCNC(=O)NCCCCCO 2708a_100015525214_100000762737 [0,0,1,0,0,0|2,0,0]=3 1625 B11R0.4 CCNC(=O)NCCCCCO 273464a_100000762737_100015525214 [0,0,1,0,0,0|2,0,0]=3 1626 B11R0.4 CCNC(=O)NCCCCCO 273464a_100015525214_100000762737 [0,0,1,0,0,0|2,0,0]=3 1627 B11R0.4 CCNC(=O)NCCCCCO 512a_100000762737_100015525214 [0,0,1,0,0,0|2,0,0]=3 1628 B11R0.4 CCNC(=O)NCCCCCO 512a_100015525214_100000762737 [0,0,1,0,0,0|2,0,0]=3 1629 B11R0.4 CCNC(=O)NCCOCCO 2708a_100015525214_100000211614 [0,0,1,0,0,0|3,0,0]=4 1630 B11R0.4 CCNC(=O)NCCOCCO 273464a_100000211614_100015525214 [0,0,1,0,0,0|3,0,0]=4 1631 B11R0.4 CCNC(=O)NCCOCCO 273464a_100015525214_100000211614 [0,0,1,0,0,0|3,0,0]=4 1632 B11R0.4 CCNC(=O)NCCOCCO 512a_100000211614_100015525214 [0,0,1,0,0,0|3,0,0]=4 1633 B11R0.4 CCNC(=O)NCCSCCO 2708a_100015525214_100011219999 [0,0,1,0,0,0|3,0,0]=4 1634 B11R0.4 CCNC(=O)NCCSCCO 273464a_100011219999_100015525214 [0,0,1,0,0,0|3,0,0]=4 1635 B11R0.4 CCNC(=O)NCCSCCO 273464a_100015525214_100011219999 [0,0,1,0,0,0|3,0,0]=4 1636 B11R0.4 CCNC(=O)NCCSCCO 512a_100011219999_100015525214 [0,0,1,0,0,0|3,0,0]=4 1637 B11R0.4 CCNC(=O)NCCSCCO 512a_100015525214_100011219999 [0,0,1,0,0,0|3,0,0]=4 1638 B11R0.4 CCOC(=O)CCCNCCO 2230a_100016997473_100009991533 [0,0,1,0,0,0|3,0,0]=4 1639 B11R0.4 CCOC(=O)CCCNCCO 34a_100016990907_100009991533 [0,0,1,0,0,0|3,0,0]=4 1640 B11R0.4 CCOC(=O)CCCOCCBr 34a_100000211926_100009991533 [0,0,1,0,0,0|3,0,0]=4 1641 B11R0.4 CCOC(=O)CCCOCCF 7a_100012001163_100011217306 [0,0,1,0,0,0|3,0,0]=4 1642 B11R0.4 CCOC(=O)CCCOCCN 34a_100000210304_100009991533 [0,0,1,0,0,0|3,0,0]=4 1643 B11R0.4 CCOC(=O)CCCOCCO 7a_100012001163_100000211926 [0,0,1,0,0,0|3,0,0]=4 1644 B11R0.4 CCOC(=O)CCCSCCO 62a_100000211926_100009991533 [0,0,1,0,0,0|3,0,0]=4 1645 B11R0.4 CCOC(=O)CCCSCCO 62a_100009991533_100000211926 [0,0,1,0,0,0|3,0,0]=4 1646 B11R0.4 CCOC(=O)CCSCCCO 62a_100000765890_100011215043 [0,0,1,0,0,0|3,0,0]=4 1647 B11R0.4 CCOC(=O)CCSCCCO 62a_100011215043_100000765890 [0,0,1,0,0,0|3,0,0]=4 1648 B11R0.4 CCOC(=O)CNCCCCO 2230a_100000750430_100000188475 [0,0,1,0,0,0|3,0,0]=4 1649 B11R0.4 CCOC(=O)CNCCCCO 34a_100000750430_100000188475 [0,0,1,0,0,0|3,0,0]=4 1650 B11R0.4 CCOC(=O)CSCCCCO 62a_100000188475_100000210776 [0,0,1,0,0,0|3,0,0]=4 1651 B11R0.4 CCOC(=O)CSCCCCO 62a_100000210776_100000188475 [0,0,1,0,0,0|3,0,0]=4 1652 B11R0.4 CCOC(=O)NCCOCCF 34a_100000158857_100011217306 [0,0,1,0,0,0|3,0,0]=4 1653 B11R0.4 CCOC(=O)NCCOCCO 34a_100000158857_100000211926 [0,0,1,0,0,0|3,0,0]=4 1654 B11R0.4 CCOC(=O)NCCOCSC 34a_100000158857_100011218213 [0,0,1,0,0,0|3,0,0]=4 1655 B11R0.4 CCOC(=O)NCCSCCO 62a_100000211926_200011445536 [0,0,1,0,0,0|3,0,0]=4 1656 B11R0.4 CCOC(=O)OCSCCCF 62a_100011934791_100000075025 [0,0,1,0,0,0|3,0,0]=4 1657 B11R0.4 CCOC(=O)OCSCCCO 62a_100011215043_100000075025 [0,0,1,0,0,0|2,0,0]=3 1658 B11R0.4 CNNC(=O)NCCCCCO 273464a_100000762737_100016993582 [0,0,1,0,0,0|3,0,0]=4 1659 B11R0.4 CNNC(=O)NCCCCCO 512a_100000762737_100016993582 [0,0,1,0,0,0|3,0,0]=4 1660 B11R0.4 CNNC(=O)NCCCCCO 512a_100016993582_100000762737 [0,0,1,0,0,0|3,0,0]=4 1661 B11R0.4 COCC(=O)CCCCCCF 1458a_100000210968_100015922095 [0,0,1,0,0,0|3,0,0]=4 1662 B11R0.4 COCC(=O)CCCCCCO 1458a_100000210968_100000766143 [0,0,1,0,0,0|2,0,0]=3 1663 B11R0.4 COCC(=O)NCCCCCO 240690a_100000762737_100000210968 [0,0,1,0,0,0|2,0,0]=3 1664 B11R0.4 COCC(=O)NCCOCCO 240690a_100000211614_100000210968 [0,0,1,0,0,0|3,0,0]=4 1665 B11R0.4 COCC(=O)NCCSCCO 240690a_100011219999_100000210968 [0,0,1,0,0,0|3,0,0]=4 1666 B11R0.4 COCC(=O)NCCSCCO 527a_100011219999_100000210968 [0,0,1,0,0,0|3,0,0]=4 1667 B11R0.4 COC[C@@H](C)OCCCCCO 34a_100011934205_100000746330 [0,0,1,0,0,0|2,0,1]=4 1668 B11R0.4 CSCC(=O)CCCCCCF 1458a_100000184570_100015922095 [0,0,1,0,0,0|3,0,0]=4 1669 B11R0.4 CSCC(=O)CCCCCCO 1458a_100000184570_100000766143 [0,0,1,0,0,0|2,0,0]=3 1670 B11R0.4 CSCC(=O)NCCCCCO 240690a_100000762737_100000184570 [0,0,1,0,0,0|2,0,0]=3 1671 B11R0.4 CSCC(=O)NCCOCCO 240690a_100000211614_100000184570 [0,0,1,0,0,0|3,0,0]=4 1672 B11R0.4 CSCC(=O)NCCSCCO 240690a_100011219999_100000184570 [0,0,1,0,0,0|3,0,0]=4 1673 B11R0.4 CSCC(=O)NCCSCCO 527a_100011219999_100000184570 [0,0,1,0,0,0|3,0,0]=4 1674 B11R0.4 N#CCC(=O)CCCCCCO 1458a_100011996774_100011214920 [0,0,1,0,0,0|2,0,1]=4 1675 B11R0.4 N#CCC(=O)CCCCCCO 1458a_100051588842_100000766143 [0,0,1,0,0,0|2,0,1]=4 1676 B11R0.4 N#CCC(=O)NCCCCCO 240690a_100000762737_100051588842 [0,0,1,0,0,0|2,0,1]=4 1677 B11R0.4 O=C(CCF)CCCCCCO 1458a_100011996774_100011217306 [0,0,1,0,0,0|2,0,0]=3 1678 B11R0.4 O=C(CCO)CCCCCCF 1458a_100011216618_100015922095 [0,0,1,0,0,0|3,0,0]=4 1679 B11R0.4 O=C(CCO)CCCCCCO 1458a_100011216618_100000766143 [0,0,1,0,0,0|2,0,0]=3 1680 B11R0.4 O=C(CCO)CCCCCCO 1458a_100011996774_100000211926 [0,0,1,0,0,0|2,0,0]=3 1681 B11R0.4 O=C(CCO)NCCCCCO 240690a_100000762737_100011216618 [0,0,1,0,0,0|2,0,0]=3 1682 B11R0.4 O=C(CCO)NCCOCCO 240690a_100000211614_100011216618 [0,0,1,0,0,0|3,0,0]=4 1683 B11R0.4 O=C(CCO)NCCSCCO 240690a_100011219999_100011216618 [0,0,1,0,0,0|3,0,0]=4 1684 B11R0.9 C#CCC(=O)NCC(CC)OC 1626a_100000731041_100011220946 [0,0,1,0,0,0|1,0,2]=4 1685 B11R0.9 C#CCC(=O)NCC(CC)OC 527a_100000731041_100011220946 [0,0,1,0,0,0|1,0,2]=4 1686 B11R0.9 C=CCC(=O)NCC(CC)OC 11a_100000731041_100000210193 [0,0,1,0,0,0|1,0,2]=4 1687 B11R0.9 C=CCC(=O)NCC(CC)OC 1626a_100000731041_100000210193 [0,0,1,0,0,0|1,0,2]=4 1688 B11R0.9 C=CCC(=O)NCC(CC)OC 240690a_100000731041_100000210193 [0,0,1,0,0,0|1,0,2]=4 1689 B11R0.9 C=CCC(=O)NCC(CC)OC 527a_100000731041_100000210193 [0,0,1,0,0,0|1,0,2]=4 1690 B11R0.9 CC=CC(=O)NCC(CC)OC 11a_100000731041_100000210699 [0,0,1,0,0,0|1,0,2]=4 1691 B11R0.9 CC=CC(=O)NCC(CC)OC 1626a_100000731041_100000210699 [0,0,1,0,0,0|1,0,2]=4 1692 B11R0.9 CC=CC(=O)NCC(CC)OC 240690a_100000731041_100000210699 [0,0,1,0,0,0|1,0,2]=4 1693 B11R0.9 CCC(CC)CNC(=O)CCO 240690a_100102946423_100011216618 [0,0,1,0,0,0|3,0,0]=4 1694 B11R0.9 CCC(CC)CNC(=O)COC 11a_100102946423_100000210968 [0,0,1,0,0,0|3,0,0]=4 1695 B11R0.9 CCC(CC)CNC(=O)COC 1626a_100102946423_100000210968 [0,0,1,0,0,0|3,0,0]=4 1696 B11R0.9 CCC(CC)CNC(=O)COC 240690a_100102946423_100000210968 [0,0,1,0,0,0|3,0,0]=4 1697 B11R0.9 CCC(CC)CNC(=O)COC 527a_100102946423_100000210968 [0,0,1,0,0,0|3,0,0]=4 1698 B11R0.9 CCC(CC)CNC(=O)CSC 11a_100102946423_100000184570 [0,0,1,0,0,0|3,0,0]=4 1699 B11R0.9 CCC(CC)CNC(=O)CSC 1626a_100102946423_100000184570 [0,0,1,0,0,0|3,0,0]=4 1700 B11R0.9 CCC(CC)CNC(=O)CSC 240690a_100102946423_100000184570 [0,0,1,0,0,0|3,0,0]=4 1701 B11R0.9 CCC(CC)CNC(=O)CSC 527a_100102946423_100000184570 [0,0,1,0,0,0|3,0,0]=4 1702 B11R0.9 CCC(CNC(=O)CC#N)OC 1626a_100000731041_100051588842 [0,0,1,0,0,0|2,0,1]=4 1703 B11R0.9 CCC(CNC(=O)CC#N)OC 240690a_100000731041_100051588842 [0,0,1,0,0,0|2,0,1]=4 1704 B11R0.9 CCC(CNC(=O)CCO)OC 240690a_100000731041_100011216618 [0,0,1,0,0,0|2,0,0]=3 1705 B11R0.9 CCC(CNC(=O)COC)OC 11a_100000731041_100000210968 [0,0,1,0,0,0|2,0,0]=3 1706 B11R0.9 CCC(CNC(=O)COC)OC 1626a_100000731041_100000210968 [0,0,1,0,0,0|2,0,0]=3 1707 B11R0.9 CCC(CNC(=O)COC)OC 240690a_100000731041_100000210968 [0,0,1,0,0,0|2,0,0]=3 1708 B11R0.9 CCC(CNC(=O)COC)OC 527a_100000731041_100000210968 [0,0,1,0,0,0|2,0,0]=3 1709 B11R0.9 CCC(CNC(=O)CSC)OC 11a_100000731041_100000184570 [0,0,1,0,0,0|2,0,0]=3 1710 B11R0.9 CCC(CNC(=O)CSC)OC 1626a_100000731041_100000184570 [0,0,1,0,0,0|2,0,0]=3 1711 B11R0.9 CCC(CNC(=O)CSC)OC 240690a_100000731041_100000184570 [0,0,1,0,0,0|2,0,0]=3 1712 B11R0.9 CCC(CNC(=O)CSC)OC 527a_100000731041_100000184570 [0,0,1,0,0,0|2,0,0]=3 1713 B11R0.9 CCC(CNC(=O)NNC)OC 273464a_100000731041_100016993582 [0,0,1,0,0,0|3,0,0]=4 1714 B11R0.9 CCC(CNC(=O)NNC)OC 512a_100000731041_100016993582 [0,0,1,0,0,0|3,0,0]=4 1715 B11R0.9 CCC(CNC(=O)NNC)OC 512a_100016993582_100000731041 [0,0,1,0,0,0|3,0,0]=4 1716 B11R0.9 CCC(COC(C)CCO)OC 34a_100011934954_100009893172 [0,0,1,0,0,0|2,0,1]=4 1717 B11R0.9 CCC(COC(C)CCO)OC 7a_100011934954_100009893172 [0,0,1,0,0,0|2,0,1]=4 1718 B11R0.9 CCC(COC(C)COC)OC 34a_100011934954_100000765312 [0,0,1,0,0,0|2,0,1]=4 1719 B11R0.9 CCC(COC(C)COC)OC 7a_100011934954_100000765312 [0,0,1,0,0,0|2,0,1]=4 1720 B11R0.9 CCCC(=O)CCC(OC)OC 1458a_100000211992_100000139399 [0,0,1,0,0,0|2,0,0]=3 1721 B11R0.9 CCCC(=O)CCC(OC)OC 1458a_200000082759_100000210303 [0,0,1,0,0,0|2,0,0]=3 1722 B11R0.9 CCCC(=O)CCN(CC)CC 1458a_100000211992_100000700428 [0,0,1,0,0,0|3,0,0]=4 1723 B11R0.9 CCCC(=O)CCN(CC)CC 1458a_100000750416_100000210303 [0,0,1,0,0,0|3,0,0]=4 1724 B11R0.9 CCCC(=O)CNC(CC)CC 2230a_100000199018_100000747444 [0,0,1,0,0,0|3,0,0]=4 1725 B11R0.9 CCCC(=O)COC(CC)CC 1458a_100012002705_100000210303 [0,0,1,0,0,0|3,0,0]=4 1726 B11R0.9 CCCC(=O)COC(CC)CC 7a_100000688536_100000747444 [0,0,1,0,0,0|3,0,0]=4 1727 B11R0.9 CCCC(=O)CSC(CC)CC 62a_100000210505_100000747444 [0,0,1,0,0,0|3,0,0]=4 1728 B11R0.9 CCCC(=O)CSC(CC)CC 62a_100000747444_100000210505 [0,0,1,0,0,0|3,0,0]=4 1729 B11R0.9 CCCC(=O)NCC(CC)CC 11a_100102946423_100000211992 [0,0,1,0,0,0|2,0,0]=3 1730 B11R0.9 CCCC(=O)NCC(CC)CC 1626a_100102946423_100000211992 [0,0,1,0,0,0|2,0,0]=3 1731 B11R0.9 CCCC(=O)NCC(CC)CC 240690a_100102946423_100000211992 [0,0,1,0,0,0|2,0,0]=3 1732 B11R0.9 CCCC(=O)NCC(CC)CC 527a_100102946423_100000211992 [0,0,1,0,0,0|2,0,0]=3 1733 B11R0.9 CCCC(=O)NCC(CC)OC 11a_100000731041_100000211992 [0,0,1,0,0,0|1,0,0]=2 1734 B11R0.9 CCCC(=O)NCC(CC)OC 1626a_100000731041_100000211992 [0,0,1,0,0,0|1,0,0]=2 1735 B11R0.9 CCCC(=O)NCC(CC)OC 240690a_100000731041_100000211992 [0,0,1,0,0,0|1,0,0]=2 1736 B11R0.9 CCCC(=O)NCC(CC)OC 527a_100000731041_100000211992 [0,0,1,0,0,0|1,0,0]=2 1737 B11R0.9 CCCC(=O)NCC(OC)OC 11a_100000210479_100000211992 [0,0,1,0,0,0|2,0,0]=3 1738 B11R0.9 CCCC(=O)NCC(OC)OC 1626a_100000210479_100000211992 [0,0,1,0,0,0|2,0,0]=3 1739 B11R0.9 CCCC(=O)NCC(OC)OC 240690a_100000210479_100000211992 [0,0,1,0,0,0|2,0,0]=3 1740 B11R0.9 CCCC(=O)NCC(OC)OC 527a_100000210479_100000211992 [0,0,1,0,0,0|2,0,0]=3 1741 B11R0.9 CCCC(=O)NNC(CC)CC 22a_100000756293_100000211992 [0,0,1,0,0,0|3,0,0]=4 1742 B11R0.9 CCCC(=O)OCN(CC)CC 2230a_100000724800_100000034017 [0,0,1,0,0,0|2,0,0]=3 1743 B11R0.9 CCCC(=O)OCN(CC)CC 269956a_100000042499_100000034017 [0,0,1,0,0,0|2,0,0]=3 1744 B11R0.9 CCCC(=O)OCN(CC)CC 269982a_100000724800_100000034017 [0,0,1,0,0,0|2,0,0]=3 1745 B11R0.9 CCCC(C)NCC(CC)OC 270004a_100000731041_100000211909 [0,0,1,0,0,0|2,0,1]=4 1746 B11R0.9 CCCC(C)OCC(CC)CC 34a_100000764384_100011215472 [0,0,1,0,0,0|2,0,1]=4 1747 B11R0.9 CCCC(C)OCC(CC)CC 7a_100000703878_100000766640 [0,0,1,0,0,0|2,0,1]=4 1748 B11R0.9 CCCC(C)OCC(CC)CC 7a_100000764384_100011215472 [0,0,1,0,0,0|2,0,1]=4 1749 B11R0.9 CCCC(C)OCC(CC)OC 34a_100011934954_100000766640 [0,0,1,0,0,0|1,0,1]=3 1750 B11R0.9 CCCC(C)OCC(CC)OC 7a_100011934954_100000766640 [0,0,1,0,0,0|1,0,1]=3 1751 B11R0.9 CCCC(C)OCC(OC)OC 34a_100000764384_100000211822 [0,0,1,0,0,0|2,0,1]=4 1752 B11R0.9 CCCC(C)OCC(OC)OC 34a_100011216393_100000766640 [0,0,1,0,0,0|2,0,1]=4 1753 B11R0.9 CCCC(C)OCC(OC)OC 7a_100000764384_100000751394 [0,0,1,0,0,0|2,0,1]=4 1754 B11R0.9 CCNC(=O)CCC(OC)OC 11a_100015525214_200000082759 [0,0,1,0,0,0|3,0,0]=4 1755 B11R0.9 CCNC(=O)CCC(OC)OC 240690a_100015525214_200000082759 [0,0,1,0,0,0|3,0,0]=4 1756 B11R0.9 CCNC(=O)CCC(OC)OC 527a_100015525214_200000082759 [0,0,1,0,0,0|3,0,0]=4 1757 B11R0.9 CCNC(=O)NCC(CC)CC 2708a_100015525214_100102946423 [0,0,1,0,0,0|3,0,0]=4 1758 B11R0.9 CCNC(=O)NCC(CC)CC 2708a_100102946423_100015525214 [0,0,1,0,0,0|3,0,0]=4 1759 B11R0.9 CCNC(=O)NCC(CC)CC 273464a_100015525214_100102946423 [0,0,1,0,0,0|3,0,0]=4 1760 B11R0.9 CCNC(=O)NCC(CC)CC 273464a_100102946423_100015525214 [0,0,1,0,0,0|3,0,0]=4 1761 B11R0.9 CCNC(=O)NCC(CC)CC 512a_100015525214_100102946423 [0,0,1,0,0,0|3,0,0]=4 1762 B11R0.9 CCNC(=O)NCC(CC)CC 512a_100102946423_100015525214 [0,0,1,0,0,0|3,0,0]=4 1763 B11R0.9 CCNC(=O)NCC(CC)OC 2708a_100000731041_100015525214 [0,0,1,0,0,0|2,0,0]=3 1764 B11R0.9 CCNC(=O)NCC(CC)OC 2708a_100015525214_100000731041 [0,0,1,0,0,0|2,0,0]=3 1765 B11R0.9 CCNC(=O)NCC(CC)OC 273464a_100000731041_100015525214 [0,0,1,0,0,0|2,0,0]=3 1766 B11R0.9 CCNC(=O)NCC(CC)OC 273464a_100015525214_100000731041 [0,0,1,0,0,0|2,0,0]=3 1767 B11R0.9 CCNC(=O)NCC(CC)OC 512a_100000731041_100015525214 [0,0,1,0,0,0|2,0,0]=3 1768 B11R0.9 CCNC(=O)NCC(CC)OC 512a_100015525214_100000731041 [0,0,1,0,0,0|2,0,0]=3 1769 B11R0.9 CCNC(=O)NCC(OC)OC 2708a_100000210479_100015525214 [0,0,1,0,0,0|3,0,0]=4 1770 B11R0.9 CCNC(=O)NCC(OC)OC 273464a_100000210479_100015525214 [0,0,1,0,0,0|3,0,0]=4 1771 B11R0.9 CCNC(=O)NCC(OC)OC 273464a_100015525214_100000210479 [0,0,1,0,0,0|3,0,0]=4 1772 B11R0.9 CCNC(=O)NCC(OC)OC 512a_100000210479_100015525214 [0,0,1,0,0,0|3,0,0]=4 1773 B11R0.9 CCNC(=O)NCC(OC)OC 512a_100015525214_100000210479 [0,0,1,0,0,0|3,0,0]=4 1774 B11R0.9 COC(CCC(=O)CCF)OC 1458a_200000082759_100011217306 [0,0,1,0,0,0|3,0,0]=4 1775 B11R0.9 COC(CCC(=O)CCO)OC 1458a_100011216618_100000139399 [0,0,1,0,0,0|3,0,0]=4 1776 B11R0.9 COC(CCC(=O)CCO)OC 1458a_200000082759_100000211926 [0,0,1,0,0,0|3,0,0]=4 1777 B11R0.9 COC(CCC(=O)CSC)OC 1458a_100000184570_100000139399 [0,0,1,0,0,0|3,0,0]=4 1778 B11R0.9 COC(CNC(=O)CCO)OC 240690a_100000210479_100011216618 [0,0,1,0,0,0|3,0,0]=4 1779 B11R0.9 COC(CNC(=O)CSC)OC 11a_100000210479_100000184570 [0,0,1,0,0,0|3,0,0]=4 1780 B11R0.9 COC(CNC(=O)CSC)OC 1626a_100000210479_100000184570 [0,0,1,0,0,0|3,0,0]=4 1781 B11R0.9 COC(CNC(=O)CSC)OC 240690a_100000210479_100000184570 [0,0,1,0,0,0|3,0,0]=4 1782 B11R0.9 COC(CNC(=O)CSC)OC 527a_100000210479_100000184570 [0,0,1,0,0,0|3,0,0]=4 1783 B11R0.9 COCC(=O)CCC(OC)OC 1458a_100000210968_100000139399 [0,0,1,0,0,0|3,0,0]=4 1784 B11R0.9 COCC(=O)NCC(OC)OC 11a_100000210479_100000210968 [0,0,1,0,0,0|3,0,0]=4 1785 B11R0.9 COCC(=O)NCC(OC)OC 1626a_100000210479_100000210968 [0,0,1,0,0,0|3,0,0]=4 1786 B11R0.9 COCC(=O)NCC(OC)OC 240690a_100000210479_100000210968 [0,0,1,0,0,0|3,0,0]=4 1787 B11R0.9 COCC(=O)NCC(OC)OC 527a_100000210479_100000210968 [0,0,1,0,0,0|3,0,0]=4 1788 B11R0.62 CCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210303 [0,0,1,0,0,0|2,0,1]=4 1789 B11R0.62 CCCC(=O)CNC(C)CCC 2230a_100000741246_100000747444 [0,0,1,0,0,0|3,0,0]=4 1790 B11R0.62 CCCC(=O)COC(=O)CCC 1458a_100000211992_100000034017 [0,0,1,0,0,0|0,0,2]=3 1791 B11R0.62 CCCC(=O)COC(C)CCC 7a_100000764384_100000747444 [0,0,1,0,0,0|3,0,0]=4 1792 B11R0.62 CCCC(=O)CSC(C)CCC 62a_100000747444_100000766640 [0,0,1,0,0,0|3,0,0]=4 1793 B11R0.62 CCCC(=O)CSC(C)CCC 62a_100000766640_100000747444 [0,0,1,0,0,0|3,0,0]=4 1794 B11R0.62 CCCC(=O)NCC(=O)OCC 188690a_100000741813_100000211992 [0,0,1,0,0,0|2,0,1]=4 1795 B11R0.62 CCCC(=O)NCC(O)COC 240690a_100000756049_100000211992 [0,0,1,0,0,0|2,0,0]=3 1796 B11R0.62 CCCC(=O)NCC(O)COC 527a_100000756049_100000211992 [0,0,1,0,0,0|2,0,0]=3 1797 B11R0.62 CCCC(=O)OCC(=O)CCO 1458a_100011216618_100000034017 [0,0,1,0,0,0|1,0,2]=4 1798 B11R0.62 CCCC(=O)OCC(=O)COC 1458a_100000210968_100000034017 [0,0,1,0,0,0|1,0,2]=4 1799 B11R0.62 CCCC(=O)OCC(=O)CSC 1458a_100000184570_100000034017 [0,0,1,0,0,0|1,0,2]=4 1800 B11R0.62 CCCC(=O)OCN(C)CCC 2230a_100000747261_100000034017 [0,0,1,0,0,0|2,0,0]=3 1801 B11R0.62 CCCC(=O)OCN(C)CCC 269982a_100000747261_100000034017 [0,0,1,0,0,0|2,0,0]=3 1802 B11R0.62 CCCC(=O)OCN(C)CCO 2230a_100000210263_100000034017 [0,0,1,0,0,0|3,0,0]=4 1803 B11R0.62 CCCC(=O)OCN(C)CCO 269982a_100000210263_100000034017 [0,0,1,0,0,0|3,0,0]=4 1804 B11R0.62 CCCC(C)COC(C)CCC 34a_100000688023_100000766640 [0,0,1,0,0,0|2,0,1]=4 1805 B11R0.62 CCCC(C)COC(C)CCC 34a_100000764384_100011216630 [0,0,1,0,0,0|2,0,1]=4 1806 B11R0.62 CCCC(C)COC(C)CCC 7a_100000688023_100000766640 [0,0,1,0,0,0|2,0,1]=4 1807 B11R0.62 CCCC(C)COC(C)CCC 7a_100000764384_100011216630 [0,0,1,0,0,0|2,0,1]=4 1808 B11R0.62 CCCC(C)OCC(O)COC 34a_100000764384_100011215053 [0,0,1,0,0,0|2,0,1]=4 1809 B11R0.62 CCCC(C)OCC(O)COC 7a_100000764384_100011215053 [0,0,1,0,0,0|2,0,1]=4 1810 B11R0.62 CCCC(C)OC[C@@H](N)CCC 34a_100000732646_100000766640 [0,0,1,0,0,0|2,0,1]=4 1811 B11R0.62 CCNC(=O)NCC(O)COC 2708a_100015525214_100000756049 [0,0,1,0,0,0|3,0,0]=4 1812 B11R0.62 CCNC(=O)NCC(O)COC 273464a_100000756049_100015525214 [0,0,1,0,0,0|3,0,0]=4 1813 B11R0.62 CCNC(=O)NCC(O)COC 273464a_100015525214_100000756049 [0,0,1,0,0,0|3,0,0]=4 1814 B11R0.62 CCNC(=O)NCC(O)COC 512a_100000756049_100015525214 [0,0,1,0,0,0|3,0,0]=4 1815 B11R0.62 CCNC(=O)NCC(O)COC 512a_100015525214_100000756049 [0,0,1,0,0,0|3,0,0]=4 1816 B11R0.62 CCNC(C)CCC(=O)OCC 2230a_100015525214_100000748298 [0,0,1,0,0,0|3,0,0]=4 1817 B11R0.62 CCOC(=O)CCC(C)OCC 34a_100121572206_100000748298 [0,0,1,0,0,0|2,0,0]=3 1818 B11R0.62 CCOC(=O)CCC(C)SCC 62a_100000210202_100000748298 [0,0,1,0,0,0|2,1,0]=4 1819 B11R0.62 CCOC(=O)CCC(C)SCC 62a_100000748298_100000210202 [0,0,1,0,0,0|2,1,0]=4 1820 B11R0.62 CCOC(C)COC(C)COC 34a_200011930013_100000210202 [0,0,1,0,0,0|2,0,1]=4 1821 B11R0.62 CCOC(C)COC(C)COC 7a_200011930013_100000210202 [0,0,1,0,0,0|2,0,1]=4 1822 B11R0.62 COCC(=O)NCC(O)COC 240690a_100000756049_100000210968 [0,0,1,0,0,0|3,0,0]=4 1823 B11R0.62 COCC(=O)NCC(O)COC 527a_100000756049_100000210968 [0,0,1,0,0,0|3,0,0]=4 1824 B11R0.62 COCC(O)CNC(=O)CCO 240690a_100000756049_100011216618 [0,0,1,0,0,0|3,0,0]=4 1825 B11R0.62 COCC(O)CNC(=O)CSC 240690a_100000756049_100000184570 [0,0,1,0,0,0|3,0,0]=4 1826 B11R0.62 COCC(O)CNC(=O)CSC 527a_100000756049_100000184570 [0,0,1,0,0,0|3,0,0]=4 1827 B13R2.29 C[C@@H]1CCCN1CC2CCCO2 2230a_100015189458_100000203698 [0,0,0,1,0,0|2,0,1]=4 1828 B13R2.29 C[C@@H]1CCCN1CC2CCCO2 269982a_100015189458_100000183445 [0,0,0,1,0,0|2,0,1]=4 1829 B13R2.29 C[C@H]1CCCN1CC2CCCO2 2230a_100020605311_100000203698 [0,0,0,1,0,0|2,0,1]=4 1830 B13R2.29 C[C@H]1CCCN1CC2CCCO2 269982a_100020605311_100000183445 [0,0,0,1,0,0|2,0,1]=4 1831 B13R2.29 O=C1CCCC1NC2CCCC2 2230a_100000211070_100000211823 [0,0,0,1,0,0|3,0,0]=4 1832 B13R2.29 O=C1CCCC1NC2CCCC2 34a_100000211070_100000709159 [0,0,0,1,0,0|3,0,0]=4 1833 B13R2.29 O=C1CCCC1OC2CCCC2 34a_100000210269_100000709159 [0,0,0,1,0,0|3,0,0]=4 1834 B13R2.29 O=C1CCCC1OC2CCCC2 34a_200000719330_100000179811 [0,0,0,1,0,0|3,0,0]=4 1835 B13R2.29 O=C1CCCC1OC2CCCC2 7a_100000210269_100000211823 [0,0,0,1,0,0|3,0,0]=4 1836 B13R2.29 O=C1CCCC1OC2CCCO2 34a_100000085407_100000709159 [0,0,0,1,0,0|2,0,0]=3 1837 B13R2.29 O=C1CCCC1SC2CCCC2 62a_100000211823_100000179811 [0,0,0,1,0,0|3,0,0]=4 1838 B13R2.29 O=C1CCCC1SC2CCCC2 62a_100011217020_100000211823 [0,0,0,1,0,0|3,0,0]=4 1839 B13R2.29 O=C1CCCN1CN2CCCC2 269982a_100000188435_100000026320 [0,0,0,1,0,0|3,0,0]=4 1840 B13R2.29 O=C1OCCC1OC2CCCO2 34a_100000085407_100000211211 [0,0,0,1,0,0|3,0,0]=4 1841 B13R2.183 C1CCC(C1)COC2CCCC2 34a_100000210269_100000740388 [0,0,0,1,0,0|2,0,1]=4 1842 B13R2.183 C1CCC(C1)COC2CCCC2 34a_100000742336_100000179811 [0,0,0,1,0,0|2,0,1]=4 1843 B13R2.183 C1CCC(C1)COC2CCCC2 7a_100000210269_100000740388 [0,0,0,1,0,0|2,0,1]=4 1844 B13R2.183 C1CCC(C1)COC2CCCC2 7a_100000742336_100000179811 [0,0,0,1,0,0|2,0,1]=4 1845 B13R2.183 C1CCC(C1)COC2CCCO2 34a_100000085407_100000740388 [0,0,0,1,0,0|1,0,2]=4 1846 B13R2.183 C1CCC(C1)NCC2CCCO2 2230a_100000211070_100000203698 [0,0,0,1,0,0|2,0,1]=4 1847 B13R2.183 C1CCC(C1)NC[C@@H]2CCCO2 2230a_100020590478_100000179811 [0,0,0,1,0,0|2,0,1]=4 1848 B13R2.183 C1CCC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000210133 [0,0,0,1,0,0|2,0,1]=4 1849 B13R2.183 C1CCC(C1)NC[C@@H]2CCCO2 34a_100020590478_100000179811 [0,0,0,1,0,0|2,0,1]=4 1850 B13R2.183 C1CCC(C1)OCC2CCCO2 34a_100000210270_100000179811 [0,0,0,1,0,0|1,0,1]=3 1851 B13R2.183 C1CCC(C1)OCC2CCCO2 7a_100000210269_100000203698 [0,0,0,1,0,0|1,0,1]=3 1852 B13R2.183 C1CCC(C1)OCC2CCCO2 7a_100000210270_100000179811 [0,0,0,1,0,0|1,0,1]=3 1853 B13R2.183 C1CCC(C1)OCC2COCO2 34a_100011216627_100000179811 [0,0,0,1,0,0|2,0,1]=4 1854 B13R2.183 C1CCC(C1)OCC2OCCO2 34a_100000087154_100000179811 [0,0,0,1,0,0|2,0,1]=4 1855 B13R2.183 C1CCC(C1)OCC2OCCO2 34a_100000210269_100000755774 [0,0,0,1,0,0|2,0,1]=4 1856 B13R2.183 C1CCC(C1)OCC2OCCO2 7a_100000210269_100000755774 [0,0,0,1,0,0|2,0,1]=4 1857 B13R2.183 C1CCC(C1)OC[C@H]2CCCN2 34a_100000745186_100000179811 [0,0,0,1,0,0|2,0,1]=4 1858 B13R2.183 C1COC(C1)COC2CCOC2 34a_100000210270_100000690089 [0,0,0,1,0,0|2,0,1]=4 1859 B13R2.183 C1COC(C1)COC2CCOC2 7a_100000210270_100000731011 [0,0,0,1,0,0|2,0,1]=4 1860 B13R2.183 C1COC(C1)COC2CCSC2 7a_100011232664_100000203698 [0,0,0,1,0,0|2,0,1]=4 1861 B13R2.183 C1COC(C1)CSC2CCCC2 62a_100000203698_100000179811 [0,0,0,1,0,0|1,1,1]=4 1862 B13R2.183 C1COC(C1)CSC2CCCC2 62a_100011217020_100000203698 [0,0,0,1,0,0|1,1,1]=4 1863 B13R2.183 C1COC(C1)OCC2OCCO2 34a_100000085407_100000755774 [0,0,0,1,0,0|1,0,2]=4 1864 B13R2.856 C#CCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100011220946 [0,0,0,1,0,0|1,0,2]=4 1865 B13R2.856 C#CCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100011220946 [0,0,0,1,0,0|1,0,2]=4 1866 B13R2.856 C=CCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000210193 [0,0,0,1,0,0|1,0,2]=4 1867 B13R2.856 C=CCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000210193 [0,0,0,1,0,0|1,0,2]=4 1868 B13R2.856 C=CCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210193 [0,0,0,1,0,0|1,0,2]=4 1869 B13R2.856 C=CCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000210193 [0,0,0,1,0,0|1,0,2]=4 1870 B13R2.856 CC=CC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000210699 [0,0,0,1,0,0|1,0,2]=4 1871 B13R2.856 CC=CC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000210699 [0,0,0,1,0,0|1,0,2]=4 1872 B13R2.856 CC=CC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210699 [0,0,0,1,0,0|1,0,2]=4 1873 B13R2.856 CCCC(=O)C1CC2C=CC1C2 1458a_100000211946_100000210303 [0,0,0,1,0,0|2,0,1]=4 1874 B13R2.856 CCCC(=O)C1CC2CCC1C2 1458a_100000181847_100000210303 [0,0,0,1,0,0|2,0,0]=3 1875 B13R2.856 CCCC(=O)C1CC2CCC1C2 1458a_100000211992_100000727232 [0,0,0,1,0,0|2,0,0]=3 1876 B13R2.856 CCCC(=O)N1CC2C=CC1C2 11a_100000732668_100000211992 [0,0,0,1,0,0|2,0,1]=4 1877 B13R2.856 CCCC(=O)N1CC2C=CC1C2 240690a_100000732668_100000211992 [0,0,0,1,0,0|2,0,1]=4 1878 B13R2.856 CCCC(=O)N1CC2C=CC1C2 527a_100000732668_100000211992 [0,0,0,1,0,0|2,0,1]=4 1879 B13R2.856 CCCC(=O)N1CC2CCC1C2 11a_100000743476_100000211992 [0,0,0,1,0,0|2,0,0]=3 1880 B13R2.856 CCCC(=O)N1CC2CCC1C2 1626a_100000743476_100000211992 [0,0,0,1,0,0|2,0,0]=3 1881 B13R2.856 CCCC(=O)N1CC2CCC1C2 240690a_100000743476_100000211992 [0,0,0,1,0,0|2,0,0]=3 1882 B13R2.856 CCCC(=O)N1CC2CCC1C2 527a_100000743476_100000211992 [0,0,0,1,0,0|2,0,0]=3 1883 B13R2.856 CCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000211992 [0,0,0,1,0,0|1,0,0]=2 1884 B13R2.856 CCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000211992 [0,0,0,1,0,0|1,0,0]=2 1885 B13R2.856 CCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000211992 [0,0,0,1,0,0|1,0,0]=2 1886 B13R2.856 CCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000211992 [0,0,0,1,0,0|1,0,0]=2 1887 B13R2.856 CCCC(C)N1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000766640 [0,0,0,1,0,0|2,0,1]=4 1888 B13R2.856 CCCC(C)N1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000766640 [0,0,0,1,0,0|2,0,1]=4 1889 B13R2.856 CCCC(C)N1C[C@H]2C[C@@H]1CO2 270004a_100016995552_100000211909 [0,0,0,1,0,0|2,0,1]=4 1890 B13R2.856 CCCC(C)N1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000766640 [0,0,0,1,0,0|2,0,1]=4 1891 B13R2.856 CCNC(=O)C1CC2CCC1C2 11a_100015525214_100000181847 [0,0,0,1,0,0|3,0,0]=4 1892 B13R2.856 CCNC(=O)C1CC2CCC1C2 240690a_100015525214_100000181847 [0,0,0,1,0,0|3,0,0]=4 1893 B13R2.856 CCNC(=O)C1CC2CCC1C2 527a_100015525214_100000181847 [0,0,0,1,0,0|3,0,0]=4 1894 B13R2.856 CCNC(=O)N1CC2CCC1C2 2708a_100015525214_100000743476 [0,0,0,1,0,0|3,0,0]=4 1895 B13R2.856 CCNC(=O)N1CC2CCC1C2 273464a_100015525214_100000743476 [0,0,0,1,0,0|3,0,0]=4 1896 B13R2.856 CCNC(=O)N1C[C@H]2C[C@@H]1CO2 2708a_100015525214_100016995552 [0,0,0,1,0,0|2,0,0]=3 1897 B13R2.856 CCNC(=O)N1C[C@H]2C[C@@H]1CO2 273464a_100015525214_100016995552 [0,0,0,1,0,0|2,0,0]=3 1898 B13R2.856 COCC(=O)C1CC2CCC1C2 1458a_100000210968_100000727232 [0,0,0,1,0,0|3,0,0]=4 1899 B13R2.856 COCC(=O)N1CC2CCC1C2 11a_100000743476_100000210968 [0,0,0,1,0,0|3,0,0]=4 1900 B13R2.856 COCC(=O)N1CC2CCC1C2 1626a_100000743476_100000210968 [0,0,0,1,0,0|3,0,0]=4 1901 B13R2.856 COCC(=O)N1CC2CCC1C2 240690a_100000743476_100000210968 [0,0,0,1,0,0|3,0,0]=4 1902 B13R2.856 COCC(=O)N1CC2CCC1C2 527a_100000743476_100000210968 [0,0,0,1,0,0|3,0,0]=4 1903 B13R2.856 COCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000210968 [0,0,0,1,0,0|2,0,0]=3 1904 B13R2.856 COCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000210968 [0,0,0,1,0,0|2,0,0]=3 1905 B13R2.856 COCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210968 [0,0,0,1,0,0|2,0,0]=3 1906 B13R2.856 COCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000210968 [0,0,0,1,0,0|2,0,0]=3 1907 B13R2.856 CSCC(=O)C1CC2CCC1C2 1458a_100000184570_100000727232 [0,0,0,1,0,0|3,0,0]=4 1908 B13R2.856 CSCC(=O)N1CC2CCC1C2 11a_100000743476_100000184570 [0,0,0,1,0,0|3,0,0]=4 1909 B13R2.856 CSCC(=O)N1CC2CCC1C2 1626a_100000743476_100000184570 [0,0,0,1,0,0|3,0,0]=4 1910 B13R2.856 CSCC(=O)N1CC2CCC1C2 240690a_100000743476_100000184570 [0,0,0,1,0,0|3,0,0]=4 1911 B13R2.856 CSCC(=O)N1CC2CCC1C2 527a_100000743476_100000184570 [0,0,0,1,0,0|3,0,0]=4 1912 B13R2.856 CSCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000184570 [0,0,0,1,0,0|2,0,0]=3 1913 B13R2.856 CSCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000184570 [0,0,0,1,0,0|2,0,0]=3 1914 B13R2.856 CSCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000184570 [0,0,0,1,0,0|2,0,0]=3 1915 B13R2.856 CSCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000184570 [0,0,0,1,0,0|2,0,0]=3 1916 B13R2.856 N#CCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100051588842 [0,0,0,1,0,0|2,0,1]=4 1917 B13R2.856 N#CCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100051588842 [0,0,0,1,0,0|2,0,1]=4 1918 B13R2.856 O=C(CCF)C1CC2CCC1C2 1458a_100000181847_100011217306 [0,0,0,1,0,0|3,0,0]=4 1919 B13R2.856 O=C(CCO)C1CC2CCC1C2 1458a_100000181847_100000211926 [0,0,0,1,0,0|3,0,0]=4 1920 B13R2.856 O=C(CCO)C1CC2CCC1C2 1458a_100011216618_100000727232 [0,0,0,1,0,0|3,0,0]=4 1921 B13R2.856 O=C(CCO)N1CC2CCC1C2 240690a_100000743476_100011216618 [0,0,0,1,0,0|3,0,0]=4 1922 B13R2.856 O=C(CCO)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100011216618 [0,0,0,1,0,0|2,0,0]=3 1923 B13R2.882 CCCC(=O)NC1C2C1COC2 11a_100000702821_100000211992 [0,0,0,1,0,0|3,0,0]=4 1924 B13R2.882 CCCC(=O)NC1C2C1COC2 240690a_100000702821_100000211992 [0,0,0,1,0,0|3,0,0]=4 1925 B13R2.882 CCCC(=O)NC1C2C1COC2 527a_100000702821_100000211992 [0,0,0,1,0,0|3,0,0]=4 1926 B13R2.3112 CC1(CCC1)NCC2CCCO2 2230a_100000692455_100000203698 [0,0,0,1,0,0|2,0,1]=4 1927 B13R2.3112 CC1(CCC1)OCC2CCCC2 34a_100000759064_100000740388 [0,0,0,1,0,0|2,0,1]=4 1928 B13R2.3112 CC1(CCC1)OCC2CCCC2 7a_100000759064_100000740388 [0,0,0,1,0,0|2,0,1]=4 1929 B13R2.3112 CC1(CCC1)OCC2CCCO2 7a_100000759064_100000203698 [0,0,0,1,0,0|1,0,1]=3 1930 B13R2.3112 CC1(CCC1)OCC2OCCO2 34a_100000759064_100000755774 [0,0,0,1,0,0|2,0,1]=4 1931 B13R2.3112 CC1(CCC1)OCC2OCCO2 7a_100000759064_100000755774 [0,0,0,1,0,0|2,0,1]=4 1932 B13R2.3112 CC1(CSC1)OCC2CCCO2 7a_100016018533_100000203698 [0,0,0,1,0,0|2,0,1]=4 1933 B13R2.6970 CC(NCC1CCCO1)C2CC2 2230a_100000700016_100000203698 [0,0,0,1,0,0|2,0,1]=4 1934 B13R2.6970 CC(NC[C@@H]1CCCO1)C2CC2 269862a_100020590478_100000210639 [0,0,0,1,0,0|2,0,1]=4 1935 B13R2.6970 CC(OCC1CCCC1)C2CC2 34a_100000744524_100000740388 [0,0,0,1,0,0|2,0,1]=4 1936 B13R2.6970 CC(OCC1CCCC1)C2CC2 7a_100000744524_100000740388 [0,0,0,1,0,0|2,0,1]=4 1937 B13R2.6970 CC(OCC1CCCO1)C2CC2 7a_100000744524_100000203698 [0,0,0,1,0,0|1,0,1]=3 1938 B13R2.6970 CC(OCC1OCCO1)C2CC2 34a_100000744524_100000755774 [0,0,0,1,0,0|2,0,1]=4 1939 B13R2.6970 CC(OCC1OCCO1)C2CC2 7a_100000744524_100000755774 [0,0,0,1,0,0|2,0,1]=4 1940 B13R2.6970 O=C(CCC1CCCC1)C2CC2 1458a_100000210395_100000760354 [0,0,0,1,0,0|2,0,0]=3 1941 B13R2.6970 O=C(CCC1CCCC1)C2CO2 1458a_100000701028_100000760354 [0,0,0,1,0,0|3,0,0]=4 1942 B13R2.6970 O=C(CCC1OCCO1)C2CC2 1458a_100000210395_100000740749 [0,0,0,1,0,0|2,0,0]=3 1943 B13R2.6970 O=C(CCC1OCCO1)C2CO2 1458a_100000701028_100000740749 [0,0,0,1,0,0|3,0,0]=4 1944 B13R2.6970 O=C(CCN1CCCC1)C2CC2 1458a_100000210395_100000004467 [0,0,0,1,0,0|3,0,0]=4 1945 B13R2.6970 O=C(CNC1CCCC1)C2CC2 2230a_100000211070_100000746382 [0,0,0,1,0,0|3,0,0]=4 1946 B13R2.6970 O=C(CNC1CCCC1)C2CC2 34a_100000211070_100000746382 [0,0,0,1,0,0|3,0,0]=4 1947 B13R2.6970 O=C(COC1CCCC1)C2CC2 34a_100000210269_100000746382 [0,0,0,1,0,0|3,0,0]=4 1948 B13R2.6970 O=C(COC1CCCC1)C2CC2 34a_100000686663_100000179811 [0,0,0,1,0,0|3,0,0]=4 1949 B13R2.6970 O=C(COC1CCCC1)C2CC2 7a_100000210269_100000746382 [0,0,0,1,0,0|3,0,0]=4 1950 B13R2.6970 O=C(COC1CCCO1)C2CC2 34a_100000085407_100000746382 [0,0,0,1,0,0|2,0,0]=3 1951 B13R2.6970 O=C(CSC1CCCC1)C2CC2 62a_100000746382_100000179811 [0,0,0,1,0,0|3,0,0]=4 1952 B13R2.6970 O=C(CSC1CCCC1)C2CC2 62a_100011217020_100000746382 [0,0,0,1,0,0|3,0,0]=4 1953 B13R2.6970 O=C(NCC1CCCC1)C2CC2 11a_100000737975_100000210395 [0,0,0,1,0,0|2,0,0]=3 1954 B13R2.6970 O=C(NCC1CCCC1)C2CC2 1626a_100000737975_100000210395 [0,0,0,1,0,0|2,0,0]=3 1955 B13R2.6970 O=C(NCC1CCCC1)C2CC2 240690a_100000737975_100000210395 [0,0,0,1,0,0|2,0,0]=3 1956 B13R2.6970 O=C(NCC1CCCC1)C2CC2 527a_100000737975_100000210395 [0,0,0,1,0,0|2,0,0]=3 1957 B13R2.6970 O=C(NCC1CCCC1)C2CO2 11a_100000737975_100000701028 [0,0,0,1,0,0|3,0,0]=4 1958 B13R2.6970 O=C(NCC1CCCC1)C2CO2 1626a_100000737975_100000701028 [0,0,0,1,0,0|3,0,0]=4 1959 B13R2.6970 O=C(NCC1CCCC1)C2CO2 240690a_100000737975_100000701028 [0,0,0,1,0,0|3,0,0]=4 1960 B13R2.6970 O=C(NCC1CCCC1)C2CO2 527a_100000737975_100000701028 [0,0,0,1,0,0|3,0,0]=4 1961 B13R2.6970 O=C(NCC1CCOC1)C2CC2 11a_100000737293_100000210395 [0,0,0,1,0,0|3,0,0]=4 1962 B13R2.6970 O=C(NCC1CCOC1)C2CC2 1626a_100000737293_100000210395 [0,0,0,1,0,0|3,0,0]=4 1963 B13R2.6970 O=C(NCC1CCOC1)C2CC2 240690a_100000737293_100000210395 [0,0,0,1,0,0|3,0,0]=4 1964 B13R2.6970 O=C(NCC1CCOC1)C2CC2 527a_100000737293_100000210395 [0,0,0,1,0,0|3,0,0]=4 1965 B13R2.6970 O=C(NCC1OCCO1)C2CC2 11a_100000036311_100000210395 [0,0,0,1,0,0|2,0,0]=3 1966 B13R2.6970 O=C(NCC1OCCO1)C2CC2 1626a_100000036311_100000210395 [0,0,0,1,0,0|2,0,0]=3 1967 B13R2.6970 O=C(NCC1OCCO1)C2CC2 527a_100000036311_100000210395 [0,0,0,1,0,0|2,0,0]=3 1968 B13R2.6970 O=C(NCC1OCCO1)C2CO2 11a_100000036311_100000701028 [0,0,0,1,0,0|3,0,0]=4 1969 B13R2.6970 O=C(NCC1OCCO1)C2CO2 1626a_100000036311_100000701028 [0,0,0,1,0,0|3,0,0]=4 1970 B13R2.6970 O=C(NCC1OCCO1)C2CO2 527a_100000036311_100000701028 [0,0,0,1,0,0|3,0,0]=4 1971 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CC2 11a_100020590478_100000210395 [0,0,0,1,0,0|1,0,0]=2 1972 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CC2 1626a_100020590478_100000210395 [0,0,0,1,0,0|1,0,0]=2 1973 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CC2 240690a_100020590478_100000210395 [0,0,0,1,0,0|1,0,0]=2 1974 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CC2 527a_100020590478_100000210395 [0,0,0,1,0,0|1,0,0]=2 1975 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CO2 11a_100020590478_100000701028 [0,0,0,1,0,0|2,0,0]=3 1976 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CO2 1626a_100020590478_100000701028 [0,0,0,1,0,0|2,0,0]=3 1977 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CO2 240690a_100020590478_100000701028 [0,0,0,1,0,0|2,0,0]=3 1978 B13R2.6970 O=C(NC[C@@H]1CCCO1)C2CO2 527a_100020590478_100000701028 [0,0,0,1,0,0|2,0,0]=3 1979 B13R2.6970 O=C(NNC1CCCC1)C2CC2 22a_100000737850_100000210395 [0,0,0,1,0,0|3,0,0]=4 1980 B13R2.6970 O=C(OCN1CCCC1)C2CC2 2230a_100000188435_100000140896 [0,0,0,1,0,0|2,0,0]=3 1981 B13R2.6970 O=C(OCN1CCCC1)C2CC2 269982a_100000188435_100000140896 [0,0,0,1,0,0|2,0,0]=3 1982 B13R2.6970 O=C(OCN1CCSC1)C2CC2 2230a_100011215254_100000140896 [0,0,0,1,0,0|3,0,0]=4 1983 B13R2.6970 O=C(OCN1CCSC1)C2CC2 269982a_100011215254_100000140896 [0,0,0,1,0,0|3,0,0]=4 1984 B11R1.30 C#CCC(=O)CC1CCCC1 1458a_100000210891_100000184674 [0,0,0,0,1,0|1,0,2]=4 1985 B11R1.30 C#CCC(=O)CC1CCCC1 1458a_100011220946_100000740388 [0,0,0,0,1,0|1,0,2]=4 1986 B11R1.30 C#CCC(=O)CC1CCCO1 1458a_100011220946_100000203698 [0,0,0,0,1,0|0,0,2]=3 1987 B11R1.30 C#CCC(=O)CC1OCCO1 1458a_100011220946_100000755774 [0,0,0,0,1,0|1,0,2]=4 1988 B11R1.30 C=CCC(=O)CC1CCCC1 1458a_100000210193_100000740388 [0,0,0,0,1,0|1,0,2]=4 1989 B11R1.30 C=CCC(=O)CC1CCCC1 1458a_100000210891_100000210623 [0,0,0,0,1,0|1,0,2]=4 1990 B11R1.30 C=CCC(=O)CC1CCCO1 1458a_100000210193_100000203698 [0,0,0,0,1,0|0,0,2]=3 1991 B11R1.30 C=CCC(=O)CC1OCCO1 1458a_100000210193_100000755774 [0,0,0,0,1,0|1,0,2]=4 1992 B11R1.30 CC#CC(=O)CC1CCCC1 1458a_100000763181_100000740388 [0,0,0,0,1,0|1,0,2]=4 1993 B11R1.30 CC#CC(=O)CC1CCCO1 1458a_100000763181_100000203698 [0,0,0,0,1,0|0,0,2]=3 1994 B11R1.30 CC#CC(=O)CC1OCCO1 1458a_100000763181_100000755774 [0,0,0,0,1,0|1,0,2]=4 1995 B11R1.30 CC(CCO)OC1CCCO1 34a_100000085407_100009893172 [0,0,0,0,1,0|2,0,1]=4 1996 B11R1.30 CC=CC(=O)CC1CCCC1 1458a_100000210699_100000740388 [0,0,0,0,1,0|1,0,2]=4 1997 B11R1.30 CC=CC(=O)CC1CCCO1 1458a_100000210699_100000203698 [0,0,0,0,1,0|0,0,2]=3 1998 B11R1.30 CC=CC(=O)CC1OCCO1 1458a_100000210699_100000755774 [0,0,0,0,1,0|1,0,2]=4 1999 B11R1.30 CCCC(=O)C=C1CCCC1 1458a_100000743260_100000210303 [0,0,0,0,1,0|1,0,2]=4 2000 B11R1.30 CCCC(=O)CC1=CCCC1 1458a_100000050221_100000210303 [0,0,0,0,1,0|1,0,1]=3 2001 B11R1.30 CCCC(=O)CC1C=CCC1 1458a_100000212241_100000210303 [0,0,0,0,1,0|1,0,1]=3 2002 B11R1.30 CCCC(=O)CC1CC=CC1 1458a_200000137526_100000210303 [0,0,0,0,1,0|1,0,2]=4 2003 B11R1.30 CCCC(=O)CC1CCCC1 1458a_100000210891_100000210303 [0,0,0,0,1,0|1,0,0]=2 2004 B11R1.30 CCCC(=O)CC1CCCC1 1458a_100000211992_100000740388 [0,0,0,0,1,0|1,0,0]=2 2005 B11R1.30 CCCC(=O)CC1CCCO1 1458a_100000211992_100000203698 [0,0,0,0,1,0|0,0,0]=1 2006 B11R1.30 CCCC(=O)CC1CCOC1 1458a_100000211992_100000702531 [0,0,0,0,1,0|2,0,0]=3 2007 B11R1.30 CCCC(=O)CC1CCOC1 1458a_100011218419_100000210303 [0,0,0,0,1,0|2,0,0]=3 2008 B11R1.30 CCCC(=O)CC1OCCO1 1458a_100000211992_100000755774 [0,0,0,0,1,0|1,0,0]=2 2009 B11R1.30 CCCC(=O)CN1CCCC1 1458a_100000740243_100000210303 [0,0,0,0,1,0|2,0,0]=3 2010 B11R1.30 CCCC(=O)CN1CCCC1 2230a_100000188435_100000747444 [0,0,0,0,1,0|2,0,0]=3 2011 B11R1.30 CCCC(=O)CN1CCCC1 269982a_100000188435_100000747444 [0,0,0,0,1,0|2,0,0]=3 2012 B11R1.30 CCCC(=O)CN1CCSC1 2230a_100011215254_100000747444 [0,0,0,0,1,0|3,0,0]=4 2013 B11R1.30 CCCC(=O)CN1CCSC1 269982a_100011215254_100000747444 [0,0,0,0,1,0|3,0,0]=4 2014 B11R1.30 CCCC(=O)NC1CCCC1 11a_100000211070_100000211992 [0,0,0,0,1,0|2,0,0]=3 2015 B11R1.30 CCCC(=O)NC1CCCC1 1626a_100000211070_100000211992 [0,0,0,0,1,0|2,0,0]=3 2016 B11R1.30 CCCC(=O)NC1CCCC1 240690a_100000211070_100000211992 [0,0,0,0,1,0|2,0,0]=3 2017 B11R1.30 CCCC(=O)NC1CCCC1 527a_100000211070_100000211992 [0,0,0,0,1,0|2,0,0]=3 2018 B11R1.30 CCCC(=O)N[C@@H]1CCOC1 240690a_200015188469_100000211992 [0,0,0,0,1,0|3,0,0]=4 2019 B11R1.30 CCCC(=O)N[C@@H]1CCOC1 527a_200015188469_100000211992 [0,0,0,0,1,0|3,0,0]=4 2020 B11R1.30 CCCC(=O)N[C@H]1CCOC1 11a_100015188467_100000211992 [0,0,0,0,1,0|3,0,0]=4 2021 B11R1.30 CCCC(=O)N[C@H]1CCOC1 1626a_100015188467_100000211992 [0,0,0,0,1,0|3,0,0]=4 2022 B11R1.30 CCCC(=O)N[C@H]1CCOC1 240690a_100015188467_100000211992 [0,0,0,0,1,0|3,0,0]=4 2023 B11R1.30 CCCC(=O)N[C@H]1CCOC1 527a_100015188467_100000211992 [0,0,0,0,1,0|3,0,0]=4 2024 B11R1.30 CCCC(C)OC1CCCC1 34a_100000210269_100000766640 [0,0,0,0,1,0|2,0,1]=4 2025 B11R1.30 CCCC(C)OC1CCCC1 34a_100000764384_100000179811 [0,0,0,0,1,0|2,0,1]=4 2026 B11R1.30 CCCC(C)OC1CCCC1 7a_100000210269_100000766640 [0,0,0,0,1,0|2,0,1]=4 2027 B11R1.30 CCCC(C)OC1CCCC1 7a_100000764384_100000179811 [0,0,0,0,1,0|2,0,1]=4 2028 B11R1.30 CCCC(C)OC1CCCO1 34a_100000085407_100000766640 [0,0,0,0,1,0|1,0,1]=3 2029 B11R1.30 CCCN(C)CC1CCCC1 2230a_100000747261_100000740388 [0,0,0,0,1,0|3,0,0]=4 2030 B11R1.30 CCCN(C)CC1CCCC1 269982a_100000747261_100000740388 [0,0,0,0,1,0|3,0,0]=4 2031 B11R1.30 CCCN(C)CC1CCCO1 2230a_100000226859_200000210301 [0,0,0,0,1,0|2,0,0]=3 2032 B11R1.30 CCCN(C)CC1CCCO1 2230a_100000747261_100000203698 [0,0,0,0,1,0|2,0,0]=3 2033 B11R1.30 CCCN(C)CC1CCCO1 2230a_100102946541_100000210303 [0,0,0,0,1,0|2,0,0]=3 2034 B11R1.30 CCCN(C)CC1CCCO1 269982a_100000226859_200000210301 [0,0,0,0,1,0|2,0,0]=3 2035 B11R1.30 CCCN(C)CC1CCCO1 269982a_100000747261_100000183445 [0,0,0,0,1,0|2,0,0]=3 2036 B11R1.30 CCCN(C)CC1CCCO1 269982a_100102946541_100000210303 [0,0,0,0,1,0|2,0,0]=3 2037 B11R1.30 CCCN(C)CC1CCCO1 34a_100000226859_200000210301 [0,0,0,0,1,0|2,0,0]=3 2038 B11R1.30 CCCN(C)CC1CCCO1 34a_100102946541_100000210303 [0,0,0,0,1,0|2,0,0]=3 2039 B11R1.30 CCCN(C)CC1OCCO1 2230a_100000747261_100000755774 [0,0,0,0,1,0|3,0,0]=4 2040 B11R1.30 CCCN(C)CC1OCCO1 2230a_200000032744_100000210303 [0,0,0,0,1,0|3,0,0]=4 2041 B11R1.30 CCCN(C)CC1OCCO1 269982a_100000747261_100000755774 [0,0,0,0,1,0|3,0,0]=4 2042 B11R1.30 CCCN(C)CC1OCCO1 269982a_200000032744_100000210303 [0,0,0,0,1,0|3,0,0]=4 2043 B11R1.30 CCCN(C)CC1OCCO1 34a_200000032744_100000210303 [0,0,0,0,1,0|3,0,0]=4 2044 B11R1.30 CCCN([13CH3])CC1CCCO1 2230a_100000226859_200025704644 [0,0,0,0,1,0|2,0,0]=3 2045 B11R1.30 CCCN([13CH3])CC1CCCO1 269982a_100000226859_200025704644 [0,0,0,0,1,0|2,0,0]=3 2046 B11R1.30 CCCN([13CH3])CC1CCCO1 34a_100000226859_200025704644 [0,0,0,0,1,0|2,0,0]=3 2047 B11R1.30 CCNC(=O)CC1=CCCC1 11a_100015525214_100000050221 [0,0,0,0,1,0|2,0,1]=4 2048 B11R1.30 CCNC(=O)CC1=CCCC1 240690a_100015525214_100000050221 [0,0,0,0,1,0|2,0,1]=4 2049 B11R1.30 CCNC(=O)CC1=CCCC1 527a_100015525214_100000050221 [0,0,0,0,1,0|2,0,1]=4 2050 B11R1.30 CCNC(=O)CC1C=CCC1 11a_100015525214_100000212241 [0,0,0,0,1,0|2,0,1]=4 2051 B11R1.30 CCNC(=O)CC1C=CCC1 240690a_100015525214_100000212241 [0,0,0,0,1,0|2,0,1]=4 2052 B11R1.30 CCNC(=O)CC1C=CCC1 527a_100015525214_100000212241 [0,0,0,0,1,0|2,0,1]=4 2053 B11R1.30 CCNC(=O)CC1CCCC1 11a_100015525214_100000210891 [0,0,0,0,1,0|2,0,0]=3 2054 B11R1.30 CCNC(=O)CC1CCCC1 240690a_100015525214_100000210891 [0,0,0,0,1,0|2,0,0]=3 2055 B11R1.30 CCNC(=O)CC1CCCC1 527a_100015525214_100000210891 [0,0,0,0,1,0|2,0,0]=3 2056 B11R1.30 CCNC(=O)CC1CCOC1 11a_100015525214_100011218419 [0,0,0,0,1,0|3,0,0]=4 2057 B11R1.30 CCNC(=O)CC1CCOC1 240690a_100015525214_100011218419 [0,0,0,0,1,0|3,0,0]=4 2058 B11R1.30 CCNC(=O)CC1CCOC1 527a_100015525214_100011218419 [0,0,0,0,1,0|3,0,0]=4 2059 B11R1.30 CCNC(=O)CN1CCCC1 2230a_100000188435_100000183381 [0,0,0,0,1,0|3,0,0]=4 2060 B11R1.30 CCNC(=O)CN1CCCC1 240690a_100015525214_100000740243 [0,0,0,0,1,0|3,0,0]=4 2061 B11R1.30 CCNC(=O)CN1CCCC1 269982a_100000188435_100000183381 [0,0,0,0,1,0|3,0,0]=4 2062 B11R1.30 CCNC(=O)CN1CCCC1 527a_100015525214_100000740243 [0,0,0,0,1,0|3,0,0]=4 2063 B11R1.30 CCNC(=O)NC1CCCC1 2708a_100000211070_100015525214 [0,0,0,0,1,0|3,0,0]=4 2064 B11R1.30 CCNC(=O)NC1CCCC1 2708a_100015525214_100000211070 [0,0,0,0,1,0|3,0,0]=4 2065 B11R1.30 CCNC(=O)NC1CCCC1 273464a_100000211070_100015525214 [0,0,0,0,1,0|3,0,0]=4 2066 B11R1.30 CCNC(=O)NC1CCCC1 273464a_100015525214_100000211070 [0,0,0,0,1,0|3,0,0]=4 2067 B11R1.30 CCNC(=O)NC1CCCC1 512a_100000211070_100015525214 [0,0,0,0,1,0|3,0,0]=4 2068 B11R1.30 CCNC(=O)NC1CCCC1 512a_100015525214_100000211070 [0,0,0,0,1,0|3,0,0]=4 2069 B11R1.30 CCOC(=O)CN1CCCC1 2230a_100000188435_100000188475 [0,0,0,0,1,0|3,0,0]=4 2070 B11R1.30 CCOC(=O)CN1CCCC1 269982a_100000188435_100000188475 [0,0,0,0,1,0|3,0,0]=4 2071 B11R1.30 CN(CCF)CC1CCCO1 2230a_100102946541_100011217306 [0,0,0,0,1,0|3,0,0]=4 2072 B11R1.30 CN(CCF)CC1CCCO1 269982a_100102946541_100011217306 [0,0,0,0,1,0|3,0,0]=4 2073 B11R1.30 CN(CCF)CC1CCCO1 34a_100102946541_100011217306 [0,0,0,0,1,0|3,0,0]=4 2074 B11R1.30 CN(CCO)CC1CCCO1 2230a_100000210263_100000203698 [0,0,0,0,1,0|3,0,0]=4 2075 B11R1.30 CN(CCO)CC1CCCO1 2230a_100102946541_100000211926 [0,0,0,0,1,0|3,0,0]=4 2076 B11R1.30 CN(CCO)CC1CCCO1 269982a_100000210263_100000183445 [0,0,0,0,1,0|3,0,0]=4 2077 B11R1.30 CN(CCO)CC1CCCO1 269982a_100102946541_100000211926 [0,0,0,0,1,0|3,0,0]=4 2078 B11R1.30 CN(CCO)CC1CCCO1 34a_100102946541_100000211926 [0,0,0,0,1,0|3,0,0]=4 2079 B11R1.30 CNCC(=O)NC1CCCC1 2230a_100000747513_200000210301 [0,0,0,0,1,0|3,0,0]=4 2080 B11R1.30 CNCC(=O)NC1CCCC1 2230a_106832991635_100000183512 [0,0,0,0,1,0|3,0,0]=4 2081 B11R1.30 CNCC(=O)NC1CCCC1 34a_100102657272_100000183512 [0,0,0,0,1,0|3,0,0]=4 2082 B11R1.30 CNCC(=O)NC1CCCC1 7a_106832991635_100000183512 [0,0,0,0,1,0|3,0,0]=4 2083 B11R1.30 CNNC(=O)CC1CCCC1 22a_100016993582_100000210891 [0,0,0,0,1,0|3,0,0]=4 2084 B11R1.30 COCC(=O)CC1CCCC1 1458a_100000210968_100000740388 [0,0,0,0,1,0|2,0,0]=3 2085 B11R1.30 COCC(=O)CC1CCCO1 1458a_100000210968_100000203698 [0,0,0,0,1,0|1,0,0]=2 2086 B11R1.30 COCC(=O)CC1CCOC1 1458a_100000210968_100000702531 [0,0,0,0,1,0|3,0,0]=4 2087 B11R1.30 COCC(=O)CC1OCCO1 1458a_100000210968_100000755774 [0,0,0,0,1,0|2,0,0]=3 2088 B11R1.30 COCC(=O)NC1CCCC1 11a_100000211070_100000210968 [0,0,0,0,1,0|3,0,0]=4 2089 B11R1.30 COCC(=O)NC1CCCC1 1626a_100000211070_100000210968 [0,0,0,0,1,0|3,0,0]=4 2090 B11R1.30 COCC(=O)NC1CCCC1 240690a_100000211070_100000210968 [0,0,0,0,1,0|3,0,0]=4 2091 B11R1.30 COCC(=O)NC1CCCC1 34a_100138415774_100000183512 [0,0,0,0,1,0|3,0,0]=4 2092 B11R1.30 COCC(=O)NC1CCCC1 527a_100000211070_100000210968 [0,0,0,0,1,0|3,0,0]=4 2093 B11R1.30 COCC(C)OC1CCCO1 34a_100000085407_100000765312 [0,0,0,0,1,0|2,0,1]=4 2094 B11R1.30 COCN(C)CC1CCCO1 2230a_100102946541_100000766300 [0,0,0,0,1,0|3,0,0]=4 2095 B11R1.30 COCN(C)CC1CCCO1 269982a_100102946541_100000766300 [0,0,0,0,1,0|3,0,0]=4 2096 B11R1.30 CSCC(=O)CC1CCCC1 1458a_100000184570_100000740388 [0,0,0,0,1,0|2,0,0]=3 2097 B11R1.30 CSCC(=O)CC1CCCO1 1458a_100000184570_100000203698 [0,0,0,0,1,0|1,0,0]=2 2098 B11R1.30 CSCC(=O)CC1CCOC1 1458a_100000184570_100000702531 [0,0,0,0,1,0|3,0,0]=4 2099 B11R1.30 CSCC(=O)CC1OCCO1 1458a_100000184570_100000755774 [0,0,0,0,1,0|2,0,0]=3 2100 B11R1.30 CSCC(=O)NC1CCCC1 11a_100000211070_100000184570 [0,0,0,0,1,0|3,0,0]=4 2101 B11R1.30 CSCC(=O)NC1CCCC1 1626a_100000211070_100000184570 [0,0,0,0,1,0|3,0,0]=4 2102 B11R1.30 CSCC(=O)NC1CCCC1 240690a_100000211070_100000184570 [0,0,0,0,1,0|3,0,0]=4 2103 B11R1.30 CSCC(=O)NC1CCCC1 527a_100000211070_100000184570 [0,0,0,0,1,0|3,0,0]=4 2104 B11R1.30 CSCC(=O)NC1CCCC1 62a_100000183512_200000210301 [0,0,0,0,1,0|3,0,0]=4 2105 B11R1.30 CSCC(=O)NC1CCCC1 62a_200000210301_100000183512 [0,0,0,0,1,0|3,0,0]=4 2106 B11R1.30 CSCN(C)CC1CCCO1 2230a_100102946541_100011218213 [0,0,0,0,1,0|3,0,0]=4 2107 B11R1.30 CSCN(C)CC1CCCO1 269982a_100102946541_100011218213 [0,0,0,0,1,0|3,0,0]=4 2108 B11R1.30 CSCN(C)CC1CCCO1 34a_100102946541_100011218213 [0,0,0,0,1,0|3,0,0]=4 2109 B11R1.30 N#CCC(=O)CC1CCCC1 1458a_100000210891_100011214920 [0,0,0,0,1,0|2,0,1]=4 2110 B11R1.30 N#CCC(=O)CC1CCCC1 1458a_100051588842_100000740388 [0,0,0,0,1,0|2,0,1]=4 2111 B11R1.30 N#CCC(=O)CC1CCCO1 1458a_100051588842_100000203698 [0,0,0,0,1,0|1,0,1]=3 2112 B11R1.30 N#CCC(=O)CC1OCCO1 1458a_100051588842_100000755774 [0,0,0,0,1,0|2,0,1]=4 2113 B11R1.30 O=C(C=CBr)CC1CCCO1 1458a_100016273825_100000203698 [0,0,0,0,1,0|1,0,2]=4 2114 B11R1.30 O=C(C=CCl)CC1CCCO1 1458a_200016279998_100000203698 [0,0,0,0,1,0|1,0,2]=4 2115 B11R1.30 O=C(C=CI)CC1CCCO1 1458a_100016256311_100000203698 [0,0,0,0,1,0|1,0,2]=4 2116 B11R1.30 O=C(CCF)CC1=CCCC1 1458a_100000050221_100011217306 [0,0,0,0,1,0|2,0,1]=4 2117 B11R1.30 O=C(CCF)CC1C=CCC1 1458a_100000212241_100011217306 [0,0,0,0,1,0|2,0,1]=4 2118 B11R1.30 O=C(CCF)CC1CCCC1 1458a_100000210891_100011217306 [0,0,0,0,1,0|2,0,0]=3 2119 B11R1.30 O=C(CCF)CC1CCOC1 1458a_100011218419_100011217306 [0,0,0,0,1,0|3,0,0]=4 2120 B11R1.30 O=C(CCF)CN1CCCC1 1458a_100000740243_100011217306 [0,0,0,0,1,0|3,0,0]=4 2121 B11R1.30 O=C(CCO)CC1=CCCC1 1458a_100000050221_100000211926 [0,0,0,0,1,0|2,0,1]=4 2122 B11R1.30 O=C(CCO)CC1C=CCC1 1458a_100000212241_100000211926 [0,0,0,0,1,0|2,0,1]=4 2123 B11R1.30 O=C(CCO)CC1CCCC1 1458a_100000210891_100000211926 [0,0,0,0,1,0|2,0,0]=3 2124 B11R1.30 O=C(CCO)CC1CCCC1 1458a_100011216618_100000740388 [0,0,0,0,1,0|2,0,0]=3 2125 B11R1.30 O=C(CCO)CC1CCCO1 1458a_100011216618_100000203698 [0,0,0,0,1,0|1,0,0]=2 2126 B11R1.30 O=C(CCO)CC1CCOC1 1458a_100011216618_100000702531 [0,0,0,0,1,0|3,0,0]=4 2127 B11R1.30 O=C(CCO)CC1CCOC1 1458a_100011218419_100000211926 [0,0,0,0,1,0|3,0,0]=4 2128 B11R1.30 O=C(CCO)CC1OCCO1 1458a_100011216618_100000755774 [0,0,0,0,1,0|2,0,0]=3 2129 B11R1.30 O=C(CCO)CN1CCCC1 1458a_100000740243_100000211926 [0,0,0,0,1,0|3,0,0]=4 2130 B11R1.30 O=C(CCO)NC1CCCC1 240690a_100000211070_100011216618 [0,0,0,0,1,0|3,0,0]=4 2131 B11R1.30 [13CH3]NCC(=O)NC1CCCC1 2230a_100000747513_200025704644 [0,0,0,0,1,0|3,0,0]=4 2132 B11R1.30 [13CH3]SCC(=O)NC1CCCC1 62a_100000183512_200025704644 [0,0,0,0,1,0|3,0,0]=4 2133 B11R1.30 [13CH3]SCC(=O)NC1CCCC1 62a_200025704644_100000183512 [0,0,0,0,1,0|3,0,0]=4 2134 B11R1.289 C#CCC(=O)NCC1CCC1 1626a_100000738700_100011220946 [0,0,0,0,1,0|1,0,2]=4 2135 B11R1.289 C#CCC(=O)NCC1CCC1 527a_100000738700_100011220946 [0,0,0,0,1,0|1,0,2]=4 2136 B11R1.289 C#CCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100011220946 [0,0,0,0,1,0|1,0,2]=4 2137 B11R1.289 C#CCC(=O)NC[C@@H]1CCO1 527a_100020831831_100011220946 [0,0,0,0,1,0|1,0,2]=4 2138 B11R1.289 C=CCC(=O)NCC1CCC1 11a_100000738700_100000210193 [0,0,0,0,1,0|1,0,2]=4 2139 B11R1.289 C=CCC(=O)NCC1CCC1 1626a_100000738700_100000210193 [0,0,0,0,1,0|1,0,2]=4 2140 B11R1.289 C=CCC(=O)NCC1CCC1 240690a_100000738700_100000210193 [0,0,0,0,1,0|1,0,2]=4 2141 B11R1.289 C=CCC(=O)NCC1CCC1 527a_100000738700_100000210193 [0,0,0,0,1,0|1,0,2]=4 2142 B11R1.289 C=CCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210193 [0,0,0,0,1,0|1,0,2]=4 2143 B11R1.289 C=CCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210193 [0,0,0,0,1,0|1,0,2]=4 2144 B11R1.289 C=CCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210193 [0,0,0,0,1,0|1,0,2]=4 2145 B11R1.289 C=CCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210193 [0,0,0,0,1,0|1,0,2]=4 2146 B11R1.289 CC(CCBr)OCC1CCC1 34a_100012276601_100000763275 [0,0,0,0,1,0|2,0,1]=4 2147 B11R1.289 CC(CCBr)OCC1CCO1 34a_100012276601_100000103362 [0,0,0,0,1,0|2,0,1]=4 2148 B11R1.289 CC(CCO)OCC1CCC1 34a_100000760304_100009893172 [0,0,0,0,1,0|2,0,1]=4 2149 B11R1.289 CC(CCO)OCC1CCO1 34a_100000039022_100009893172 [0,0,0,0,1,0|2,0,1]=4 2150 B11R1.289 CC=CC(=O)NCC1CCC1 11a_100000738700_100000210699 [0,0,0,0,1,0|1,0,2]=4 2151 B11R1.289 CC=CC(=O)NCC1CCC1 1626a_100000738700_100000210699 [0,0,0,0,1,0|1,0,2]=4 2152 B11R1.289 CC=CC(=O)NCC1CCC1 240690a_100000738700_100000210699 [0,0,0,0,1,0|1,0,2]=4 2153 B11R1.289 CC=CC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210699 [0,0,0,0,1,0|1,0,2]=4 2154 B11R1.289 CC=CC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210699 [0,0,0,0,1,0|1,0,2]=4 2155 B11R1.289 CC=CC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210699 [0,0,0,0,1,0|1,0,2]=4 2156 B11R1.289 CCCC(=NNC1CCC1)C 4a_100000736358_100000211909 [0,0,0,0,1,0|3,0,0]=4 2157 B11R1.289 CCCC(=O)CNC1CCC1 2230a_100000749019_100000747444 [0,0,0,0,1,0|2,0,0]=3 2158 B11R1.289 CCCC(=O)CNC1COC1 2230a_100016991112_100000747444 [0,0,0,0,1,0|3,0,0]=4 2159 B11R1.289 CCCC(=O)COC1CSC1 7a_100000072292_100000747444 [0,0,0,0,1,0|3,0,0]=4 2160 B11R1.289 CCCC(=O)CSC1CCC1 62a_100000747444_100000749161 [0,0,0,0,1,0|2,0,0]=3 2161 B11R1.289 CCCC(=O)CSC1COC1 62a_100000747444_100009818527 [0,0,0,0,1,0|3,0,0]=4 2162 B11R1.289 CCCC(=O)NCC1CCC1 11a_100000738700_100000211992 [0,0,0,0,1,0|1,0,0]=2 2163 B11R1.289 CCCC(=O)NCC1CCC1 1626a_100000738700_100000211992 [0,0,0,0,1,0|1,0,0]=2 2164 B11R1.289 CCCC(=O)NCC1CCC1 240690a_100000738700_100000211992 [0,0,0,0,1,0|1,0,0]=2 2165 B11R1.289 CCCC(=O)NCC1CCC1 527a_100000738700_100000211992 [0,0,0,0,1,0|1,0,0]=2 2166 B11R1.289 CCCC(=O)NCC1COC1 11a_100015281925_100000211992 [0,0,0,0,1,0|2,0,0]=3 2167 B11R1.289 CCCC(=O)NCC1COC1 1626a_100015281925_100000211992 [0,0,0,0,1,0|2,0,0]=3 2168 B11R1.289 CCCC(=O)NCC1COC1 240690a_100015281925_100000211992 [0,0,0,0,1,0|2,0,0]=3 2169 B11R1.289 CCCC(=O)NCC1COC1 527a_100015281925_100000211992 [0,0,0,0,1,0|2,0,0]=3 2170 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000211992 [0,0,0,0,1,0|1,0,0]=2 2171 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000211992 [0,0,0,0,1,0|1,0,0]=2 2172 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000211992 [0,0,0,0,1,0|1,0,0]=2 2173 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000211992 [0,0,0,0,1,0|1,0,0]=2 2174 B11R1.289 CCCC(=O)NN=C1CCC1 4a_100000189770_100000241760 [0,0,0,0,1,0|2,0,1]=4 2175 B11R1.289 CCCC(=O)NNC1CCC1 22a_100000736358_100000211992 [0,0,0,0,1,0|2,0,0]=3 2176 B11R1.289 CCCC(=O)NNC1COC1 22a_100015188821_100000211992 [0,0,0,0,1,0|3,0,0]=4 2177 B11R1.289 CCCC(=O)OCN1CCC1 269982a_100000754969_100000034017 [0,0,0,0,1,0|1,0,0]=2 2178 B11R1.289 CCCC(C)NCC1CCC1 2230a_100000738700_100000766640 [0,0,0,0,1,0|2,0,1]=4 2179 B11R1.289 CCCC(C)NCC1CCC1 2230a_100000741246_100000763275 [0,0,0,0,1,0|2,0,1]=4 2180 B11R1.289 CCCC(C)NCC1CCC1 269862a_100000741246_100000753134 [0,0,0,0,1,0|2,0,1]=4 2181 B11R1.289 CCCC(C)NCC1CCC1 270004a_100000738700_100000211909 [0,0,0,0,1,0|2,0,1]=4 2182 B11R1.289 CCCC(C)NCC1CCC1 34a_100000738700_100000766640 [0,0,0,0,1,0|2,0,1]=4 2183 B11R1.289 CCCC(C)NCC1CCO1 2230a_100000741246_100000103362 [0,0,0,0,1,0|2,0,1]=4 2184 B11R1.289 CCCC(C)NC[C@@H]1CCO1 2230a_100020831831_100000766640 [0,0,0,0,1,0|2,0,1]=4 2185 B11R1.289 CCCC(C)NC[C@@H]1CCO1 270004a_100020831831_100000211909 [0,0,0,0,1,0|2,0,1]=4 2186 B11R1.289 CCCC(C)NC[C@@H]1CCO1 34a_100020831831_100000766640 [0,0,0,0,1,0|2,0,1]=4 2187 B11R1.289 CCCC(C)OCC1CCC1 34a_100000760304_100000766640 [0,0,0,0,1,0|1,0,1]=3 2188 B11R1.289 CCCC(C)OCC1CCC1 34a_100000764384_100000763275 [0,0,0,0,1,0|1,0,1]=3 2189 B11R1.289 CCCC(C)OCC1CCC1 7a_100000764384_100000763275 [0,0,0,0,1,0|1,0,1]=3 2190 B11R1.289 CCCC(C)OCC1CCO1 34a_100000039022_100000766640 [0,0,0,0,1,0|1,0,1]=3 2191 B11R1.289 CCCC(C)OCC1CCO1 34a_100000764384_100000103362 [0,0,0,0,1,0|1,0,1]=3 2192 B11R1.289 CCCC(C)OCC1CCO1 7a_100000764384_100000103362 [0,0,0,0,1,0|1,0,1]=3 2193 B11R1.289 CCCC(C)OCC1CNC1 34a_100016987283_100000766640 [0,0,0,0,1,0|2,0,1]=4 2194 B11R1.289 CCCC(C)OCC1COC1 34a_100000060846_100000766640 [0,0,0,0,1,0|2,0,1]=4 2195 B11R1.289 CCCC(C)OCC1COC1 34a_100000764384_100010264016 [0,0,0,0,1,0|2,0,1]=4 2196 B11R1.289 CCCC(C)OCC1COC1 7a_100000764384_100010264016 [0,0,0,0,1,0|2,0,1]=4 2197 B11R1.289 CCCC(C)SCC1CCC1 62a_100000763275_100000766640 [0,0,0,0,1,0|1,1,1]=4 2198 B11R1.289 CCCC(C)SCC1CCC1 62a_100000766640_100000763275 [0,0,0,0,1,0|1,1,1]=4 2199 B11R1.289 CCCC(C)SCC1CCO1 62a_100000103362_100000766640 [0,0,0,0,1,0|1,1,1]=4 2200 B11R1.289 CCCC(C)SCC1CCO1 62a_100000766640_100000103362 [0,0,0,0,1,0|1,1,1]=4 2201 B11R1.289 CCNC(=O)CCN1CCC1 269982a_100000754969_100000737597 [0,0,0,0,1,0|3,0,0]=4 2202 B11R1.289 CCNC(=O)CNC1CCC1 2230a_100000749019_100000183381 [0,0,0,0,1,0|3,0,0]=4 2203 B11R1.289 CCNC(=O)CNC1CCC1 270004a_100016988866_100000241760 [0,0,0,0,1,0|3,0,0]=4 2204 B11R1.289 CCNC(=O)CNC1CCC1 34a_100000749019_100000183381 [0,0,0,0,1,0|3,0,0]=4 2205 B11R1.289 CCNC(=O)COC1CCC1 34a_100000748187_100000183381 [0,0,0,0,1,0|3,0,0]=4 2206 B11R1.289 CCNC(=O)CSC1CCC1 62a_100000183381_100000749161 [0,0,0,0,1,0|3,0,0]=4 2207 B11R1.289 CCNC(=O)NCC1CCC1 2708a_100000738700_100015525214 [0,0,0,0,1,0|2,0,0]=3 2208 B11R1.289 CCNC(=O)NCC1CCC1 2708a_100015525214_100000738700 [0,0,0,0,1,0|2,0,0]=3 2209 B11R1.289 CCNC(=O)NCC1CCC1 273464a_100000738700_100015525214 [0,0,0,0,1,0|2,0,0]=3 2210 B11R1.289 CCNC(=O)NCC1CCC1 273464a_100015525214_100000738700 [0,0,0,0,1,0|2,0,0]=3 2211 B11R1.289 CCNC(=O)NCC1CCC1 512a_100000738700_100015525214 [0,0,0,0,1,0|2,0,0]=3 2212 B11R1.289 CCNC(=O)NCC1CCC1 512a_100015525214_100000738700 [0,0,0,0,1,0|2,0,0]=3 2213 B11R1.289 CCNC(=O)NCC1COC1 2708a_100015281925_100015525214 [0,0,0,0,1,0|3,0,0]=4 2214 B11R1.289 CCNC(=O)NCC1COC1 2708a_100015525214_100015281925 [0,0,0,0,1,0|3,0,0]=4 2215 B11R1.289 CCNC(=O)NCC1COC1 273464a_100015281925_100015525214 [0,0,0,0,1,0|3,0,0]=4 2216 B11R1.289 CCNC(=O)NCC1COC1 273464a_100015525214_100015281925 [0,0,0,0,1,0|3,0,0]=4 2217 B11R1.289 CCNC(=O)NCC1COC1 512a_100015281925_100015525214 [0,0,0,0,1,0|3,0,0]=4 2218 B11R1.289 CCNC(=O)NCC1COC1 512a_100015525214_100015281925 [0,0,0,0,1,0|3,0,0]=4 2219 B11R1.289 CCNC(=O)NC[C@@H]1CCO1 2708a_100015525214_100020831831 [0,0,0,0,1,0|2,0,0]=3 2220 B11R1.289 CCNC(=O)NC[C@@H]1CCO1 2708a_100020831831_100015525214 [0,0,0,0,1,0|2,0,0]=3 2221 B11R1.289 CCNC(=O)NC[C@@H]1CCO1 273464a_100015525214_100020831831 [0,0,0,0,1,0|2,0,0]=3 2222 B11R1.289 CCNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100015525214 [0,0,0,0,1,0|2,0,0]=3 2223 B11R1.289 CCNC(=O)NC[C@@H]1CCO1 512a_100015525214_100020831831 [0,0,0,0,1,0|2,0,0]=3 2224 B11R1.289 CCNC(=O)NC[C@@H]1CCO1 512a_100020831831_100015525214 [0,0,0,0,1,0|2,0,0]=3 2225 B11R1.289 CCNC(=O)NNC1CCC1 273464a_100015525214_100000736358 [0,0,0,0,1,0|3,0,0]=4 2226 B11R1.289 CCNC(=O)NNC1CCC1 512a_100000736358_100015525214 [0,0,0,0,1,0|3,0,0]=4 2227 B11R1.289 CCNC(=O)NNC1CCC1 512a_100015525214_100000736358 [0,0,0,0,1,0|3,0,0]=4 2228 B11R1.289 CCOC(=O)CCN1CCC1 269982a_100000754969_100011206558 [0,0,0,0,1,0|3,0,0]=4 2229 B11R1.289 CCOC(=O)CNC1CCC1 2230a_100000749019_100000188475 [0,0,0,0,1,0|3,0,0]=4 2230 B11R1.289 CCOC(=O)CNC1CCC1 34a_100000749019_100000188475 [0,0,0,0,1,0|3,0,0]=4 2231 B11R1.289 CCOC(=O)COC1CCC1 34a_100000748187_100000188475 [0,0,0,0,1,0|3,0,0]=4 2232 B11R1.289 CCOC(=O)CSC1CCC1 62a_100000188475_100000749161 [0,0,0,0,1,0|3,0,0]=4 2233 B11R1.289 CNNC(=O)NCC1CCC1 273464a_100000738700_100016993582 [0,0,0,0,1,0|3,0,0]=4 2234 B11R1.289 CNNC(=O)NCC1CCC1 512a_100000738700_100016993582 [0,0,0,0,1,0|3,0,0]=4 2235 B11R1.289 CNNC(=O)NCC1CCC1 512a_100016993582_100000738700 [0,0,0,0,1,0|3,0,0]=4 2236 B11R1.289 CNNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100016993582 [0,0,0,0,1,0|3,0,0]=4 2237 B11R1.289 CNNC(=O)NC[C@@H]1CCO1 512a_100016993582_100020831831 [0,0,0,0,1,0|3,0,0]=4 2238 B11R1.289 CNNC(=O)NC[C@@H]1CCO1 512a_100020831831_100016993582 [0,0,0,0,1,0|3,0,0]=4 2239 B11R1.289 COCC(=O)NCC1CCC1 11a_100000738700_100000210968 [0,0,0,0,1,0|2,0,0]=3 2240 B11R1.289 COCC(=O)NCC1CCC1 1626a_100000738700_100000210968 [0,0,0,0,1,0|2,0,0]=3 2241 B11R1.289 COCC(=O)NCC1CCC1 240690a_100000738700_100000210968 [0,0,0,0,1,0|2,0,0]=3 2242 B11R1.289 COCC(=O)NCC1CCC1 527a_100000738700_100000210968 [0,0,0,0,1,0|2,0,0]=3 2243 B11R1.289 COCC(=O)NCC1COC1 11a_100015281925_100000210968 [0,0,0,0,1,0|3,0,0]=4 2244 B11R1.289 COCC(=O)NCC1COC1 1626a_100015281925_100000210968 [0,0,0,0,1,0|3,0,0]=4 2245 B11R1.289 COCC(=O)NCC1COC1 240690a_100015281925_100000210968 [0,0,0,0,1,0|3,0,0]=4 2246 B11R1.289 COCC(=O)NCC1COC1 527a_100015281925_100000210968 [0,0,0,0,1,0|3,0,0]=4 2247 B11R1.289 COCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210968 [0,0,0,0,1,0|2,0,0]=3 2248 B11R1.289 COCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210968 [0,0,0,0,1,0|2,0,0]=3 2249 B11R1.289 COCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210968 [0,0,0,0,1,0|2,0,0]=3 2250 B11R1.289 COCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210968 [0,0,0,0,1,0|2,0,0]=3 2251 B11R1.289 COCC(=O)NNC1CCC1 22a_100000736358_100000210968 [0,0,0,0,1,0|3,0,0]=4 2252 B11R1.289 COCC(C)OCC1CCC1 34a_100000760304_100000765312 [0,0,0,0,1,0|2,0,1]=4 2253 B11R1.289 COCC(C)OCC1CCO1 34a_100000039022_100000765312 [0,0,0,0,1,0|2,0,1]=4 2254 B11R1.289 COC[C@@H](C)OCC1CCC1 34a_100011934205_100000763275 [0,0,0,0,1,0|2,0,1]=4 2255 B11R1.289 COC[C@@H](C)OCC1CCO1 34a_100011934205_100000103362 [0,0,0,0,1,0|2,0,1]=4 2256 B11R1.289 CSCC(=O)NCC1CCC1 11a_100000738700_100000184570 [0,0,0,0,1,0|2,0,0]=3 2257 B11R1.289 CSCC(=O)NCC1CCC1 1626a_100000738700_100000184570 [0,0,0,0,1,0|2,0,0]=3 2258 B11R1.289 CSCC(=O)NCC1CCC1 240690a_100000738700_100000184570 [0,0,0,0,1,0|2,0,0]=3 2259 B11R1.289 CSCC(=O)NCC1CCC1 527a_100000738700_100000184570 [0,0,0,0,1,0|2,0,0]=3 2260 B11R1.289 CSCC(=O)NCC1COC1 11a_100015281925_100000184570 [0,0,0,0,1,0|3,0,0]=4 2261 B11R1.289 CSCC(=O)NCC1COC1 1626a_100015281925_100000184570 [0,0,0,0,1,0|3,0,0]=4 2262 B11R1.289 CSCC(=O)NCC1COC1 240690a_100015281925_100000184570 [0,0,0,0,1,0|3,0,0]=4 2263 B11R1.289 CSCC(=O)NCC1COC1 527a_100015281925_100000184570 [0,0,0,0,1,0|3,0,0]=4 2264 B11R1.289 CSCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000184570 [0,0,0,0,1,0|2,0,0]=3 2265 B11R1.289 CSCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000184570 [0,0,0,0,1,0|2,0,0]=3 2266 B11R1.289 CSCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000184570 [0,0,0,0,1,0|2,0,0]=3 2267 B11R1.289 CSCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000184570 [0,0,0,0,1,0|2,0,0]=3 2268 B11R1.289 CSCC(=O)NNC1CCC1 22a_100000736358_100000184570 [0,0,0,0,1,0|3,0,0]=4 2269 B11R1.289 N#CCC(=O)NCC1CCC1 1626a_100000738700_100051588842 [0,0,0,0,1,0|2,0,1]=4 2270 B11R1.289 N#CCC(=O)NCC1CCC1 240690a_100000738700_100051588842 [0,0,0,0,1,0|2,0,1]=4 2271 B11R1.289 N#CCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100051588842 [0,0,0,0,1,0|2,0,1]=4 2272 B11R1.289 N#CCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100051588842 [0,0,0,0,1,0|2,0,1]=4 2273 B11R1.289 O=C(CCO)NCC1CCC1 240690a_100000738700_100011216618 [0,0,0,0,1,0|2,0,0]=3 2274 B11R1.289 O=C(CCO)NCC1COC1 240690a_100015281925_100011216618 [0,0,0,0,1,0|3,0,0]=4 2275 B11R1.289 O=C(CCO)NC[C@@H]1CCO1 240690a_100020831831_100011216618 [0,0,0,0,1,0|2,0,0]=3 2276 B11R1.289 O=C(CCO)NNC1CCC1 22a_100000736358_100011216618 [0,0,0,0,1,0|3,0,0]=4 2277 B13R1.42 C#CCC(=O)CCC1OCCCO1 1458a_100011220946_100000764188 [0,0,0,0,0,1|1,0,2]=4 2278 B13R1.42 C#CCC(=O)NCC1CCCCO1 1626a_100000174945_100011220946 [0,0,0,0,0,1|1,0,2]=4 2279 B13R1.42 C#CCC(=O)NCC1CCCCO1 527a_100000174945_100011220946 [0,0,0,0,0,1|1,0,2]=4 2280 B13R1.42 C#CCC(=O)NCC1CCCOC1 1626a_100000720124_100011220946 [0,0,0,0,0,1|1,0,2]=4 2281 B13R1.42 C#CCC(=O)NCC1CCCOC1 527a_100000720124_100011220946 [0,0,0,0,0,1|1,0,2]=4 2282 B13R1.42 C#CCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100011220946 [0,0,0,0,0,1|1,0,2]=4 2283 B13R1.42 C#CCC(=O)NC[C@H]1COCCO1 527a_100010981119_100011220946 [0,0,0,0,0,1|1,0,2]=4 2284 B13R1.42 C=CCC(=O)CCC1OCCCO1 1458a_100000210193_100000764188 [0,0,0,0,0,1|1,0,2]=4 2285 B13R1.42 C=CCC(=O)NCC1CCCCO1 11a_100000174945_100000210193 [0,0,0,0,0,1|1,0,2]=4 2286 B13R1.42 C=CCC(=O)NCC1CCCCO1 1626a_100000174945_100000210193 [0,0,0,0,0,1|1,0,2]=4 2287 B13R1.42 C=CCC(=O)NCC1CCCCO1 240690a_100000174945_100000210193 [0,0,0,0,0,1|1,0,2]=4 2288 B13R1.42 C=CCC(=O)NCC1CCCCO1 527a_100000174945_100000210193 [0,0,0,0,0,1|1,0,2]=4 2289 B13R1.42 C=CCC(=O)NCC1CCCOC1 11a_100000720124_100000210193 [0,0,0,0,0,1|1,0,2]=4 2290 B13R1.42 C=CCC(=O)NCC1CCCOC1 1626a_100000720124_100000210193 [0,0,0,0,0,1|1,0,2]=4 2291 B13R1.42 C=CCC(=O)NCC1CCCOC1 240690a_100000720124_100000210193 [0,0,0,0,0,1|1,0,2]=4 2292 B13R1.42 C=CCC(=O)NCC1CCCOC1 527a_100000720124_100000210193 [0,0,0,0,0,1|1,0,2]=4 2293 B13R1.42 C=CCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000210193 [0,0,0,0,0,1|1,0,2]=4 2294 B13R1.42 C=CCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000210193 [0,0,0,0,0,1|1,0,2]=4 2295 B13R1.42 C=CCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000210193 [0,0,0,0,0,1|1,0,2]=4 2296 B13R1.42 C=CCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000210193 [0,0,0,0,0,1|1,0,2]=4 2297 B13R1.42 CC#CC(=O)CCC1OCCCO1 1458a_100000763181_100000764188 [0,0,0,0,0,1|1,0,2]=4 2298 B13R1.42 CC(CCBr)OCC1CCCCO1 34a_100012276601_100000211543 [0,0,0,0,0,1|2,0,1]=4 2299 B13R1.42 CC(CCBr)OCC1CCCOC1 34a_100012276601_100000741521 [0,0,0,0,0,1|2,0,1]=4 2300 B13R1.42 CC(CCO)OCC1CCCCO1 34a_100000211370_100009893172 [0,0,0,0,0,1|2,0,1]=4 2301 B13R1.42 CC(CCO)OCC1CCCCO1 7a_100000211370_100009893172 [0,0,0,0,0,1|2,0,1]=4 2302 B13R1.42 CC(CCO)OCC1CCCOC1 34a_100000741520_100009893172 [0,0,0,0,0,1|2,0,1]=4 2303 B13R1.42 CC(CCO)OC[C@@H]1CNCCO1 34a_100015189573_100009893172 [0,0,0,0,0,1|2,0,1]=4 2304 B13R1.42 CC(CCO)OC[C@H]1COCCO1 34a_100009875890_100009893172 [0,0,0,0,0,1|2,0,1]=4 2305 B13R1.42 CC=CC(=O)CCC1OCCCO1 1458a_100000210699_100000764188 [0,0,0,0,0,1|1,0,2]=4 2306 B13R1.42 CC=CC(=O)NCC1CCCCO1 11a_100000174945_100000210699 [0,0,0,0,0,1|1,0,2]=4 2307 B13R1.42 CC=CC(=O)NCC1CCCCO1 1626a_100000174945_100000210699 [0,0,0,0,0,1|1,0,2]=4 2308 B13R1.42 CC=CC(=O)NCC1CCCCO1 240690a_100000174945_100000210699 [0,0,0,0,0,1|1,0,2]=4 2309 B13R1.42 CC=CC(=O)NCC1CCCOC1 11a_100000720124_100000210699 [0,0,0,0,0,1|1,0,2]=4 2310 B13R1.42 CC=CC(=O)NCC1CCCOC1 1626a_100000720124_100000210699 [0,0,0,0,0,1|1,0,2]=4 2311 B13R1.42 CC=CC(=O)NCC1CCCOC1 240690a_100000720124_100000210699 [0,0,0,0,0,1|1,0,2]=4 2312 B13R1.42 CC=CC(=O)NC[C@H]1COCCO1 11a_100010981119_100000210699 [0,0,0,0,0,1|1,0,2]=4 2313 B13R1.42 CC=CC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000210699 [0,0,0,0,0,1|1,0,2]=4 2314 B13R1.42 CC=CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000210699 [0,0,0,0,0,1|1,0,2]=4 2315 B13R1.42 CCCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210303 [0,0,0,0,0,1|2,0,1]=4 2316 B13R1.42 CCCC(=O)CCC1CCCCC1 1458a_100000211375_100000210303 [0,0,0,0,0,1|2,0,0]=3 2317 B13R1.42 CCCC(=O)CCC1CCCCC1 1458a_100000211992_100011273959 [0,0,0,0,0,1|2,0,0]=3 2318 B13R1.42 CCCC(=O)CCC1CCOCC1 1458a_100000211992_100011934994 [0,0,0,0,0,1|2,0,0]=3 2319 B13R1.42 CCCC(=O)CCC1OCCCO1 1458a_100000211992_100000764188 [0,0,0,0,0,1|1,0,0]=2 2320 B13R1.42 CCCC(=O)CCN1CCCCC1 1458a_100000211992_100000739454 [0,0,0,0,0,1|3,0,0]=4 2321 B13R1.42 CCCC(=O)CCN1CCCCC1 1458a_100000743487_100000210303 [0,0,0,0,0,1|3,0,0]=4 2322 B13R1.42 CCCC(=O)CCN1CCCCO1 1458a_200015184090_100000210303 [0,0,0,0,0,1|2,0,0]=3 2323 B13R1.42 CCCC(=O)CCN1CCOCC1 1458a_100000211992_100000753993 [0,0,0,0,0,1|3,0,0]=4 2324 B13R1.42 CCCC(=O)CCN1CCOCC1 1458a_100000749337_100000210303 [0,0,0,0,0,1|3,0,0]=4 2325 B13R1.42 CCCC(=O)CNC1CCCCC1 2230a_100000182618_100000747444 [0,0,0,0,0,1|3,0,0]=4 2326 B13R1.42 CCCC(=O)CNC1CCCOC1 2230a_100000719290_100000747444 [0,0,0,0,0,1|2,0,0]=3 2327 B13R1.42 CCCC(=O)CNC1CCOCC1 2230a_100000741149_100000747444 [0,0,0,0,0,1|3,0,0]=4 2328 B13R1.42 CCCC(=O)CNC1CCSCC1 2230a_100000748639_100000747444 [0,0,0,0,0,1|3,0,0]=4 2329 B13R1.42 CCCC(=O)COC1CCCCC1 1458a_100000211992_100011935260 [0,0,0,0,0,1|3,0,0]=4 2330 B13R1.42 CCCC(=O)COC1CCCCC1 1458a_100011223303_100000210303 [0,0,0,0,0,1|3,0,0]=4 2331 B13R1.42 CCCC(=O)COC1CCCCC1 7a_100000210231_100000747444 [0,0,0,0,0,1|3,0,0]=4 2332 B13R1.42 CCCC(=O)COC1CCCSC1 7a_100015962668_100000747444 [0,0,0,0,0,1|2,1,0]=4 2333 B13R1.42 CCCC(=O)COC1CCSCC1 7a_100000731022_100000747444 [0,0,0,0,0,1|3,0,0]=4 2334 B13R1.42 CCCC(=O)CSC1C=CCCC1 62a_100000747444_100000751183 [0,0,0,0,0,1|3,0,0]=4 2335 B13R1.42 CCCC(=O)CSC1C=CCCC1 62a_100000751183_100000747444 [0,0,0,0,0,1|3,0,0]=4 2336 B13R1.42 CCCC(=O)CSC1CCCCC1 62a_100000210327_100000747444 [0,0,0,0,0,1|3,0,0]=4 2337 B13R1.42 CCCC(=O)CSC1CCCCC1 62a_100000747444_100000210327 [0,0,0,0,0,1|3,0,0]=4 2338 B13R1.42 CCCC(=O)CSC1CCCOC1 62a_100000747444_100000693364 [0,0,0,0,0,1|2,0,0]=3 2339 B13R1.42 CCCC(=O)CSC1CCOCC1 62a_100000747444_100011324220 [0,0,0,0,0,1|3,0,0]=4 2340 B13R1.42 CCCC(=O)CSC1CCSCC1 62a_100000747444_100000069128 [0,0,0,0,0,1|3,0,0]=4 2341 B13R1.42 CCCC(=O)NCC1CCCCC1 11a_100000210473_100000211992 [0,0,0,0,0,1|2,0,0]=3 2342 B13R1.42 CCCC(=O)NCC1CCCCC1 1626a_100000210473_100000211992 [0,0,0,0,0,1|2,0,0]=3 2343 B13R1.42 CCCC(=O)NCC1CCCCC1 240690a_100000210473_100000211992 [0,0,0,0,0,1|2,0,0]=3 2344 B13R1.42 CCCC(=O)NCC1CCCCC1 527a_100000210473_100000211992 [0,0,0,0,0,1|2,0,0]=3 2345 B13R1.42 CCCC(=O)NCC1CCCCO1 11a_100000174945_100000211992 [0,0,0,0,0,1|1,0,0]=2 2346 B13R1.42 CCCC(=O)NCC1CCCCO1 1626a_100000174945_100000211992 [0,0,0,0,0,1|1,0,0]=2 2347 B13R1.42 CCCC(=O)NCC1CCCCO1 240690a_100000174945_100000211992 [0,0,0,0,0,1|1,0,0]=2 2348 B13R1.42 CCCC(=O)NCC1CCCCO1 527a_100000174945_100000211992 [0,0,0,0,0,1|1,0,0]=2 2349 B13R1.42 CCCC(=O)NCC1CCCOC1 11a_100000720124_100000211992 [0,0,0,0,0,1|1,0,0]=2 2350 B13R1.42 CCCC(=O)NCC1CCCOC1 1626a_100000720124_100000211992 [0,0,0,0,0,1|1,0,0]=2 2351 B13R1.42 CCCC(=O)NCC1CCCOC1 240690a_100000720124_100000211992 [0,0,0,0,0,1|1,0,0]=2 2352 B13R1.42 CCCC(=O)NCC1CCCOC1 527a_100000720124_100000211992 [0,0,0,0,0,1|1,0,0]=2 2353 B13R1.42 CCCC(=O)NCC1CCOCC1 11a_100000746373_100000211992 [0,0,0,0,0,1|2,0,0]=3 2354 B13R1.42 CCCC(=O)NCC1CCOCC1 1626a_100000746373_100000211992 [0,0,0,0,0,1|2,0,0]=3 2355 B13R1.42 CCCC(=O)NCC1CCOCC1 240690a_100000746373_100000211992 [0,0,0,0,0,1|2,0,0]=3 2356 B13R1.42 CCCC(=O)NCC1CCOCC1 527a_100000746373_100000211992 [0,0,0,0,0,1|2,0,0]=3 2357 B13R1.42 CCCC(=O)NCC1CCSCC1 11a_100015188806_100000211992 [0,0,0,0,0,1|2,0,0]=3 2358 B13R1.42 CCCC(=O)NCC1CCSCC1 240690a_100015188806_100000211992 [0,0,0,0,0,1|2,0,0]=3 2359 B13R1.42 CCCC(=O)NCC1CCSCC1 527a_100015188806_100000211992 [0,0,0,0,0,1|2,0,0]=3 2360 B13R1.42 CCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000211992 [0,0,0,0,0,1|1,0,0]=2 2361 B13R1.42 CCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000211992 [0,0,0,0,0,1|1,0,0]=2 2362 B13R1.42 CCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000211992 [0,0,0,0,0,1|1,0,0]=2 2363 B13R1.42 CCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000211992 [0,0,0,0,0,1|1,0,0]=2 2364 B13R1.42 CCCC(=O)NN=C1CCCOC1 4a_100000189770_100000753404 [0,0,0,0,0,1|2,0,1]=4 2365 B13R1.42 CCCC(=O)NNC1CCCCC1 22a_100000709804_100000211992 [0,0,0,0,0,1|3,0,0]=4 2366 B13R1.42 CCCC(=O)NNC1CCOCC1 22a_100000687383_100000211992 [0,0,0,0,0,1|3,0,0]=4 2367 B13R1.42 CCCC(=O)OCN1CC=CCC1 2230a_100000698166_100000034017 [0,0,0,0,0,1|2,0,1]=4 2368 B13R1.42 CCCC(=O)OCN1CC=CCC1 269982a_100000698166_100000034017 [0,0,0,0,0,1|2,0,1]=4 2369 B13R1.42 CCCC(=O)OCN1CC=CCC1 34a_100000698166_100000034017 [0,0,0,0,0,1|2,0,1]=4 2370 B13R1.42 CCCC(=O)OCN1CCCOC1 2230a_100000131196_100000034017 [0,0,0,0,0,1|1,0,0]=2 2371 B13R1.42 CCCC(=O)OCN1CCCOC1 269982a_100000131196_100000034017 [0,0,0,0,0,1|1,0,0]=2 2372 B13R1.42 CCCC(=O)OCN1CCCOC1 34a_100000131196_100000034017 [0,0,0,0,0,1|1,0,0]=2 2373 B13R1.42 CCCC(=O)OCN1CCOCC1 2230a_100015191051_100000034017 [0,0,0,0,0,1|2,0,0]=3 2374 B13R1.42 CCCC(=O)OCN1CCOCC1 269982a_100015191051_100000034017 [0,0,0,0,0,1|2,0,0]=3 2375 B13R1.42 CCCC(=O)OCN1CCOCC1 34a_100015191051_100000034017 [0,0,0,0,0,1|2,0,0]=3 2376 B13R1.42 CCCC(=O)OCN1CCSCC1 2230a_100000737611_100000034017 [0,0,0,0,0,1|2,0,0]=3 2377 B13R1.42 CCCC(=O)OCN1CCSCC1 269982a_100000737611_100000034017 [0,0,0,0,0,1|2,0,0]=3 2378 B13R1.42 CCCC(C)NCC1CCCCO1 2230a_100000174945_100000766640 [0,0,0,0,0,1|2,0,1]=4 2379 B13R1.42 CCCC(C)NCC1CCCCO1 2230a_100000741246_100000211543 [0,0,0,0,0,1|2,0,1]=4 2380 B13R1.42 CCCC(C)NCC1CCCCO1 270004a_100000174945_100000211909 [0,0,0,0,0,1|2,0,1]=4 2381 B13R1.42 CCCC(C)NCC1CCCCO1 34a_100000174945_100000766640 [0,0,0,0,0,1|2,0,1]=4 2382 B13R1.42 CCCC(C)NCC1CCCOC1 2230a_100000720124_100000766640 [0,0,0,0,0,1|2,0,1]=4 2383 B13R1.42 CCCC(C)NCC1CCCOC1 2230a_100000741246_100000741521 [0,0,0,0,0,1|2,0,1]=4 2384 B13R1.42 CCCC(C)NCC1CCCOC1 270004a_100000720124_100000211909 [0,0,0,0,0,1|2,0,1]=4 2385 B13R1.42 CCCC(C)NCC1CCCOC1 34a_100000720124_100000766640 [0,0,0,0,0,1|2,0,1]=4 2386 B13R1.42 CCCC(C)NC[C@H]1COCCO1 2230a_100010981119_100000766640 [0,0,0,0,0,1|2,0,1]=4 2387 B13R1.42 CCCC(C)NC[C@H]1COCCO1 270004a_100010981119_100000211909 [0,0,0,0,0,1|2,0,1]=4 2388 B13R1.42 CCCC(C)NC[C@H]1COCCO1 34a_100010981119_100000766640 [0,0,0,0,0,1|2,0,1]=4 2389 B13R1.42 CCCC(C)OCC1CCC=CO1 34a_100011217868_100000766640 [0,0,0,0,0,1|1,0,2]=4 2390 B13R1.42 CCCC(C)OCC1CCCCC1 34a_100000212181_100000766640 [0,0,0,0,0,1|2,0,1]=4 2391 B13R1.42 CCCC(C)OCC1CCCCC1 34a_100000764384_100000211423 [0,0,0,0,0,1|2,0,1]=4 2392 B13R1.42 CCCC(C)OCC1CCCCC1 7a_100000212181_100000766640 [0,0,0,0,0,1|2,0,1]=4 2393 B13R1.42 CCCC(C)OCC1CCCCC1 7a_100000764384_100000211423 [0,0,0,0,0,1|2,0,1]=4 2394 B13R1.42 CCCC(C)OCC1CCCCN1 34a_100000210821_100000766640 [0,0,0,0,0,1|2,0,1]=4 2395 B13R1.42 CCCC(C)OCC1CCCCO1 34a_100000211370_100000766640 [0,0,0,0,0,1|1,0,1]=3 2396 B13R1.42 CCCC(C)OCC1CCCCO1 34a_100000764384_100000211543 [0,0,0,0,0,1|1,0,1]=3 2397 B13R1.42 CCCC(C)OCC1CCCCO1 7a_100000211370_100000766640 [0,0,0,0,0,1|1,0,1]=3 2398 B13R1.42 CCCC(C)OCC1CCCCO1 7a_100000764384_100000211543 [0,0,0,0,0,1|1,0,1]=3 2399 B13R1.42 CCCC(C)OCC1CCCNC1 34a_100000211344_100000766640 [0,0,0,0,0,1|2,0,1]=4 2400 B13R1.42 CCCC(C)OCC1CCCOC1 34a_100000741520_100000766640 [0,0,0,0,0,1|1,0,1]=3 2401 B13R1.42 CCCC(C)OCC1CCCOC1 34a_100000764384_100000741521 [0,0,0,0,0,1|1,0,1]=3 2402 B13R1.42 CCCC(C)OCC1CCCOC1 7a_100000764384_100000741521 [0,0,0,0,0,1|1,0,1]=3 2403 B13R1.42 CCCC(C)OCC1CCNCC1 34a_100000738675_100000766640 [0,0,0,0,0,1|2,0,1]=4 2404 B13R1.42 CCCC(C)OCC1CCOCC1 34a_100000749013_100000766640 [0,0,0,0,0,1|2,0,1]=4 2405 B13R1.42 CCCC(C)OCC1CCOCC1 34a_100000764384_100000754603 [0,0,0,0,0,1|2,0,1]=4 2406 B13R1.42 CCCC(C)OCC1CCOCC1 7a_100000764384_100000754603 [0,0,0,0,0,1|2,0,1]=4 2407 B13R1.42 CCCC(C)OCC1CCSCC1 34a_100000070558_100000766640 [0,0,0,0,0,1|2,0,1]=4 2408 B13R1.42 CCCC(C)OCC1CCSCC1 7a_100000070558_100000766640 [0,0,0,0,0,1|2,0,1]=4 2409 B13R1.42 CCCC(C)OC[C@@H]1CNCCO1 34a_100015189573_100000766640 [0,0,0,0,0,1|1,0,1]=3 2410 B13R1.42 CCCC(C)OC[C@@H]1COCCN1 34a_100000717676_100000766640 [0,0,0,0,0,1|2,0,1]=4 2411 B13R1.42 CCCC(C)OC[C@H]1COCCO1 34a_100009875890_100000766640 [0,0,0,0,0,1|1,0,1]=3 2412 B13R1.42 CCCC(C)SCC1CCCCO1 62a_100000211543_100000766640 [0,0,0,0,0,1|1,1,1]=4 2413 B13R1.42 CCCC(C)SCC1CCCCO1 62a_100000766640_100000211543 [0,0,0,0,0,1|1,1,1]=4 2414 B13R1.42 CCCC(C)SCC1CCCOC1 62a_100000741521_100000766640 [0,0,0,0,0,1|1,1,1]=4 2415 B13R1.42 CCCC(C)SCC1CCCOC1 62a_100000766640_100000741521 [0,0,0,0,0,1|1,1,1]=4 2416 B13R1.42 CCCN(C)CCC1CCCCO1 2230a_100015183322_100000210303 [0,0,0,0,0,1|3,0,0]=4 2417 B13R1.42 CCCN(C)CCC1CCCCO1 269982a_100015183322_100000210303 [0,0,0,0,0,1|3,0,0]=4 2418 B13R1.42 CCCN(C)CCC1CCCCO1 34a_100015183322_100000210303 [0,0,0,0,0,1|3,0,0]=4 2419 B13R1.42 CCCN(C)CCC1OCCCO1 2230a_100000747261_100000764188 [0,0,0,0,0,1|3,0,0]=4 2420 B13R1.42 CCCN(C)CCC1OCCCO1 269982a_100000747261_100000764188 [0,0,0,0,0,1|3,0,0]=4 2421 B13R1.42 CCNC(=O)CCC1CCCCC1 11a_100015525214_100000211375 [0,0,0,0,0,1|3,0,0]=4 2422 B13R1.42 CCNC(=O)CCC1CCCCC1 240690a_100015525214_100000211375 [0,0,0,0,0,1|3,0,0]=4 2423 B13R1.42 CCNC(=O)CCC1CCCCC1 527a_100015525214_100000211375 [0,0,0,0,0,1|3,0,0]=4 2424 B13R1.42 CCNC(=O)CCN1CCCCO1 240690a_100015525214_200015184090 [0,0,0,0,0,1|3,0,0]=4 2425 B13R1.42 CCNC(=O)CCN1CCCOC1 2230a_100000131196_100000737597 [0,0,0,0,0,1|3,0,0]=4 2426 B13R1.42 CCNC(=O)CCN1CCCOC1 269982a_100000131196_100000737597 [0,0,0,0,0,1|3,0,0]=4 2427 B13R1.42 CCNC(=O)CNC1CCCOC1 2230a_100000719290_100000183381 [0,0,0,0,0,1|3,0,0]=4 2428 B13R1.42 CCNC(=O)CNC1CCCOC1 270004a_100016988866_100000753404 [0,0,0,0,0,1|3,0,0]=4 2429 B13R1.42 CCNC(=O)CNC1CCCOC1 34a_100000719290_100000183381 [0,0,0,0,0,1|3,0,0]=4 2430 B13R1.42 CCNC(=O)COC1CCCCO1 34a_100000033831_100000183381 [0,0,0,0,0,1|3,0,0]=4 2431 B13R1.42 CCNC(=O)COC1CCCOC1 34a_100000754041_100000183381 [0,0,0,0,0,1|3,0,0]=4 2432 B13R1.42 CCNC(=O)CSC1CCCOC1 62a_100000183381_100000693364 [0,0,0,0,0,1|3,0,0]=4 2433 B13R1.42 CCNC(=O)NCC1CCCCC1 2708a_100000210473_100015525214 [0,0,0,0,0,1|3,0,0]=4 2434 B13R1.42 CCNC(=O)NCC1CCCCC1 2708a_100015525214_100000210473 [0,0,0,0,0,1|3,0,0]=4 2435 B13R1.42 CCNC(=O)NCC1CCCCC1 273464a_100000210473_100015525214 [0,0,0,0,0,1|3,0,0]=4 2436 B13R1.42 CCNC(=O)NCC1CCCCC1 273464a_100015525214_100000210473 [0,0,0,0,0,1|3,0,0]=4 2437 B13R1.42 CCNC(=O)NCC1CCCCC1 512a_100015525214_100000210473 [0,0,0,0,0,1|3,0,0]=4 2438 B13R1.42 CCNC(=O)NCC1CCCCO1 2708a_100000174945_100015525214 [0,0,0,0,0,1|2,0,0]=3 2439 B13R1.42 CCNC(=O)NCC1CCCCO1 2708a_100015525214_100000174945 [0,0,0,0,0,1|2,0,0]=3 2440 B13R1.42 CCNC(=O)NCC1CCCCO1 273464a_100000174945_100015525214 [0,0,0,0,0,1|2,0,0]=3 2441 B13R1.42 CCNC(=O)NCC1CCCCO1 273464a_100015525214_100000174945 [0,0,0,0,0,1|2,0,0]=3 2442 B13R1.42 CCNC(=O)NCC1CCCCO1 512a_100000174945_100015525214 [0,0,0,0,0,1|2,0,0]=3 2443 B13R1.42 CCNC(=O)NCC1CCCCO1 512a_100015525214_100000174945 [0,0,0,0,0,1|2,0,0]=3 2444 B13R1.42 CCNC(=O)NCC1CCCOC1 2708a_100000720124_100015525214 [0,0,0,0,0,1|2,0,0]=3 2445 B13R1.42 CCNC(=O)NCC1CCCOC1 2708a_100015525214_100000720124 [0,0,0,0,0,1|2,0,0]=3 2446 B13R1.42 CCNC(=O)NCC1CCCOC1 273464a_100000720124_100015525214 [0,0,0,0,0,1|2,0,0]=3 2447 B13R1.42 CCNC(=O)NCC1CCCOC1 273464a_100015525214_100000720124 [0,0,0,0,0,1|2,0,0]=3 2448 B13R1.42 CCNC(=O)NCC1CCCOC1 512a_100000720124_100015525214 [0,0,0,0,0,1|2,0,0]=3 2449 B13R1.42 CCNC(=O)NCC1CCCOC1 512a_100015525214_100000720124 [0,0,0,0,0,1|2,0,0]=3 2450 B13R1.42 CCNC(=O)NCC1CCOCC1 2708a_100000746373_100015525214 [0,0,0,0,0,1|3,0,0]=4 2451 B13R1.42 CCNC(=O)NCC1CCOCC1 2708a_100015525214_100000746373 [0,0,0,0,0,1|3,0,0]=4 2452 B13R1.42 CCNC(=O)NCC1CCOCC1 273464a_100000746373_100015525214 [0,0,0,0,0,1|3,0,0]=4 2453 B13R1.42 CCNC(=O)NCC1CCOCC1 273464a_100015525214_100000746373 [0,0,0,0,0,1|3,0,0]=4 2454 B13R1.42 CCNC(=O)NCC1CCOCC1 512a_100000746373_100015525214 [0,0,0,0,0,1|3,0,0]=4 2455 B13R1.42 CCNC(=O)NCC1CCOCC1 512a_100015525214_100000746373 [0,0,0,0,0,1|3,0,0]=4 2456 B13R1.42 CCNC(=O)NCC1CCSCC1 2708a_100015188806_100015525214 [0,0,0,0,0,1|3,0,0]=4 2457 B13R1.42 CCNC(=O)NCC1CCSCC1 2708a_100015525214_100015188806 [0,0,0,0,0,1|3,0,0]=4 2458 B13R1.42 CCNC(=O)NCC1CCSCC1 273464a_100015188806_100015525214 [0,0,0,0,0,1|3,0,0]=4 2459 B13R1.42 CCNC(=O)NCC1CCSCC1 273464a_100015525214_100015188806 [0,0,0,0,0,1|3,0,0]=4 2460 B13R1.42 CCNC(=O)NCC1CCSCC1 512a_100015188806_100015525214 [0,0,0,0,0,1|3,0,0]=4 2461 B13R1.42 CCNC(=O)NCC1CCSCC1 512a_100015525214_100015188806 [0,0,0,0,0,1|3,0,0]=4 2462 B13R1.42 CCNC(=O)NC[C@H]1COCCO1 2708a_100010981119_100015525214 [0,0,0,0,0,1|2,0,0]=3 2463 B13R1.42 CCNC(=O)NC[C@H]1COCCO1 2708a_100015525214_100010981119 [0,0,0,0,0,1|2,0,0]=3 2464 B13R1.42 CCNC(=O)NC[C@H]1COCCO1 273464a_100010981119_100015525214 [0,0,0,0,0,1|2,0,0]=3 2465 B13R1.42 CCNC(=O)NC[C@H]1COCCO1 273464a_100015525214_100010981119 [0,0,0,0,0,1|2,0,0]=3 2466 B13R1.42 CCNC(=O)NC[C@H]1COCCO1 512a_100010981119_100015525214 [0,0,0,0,0,1|2,0,0]=3 2467 B13R1.42 CCNC(=O)NC[C@H]1COCCO1 512a_100015525214_100010981119 [0,0,0,0,0,1|2,0,0]=3 2468 B13R1.42 CCOC(=O)CCN1CCCOC1 2230a_100000131196_100011206558 [0,0,0,0,0,1|3,0,0]=4 2469 B13R1.42 CCOC(=O)CCN1CCCOC1 269982a_100000131196_100011206558 [0,0,0,0,0,1|3,0,0]=4 2470 B13R1.42 CCOC(=O)CCN1CCCOC1 34a_100000131196_100000765890 [0,0,0,0,0,1|3,0,0]=4 2471 B13R1.42 CCOC(=O)CNC1CCCOC1 2230a_100000719290_100000188475 [0,0,0,0,0,1|3,0,0]=4 2472 B13R1.42 CCOC(=O)CNC1CCCOC1 34a_100000719290_100000188475 [0,0,0,0,0,1|3,0,0]=4 2473 B13R1.42 CCOC(=O)COC1CCCCO1 34a_100000033831_100000188475 [0,0,0,0,0,1|3,0,0]=4 2474 B13R1.42 CCOC(=O)COC1CCCOC1 34a_100000754041_100000188475 [0,0,0,0,0,1|3,0,0]=4 2475 B13R1.42 CCOC(=O)CSC1CCCOC1 62a_100000188475_100000693364 [0,0,0,0,0,1|3,0,0]=4 2476 B13R1.42 CNCC(=O)NCC1CCCCC1 2230a_106832991635_100000183341 [0,0,0,0,0,1|3,0,0]=4 2477 B13R1.42 CNCC(=O)NCC1CCCCC1 34a_100102657272_100000183341 [0,0,0,0,0,1|3,0,0]=4 2478 B13R1.42 CNCC(=O)NCC1CCCCC1 7a_106832991635_100000183341 [0,0,0,0,0,1|3,0,0]=4 2479 B13R1.42 CNNC(=O)NCC1CCCCO1 273464a_100000174945_100016993582 [0,0,0,0,0,1|3,0,0]=4 2480 B13R1.42 CNNC(=O)NCC1CCCCO1 512a_100000174945_100016993582 [0,0,0,0,0,1|3,0,0]=4 2481 B13R1.42 CNNC(=O)NCC1CCCCO1 512a_100016993582_100000174945 [0,0,0,0,0,1|3,0,0]=4 2482 B13R1.42 CNNC(=O)NCC1CCCOC1 273464a_100000720124_100016993582 [0,0,0,0,0,1|3,0,0]=4 2483 B13R1.42 CNNC(=O)NCC1CCCOC1 512a_100000720124_100016993582 [0,0,0,0,0,1|3,0,0]=4 2484 B13R1.42 CNNC(=O)NCC1CCCOC1 512a_100016993582_100000720124 [0,0,0,0,0,1|3,0,0]=4 2485 B13R1.42 CNNC(=O)NC[C@H]1COCCO1 273464a_100010981119_100016993582 [0,0,0,0,0,1|3,0,0]=4 2486 B13R1.42 CNNC(=O)NC[C@H]1COCCO1 512a_100010981119_100016993582 [0,0,0,0,0,1|3,0,0]=4 2487 B13R1.42 CNNC(=O)NC[C@H]1COCCO1 512a_100016993582_100010981119 [0,0,0,0,0,1|3,0,0]=4 2488 B13R1.42 COCC(=O)CCC1CCCCC1 1458a_100000210968_100011273959 [0,0,0,0,0,1|3,0,0]=4 2489 B13R1.42 COCC(=O)CCC1CCOCC1 1458a_100000210968_100011934994 [0,0,0,0,0,1|3,0,0]=4 2490 B13R1.42 COCC(=O)CCC1OCCCO1 1458a_100000210968_100000764188 [0,0,0,0,0,1|2,0,0]=3 2491 B13R1.42 COCC(=O)NCC1CCCCC1 11a_100000210473_100000210968 [0,0,0,0,0,1|3,0,0]=4 2492 B13R1.42 COCC(=O)NCC1CCCCC1 1626a_100000210473_100000210968 [0,0,0,0,0,1|3,0,0]=4 2493 B13R1.42 COCC(=O)NCC1CCCCC1 240690a_100000210473_100000210968 [0,0,0,0,0,1|3,0,0]=4 2494 B13R1.42 COCC(=O)NCC1CCCCC1 34a_100138415774_100000183341 [0,0,0,0,0,1|3,0,0]=4 2495 B13R1.42 COCC(=O)NCC1CCCCC1 527a_100000210473_100000210968 [0,0,0,0,0,1|3,0,0]=4 2496 B13R1.42 COCC(=O)NCC1CCCCO1 11a_100000174945_100000210968 [0,0,0,0,0,1|2,0,0]=3 2497 B13R1.42 COCC(=O)NCC1CCCCO1 1626a_100000174945_100000210968 [0,0,0,0,0,1|2,0,0]=3 2498 B13R1.42 COCC(=O)NCC1CCCCO1 240690a_100000174945_100000210968 [0,0,0,0,0,1|2,0,0]=3 2499 B13R1.42 COCC(=O)NCC1CCCCO1 527a_100000174945_100000210968 [0,0,0,0,0,1|2,0,0]=3 2500 B13R1.42 COCC(=O)NCC1CCCOC1 11a_100000720124_100000210968 [0,0,0,0,0,1|2,0,0]=3 2501 B13R1.42 COCC(=O)NCC1CCCOC1 1626a_100000720124_100000210968 [0,0,0,0,0,1|2,0,0]=3 2502 B13R1.42 COCC(=O)NCC1CCCOC1 240690a_100000720124_100000210968 [0,0,0,0,0,1|2,0,0]=3 2503 B13R1.42 COCC(=O)NCC1CCCOC1 527a_100000720124_100000210968 [0,0,0,0,0,1|2,0,0]=3 2504 B13R1.42 COCC(=O)NCC1CCOCC1 11a_100000746373_100000210968 [0,0,0,0,0,1|3,0,0]=4 2505 B13R1.42 COCC(=O)NCC1CCOCC1 1626a_100000746373_100000210968 [0,0,0,0,0,1|3,0,0]=4 2506 B13R1.42 COCC(=O)NCC1CCOCC1 240690a_100000746373_100000210968 [0,0,0,0,0,1|3,0,0]=4 2507 B13R1.42 COCC(=O)NCC1CCOCC1 527a_100000746373_100000210968 [0,0,0,0,0,1|3,0,0]=4 2508 B13R1.42 COCC(=O)NCC1CCSCC1 11a_100015188806_100000210968 [0,0,0,0,0,1|3,0,0]=4 2509 B13R1.42 COCC(=O)NCC1CCSCC1 240690a_100015188806_100000210968 [0,0,0,0,0,1|3,0,0]=4 2510 B13R1.42 COCC(=O)NCC1CCSCC1 527a_100015188806_100000210968 [0,0,0,0,0,1|3,0,0]=4 2511 B13R1.42 COCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000210968 [0,0,0,0,0,1|2,0,0]=3 2512 B13R1.42 COCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000210968 [0,0,0,0,0,1|2,0,0]=3 2513 B13R1.42 COCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000210968 [0,0,0,0,0,1|2,0,0]=3 2514 B13R1.42 COCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000210968 [0,0,0,0,0,1|2,0,0]=3 2515 B13R1.42 COCC(C)OCC1CCCCO1 34a_100000211370_100000765312 [0,0,0,0,0,1|2,0,1]=4 2516 B13R1.42 COCC(C)OCC1CCCCO1 7a_100000211370_100000765312 [0,0,0,0,0,1|2,0,1]=4 2517 B13R1.42 COCC(C)OCC1CCCOC1 34a_100000741520_100000765312 [0,0,0,0,0,1|2,0,1]=4 2518 B13R1.42 COCC(C)OC[C@@H]1CNCCO1 34a_100015189573_100000765312 [0,0,0,0,0,1|2,0,1]=4 2519 B13R1.42 COCC(C)OC[C@H]1COCCO1 34a_100009875890_100000765312 [0,0,0,0,0,1|2,0,1]=4 2520 B13R1.42 COC[C@@H](C)OCC1CCCCO1 34a_100011934205_100000211543 [0,0,0,0,0,1|2,0,1]=4 2521 B13R1.42 COC[C@@H](C)OCC1CCCOC1 34a_100011934205_100000741521 [0,0,0,0,0,1|2,0,1]=4 2522 B13R1.42 CSCC(=O)CCC1CCCCC1 1458a_100000184570_100011273959 [0,0,0,0,0,1|3,0,0]=4 2523 B13R1.42 CSCC(=O)CCC1CCOCC1 1458a_100000184570_100011934994 [0,0,0,0,0,1|3,0,0]=4 2524 B13R1.42 CSCC(=O)CCC1OCCCO1 1458a_100000184570_100000764188 [0,0,0,0,0,1|2,0,0]=3 2525 B13R1.42 CSCC(=O)NCC1CCCCC1 11a_100000210473_100000184570 [0,0,0,0,0,1|3,0,0]=4 2526 B13R1.42 CSCC(=O)NCC1CCCCC1 1626a_100000210473_100000184570 [0,0,0,0,0,1|3,0,0]=4 2527 B13R1.42 CSCC(=O)NCC1CCCCC1 240690a_100000210473_100000184570 [0,0,0,0,0,1|3,0,0]=4 2528 B13R1.42 CSCC(=O)NCC1CCCCC1 527a_100000210473_100000184570 [0,0,0,0,0,1|3,0,0]=4 2529 B13R1.42 CSCC(=O)NCC1CCCCC1 62a_100000183341_200000210301 [0,0,0,0,0,1|3,0,0]=4 2530 B13R1.42 CSCC(=O)NCC1CCCCC1 62a_200000210301_100000183341 [0,0,0,0,0,1|3,0,0]=4 2531 B13R1.42 CSCC(=O)NCC1CCCCO1 11a_100000174945_100000184570 [0,0,0,0,0,1|2,0,0]=3 2532 B13R1.42 CSCC(=O)NCC1CCCCO1 1626a_100000174945_100000184570 [0,0,0,0,0,1|2,0,0]=3 2533 B13R1.42 CSCC(=O)NCC1CCCCO1 240690a_100000174945_100000184570 [0,0,0,0,0,1|2,0,0]=3 2534 B13R1.42 CSCC(=O)NCC1CCCCO1 527a_100000174945_100000184570 [0,0,0,0,0,1|2,0,0]=3 2535 B13R1.42 CSCC(=O)NCC1CCCOC1 11a_100000720124_100000184570 [0,0,0,0,0,1|2,0,0]=3 2536 B13R1.42 CSCC(=O)NCC1CCCOC1 1626a_100000720124_100000184570 [0,0,0,0,0,1|2,0,0]=3 2537 B13R1.42 CSCC(=O)NCC1CCCOC1 240690a_100000720124_100000184570 [0,0,0,0,0,1|2,0,0]=3 2538 B13R1.42 CSCC(=O)NCC1CCCOC1 527a_100000720124_100000184570 [0,0,0,0,0,1|2,0,0]=3 2539 B13R1.42 CSCC(=O)NCC1CCOCC1 11a_100000746373_100000184570 [0,0,0,0,0,1|3,0,0]=4 2540 B13R1.42 CSCC(=O)NCC1CCOCC1 1626a_100000746373_100000184570 [0,0,0,0,0,1|3,0,0]=4 2541 B13R1.42 CSCC(=O)NCC1CCOCC1 240690a_100000746373_100000184570 [0,0,0,0,0,1|3,0,0]=4 2542 B13R1.42 CSCC(=O)NCC1CCOCC1 527a_100000746373_100000184570 [0,0,0,0,0,1|3,0,0]=4 2543 B13R1.42 CSCC(=O)NCC1CCSCC1 11a_100015188806_100000184570 [0,0,0,0,0,1|3,0,0]=4 2544 B13R1.42 CSCC(=O)NCC1CCSCC1 240690a_100015188806_100000184570 [0,0,0,0,0,1|3,0,0]=4 2545 B13R1.42 CSCC(=O)NCC1CCSCC1 527a_100015188806_100000184570 [0,0,0,0,0,1|3,0,0]=4 2546 B13R1.42 CSCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000184570 [0,0,0,0,0,1|2,0,0]=3 2547 B13R1.42 CSCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000184570 [0,0,0,0,0,1|2,0,0]=3 2548 B13R1.42 CSCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000184570 [0,0,0,0,0,1|2,0,0]=3 2549 B13R1.42 CSCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000184570 [0,0,0,0,0,1|2,0,0]=3 2550 B13R1.42 N#CCC(=O)CCC1OCCCO1 1458a_100051588842_100000764188 [0,0,0,0,0,1|2,0,1]=4 2551 B13R1.42 N#CCC(=O)NCC1CCCCO1 1626a_100000174945_100051588842 [0,0,0,0,0,1|2,0,1]=4 2552 B13R1.42 N#CCC(=O)NCC1CCCCO1 240690a_100000174945_100051588842 [0,0,0,0,0,1|2,0,1]=4 2553 B13R1.42 N#CCC(=O)NCC1CCCOC1 1626a_100000720124_100051588842 [0,0,0,0,0,1|2,0,1]=4 2554 B13R1.42 N#CCC(=O)NCC1CCCOC1 240690a_100000720124_100051588842 [0,0,0,0,0,1|2,0,1]=4 2555 B13R1.42 N#CCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100051588842 [0,0,0,0,0,1|2,0,1]=4 2556 B13R1.42 N#CCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100051588842 [0,0,0,0,0,1|2,0,1]=4 2557 B13R1.42 O=C(CCF)CCC1CCCCC1 1458a_100000211375_100011217306 [0,0,0,0,0,1|3,0,0]=4 2558 B13R1.42 O=C(CCF)CCN1CCCCO1 1458a_200015184090_100011217306 [0,0,0,0,0,1|3,0,0]=4 2559 B13R1.42 O=C(CCO)CCC1CCCCC1 1458a_100000211375_100000211926 [0,0,0,0,0,1|3,0,0]=4 2560 B13R1.42 O=C(CCO)CCC1CCCCC1 1458a_100011216618_100011273959 [0,0,0,0,0,1|3,0,0]=4 2561 B13R1.42 O=C(CCO)CCC1CCOCC1 1458a_100011216618_100011934994 [0,0,0,0,0,1|3,0,0]=4 2562 B13R1.42 O=C(CCO)CCC1OCCCO1 1458a_100011216618_100000764188 [0,0,0,0,0,1|2,0,0]=3 2563 B13R1.42 O=C(CCO)CCN1CCCCO1 1458a_200015184090_100000211926 [0,0,0,0,0,1|3,0,0]=4 2564 B13R1.42 O=C(CCO)NCC1CCCCC1 240690a_100000210473_100011216618 [0,0,0,0,0,1|3,0,0]=4 2565 B13R1.42 O=C(CCO)NCC1CCCCO1 240690a_100000174945_100011216618 [0,0,0,0,0,1|2,0,0]=3 2566 B13R1.42 O=C(CCO)NCC1CCCOC1 240690a_100000720124_100011216618 [0,0,0,0,0,1|2,0,0]=3 2567 B13R1.42 O=C(CCO)NCC1CCOCC1 240690a_100000746373_100011216618 [0,0,0,0,0,1|3,0,0]=4 2568 B13R1.42 O=C(CCO)NCC1CCSCC1 240690a_100015188806_100011216618 [0,0,0,0,0,1|3,0,0]=4 2569 B13R1.42 O=C(CCO)NC[C@H]1COCCO1 240690a_100010981119_100011216618 [0,0,0,0,0,1|2,0,0]=3 2570 B13R1.42 [13CH3]SCC(=O)NCC1CCCCC1 62a_100000183341_200025704644 [0,0,0,0,0,1|3,0,0]=4 2571 B13R1.42 [13CH3]SCC(=O)NCC1CCCCC1 62a_200025704644_100000183341 [0,0,0,0,0,1|3,0,0]=4 2572 B13R1.404 C#CCC(=O)COCC1CCCO1 1458a_100011223388_100000184674 [0,0,0,0,0,1|0,0,2]=3 2573 B13R1.404 C#CCC(=O)CSCC1CCCO1 1458a_100000217298_100000184674 [0,0,0,0,0,1|0,1,2]=4 2574 B13R1.404 C=CCC(=O)COCC1CCCO1 1458a_100011223388_100000210623 [0,0,0,0,0,1|0,0,2]=3 2575 B13R1.404 C=CCC(=O)CSCC1CCCO1 1458a_100000217298_100000210623 [0,0,0,0,0,1|0,1,2]=4 2576 B13R1.404 C=COC(=O)COCC1CCCO1 34a_100000210270_100000036128 [0,0,0,0,0,1|1,0,2]=4 2577 B13R1.404 CCCC(=O)CCCC1CCCC1 1458a_100000211992_100011713738 [0,0,0,0,0,1|2,0,0]=3 2578 B13R1.404 CCCC(=O)CCCC1OCCO1 1458a_100000211992_100000042513 [0,0,0,0,0,1|2,0,0]=3 2579 B13R1.404 CCCC(=O)CCCN1CCCC1 1458a_100000211992_100011445909 [0,0,0,0,0,1|3,0,0]=4 2580 B13R1.404 CCCC(=O)CCCN1CCCC1 1458a_100000743284_100000210303 [0,0,0,0,0,1|3,0,0]=4 2581 B13R1.404 CCCC(=O)CNCC1CCCC1 2230a_100000737975_100000747444 [0,0,0,0,0,1|2,0,0]=3 2582 B13R1.404 CCCC(=O)CNCC1CCOC1 2230a_100000737293_100000747444 [0,0,0,0,0,1|3,0,0]=4 2583 B13R1.404 CCCC(=O)CNCC1OCCO1 2230a_100000036311_100000747444 [0,0,0,0,0,1|2,0,0]=3 2584 B13R1.404 CCCC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000747444 [0,0,0,0,0,1|1,0,0]=2 2585 B13R1.404 CCCC(=O)COCC1CCCC1 7a_100000742336_100000747444 [0,0,0,0,0,1|1,0,0]=2 2586 B13R1.404 CCCC(=O)COCC1CCCO1 1458a_100011223388_100000210303 [0,0,0,0,0,1|0,0,0]=1 2587 B13R1.404 CCCC(=O)COCC1CCCO1 7a_100000210270_100000747444 [0,0,0,0,0,1|0,0,0]=1 2588 B13R1.404 CCCC(=O)CSCC1CCCC1 62a_100000740388_100000747444 [0,0,0,0,0,1|1,1,0]=3 2589 B13R1.404 CCCC(=O)CSCC1CCCC1 62a_100000747444_100000740388 [0,0,0,0,0,1|1,1,0]=3 2590 B13R1.404 CCCC(=O)CSCC1CCCO1 1458a_100000217298_100000210303 [0,0,0,0,0,1|0,1,0]=2 2591 B13R1.404 CCCC(=O)CSCC1CCCO1 62a_100000203698_100000747444 [0,0,0,0,0,1|0,1,0]=2 2592 B13R1.404 CCCC(=O)CSCC1CCCO1 62a_100000747444_100000203698 [0,0,0,0,0,1|0,1,0]=2 2593 B13R1.404 CCCC(=O)CSCC1CCOC1 62a_100000702531_100000747444 [0,0,0,0,0,1|2,1,0]=4 2594 B13R1.404 CCCC(=O)CSCC1CCOC1 62a_100000747444_100000702531 [0,0,0,0,0,1|2,1,0]=4 2595 B13R1.404 CCCC(=O)CSCC1OCCO1 62a_100000747444_100000755774 [0,0,0,0,0,1|1,1,0]=3 2596 B13R1.404 CCCC(=O)CSCC1OCCO1 62a_100000755774_100000747444 [0,0,0,0,0,1|1,1,0]=3 2597 B13R1.404 CCCC(=O)NCCC1CCCC1 11a_100000739158_100000211992 [0,0,0,0,0,1|2,0,0]=3 2598 B13R1.404 CCCC(=O)NCCC1CCCC1 1626a_100000739158_100000211992 [0,0,0,0,0,1|2,0,0]=3 2599 B13R1.404 CCCC(=O)NCCC1CCCC1 240690a_100000739158_100000211992 [0,0,0,0,0,1|2,0,0]=3 2600 B13R1.404 CCCC(=O)NCCC1CCCC1 527a_100000739158_100000211992 [0,0,0,0,0,1|2,0,0]=3 2601 B13R1.404 CCCC(=O)NCCC1OCCO1 11a_100000034215_100000211992 [0,0,0,0,0,1|2,0,0]=3 2602 B13R1.404 CCCC(=O)NCCC1OCCO1 1626a_100000034215_100000211992 [0,0,0,0,0,1|2,0,0]=3 2603 B13R1.404 CCCC(=O)NCCC1OCCO1 240690a_100000034215_100000211992 [0,0,0,0,0,1|2,0,0]=3 2604 B13R1.404 CCCC(=O)NCCC1OCCO1 527a_100000034215_100000211992 [0,0,0,0,0,1|2,0,0]=3 2605 B13R1.404 CCCC(=O)NCCN1CCCC1 240690a_100000212299_100000211992 [0,0,0,0,0,1|3,0,0]=4 2606 B13R1.404 CCCC(=O)NN=CC1CCCC1 4a_100000189770_100000746403 [0,0,0,0,0,1|2,0,1]=4 2607 B13R1.404 CCCC(=O)OCNC1CC=CC1 2230a_100015188752_100000034017 [0,0,0,0,0,1|1,0,2]=4 2608 B13R1.404 CCCC(=O)OCNC1CCCC1 2230a_100000211070_100000034017 [0,0,0,0,0,1|1,0,0]=2 2609 B13R1.404 CCCC(=O)OCNC1CCCC1 34a_100000211070_100000034017 [0,0,0,0,0,1|1,0,0]=2 2610 B13R1.404 CCCC(=O)OCN[C@@H]1CCOC1 2230a_200015188469_100000034017 [0,0,0,0,0,1|2,0,0]=3 2611 B13R1.404 CCCC(=O)OCN[C@H]1CCOC1 2230a_100015188467_100000034017 [0,0,0,0,0,1|2,0,0]=3 2612 B13R1.404 CCCC(=O)OCN[C@H]1CCOC1 34a_100015188467_100000034017 [0,0,0,0,0,1|2,0,0]=3 2613 B13R1.404 CCCC(=O)OCOC1CCCC1 34a_100000210269_100000034017 [0,0,0,0,0,1|1,0,0]=2 2614 B13R1.404 CCCC(=O)OCOC1CCCO1 34a_100000085407_100000034017 [0,0,0,0,0,1|0,0,0]=1 2615 B13R1.404 CCCC(=O)OCO[C@H]1CCOC1 34a_100000717292_100000034017 [0,0,0,0,0,1|2,0,0]=3 2616 B13R1.404 CCCC(=O)OCSC1CCCC1 62a_100011217020_100000034017 [0,0,0,0,0,1|1,0,0]=2 2617 B13R1.404 CCCC(C)CNC[C@@H]1CCCO1 2230a_100020590478_100011216630 [0,0,0,0,0,1|2,0,1]=4 2618 B13R1.404 CCCC(C)CNC[C@@H]1CCCO1 270004a_100020590478_100000243154 [0,0,0,0,0,1|2,0,1]=4 2619 B13R1.404 CCCC(C)CNC[C@@H]1CCCO1 34a_100020590478_100011216630 [0,0,0,0,0,1|2,0,1]=4 2620 B13R1.404 CCCC(C)COCC1CCCC1 34a_100000688023_100000740388 [0,0,0,0,0,1|2,0,1]=4 2621 B13R1.404 CCCC(C)COCC1CCCC1 34a_100000742336_100011216630 [0,0,0,0,0,1|2,0,1]=4 2622 B13R1.404 CCCC(C)COCC1CCCC1 7a_100000688023_100000740388 [0,0,0,0,0,1|2,0,1]=4 2623 B13R1.404 CCCC(C)COCC1CCCC1 7a_100000742336_100011216630 [0,0,0,0,0,1|2,0,1]=4 2624 B13R1.404 CCCC(C)COCC1CCCO1 34a_100000210270_100011216630 [0,0,0,0,0,1|1,0,1]=3 2625 B13R1.404 CCCC(C)COCC1CCCO1 7a_100000210270_100011216630 [0,0,0,0,0,1|1,0,1]=3 2626 B13R1.404 CCCC(C)COCC1CCCO1 7a_100000688023_100000203698 [0,0,0,0,0,1|1,0,1]=3 2627 B13R1.404 CCCC(C)COCC1COCO1 34a_100011216627_100011216630 [0,0,0,0,0,1|2,0,1]=4 2628 B13R1.404 CCCC(C)COCC1OCCO1 34a_100000087154_100011216630 [0,0,0,0,0,1|2,0,1]=4 2629 B13R1.404 CCCC(C)COCC1OCCO1 34a_100000688023_100000755774 [0,0,0,0,0,1|2,0,1]=4 2630 B13R1.404 CCCC(C)COCC1OCCO1 7a_100000688023_100000755774 [0,0,0,0,0,1|2,0,1]=4 2631 B13R1.404 CCCC(C)COC[C@H]1CCCN1 34a_100000745186_100011216630 [0,0,0,0,0,1|2,0,1]=4 2632 B13R1.404 CCCC(C)CSCC1CCCO1 62a_100000203698_100011216630 [0,0,0,0,0,1|1,1,1]=4 2633 B13R1.404 CCCC(C)CSCC1CCCO1 62a_100011216630_100000203698 [0,0,0,0,0,1|1,1,1]=4 2634 B13R1.404 CCCC(C)OCCC1CCCC1 34a_100000749090_100000766640 [0,0,0,0,0,1|2,0,1]=4 2635 B13R1.404 CCCC(C)OCCC1CCCC1 34a_100000764384_100000760354 [0,0,0,0,0,1|2,0,1]=4 2636 B13R1.404 CCCC(C)OCCC1CCCC1 7a_100000749090_100000766640 [0,0,0,0,0,1|2,0,1]=4 2637 B13R1.404 CCCC(C)OCCC1CCCC1 7a_100000764384_100000760354 [0,0,0,0,0,1|2,0,1]=4 2638 B13R1.404 CCCC(C)OCCC1OCCO1 34a_100000764384_100000740749 [0,0,0,0,0,1|2,0,1]=4 2639 B13R1.404 CCCC(C)OCCC1OCCO1 7a_100000764384_100000740749 [0,0,0,0,0,1|2,0,1]=4 2640 B13R1.404 CCCN(C)CCCC1CCCO1 2230a_100011698863_100000210303 [0,0,0,0,0,1|3,0,0]=4 2641 B13R1.404 CCCN(C)CCCC1CCCO1 269982a_100011698863_100000210303 [0,0,0,0,0,1|3,0,0]=4 2642 B13R1.404 CCCN(C)CCCC1CCCO1 34a_100011698863_100000210303 [0,0,0,0,0,1|3,0,0]=4 2643 B13R1.404 CCC[C@H](N)COCC1CCCC1 34a_100000732646_100000740388 [0,0,0,0,0,1|2,0,1]=4 2644 B13R1.404 CCC[C@H](N)COCC1OCCO1 34a_100000732646_100000755774 [0,0,0,0,0,1|2,0,1]=4 2645 B13R1.404 CCNC(=O)CCNC1CCCC1 2230a_100000211070_100000737597 [0,0,0,0,0,1|3,0,0]=4 2646 B13R1.404 CCNC(=O)CCNC1CCCC1 270004a_100025743525_100000210133 [0,0,0,0,0,1|3,0,0]=4 2647 B13R1.404 CCNC(=O)CCNC1CCCC1 34a_100025743525_100000179811 [0,0,0,0,0,1|3,0,0]=4 2648 B13R1.404 CCNC(=O)CCOC1CCCC1 7a_100000210269_100000737597 [0,0,0,0,0,1|3,0,0]=4 2649 B13R1.404 CCNC(=O)CCSC1CCCC1 62a_100000737597_100000179811 [0,0,0,0,0,1|3,0,0]=4 2650 B13R1.404 CCNC(=O)CCSC1CCCC1 62a_100011217020_100000737597 [0,0,0,0,0,1|3,0,0]=4 2651 B13R1.404 CCNC(=O)CNCC1CCCC1 2230a_100000737975_100000183381 [0,0,0,0,0,1|3,0,0]=4 2652 B13R1.404 CCNC(=O)CNCC1CCCC1 2230a_100016988866_100000740388 [0,0,0,0,0,1|3,0,0]=4 2653 B13R1.404 CCNC(=O)CNCC1CCCC1 34a_100000737975_100000183381 [0,0,0,0,0,1|3,0,0]=4 2654 B13R1.404 CCNC(=O)CNCC1CCCO1 2230a_100016988866_100000203698 [0,0,0,0,0,1|2,0,0]=3 2655 B13R1.404 CCNC(=O)CNCC1OCCO1 2230a_100000036311_100000183381 [0,0,0,0,0,1|3,0,0]=4 2656 B13R1.404 CCNC(=O)CNCC1OCCO1 2230a_100016988866_100000755774 [0,0,0,0,0,1|3,0,0]=4 2657 B13R1.404 CCNC(=O)CNCC1OCCO1 34a_100000036311_100000183381 [0,0,0,0,0,1|3,0,0]=4 2658 B13R1.404 CCNC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000183381 [0,0,0,0,0,1|2,0,0]=3 2659 B13R1.404 CCNC(=O)CNC[C@@H]1CCCO1 34a_100020590478_100000183381 [0,0,0,0,0,1|2,0,0]=3 2660 B13R1.404 CCNC(=O)COCC1CCCC1 34a_100000742336_100000183381 [0,0,0,0,0,1|2,0,0]=3 2661 B13R1.404 CCNC(=O)COCC1CCCC1 7a_100000742336_100000183381 [0,0,0,0,0,1|2,0,0]=3 2662 B13R1.404 CCNC(=O)COCC1CCCO1 11a_100015525214_100011223388 [0,0,0,0,0,1|1,0,0]=2 2663 B13R1.404 CCNC(=O)COCC1CCCO1 240690a_100015525214_100011223388 [0,0,0,0,0,1|1,0,0]=2 2664 B13R1.404 CCNC(=O)COCC1CCCO1 34a_100000210270_100000183381 [0,0,0,0,0,1|1,0,0]=2 2665 B13R1.404 CCNC(=O)COCC1CCCO1 527a_100015525214_100011223388 [0,0,0,0,0,1|1,0,0]=2 2666 B13R1.404 CCNC(=O)COCC1CCCO1 7a_100000210270_100000183381 [0,0,0,0,0,1|1,0,0]=2 2667 B13R1.404 CCNC(=O)COCC1CCNC1 34a_100000748654_100000183381 [0,0,0,0,0,1|3,0,0]=4 2668 B13R1.404 CCNC(=O)COCC1CCOC1 34a_100000740260_100000183381 [0,0,0,0,0,1|3,0,0]=4 2669 B13R1.404 CCNC(=O)COCC1COCO1 34a_100011216627_100000183381 [0,0,0,0,0,1|2,0,0]=3 2670 B13R1.404 CCNC(=O)COCC1OCCO1 34a_100000087154_100000183381 [0,0,0,0,0,1|2,0,0]=3 2671 B13R1.404 CCNC(=O)COC[C@H]1CCCN1 34a_100000745186_100000183381 [0,0,0,0,0,1|2,0,0]=3 2672 B13R1.404 CCNC(=O)CSCC1CCCC1 62a_100000183381_100000740388 [0,0,0,0,0,1|2,1,0]=4 2673 B13R1.404 CCNC(=O)CSCC1CCCC1 62a_100000740388_100000183381 [0,0,0,0,0,1|2,1,0]=4 2674 B13R1.404 CCNC(=O)CSCC1CCCO1 11a_100015525214_100000217298 [0,0,0,0,0,1|1,1,0]=3 2675 B13R1.404 CCNC(=O)CSCC1CCCO1 240690a_100015525214_100000217298 [0,0,0,0,0,1|1,1,0]=3 2676 B13R1.404 CCNC(=O)CSCC1CCCO1 527a_100015525214_100000217298 [0,0,0,0,0,1|1,1,0]=3 2677 B13R1.404 CCNC(=O)CSCC1CCCO1 62a_100000183381_100000203698 [0,0,0,0,0,1|1,1,0]=3 2678 B13R1.404 CCNC(=O)CSCC1CCCO1 62a_100000203698_100000183381 [0,0,0,0,0,1|1,1,0]=3 2679 B13R1.404 CCNC(=O)CSCC1OCCO1 62a_100000183381_100000755774 [0,0,0,0,0,1|2,1,0]=4 2680 B13R1.404 CCNC(=O)CSCC1OCCO1 62a_100000755774_100000183381 [0,0,0,0,0,1|2,1,0]=4 2681 B13R1.404 CCNC(=O)NCCC1CCCC1 2708a_100000739158_100015525214 [0,0,0,0,0,1|3,0,0]=4 2682 B13R1.404 CCNC(=O)NCCC1CCCC1 2708a_100015525214_100000739158 [0,0,0,0,0,1|3,0,0]=4 2683 B13R1.404 CCNC(=O)NCCC1CCCC1 273464a_100000739158_100015525214 [0,0,0,0,0,1|3,0,0]=4 2684 B13R1.404 CCNC(=O)NCCC1CCCC1 273464a_100015525214_100000739158 [0,0,0,0,0,1|3,0,0]=4 2685 B13R1.404 CCNC(=O)NCCC1CCCC1 512a_100000739158_100015525214 [0,0,0,0,0,1|3,0,0]=4 2686 B13R1.404 CCNC(=O)NCCC1CCCC1 512a_100015525214_100000739158 [0,0,0,0,0,1|3,0,0]=4 2687 B13R1.404 CCNC(=O)NCCC1OCCO1 2708a_100000034215_100015525214 [0,0,0,0,0,1|3,0,0]=4 2688 B13R1.404 CCNC(=O)NCCC1OCCO1 2708a_100015525214_100000034215 [0,0,0,0,0,1|3,0,0]=4 2689 B13R1.404 CCNC(=O)NCCC1OCCO1 273464a_100000034215_100015525214 [0,0,0,0,0,1|3,0,0]=4 2690 B13R1.404 CCNC(=O)NCCC1OCCO1 273464a_100015525214_100000034215 [0,0,0,0,0,1|3,0,0]=4 2691 B13R1.404 CCNC(=O)NCCC1OCCO1 512a_100000034215_100015525214 [0,0,0,0,0,1|3,0,0]=4 2692 B13R1.404 CCNC(=O)NCCC1OCCO1 512a_100015525214_100000034215 [0,0,0,0,0,1|3,0,0]=4 2693 B13R1.404 CCOC(=O)CCNC1CCCC1 2230a_100000211070_100011206558 [0,0,0,0,0,1|3,0,0]=4 2694 B13R1.404 CCOC(=O)CCNC1CCCC1 34a_100000211070_100000765890 [0,0,0,0,0,1|3,0,0]=4 2695 B13R1.404 CCOC(=O)CCOC1CCCC1 34a_100000210269_100000765890 [0,0,0,0,0,1|3,0,0]=4 2696 B13R1.404 CCOC(=O)CCOC1CCCC1 7a_100000210269_100011206558 [0,0,0,0,0,1|3,0,0]=4 2697 B13R1.404 CCOC(=O)CCOC1CCCO1 34a_100000085407_100000765890 [0,0,0,0,0,1|2,0,0]=3 2698 B13R1.404 CCOC(=O)CCSC1CCCC1 62a_100000765890_100000179811 [0,0,0,0,0,1|3,0,0]=4 2699 B13R1.404 CCOC(=O)CCSC1CCCC1 62a_100011217020_100000765890 [0,0,0,0,0,1|3,0,0]=4 2700 B13R1.404 CCOC(=O)CNCC1CCCC1 2230a_100000737975_100000188475 [0,0,0,0,0,1|3,0,0]=4 2701 B13R1.404 CCOC(=O)CNCC1CCCC1 34a_100000737975_100000188475 [0,0,0,0,0,1|3,0,0]=4 2702 B13R1.404 CCOC(=O)CNCC1OCCO1 2230a_100000036311_100000188475 [0,0,0,0,0,1|3,0,0]=4 2703 B13R1.404 CCOC(=O)CNCC1OCCO1 34a_100000036311_100000188475 [0,0,0,0,0,1|3,0,0]=4 2704 B13R1.404 CCOC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000188475 [0,0,0,0,0,1|2,0,0]=3 2705 B13R1.404 CCOC(=O)CNC[C@@H]1CCCO1 34a_100020590478_100000188475 [0,0,0,0,0,1|2,0,0]=3 2706 B13R1.404 CCOC(=O)COCC1CCCC1 34a_100000742336_100000188475 [0,0,0,0,0,1|2,0,0]=3 2707 B13R1.404 CCOC(=O)COCC1CCCC1 7a_100000742336_100000188475 [0,0,0,0,0,1|2,0,0]=3 2708 B13R1.404 CCOC(=O)COCC1CCCO1 34a_100000210270_100000188475 [0,0,0,0,0,1|1,0,0]=2 2709 B13R1.404 CCOC(=O)COCC1CCCO1 7a_100000210270_100000188475 [0,0,0,0,0,1|1,0,0]=2 2710 B13R1.404 CCOC(=O)COCC1CCNC1 34a_100000748654_100000188475 [0,0,0,0,0,1|3,0,0]=4 2711 B13R1.404 CCOC(=O)COCC1CCOC1 34a_100000740260_100000188475 [0,0,0,0,0,1|3,0,0]=4 2712 B13R1.404 CCOC(=O)COCC1COCO1 34a_100011216627_100000188475 [0,0,0,0,0,1|2,0,0]=3 2713 B13R1.404 CCOC(=O)COCC1OCCO1 34a_100000087154_100000188475 [0,0,0,0,0,1|2,0,0]=3 2714 B13R1.404 CCOC(=O)COC[C@H]1CCCN1 34a_100000745186_100000188475 [0,0,0,0,0,1|2,0,0]=3 2715 B13R1.404 CCOC(=O)CSCC1CCCC1 62a_100000188475_100000740388 [0,0,0,0,0,1|2,1,0]=4 2716 B13R1.404 CCOC(=O)CSCC1CCCC1 62a_100000740388_100000188475 [0,0,0,0,0,1|2,1,0]=4 2717 B13R1.404 CCOC(=O)CSCC1CCCO1 62a_100000188475_100000203698 [0,0,0,0,0,1|1,1,0]=3 2718 B13R1.404 CCOC(=O)CSCC1CCCO1 62a_100000203698_100000188475 [0,0,0,0,0,1|1,1,0]=3 2719 B13R1.404 CCOC(=O)CSCC1OCCO1 62a_100000188475_100000755774 [0,0,0,0,0,1|2,1,0]=4 2720 B13R1.404 CCOC(=O)CSCC1OCCO1 62a_100000755774_100000188475 [0,0,0,0,0,1|2,1,0]=4 2721 B13R1.404 CCOC(=O)OCSC1CCCC1 62a_100011217020_100000075025 [0,0,0,0,0,1|2,0,0]=3 2722 B13R1.404 CNNC(=O)COCC1CCCO1 22a_100016993582_100011223388 [0,0,0,0,0,1|2,0,0]=3 2723 B13R1.404 CNNC(=O)CSCC1CCCO1 22a_100016993582_100000217298 [0,0,0,0,0,1|2,1,0]=4 2724 B13R1.404 COCC(=O)CCCC1CCCC1 1458a_100000210968_100011713738 [0,0,0,0,0,1|3,0,0]=4 2725 B13R1.404 COCC(=O)CCCC1OCCO1 1458a_100000210968_100000042513 [0,0,0,0,0,1|3,0,0]=4 2726 B13R1.404 COCC(=O)NCCC1CCCC1 11a_100000739158_100000210968 [0,0,0,0,0,1|3,0,0]=4 2727 B13R1.404 COCC(=O)NCCC1CCCC1 1626a_100000739158_100000210968 [0,0,0,0,0,1|3,0,0]=4 2728 B13R1.404 COCC(=O)NCCC1CCCC1 240690a_100000739158_100000210968 [0,0,0,0,0,1|3,0,0]=4 2729 B13R1.404 COCC(=O)NCCC1CCCC1 527a_100000739158_100000210968 [0,0,0,0,0,1|3,0,0]=4 2730 B13R1.404 COCC(=O)NCCC1OCCO1 11a_100000034215_100000210968 [0,0,0,0,0,1|3,0,0]=4 2731 B13R1.404 COCC(=O)NCCC1OCCO1 1626a_100000034215_100000210968 [0,0,0,0,0,1|3,0,0]=4 2732 B13R1.404 COCC(=O)NCCC1OCCO1 240690a_100000034215_100000210968 [0,0,0,0,0,1|3,0,0]=4 2733 B13R1.404 COCC(=O)NCCC1OCCO1 527a_100000034215_100000210968 [0,0,0,0,0,1|3,0,0]=4 2734 B13R1.404 COCC(O)COCC1CCCO1 34a_100000210270_100011215053 [0,0,0,0,0,1|1,0,2]=4 2735 B13R1.404 COCC(O)COCC1CCCO1 7a_100000210270_100011215053 [0,0,0,0,0,1|1,0,2]=4 2736 B13R1.404 CSCC(=O)CCCC1CCCC1 1458a_100000184570_100011713738 [0,0,0,0,0,1|3,0,0]=4 2737 B13R1.404 CSCC(=O)CCCC1OCCO1 1458a_100000184570_100000042513 [0,0,0,0,0,1|3,0,0]=4 2738 B13R1.404 CSCC(=O)NCCC1CCCC1 11a_100000739158_100000184570 [0,0,0,0,0,1|3,0,0]=4 2739 B13R1.404 CSCC(=O)NCCC1CCCC1 1626a_100000739158_100000184570 [0,0,0,0,0,1|3,0,0]=4 2740 B13R1.404 CSCC(=O)NCCC1CCCC1 240690a_100000739158_100000184570 [0,0,0,0,0,1|3,0,0]=4 2741 B13R1.404 CSCC(=O)NCCC1CCCC1 527a_100000739158_100000184570 [0,0,0,0,0,1|3,0,0]=4 2742 B13R1.404 CSCC(=O)NCCC1OCCO1 11a_100000034215_100000184570 [0,0,0,0,0,1|3,0,0]=4 2743 B13R1.404 CSCC(=O)NCCC1OCCO1 1626a_100000034215_100000184570 [0,0,0,0,0,1|3,0,0]=4 2744 B13R1.404 CSCC(=O)NCCC1OCCO1 240690a_100000034215_100000184570 [0,0,0,0,0,1|3,0,0]=4 2745 B13R1.404 CSCC(=O)NCCC1OCCO1 527a_100000034215_100000184570 [0,0,0,0,0,1|3,0,0]=4 2746 B13R1.404 N#CCC(=O)COCC1CCCO1 1458a_100011223388_100011214920 [0,0,0,0,0,1|1,0,1]=3 2747 B13R1.404 N#CCC(=O)CSCC1CCCO1 1458a_100000217298_100011214920 [0,0,0,0,0,1|1,1,1]=4 2748 B13R1.404 O=C(CCF)COCC1CCCO1 1458a_100011223388_100011217306 [0,0,0,0,0,1|1,0,0]=2 2749 B13R1.404 O=C(CCF)CSCC1CCCO1 1458a_100000217298_100011217306 [0,0,0,0,0,1|1,1,0]=3 2750 B13R1.404 O=C(CCO)CCCC1CCCC1 1458a_100011216618_100011713738 [0,0,0,0,0,1|3,0,0]=4 2751 B13R1.404 O=C(CCO)CCCC1OCCO1 1458a_100011216618_100000042513 [0,0,0,0,0,1|3,0,0]=4 2752 B13R1.404 O=C(CCO)COCC1CCCO1 1458a_100011223388_100000211926 [0,0,0,0,0,1|1,0,0]=2 2753 B13R1.404 O=C(CCO)CSCC1CCCO1 1458a_100000217298_100000211926 [0,0,0,0,0,1|1,1,0]=3 2754 B13R1.404 O=C(CCO)NCCC1CCCC1 240690a_100000739158_100011216618 [0,0,0,0,0,1|3,0,0]=4 2755 B13R1.404 O=C(CCO)NCCC1OCCO1 240690a_100000034215_100011216618 [0,0,0,0,0,1|3,0,0]=4 2756 B13R1.404 O=C(CNC[C@@H]1CCCO1)NCO 2230a_100020590478_100000185155 [0,0,0,0,0,1|3,0,0]=4 2757 B13R1.404 O=C(CNC[C@@H]1CCCO1)NCO 34a_100020590478_100000185155 [0,0,0,0,0,1|3,0,0]=4 2758 B13R1.404 O=C(COCC1CCCC1)NCO 34a_100000742336_100000185155 [0,0,0,0,0,1|3,0,0]=4 2759 B13R1.404 O=C(COCC1CCCC1)NCO 7a_100000742336_100000185155 [0,0,0,0,0,1|3,0,0]=4 2760 B13R1.404 O=C(COCC1CCCO1)NCO 34a_100000210270_100000185155 [0,0,0,0,0,1|2,0,0]=3 2761 B13R1.404 O=C(COCC1CCCO1)NCO 7a_100000210270_100000185155 [0,0,0,0,0,1|2,0,0]=3 2762 B13R1.404 O=C(COCC1COCO1)NCO 34a_100011216627_100000185155 [0,0,0,0,0,1|3,0,0]=4 2763 B13R1.404 O=C(COCC1OCCO1)NCO 34a_100000087154_100000185155 [0,0,0,0,0,1|3,0,0]=4 2764 B13R1.404 O=C(COC[C@H]1CCCN1)NCO 34a_100000745186_100000185155 [0,0,0,0,0,1|3,0,0]=4 2765 B13R1.404 O=C(CSCC1CCCO1)NCO 62a_100000185155_100000203698 [0,0,0,0,0,1|2,1,0]=4 2766 B13R1.404 O=C(CSCC1CCCO1)NCO 62a_100000203698_100000185155 [0,0,0,0,0,1|2,1,0]=4 2767 B10R0.1 C#CCC(=O)CCCCCO 1458a_100011220946_100000746330 [1,0,1,0,0,0|0,0,2]=4 2768 B10R0.1 C#CCC(=O)CCCCCO 1458a_100102619762_100000184674 [1,0,1,0,0,0|0,0,2]=4 2769 B10R0.1 C#CCC(=O)CCOCCC 1458a_100011220946_100011215938 [1,0,1,0,0,0|0,0,2]=4 2770 B10R0.1 C#CCCCCC(=O)CCC 1458a_100000211992_100010269958 [1,0,1,0,0,0|1,0,1]=4 2771 B10R0.1 C#CCCCCC(=O)CCC 1458a_100000696528_100000210303 [1,0,1,0,0,0|1,0,1]=4 2772 B10R0.1 C#CCOCCC(=O)CCC 1458a_100000211992_100010402529 [1,0,1,0,0,0|0,0,2]=4 2773 B10R0.1 C#CCOCCC(=O)CCC 1458a_100000693358_100000210303 [1,0,1,0,0,0|0,0,2]=4 2774 B10R0.1 C#CCOCOC(=O)CCC 34a_100000210247_100000034017 [1,0,1,0,0,0|0,0,2]=4 2775 B10R0.1 C=CCC(=O)CCCCCO 1458a_100000210193_100000746330 [1,0,1,0,0,0|0,0,2]=4 2776 B10R0.1 C=CCC(=O)CCCCCO 1458a_100102619762_100000210623 [1,0,1,0,0,0|0,0,2]=4 2777 B10R0.1 C=CCC(=O)CCOCCC 1458a_100000210193_100011215938 [1,0,1,0,0,0|0,0,2]=4 2778 B10R0.1 C=CCCCCC(=O)CCC 1458a_100000211992_100011215482 [1,0,1,0,0,0|1,0,1]=4 2779 B10R0.1 C=CCCCCC(=O)CCC 1458a_100011215552_100000210303 [1,0,1,0,0,0|1,0,1]=4 2780 B10R0.1 C=CCOCCC(=O)CCC 1458a_200011217002_100000210303 [1,0,1,0,0,0|0,0,2]=4 2781 B10R0.1 C=CCOCOC(=O)CCC 34a_200000210373_100000034017 [1,0,1,0,0,0|0,0,2]=4 2782 B10R0.1 CC#CC(=O)CCCCCO 1458a_100000763181_100000746330 [1,0,1,0,0,0|0,0,2]=4 2783 B10R0.1 CC#CC(=O)CCOCCC 1458a_100000763181_100011215938 [1,0,1,0,0,0|0,0,2]=4 2784 B10R0.1 CC/C=C\CCC(=O)CCC 1458a_100000211992_100015370543 [1,0,1,0,0,0|1,0,1]=4 2785 B10R0.1 CC=CC(=O)CCCCCO 1458a_100000210699_100000746330 [1,0,1,0,0,0|0,0,2]=4 2786 B10R0.1 CC=CC(=O)CCOCCC 1458a_100000210699_100011215938 [1,0,1,0,0,0|0,0,2]=4 2787 B10R0.1 CCC/C=C/CC(=O)CCC 1458a_200016266809_100000210303 [1,0,1,0,0,0|1,0,1]=4 2788 B10R0.1 CCCC(=O)CCCCC#N 1458a_100000211992_100000211819 [1,0,1,0,0,0|1,0,1]=4 2789 B10R0.1 CCCC(=O)CCCCCF 1458a_100000211992_100000729378 [1,0,1,0,0,0|1,0,0]=3 2790 B10R0.1 CCCC(=O)CCCCCO 1458a_100000211992_100000746330 [1,0,1,0,0,0|0,0,0]=2 2791 B10R0.1 CCCC(=O)CCCCCO 1458a_100102619762_100000210303 [1,0,1,0,0,0|0,0,0]=2 2792 B10R0.1 CCCC(=O)CCCCOC 1458a_100000211992_100000755781 [1,0,1,0,0,0|2,0,0]=4 2793 B10R0.1 CCCC(=O)CCCOCC 1458a_100000211992_100012232248 [1,0,1,0,0,0|1,0,0]=3 2794 B10R0.1 CCCC(=O)CCOCC#N 1458a_100000211992_200000047693 [1,0,1,0,0,0|1,0,1]=4 2795 B10R0.1 CCCC(=O)CCOCCO 1458a_100000211992_100011215305 [1,0,1,0,0,0|1,0,0]=3 2796 B10R0.1 CCCC(=O)CCOCCO 1458a_100011229844_100000210303 [1,0,1,0,0,0|1,0,0]=3 2797 B10R0.1 CCCC(=O)CNCCCF 2230a_100015189416_100000747444 [1,0,1,0,0,0|2,0,0]=4 2798 B10R0.1 CCCC(=O)CSCCCF 62a_100000747444_100011934791 [1,0,1,0,0,0|2,0,0]=4 2799 B10R0.1 CCCC(=O)CSCCCF 62a_100011934791_100000747444 [1,0,1,0,0,0|2,0,0]=4 2800 B10R0.1 CCCC(=O)CSCCCO 62a_100000747444_100011215043 [1,0,1,0,0,0|1,0,0]=3 2801 B10R0.1 CCCC(=O)CSCCCO 62a_100011215043_100000747444 [1,0,1,0,0,0|1,0,0]=3 2802 B10R0.1 CCCC(=O)CSCOCC 62a_100000739092_100000747444 [1,0,1,0,0,0|2,0,0]=4 2803 B10R0.1 CCCC(=O)CSCOCC 62a_100000747444_100000739092 [1,0,1,0,0,0|2,0,0]=4 2804 B10R0.1 CCCC(=O)NCCCCO 240690a_100000750430_100000211992 [1,0,1,0,0,0|1,0,0]=3 2805 B10R0.1 CCCC(=O)NCCCCO 527a_100000750430_100000211992 [1,0,1,0,0,0|1,0,0]=3 2806 B10R0.1 CCCC(=O)NCCCOC 1626a_100150723488_100000211992 [1,0,1,0,0,0|2,0,0]=4 2807 B10R0.1 CCCC(=O)NCCCOC 240690a_100150723488_100000211992 [1,0,1,0,0,0|2,0,0]=4 2808 B10R0.1 CCCC(=O)NCCCOC 527a_100150723488_100000211992 [1,0,1,0,0,0|2,0,0]=4 2809 B10R0.1 CCCC(=O)NCCCSC 11a_100000749238_100000211992 [1,0,1,0,0,0|2,0,0]=4 2810 B10R0.1 CCCC(=O)NCCCSC 1626a_100000749238_100000211992 [1,0,1,0,0,0|2,0,0]=4 2811 B10R0.1 CCCC(=O)NCCCSC 240690a_100000749238_100000211992 [1,0,1,0,0,0|2,0,0]=4 2812 B10R0.1 CCCC(=O)NCCCSC 527a_100000749238_100000211992 [1,0,1,0,0,0|2,0,0]=4 2813 B10R0.1 CCCC(=O)NCCOCC 11a_100011200944_100000211992 [1,0,1,0,0,0|1,0,0]=3 2814 B10R0.1 CCCC(=O)NCCOCC 1626a_102516460346_100000211992 [1,0,1,0,0,0|1,0,0]=3 2815 B10R0.1 CCCC(=O)NCCOCC 240690a_100011200944_100000211992 [1,0,1,0,0,0|1,0,0]=3 2816 B10R0.1 CCCC(=O)NCCOCC 527a_100011200944_100000211992 [1,0,1,0,0,0|1,0,0]=3 2817 B10R0.1 CCCC(=O)NCCSCC 11a_100000106463_100000211992 [1,0,1,0,0,0|1,1,0]=4 2818 B10R0.1 CCCC(=O)NCCSCC 1626a_100000106463_100000211992 [1,0,1,0,0,0|1,1,0]=4 2819 B10R0.1 CCCC(=O)NCCSCC 240690a_100000106463_100000211992 [1,0,1,0,0,0|1,1,0]=4 2820 B10R0.1 CCCC(=O)NCCSCC 527a_100000106463_100000211992 [1,0,1,0,0,0|1,1,0]=4 2821 B10R0.1 CCCC(=O)OCNCCF 34a_100000724931_100000034017 [1,0,1,0,0,0|2,0,0]=4 2822 B10R0.1 CCCC(=O)OCNCCO 2230a_100016997473_100000034017 [1,0,1,0,0,0|1,0,0]=3 2823 B10R0.1 CCCC(=O)OCNCCO 34a_100016990907_100000034017 [1,0,1,0,0,0|1,0,0]=3 2824 B10R0.1 CCCC(=O)OCOCCBr 34a_100000211926_100000034017 [1,0,1,0,0,0|1,0,0]=3 2825 B10R0.1 CCCC(=O)OCOCCN 34a_100000210304_100000034017 [1,0,1,0,0,0|1,0,0]=3 2826 B10R0.1 CCCC(=O)OCSCCF 62a_100011217306_100000034017 [1,0,1,0,0,0|1,1,0]=4 2827 B10R0.1 CCCC(=O)OCSCCO 62a_100000211926_100000034017 [1,0,1,0,0,0|1,0,0]=3 2828 B10R0.1 CCCC(=O)OCSCOC 62a_100000766300_100000034017 [1,0,1,0,0,0|1,1,0]=4 2829 B10R0.1 CCCC(=O)OCSCSC 62a_100011218213_100000034017 [1,0,1,0,0,0|1,1,0]=4 2830 B10R0.1 CCCC(C)OCCCCO 34a_100000764384_100011216708 [1,0,1,0,0,0|1,0,1]=4 2831 B10R0.1 CCCC(C)OCCCCO 7a_100000764384_100000210776 [1,0,1,0,0,0|1,0,1]=4 2832 B10R0.1 CCCC(C)OCCOCC 34a_100000210136_100000766640 [1,0,1,0,0,0|1,0,1]=4 2833 B10R0.1 CCCC(C)OCCOCC 34a_100000764384_100000210147 [1,0,1,0,0,0|1,0,1]=4 2834 B10R0.1 CCCC(C)OCCOCC 7a_100000210136_100000766640 [1,0,1,0,0,0|1,0,1]=4 2835 B10R0.1 CCCC(C)OCCOCC 7a_100000764384_100011215890 [1,0,1,0,0,0|1,0,1]=4 2836 B10R0.1 CCCCC=CC(=O)CCC 1458a_100016266645_100000210303 [1,0,1,0,0,0|1,0,1]=4 2837 B10R0.1 CCCCCCC(=O)CCC 1458a_100000211992_100000210757 [1,0,1,0,0,0|1,0,0]=3 2838 B10R0.1 CCCCCCC(=O)CCC 1458a_100102632555_100000210303 [1,0,1,0,0,0|1,0,0]=3 2839 B10R0.1 CCCCCCC(=O)CCF 1458a_100102632555_100011217306 [1,0,1,0,0,0|2,0,0]=4 2840 B10R0.1 CCCCCCC(=O)CCO 1458a_100011216618_100000210757 [1,0,1,0,0,0|2,0,0]=4 2841 B10R0.1 CCCCCCC(=O)CCO 1458a_100102632555_100000211926 [1,0,1,0,0,0|2,0,0]=4 2842 B10R0.1 CCCCCCC(=O)COC 1458a_100000210968_100000210757 [1,0,1,0,0,0|2,0,0]=4 2843 B10R0.1 CCCCCCC(=O)CSC 1458a_100000184570_100000210757 [1,0,1,0,0,0|2,0,0]=4 2844 B10R0.1 CCCCCCC(=O)NCC 11a_100015525214_100102632555 [1,0,1,0,0,0|2,0,0]=4 2845 B10R0.1 CCCCCCC(=O)NCC 240690a_100015525214_100102632555 [1,0,1,0,0,0|2,0,0]=4 2846 B10R0.1 CCCCCCC(=O)NCC 527a_100015525214_100102632555 [1,0,1,0,0,0|2,0,0]=4 2847 B10R0.1 CCCCCCC(C)OCC 34a_100000210265_100000210202 [1,0,1,0,0,0|1,0,1]=4 2848 B10R0.1 CCCCCCC(C)OCC 34a_100121572206_100011215978 [1,0,1,0,0,0|1,0,1]=4 2849 B10R0.1 CCCCCCC(C)OCC 7a_100000210265_100000210202 [1,0,1,0,0,0|1,0,1]=4 2850 B10R0.1 CCCCCNC(=O)CCC 11a_100000209983_100000211992 [1,0,1,0,0,0|1,0,0]=3 2851 B10R0.1 CCCCCNC(=O)CCC 1626a_100000209983_100000211992 [1,0,1,0,0,0|1,0,0]=3 2852 B10R0.1 CCCCCNC(=O)CCC 240690a_100000209983_100000211992 [1,0,1,0,0,0|1,0,0]=3 2853 B10R0.1 CCCCCNC(=O)CCC 527a_100000209983_100000211992 [1,0,1,0,0,0|1,0,0]=3 2854 B10R0.1 CCCCCNC(=O)CCO 240690a_100000209983_100011216618 [1,0,1,0,0,0|2,0,0]=4 2855 B10R0.1 CCCCCNC(=O)CNC 2230a_106832991635_100000230301 [1,0,1,0,0,0|2,0,0]=4 2856 B10R0.1 CCCCCNC(=O)CNC 34a_100102657272_100000230301 [1,0,1,0,0,0|2,0,0]=4 2857 B10R0.1 CCCCCNC(=O)CNC 7a_106832991635_100000230301 [1,0,1,0,0,0|2,0,0]=4 2858 B10R0.1 CCCCCNC(=O)COC 11a_100000209983_100000210968 [1,0,1,0,0,0|2,0,0]=4 2859 B10R0.1 CCCCCNC(=O)COC 1626a_100000209983_100000210968 [1,0,1,0,0,0|2,0,0]=4 2860 B10R0.1 CCCCCNC(=O)COC 240690a_100000209983_100000210968 [1,0,1,0,0,0|2,0,0]=4 2861 B10R0.1 CCCCCNC(=O)COC 34a_100138415774_100000230301 [1,0,1,0,0,0|2,0,0]=4 2862 B10R0.1 CCCCCNC(=O)COC 527a_100000209983_100000210968 [1,0,1,0,0,0|2,0,0]=4 2863 B10R0.1 CCCCCNC(=O)CSC 11a_100000209983_100000184570 [1,0,1,0,0,0|2,0,0]=4 2864 B10R0.1 CCCCCNC(=O)CSC 1626a_100000209983_100000184570 [1,0,1,0,0,0|2,0,0]=4 2865 B10R0.1 CCCCCNC(=O)CSC 240690a_100000209983_100000184570 [1,0,1,0,0,0|2,0,0]=4 2866 B10R0.1 CCCCCNC(=O)CSC 527a_100000209983_100000184570 [1,0,1,0,0,0|2,0,0]=4 2867 B10R0.1 CCCCCNC(=O)CSC 62a_100000230301_200000210301 [1,0,1,0,0,0|2,0,0]=4 2868 B10R0.1 CCCCCNC(=O)CSC 62a_200000210301_100000230301 [1,0,1,0,0,0|2,0,0]=4 2869 B10R0.1 CCCCCNC(=O)CS[13CH3] 62a_100000230301_200025704644 [1,0,1,0,0,0|2,0,0]=4 2870 B10R0.1 CCCCCNC(=O)CS[13CH3] 62a_200025704644_100000230301 [1,0,1,0,0,0|2,0,0]=4 2871 B10R0.1 CCCCCNC(=O)NCC 2708a_100000209983_100015525214 [1,0,1,0,0,0|2,0,0]=4 2872 B10R0.1 CCCCCNC(=O)NCC 2708a_100015525214_100000209983 [1,0,1,0,0,0|2,0,0]=4 2873 B10R0.1 CCCCCNC(=O)NCC 273464a_100000209983_100015525214 [1,0,1,0,0,0|2,0,0]=4 2874 B10R0.1 CCCCCNC(=O)NCC 273464a_100015525214_100000209983 [1,0,1,0,0,0|2,0,0]=4 2875 B10R0.1 CCCCCNC(=O)NCC 512a_100000209983_100015525214 [1,0,1,0,0,0|2,0,0]=4 2876 B10R0.1 CCCCCNC(=O)NCC 512a_100015525214_100000209983 [1,0,1,0,0,0|2,0,0]=4 2877 B10R0.1 CCCCCOC(C)CCC 34a_100000210253_100000766640 [1,0,1,0,0,0|1,0,1]=4 2878 B10R0.1 CCCCCOC(C)CCC 34a_100000764384_100000718602 [1,0,1,0,0,0|1,0,1]=4 2879 B10R0.1 CCCCCOC(C)CCC 7a_100000210253_100000766640 [1,0,1,0,0,0|1,0,1]=4 2880 B10R0.1 CCCCCOC(C)CCC 7a_100000764384_100000210326 [1,0,1,0,0,0|1,0,1]=4 2881 B10R0.1 CCCCNCC(=O)CCC 2230a_100000102301_100000747444 [1,0,1,0,0,0|2,0,0]=4 2882 B10R0.1 CCCCNCC(=O)CCC 7a_106832991798_100000747444 [1,0,1,0,0,0|2,0,0]=4 2883 B10R0.1 CCCCNNC(=O)CCC 22a_100025702795_100000211992 [1,0,1,0,0,0|2,0,0]=4 2884 B10R0.1 CCCCOCC(=O)CCC 1458a_100000211992_100011995733 [1,0,1,0,0,0|2,0,0]=4 2885 B10R0.1 CCCCOCC(=O)CCC 1458a_100000757543_100000210303 [1,0,1,0,0,0|2,0,0]=4 2886 B10R0.1 CCCCOCC(=O)CCC 7a_100000210227_100000747444 [1,0,1,0,0,0|2,0,0]=4 2887 B10R0.1 CCCCOCC(C)CCC 34a_100000210227_100011216630 [1,0,1,0,0,0|1,0,1]=4 2888 B10R0.1 CCCCOCC(C)CCC 34a_100000688023_100000210210 [1,0,1,0,0,0|1,0,1]=4 2889 B10R0.1 CCCCOCC(C)CCC 7a_100000210227_100011216630 [1,0,1,0,0,0|1,0,1]=4 2890 B10R0.1 CCCCOCC(C)CCC 7a_100000688023_100000210211 [1,0,1,0,0,0|1,0,1]=4 2891 B10R0.1 CCCCOCC(C)OCC 34a_100011217071_100000210202 [1,0,1,0,0,0|0,0,1]=3 2892 B10R0.1 CCCCOCC(C)OCC 7a_100011217071_100000210202 [1,0,1,0,0,0|0,0,1]=3 2893 B10R0.1 CCCCOCC(C)OCF 34a_100011217071_100015361967 [1,0,1,0,0,0|1,0,1]=4 2894 B10R0.1 CCCCOCC(C)OCF 7a_100011217071_100015361967 [1,0,1,0,0,0|1,0,1]=4 2895 B10R0.1 CCCCOCC(O)COC 34a_100000210227_100011215053 [1,0,1,0,0,0|1,0,1]=4 2896 B10R0.1 CCCCOCC(O)COC 7a_100000210227_100011215053 [1,0,1,0,0,0|1,0,1]=4 2897 B10R0.1 CCCCOC[C@@H](N)CCC 34a_100000732646_100000210210 [1,0,1,0,0,0|1,0,1]=4 2898 B10R0.1 CCCCSCC(=O)CCC 1458a_100000191162_100000210303 [1,0,1,0,0,0|2,0,0]=4 2899 B10R0.1 CCCCSCC(=O)CCC 62a_100000210211_100000747444 [1,0,1,0,0,0|2,0,0]=4 2900 B10R0.1 CCCCSCC(=O)CCC 62a_100000747444_100000210210 [1,0,1,0,0,0|2,0,0]=4 2901 B10R0.1 CCCN(C)CCCCCO 2230a_100000722520_100000210303 [1,0,1,0,0,0|2,0,0]=4 2902 B10R0.1 CCCN(C)CCCCCO 2230a_100000747261_100000746330 [1,0,1,0,0,0|2,0,0]=4 2903 B10R0.1 CCCN(C)CCCCCO 269982a_100000722520_100000210303 [1,0,1,0,0,0|2,0,0]=4 2904 B10R0.1 CCCN(C)CCCCCO 269982a_100000747261_100000746330 [1,0,1,0,0,0|2,0,0]=4 2905 B10R0.1 CCCNCCC(=O)NCC 34a_100025743525_100000210303 [1,0,1,0,0,0|2,0,0]=4 2906 B10R0.1 CCCOCCC(=O)CC#N 1458a_100051588842_100011215938 [1,0,1,0,0,0|1,0,1]=4 2907 B10R0.1 CCCOCCC(=O)CCC 1458a_100000211992_100011215938 [1,0,1,0,0,0|0,0,0]=2 2908 B10R0.1 CCCOCCC(=O)CCO 1458a_100011216618_100011215938 [1,0,1,0,0,0|1,0,0]=3 2909 B10R0.1 CCCOCCC(=O)COC 1458a_100000210968_100011215938 [1,0,1,0,0,0|1,0,0]=3 2910 B10R0.1 CCCOCCC(=O)CSC 1458a_100000184570_100011215938 [1,0,1,0,0,0|1,0,0]=3 2911 B10R0.1 CCCOCCC(=O)OCC 34a_100000210258_100000765890 [1,0,1,0,0,0|1,0,0]=3 2912 B10R0.1 CCCOCCC(C)CCC 34a_100011217855_100000210303 [1,0,1,0,0,0|1,0,1]=4 2913 B10R0.1 CCCOCCC(C)CCC 7a_100011217855_100000210303 [1,0,1,0,0,0|1,0,1]=4 2914 B10R0.1 CCCOCCN(C)CCC 2230a_100000747261_100011215938 [1,0,1,0,0,0|2,0,0]=4 2915 B10R0.1 CCCOCCN(C)CCC 269982a_100000747261_100011215938 [1,0,1,0,0,0|2,0,0]=4 2916 B10R0.1 CCCOCC[C@@H](N)CCC 34a_100015193777_100000210303 [1,0,1,0,0,0|1,0,1]=4 2917 B10R0.1 CCCOCOC(=O)CCC 34a_100000210258_100000034017 [1,0,1,0,0,0|0,0,0]=2 2918 B10R0.1 CCCSCCC(=O)NCC 62a_100000210303_100000737597 [1,0,1,0,0,0|1,1,0]=4 2919 B10R0.1 CCCSCCC(=O)NCC 62a_100000737597_100000210303 [1,0,1,0,0,0|1,1,0]=4 2920 B10R0.1 CCCSCCC(=O)OCC 62a_100000210303_100000765890 [1,0,1,0,0,0|1,1,0]=4 2921 B10R0.1 CCCSCCC(=O)OCC 62a_100000765890_100000210303 [1,0,1,0,0,0|1,1,0]=4 2922 B10R0.1 CCCSCOC(=O)CCC 62a_100000210303_100000034017 [1,0,1,0,0,0|0,1,0]=3 2923 B10R0.1 CCCSCOC(=O)OCC 62a_100000210303_100000075025 [1,0,1,0,0,0|1,1,0]=4 2924 B10R0.1 CCNC(=O)CCCCCO 240690a_100015525214_100102619762 [1,0,1,0,0,0|1,0,0]=3 2925 B10R0.1 CCNC(=O)CCNCCO 2230a_100016997473_100000737597 [1,0,1,0,0,0|2,0,0]=4 2926 B10R0.1 CCNC(=O)CCNCCO 34a_100025743525_100000211926 [1,0,1,0,0,0|2,0,0]=4 2927 B10R0.1 CCNC(=O)CCOCCO 240690a_100015525214_100011229844 [1,0,1,0,0,0|2,0,0]=4 2928 B10R0.1 CCNC(=O)CCSCCO 62a_100000211926_100000737597 [1,0,1,0,0,0|2,0,0]=4 2929 B10R0.1 CCNC(=O)CCSCCO 62a_100000737597_100000211926 [1,0,1,0,0,0|2,0,0]=4 2930 B10R0.1 CCNC(=O)CNCCCO 2230a_100016988866_100000230001 [1,0,1,0,0,0|2,0,0]=4 2931 B10R0.1 CCNC(=O)CSCCCO 62a_100000183381_100011215043 [1,0,1,0,0,0|2,0,0]=4 2932 B10R0.1 CCNC(=O)CSCCCO 62a_100011215043_100000183381 [1,0,1,0,0,0|2,0,0]=4 2933 B10R0.1 CCNC(=O)NCCCCO 2708a_100000750430_100015525214 [1,0,1,0,0,0|2,0,0]=4 2934 B10R0.1 CCNC(=O)NCCCCO 2708a_100015525214_100000750430 [1,0,1,0,0,0|2,0,0]=4 2935 B10R0.1 CCNC(=O)NCCCCO 273464a_100000750430_100015525214 [1,0,1,0,0,0|2,0,0]=4 2936 B10R0.1 CCNC(=O)NCCCCO 273464a_100015525214_100000750430 [1,0,1,0,0,0|2,0,0]=4 2937 B10R0.1 CCNC(=O)NCCCCO 512a_100000750430_100015525214 [1,0,1,0,0,0|2,0,0]=4 2938 B10R0.1 CCNC(=O)NCCCCO 512a_100015525214_100000750430 [1,0,1,0,0,0|2,0,0]=4 2939 B10R0.1 CCNC(=O)NCCOCC 2708a_100011200944_100015525214 [1,0,1,0,0,0|2,0,0]=4 2940 B10R0.1 CCNC(=O)NCCOCC 2708a_100015525214_100011200944 [1,0,1,0,0,0|2,0,0]=4 2941 B10R0.1 CCNC(=O)NCCOCC 273464a_100015525214_102516460346 [1,0,1,0,0,0|2,0,0]=4 2942 B10R0.1 CCNC(=O)NCCOCC 273464a_102516460346_100015525214 [1,0,1,0,0,0|2,0,0]=4 2943 B10R0.1 CCNC(=O)NCCOCC 512a_100011200944_100015525214 [1,0,1,0,0,0|2,0,0]=4 2944 B10R0.1 CCNC(=O)NCCOCC 512a_100015525214_100011200944 [1,0,1,0,0,0|2,0,0]=4 2945 B10R0.1 CCOC(=O)CCNCCO 2230a_100016997473_100011206558 [1,0,1,0,0,0|2,0,0]=4 2946 B10R0.1 CCOC(=O)CCNCCO 34a_100016990907_100000765890 [1,0,1,0,0,0|2,0,0]=4 2947 B10R0.1 CCOC(=O)CCOCCBr 34a_100000211926_100000765890 [1,0,1,0,0,0|2,0,0]=4 2948 B10R0.1 CCOC(=O)CCOCCN 34a_100000210304_100000765890 [1,0,1,0,0,0|2,0,0]=4 2949 B10R0.1 CCOC(=O)CCSCCO 62a_100000211926_100000765890 [1,0,1,0,0,0|2,0,0]=4 2950 B10R0.1 CCOC(=O)CCSCCO 62a_100000765890_100000211926 [1,0,1,0,0,0|2,0,0]=4 2951 B10R0.1 CCOC(=O)CSCCCO 62a_100000188475_100011215043 [1,0,1,0,0,0|2,0,0]=4 2952 B10R0.1 CCOC(=O)CSCCCO 62a_100011215043_100000188475 [1,0,1,0,0,0|2,0,0]=4 2953 B10R0.1 CCOC(=O)OCSCCO 62a_100000211926_100000075025 [1,0,1,0,0,0|2,0,0]=4 2954 B10R0.1 CCOCCCC(=O)CCO 1458a_100011216618_100012232248 [1,0,1,0,0,0|2,0,0]=4 2955 B10R0.1 CCOCCCC(=O)COC 1458a_100000210968_100012232248 [1,0,1,0,0,0|2,0,0]=4 2956 B10R0.1 CCOCCCC(=O)CSC 1458a_100000184570_100012232248 [1,0,1,0,0,0|2,0,0]=4 2957 B10R0.1 CCOCCCC(=O)OCC 34a_100121572206_100009991533 [1,0,1,0,0,0|2,0,0]=4 2958 B10R0.1 CCOCCCC(=O)OCC 7a_100012001163_100000210202 [1,0,1,0,0,0|2,0,0]=4 2959 B10R0.1 CCOCCNC(=O)CCO 240690a_100011200944_100011216618 [1,0,1,0,0,0|2,0,0]=4 2960 B10R0.1 CCOCCNC(=O)COC 11a_100011200944_100000210968 [1,0,1,0,0,0|2,0,0]=4 2961 B10R0.1 CCOCCNC(=O)COC 1626a_102516460346_100000210968 [1,0,1,0,0,0|2,0,0]=4 2962 B10R0.1 CCOCCNC(=O)COC 240690a_100011200944_100000210968 [1,0,1,0,0,0|2,0,0]=4 2963 B10R0.1 CCOCCNC(=O)COC 527a_100011200944_100000210968 [1,0,1,0,0,0|2,0,0]=4 2964 B10R0.1 CCOCCNC(=O)CSC 11a_100011200944_100000184570 [1,0,1,0,0,0|2,0,0]=4 2965 B10R0.1 CCOCCNC(=O)CSC 1626a_102516460346_100000184570 [1,0,1,0,0,0|2,0,0]=4 2966 B10R0.1 CCOCCNC(=O)CSC 240690a_100011200944_100000184570 [1,0,1,0,0,0|2,0,0]=4 2967 B10R0.1 CCOCCNC(=O)CSC 527a_100011200944_100000184570 [1,0,1,0,0,0|2,0,0]=4 2968 B10R0.1 CCOCCNC(=O)OCC 34a_100000158857_100000210202 [1,0,1,0,0,0|2,0,0]=4 2969 B10R0.1 CCOCCOC(=O)CNC 2230a_106832991635_200000101388 [1,0,1,0,0,0|1,0,0]=3 2970 B10R0.1 CCOCCOC(=O)CNC 34a_100102657272_200000101388 [1,0,1,0,0,0|1,0,0]=3 2971 B10R0.1 CCOCCOC(=O)CNC 7a_106832991635_200000101388 [1,0,1,0,0,0|1,0,0]=3 2972 B10R0.1 CCOCCOC(=O)COC 34a_100138415774_200000101388 [1,0,1,0,0,0|1,0,0]=3 2973 B10R0.1 CCOCCOC(=O)CSC 62a_200000101388_200000210301 [1,0,1,0,0,0|1,0,0]=3 2974 B10R0.1 CCOCCOC(=O)CSC 62a_200000210301_200000101388 [1,0,1,0,0,0|1,0,0]=3 2975 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200000101388_200025704644 [1,0,1,0,0,0|1,0,0]=3 2976 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200025704644_200000101388 [1,0,1,0,0,0|1,0,0]=3 2977 B10R0.1 CNNC(=O)CCCCCO 22a_100016993582_100102619762 [1,0,1,0,0,0|2,0,0]=4 2978 B10R0.1 COCC(=O)CCCCCF 1458a_100000210968_100000729378 [1,0,1,0,0,0|2,0,0]=4 2979 B10R0.1 COCC(=O)CCCCCO 1458a_100000210968_100000746330 [1,0,1,0,0,0|1,0,0]=3 2980 B10R0.1 COCC(=O)CCOCCO 1458a_100000210968_100011215305 [1,0,1,0,0,0|2,0,0]=4 2981 B10R0.1 COCC(=O)NCCCCO 240690a_100000750430_100000210968 [1,0,1,0,0,0|2,0,0]=4 2982 B10R0.1 COCC(=O)NCCCCO 527a_100000750430_100000210968 [1,0,1,0,0,0|2,0,0]=4 2983 B10R0.1 CSCC(=O)CCCCCF 1458a_100000184570_100000729378 [1,0,1,0,0,0|2,0,0]=4 2984 B10R0.1 CSCC(=O)CCCCCO 1458a_100000184570_100000746330 [1,0,1,0,0,0|1,0,0]=3 2985 B10R0.1 CSCC(=O)CCOCCO 1458a_100000184570_100011215305 [1,0,1,0,0,0|2,0,0]=4 2986 B10R0.1 CSCC(=O)NCCCCO 240690a_100000750430_100000184570 [1,0,1,0,0,0|2,0,0]=4 2987 B10R0.1 CSCC(=O)NCCCCO 527a_100000750430_100000184570 [1,0,1,0,0,0|2,0,0]=4 2988 B10R0.1 N#CCC(=O)CCCCCO 1458a_100051588842_100000746330 [1,0,1,0,0,0|1,0,1]=4 2989 B10R0.1 N#CCC(=O)CCCCCO 1458a_100102619762_100011214920 [1,0,1,0,0,0|1,0,1]=4 2990 B10R0.1 O=C(CCF)CCCCCO 1458a_100102619762_100011217306 [1,0,1,0,0,0|1,0,0]=3 2991 B10R0.1 O=C(CCF)CCOCCO 1458a_100011229844_100011217306 [1,0,1,0,0,0|2,0,0]=4 2992 B10R0.1 O=C(CCO)CCCCCF 1458a_100011216618_100000729378 [1,0,1,0,0,0|2,0,0]=4 2993 B10R0.1 O=C(CCO)CCCCCO 1458a_100011216618_100000746330 [1,0,1,0,0,0|1,0,0]=3 2994 B10R0.1 O=C(CCO)CCCCCO 1458a_100102619762_100000211926 [1,0,1,0,0,0|1,0,0]=3 2995 B10R0.1 O=C(CCO)CCOCCO 1458a_100011216618_100011215305 [1,0,1,0,0,0|2,0,0]=4 2996 B10R0.1 O=C(CCO)CCOCCO 1458a_100011229844_100000211926 [1,0,1,0,0,0|2,0,0]=4 2997 B10R0.1 O=C(CCO)NCCCCO 240690a_100000750430_100011216618 [1,0,1,0,0,0|2,0,0]=4 2998 B10R0.71 CC/C=C/CCCOCCC 34a_100016287902_100000210303 [1,0,1,0,0,0|1,0,1]=4 2999 B10R0.71 CC/C=C/CCCOCCC 7a_100016287902_100000210303 [1,0,1,0,0,0|1,0,1]=4 3000 B10R0.71 CCC/C=C/COCCCO 34a_100016278788_100000230001 [1,0,1,0,0,0|2,0,0]=4 3001 B10R0.71 CCC/C=C/COCCCO 7a_100016278788_100011215043 [1,0,1,0,0,0|2,0,0]=4 3002 B10R0.71 CCCC#CCCOCCC 34a_100000042726_100000210303 [1,0,1,0,0,0|1,0,1]=4 3003 B10R0.71 CCCC#CCCOCCC 7a_100000042726_100000210303 [1,0,1,0,0,0|1,0,1]=4 3004 B10R0.71 CCCCCCCOCCC 34a_100000210258_100000210614 [1,0,1,0,0,0|1,0,1]=4 3005 B10R0.71 CCCCCCCOCCC 34a_100000210272_100000210303 [1,0,1,0,0,0|1,0,1]=4 3006 B10R0.71 CCCCCCCOCCC 7a_100000210272_100000210303 [1,0,1,0,0,0|1,0,1]=4 3007 B10R0.71 CCCCCCOCCCC 34a_100000210227_100000210314 [1,0,1,0,0,0|1,0,1]=4 3008 B10R0.71 CCCCCCOCCCC 34a_100000210259_100000210210 [1,0,1,0,0,0|1,0,1]=4 3009 B10R0.71 CCCCCCOCCCC 7a_100000210227_100000210314 [1,0,1,0,0,0|1,0,1]=4 3010 B10R0.71 CCCCCCOCCCC 7a_100000210259_100000210211 [1,0,1,0,0,0|1,0,1]=4 3011 B10R0.71 CCCCNCCCCCO 2230a_100000102301_100000746330 [1,0,1,0,0,0|1,0,1]=4 3012 B10R0.71 CCCCNCCCCCO 2230a_100000762737_100000210211 [1,0,1,0,0,0|1,0,1]=4 3013 B10R0.71 CCCCNCCCCCO 34a_100000762737_100000210210 [1,0,1,0,0,0|1,0,1]=4 3014 B10R0.71 CCCCNCCCCCO 7a_106832991798_100000746330 [1,0,1,0,0,0|1,0,1]=4 3015 B10R0.71 CCCCNCCOCCC 2230a_100000102301_100011215938 [1,0,1,0,0,0|1,0,1]=4 3016 B10R0.71 CCCCNCCOCCC 2230a_100161115042_100000210211 [1,0,1,0,0,0|1,0,1]=4 3017 B10R0.71 CCCCNCCOCCC 34a_100161115042_100000210210 [1,0,1,0,0,0|1,0,1]=4 3018 B10R0.71 CCCCNCCOCCC 7a_106832991798_100011215938 [1,0,1,0,0,0|1,0,1]=4 3019 B10R0.71 CCCCOCCCCCBr 34a_100000746331_100000210210 [1,0,1,0,0,0|1,0,1]=4 3020 B10R0.71 CCCCOCCCCCBr 7a_100000746331_100000210211 [1,0,1,0,0,0|1,0,1]=4 3021 B10R0.71 CCCCOCCCCCCl 34a_100000746330_100000210210 [1,0,1,0,0,0|1,0,1]=4 3022 B10R0.71 CCCCOCCCCCCl 7a_100000746330_100000210211 [1,0,1,0,0,0|1,0,1]=4 3023 B10R0.71 CCCCOCCCCCF 34a_100000210227_100000729378 [1,0,1,0,0,0|1,0,1]=4 3024 B10R0.71 CCCCOCCCCCF 7a_100000210227_100000729378 [1,0,1,0,0,0|1,0,1]=4 3025 B10R0.71 CCCCOCCCCCI 34a_200012148887_100000210210 [1,0,1,0,0,0|1,0,1]=4 3026 B10R0.71 CCCCOCCCCCI 7a_200012148887_100000210211 [1,0,1,0,0,0|1,0,1]=4 3027 B10R0.71 CCCCOCCCCCN 34a_100000762737_100000210210 [1,0,1,0,0,0|1,0,1]=4 3028 B10R0.71 CCCCOCCCCCO 34a_100000210227_100000746330 [1,0,1,0,0,0|0,0,1]=3 3029 B10R0.71 CCCCOCCCCCO 7a_100000210227_100000746330 [1,0,1,0,0,0|0,0,1]=3 3030 B10R0.71 CCCCOCCNCCO 2230a_100016997473_100000743108 [1,0,1,0,0,0|1,0,1]=4 3031 B10R0.71 CCCCOCCNCCO 34a_100016990907_100000743108 [1,0,1,0,0,0|1,0,1]=4 3032 B10R0.71 CCCCOCCOCCBr 34a_100000211926_100000743108 [1,0,1,0,0,0|1,0,1]=4 3033 B10R0.71 CCCCOCCOCCBr 34a_100000692535_100000210210 [1,0,1,0,0,0|1,0,1]=4 3034 B10R0.71 CCCCOCCOCCBr 7a_100000692535_100000210211 [1,0,1,0,0,0|1,0,1]=4 3035 B10R0.71 CCCCOCCOCCC 34a_100000210227_100011215938 [1,0,1,0,0,0|0,0,1]=3 3036 B10R0.71 CCCCOCCOCCC 34a_100000210238_100000210303 [1,0,1,0,0,0|0,0,1]=3 3037 B10R0.71 CCCCOCCOCCC 34a_100000210258_100000743108 [1,0,1,0,0,0|0,0,1]=3 3038 B10R0.71 CCCCOCCOCCC 34a_100000752267_100000210210 [1,0,1,0,0,0|0,0,1]=3 3039 B10R0.71 CCCCOCCOCCC 7a_100000210227_100011215938 [1,0,1,0,0,0|0,0,1]=3 3040 B10R0.71 CCCCOCCOCCC 7a_100000210238_100000210303 [1,0,1,0,0,0|0,0,1]=3 3041 B10R0.71 CCCCOCCOCCC 7a_100000752267_100000210211 [1,0,1,0,0,0|0,0,1]=3 3042 B10R0.71 CCCCOCCOCCCl 34a_100011215305_100000210210 [1,0,1,0,0,0|1,0,1]=4 3043 B10R0.71 CCCCOCCOCCCl 7a_100011215305_100000210211 [1,0,1,0,0,0|1,0,1]=4 3044 B10R0.71 CCCCOCCOCCF 34a_100000210238_100011217306 [1,0,1,0,0,0|1,0,1]=4 3045 B10R0.71 CCCCOCCOCCF 34a_200015357709_100000210210 [1,0,1,0,0,0|1,0,1]=4 3046 B10R0.71 CCCCOCCOCCF 7a_100000210238_100011217306 [1,0,1,0,0,0|1,0,1]=4 3047 B10R0.71 CCCCOCCOCCF 7a_200015357709_100000210211 [1,0,1,0,0,0|1,0,1]=4 3048 B10R0.71 CCCCOCCOCCI 34a_100012149058_100000210210 [1,0,1,0,0,0|1,0,1]=4 3049 B10R0.71 CCCCOCCOCCI 7a_100012149058_100000210211 [1,0,1,0,0,0|1,0,1]=4 3050 B10R0.71 CCCCOCCOCCN 34a_100000210304_100000743108 [1,0,1,0,0,0|1,0,1]=4 3051 B10R0.71 CCCCOCCOCCN 34a_100000211614_100000210210 [1,0,1,0,0,0|1,0,1]=4 3052 B10R0.71 CCCCOCCOCCO 34a_100000210227_100000692535 [1,0,1,0,0,0|1,0,1]=4 3053 B10R0.71 CCCCOCCOCCO 34a_100000210238_100000211926 [1,0,1,0,0,0|1,0,1]=4 3054 B10R0.71 CCCCOCCOCCO 7a_100000210227_100011215305 [1,0,1,0,0,0|1,0,1]=4 3055 B10R0.71 CCCCOCCOCCO 7a_100000210238_100000211926 [1,0,1,0,0,0|1,0,1]=4 3056 B10R0.71 CCCCOCCOCSC 34a_100000210238_100011218213 [1,0,1,0,0,0|1,0,1]=4 3057 B10R0.71 CCCCOCCSCCC 34a_200000230433_100000210210 [1,0,1,0,0,0|0,1,1]=4 3058 B10R0.71 CCCCOCCSCCC 62a_100000210303_100000743108 [1,0,1,0,0,0|0,1,1]=4 3059 B10R0.71 CCCCOCCSCCC 62a_100000743108_100000210303 [1,0,1,0,0,0|0,1,1]=4 3060 B10R0.71 CCCCOCCSCCC 7a_200000230433_100000210211 [1,0,1,0,0,0|0,1,1]=4 3061 B10R0.71 CCCCOCCSCCO 62a_100000211926_100000743108 [1,0,1,0,0,0|1,0,1]=4 3062 B10R0.71 CCCCOCCSCCO 62a_100000743108_100000211926 [1,0,1,0,0,0|1,0,1]=4 3063 B10R0.71 CCCCOCSCCCO 62a_100011215043_100011995733 [1,0,1,0,0,0|1,0,1]=4 3064 B10R0.71 CCCCOCSCCCO 62a_100011995733_100011215043 [1,0,1,0,0,0|1,0,1]=4 3065 B10R0.71 CCCCSCCCCCO 62a_100000210211_100000746330 [1,0,1,0,0,0|0,1,1]=4 3066 B10R0.71 CCCCSCCCCCO 62a_100000746330_100000210210 [1,0,1,0,0,0|0,1,1]=4 3067 B10R0.71 CCCCSCCOCCC 34a_200000230436_100000210303 [1,0,1,0,0,0|0,1,1]=4 3068 B10R0.71 CCCCSCCOCCC 62a_100000210211_100011215938 [1,0,1,0,0,0|0,1,1]=4 3069 B10R0.71 CCCCSCCOCCC 62a_100011215938_100000210210 [1,0,1,0,0,0|0,1,1]=4 3070 B10R0.71 CCCCSCCOCCC 7a_200000230436_100000210303 [1,0,1,0,0,0|0,1,1]=4 3071 B10R0.71 CCCNCCCCCCO 2230a_100000686447_100000210303 [1,0,1,0,0,0|2,0,0]=4 3072 B10R0.71 CCCNCCCCCCO 34a_100000686447_100000210303 [1,0,1,0,0,0|2,0,0]=4 3073 B10R0.71 CCCNCCCOCCC 2230a_100011217757_100000210303 [1,0,1,0,0,0|2,0,0]=4 3074 B10R0.71 CCCNCCCOCCC 34a_100011217757_100000210303 [1,0,1,0,0,0|2,0,0]=4 3075 B10R0.71 CCCOCCCCCCO 34a_100000210258_100000766143 [1,0,1,0,0,0|2,0,0]=4 3076 B10R0.71 CCCOCCOCCCBr 34a_100011217188_100011215938 [1,0,1,0,0,0|1,0,1]=4 3077 B10R0.71 CCCOCCOCCCCl 34a_100000230001_100011215938 [1,0,1,0,0,0|1,0,1]=4 3078 B10R0.71 CCCOCCOCCCF 34a_100000752267_100011934791 [1,0,1,0,0,0|1,0,1]=4 3079 B10R0.71 CCCOCCOCCCF 34a_100000759539_100011215938 [1,0,1,0,0,0|1,0,1]=4 3080 B10R0.71 CCCOCCOCCCF 7a_100000752267_100011934791 [1,0,1,0,0,0|1,0,1]=4 3081 B10R0.71 CCCOCCOCCCN 34a_100000182051_100011215938 [1,0,1,0,0,0|1,0,1]=4 3082 B10R0.71 CCCOCCOCCCO 34a_100000752267_100000230001 [1,0,1,0,0,0|1,0,1]=4 3083 B10R0.71 CCCOCCOCCCO 7a_100000752267_100011215043 [1,0,1,0,0,0|1,0,1]=4 3084 B10R0.71 CCCOCCOCCNC 2230a_200011904461_200000210301 [1,0,1,0,0,0|1,0,1]=4 3085 B10R0.71 CCCOCCOCCNC 34a_100000228057_100000210303 [1,0,1,0,0,0|1,0,1]=4 3086 B10R0.71 CCCOCCOCCNC 34a_200011904461_200000210301 [1,0,1,0,0,0|1,0,1]=4 3087 B10R0.71 CCCOCCOCCN[13CH3] 2230a_200011904461_200025704644 [1,0,1,0,0,0|1,0,1]=4 3088 B10R0.71 CCCOCCOCCN[13CH3] 34a_200011904461_200025704644 [1,0,1,0,0,0|1,0,1]=4 3089 B10R0.71 CCCOCCOCCOC 34a_100000210237_100011215938 [1,0,1,0,0,0|1,0,1]=4 3090 B10R0.71 CCCOCCOCCOC 34a_100000210258_100000695917 [1,0,1,0,0,0|1,0,1]=4 3091 B10R0.71 CCCOCCOCCOC 34a_100000752267_100011201679 [1,0,1,0,0,0|1,0,1]=4 3092 B10R0.71 CCCOCCOCCOC 34a_100011215163_100000210303 [1,0,1,0,0,0|1,0,1]=4 3093 B10R0.71 CCCOCCOCCOC 7a_100000752267_100000233755 [1,0,1,0,0,0|1,0,1]=4 3094 B10R0.71 CCCOCCOCCOC 7a_100011215163_100000210303 [1,0,1,0,0,0|1,0,1]=4 3095 B10R0.71 CCCOCCOCCSC 34a_100000230434_100011215938 [1,0,1,0,0,0|1,0,1]=4 3096 B10R0.71 CCCOCCOCCSC 34a_100000752267_100000212216 [1,0,1,0,0,0|1,0,1]=4 3097 B10R0.71 CCCOCCOCCSC 7a_100000230434_100011215938 [1,0,1,0,0,0|1,0,1]=4 3098 B10R0.71 CCCOCCOCCSC 7a_100000752267_100000212216 [1,0,1,0,0,0|1,0,1]=4 3099 B10R0.71 CCCSCCCCCCO 62a_100000210303_100000766143 [1,0,1,0,0,0|2,0,0]=4 3100 B10R0.71 CCCSCCCCCCO 62a_100000766143_100000210303 [1,0,1,0,0,0|2,0,0]=4 3101 B10R0.71 COCCOCCCCCO 34a_100000210237_100000746330 [1,0,1,0,0,0|1,0,1]=4 3102 B10R0.71 CSCCOCCCCCO 34a_100000230434_100000746330 [1,0,1,0,0,0|1,0,1]=4 3103 B10R0.71 CSCCOCCCCCO 7a_100000230434_100000746330 [1,0,1,0,0,0|1,0,1]=4 3104 B10R0.71 NCCCOCCCCCO 34a_100000182051_100000746330 [1,0,1,0,0,0|1,0,1]=4 3105 B10R0.71 OCCCCCOCCCBr 34a_100011217188_100000746330 [1,0,1,0,0,0|1,0,1]=4 3106 B10R0.71 OCCCCCOCCCCl 34a_100000230001_100000746330 [1,0,1,0,0,0|1,0,1]=4 3107 B10R0.71 OCCCCCOCCCF 34a_100000759539_100000746330 [1,0,1,0,0,0|1,0,1]=4 3108 B10R0.74 C#CCOCCOC(=O)CC 7a_200000031056_100000038162 [1,0,1,0,0,0|0,0,2]=4 3109 B10R0.74 C=CC(=O)OCCOCCC 34a_100000210258_100009813456 [1,0,1,0,0,0|0,0,2]=4 3110 B10R0.74 C=CCOCCOC(=O)CC 7a_200000031056_100015514636 [1,0,1,0,0,0|0,0,2]=4 3111 B10R0.74 CCC(=O)CCCCCCF 1458a_100000210414_100015922095 [1,0,1,0,0,0|2,0,0]=4 3112 B10R0.74 CCC(=O)CCCCCCO 1458a_100000210414_100000766143 [1,0,1,0,0,0|1,0,0]=3 3113 B10R0.74 CCC(=O)CCCCCCO 1458a_100011996774_100000210202 [1,0,1,0,0,0|1,0,0]=3 3114 B10R0.74 CCC(=O)COCCCCO 34a_100000725409_100011216708 [1,0,1,0,0,0|2,0,0]=4 3115 B10R0.74 CCC(=O)CSCCCCO 62a_100000210776_100000747405 [1,0,1,0,0,0|2,0,0]=4 3116 B10R0.74 CCC(=O)CSCCCCO 62a_100000747405_100000210776 [1,0,1,0,0,0|2,0,0]=4 3117 B10R0.74 CCC(=O)NCCCCCO 240690a_100000762737_100000210414 [1,0,1,0,0,0|1,0,0]=3 3118 B10R0.74 CCC(=O)NCCNCCO 34a_100132302217_100000211926 [1,0,1,0,0,0|2,0,0]=4 3119 B10R0.74 CCC(=O)NCCOCCF 34a_200000158885_100011217306 [1,0,1,0,0,0|2,0,0]=4 3120 B10R0.74 CCC(=O)NCCOCCF 7a_200000158885_100011217306 [1,0,1,0,0,0|2,0,0]=4 3121 B10R0.74 CCC(=O)NCCOCCO 240690a_100000211614_100000210414 [1,0,1,0,0,0|2,0,0]=4 3122 B10R0.74 CCC(=O)NCCOCCO 34a_200000158885_100000211926 [1,0,1,0,0,0|2,0,0]=4 3123 B10R0.74 CCC(=O)NCCOCCO 7a_200000158885_100000211926 [1,0,1,0,0,0|2,0,0]=4 3124 B10R0.74 CCC(=O)NCCOCSC 34a_200000158885_100011218213 [1,0,1,0,0,0|2,0,0]=4 3125 B10R0.74 CCC(=O)NCCSCCO 240690a_100011219999_100000210414 [1,0,1,0,0,0|2,0,0]=4 3126 B10R0.74 CCC(=O)NCCSCCO 527a_100011219999_100000210414 [1,0,1,0,0,0|2,0,0]=4 3127 B10R0.74 CCC(=O)OCCOCC#N 7a_200000031056_100011215382 [1,0,1,0,0,0|1,0,1]=4 3128 B10R0.74 CCC(=O)OCCOCC=O 7a_200000031056_200015260668 [1,0,1,0,0,0|1,0,1]=4 3129 B10R0.74 CCC(=O)OCCOCCF 7a_200000031056_100011217306 [1,0,1,0,0,0|1,0,0]=3 3130 B10R0.74 CCC(=O)OCCOCCO 7a_200000031056_100000211926 [1,0,1,0,0,0|1,0,0]=3 3131 B10R0.74 CCC(C)OCCCCCO 7a_100000210228_100000746330 [1,0,1,0,0,0|1,0,1]=4 3132 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [1,0,1,0,0,0|2,0,0]=4 3133 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [1,0,1,0,0,0|2,0,0]=4 3134 B10R0.74 CCCCCCNC(=O)CC 11a_100000210581_100000210414 [1,0,1,0,0,0|2,0,0]=4 3135 B10R0.74 CCCCCCNC(=O)CC 1626a_100000210581_100000210414 [1,0,1,0,0,0|2,0,0]=4 3136 B10R0.74 CCCCCCNC(=O)CC 240690a_100000210581_100000210414 [1,0,1,0,0,0|2,0,0]=4 3137 B10R0.74 CCCCCCNC(=O)CC 527a_100000210581_100000210414 [1,0,1,0,0,0|2,0,0]=4 3138 B10R0.74 CCCNCCNC(=O)CC 34a_100132302217_100000210303 [1,0,1,0,0,0|2,0,0]=4 3139 B10R0.74 CCCOCCCC(=O)NC 34a_100000210258_100000741757 [1,0,1,0,0,0|2,0,0]=4 3140 B10R0.74 CCCOCCCC(=O)OC 34a_100000210258_100000742333 [1,0,1,0,0,0|2,0,0]=4 3141 B10R0.74 CCCOCCNC(=O)CC 1626a_100161115042_100000210414 [1,0,1,0,0,0|1,0,0]=3 3142 B10R0.74 CCCOCCNC(=O)CC 240690a_100161115042_100000210414 [1,0,1,0,0,0|1,0,0]=3 3143 B10R0.74 CCCOCCNC(=O)CC 34a_200000158885_100000210303 [1,0,1,0,0,0|1,0,0]=3 3144 B10R0.74 CCCOCCNC(=O)CC 527a_100161115042_100000210414 [1,0,1,0,0,0|1,0,0]=3 3145 B10R0.74 CCCOCCNC(=O)CC 7a_200000158885_100000210303 [1,0,1,0,0,0|1,0,0]=3 3146 B10R0.74 CCCOCCNC(=O)CO 240690a_100161115042_100000210174 [1,0,1,0,0,0|2,0,0]=4 3147 B10R0.74 CCCOCCNC(=O)CO 527a_100161115042_100000210174 [1,0,1,0,0,0|2,0,0]=4 3148 B10R0.74 CCCOCCNC(=O)NC 2708a_100102657272_100161115042 [1,0,1,0,0,0|2,0,0]=4 3149 B10R0.74 CCCOCCNC(=O)NC 2708a_100161115042_106832991635 [1,0,1,0,0,0|2,0,0]=4 3150 B10R0.74 CCCOCCNC(=O)NC 273464a_100102657272_100161115042 [1,0,1,0,0,0|2,0,0]=4 3151 B10R0.74 CCCOCCNC(=O)NC 273464a_100161115042_100102657272 [1,0,1,0,0,0|2,0,0]=4 3152 B10R0.74 CCCOCCNC(=O)NC 512a_100161115042_100102657272 [1,0,1,0,0,0|2,0,0]=4 3153 B10R0.74 CCCOCCNC(=O)NC 512a_106832991638_100161115042 [1,0,1,0,0,0|2,0,0]=4 3154 B10R0.74 CCCOCCNC(=O)OC 34a_100000757965_100000210303 [1,0,1,0,0,0|2,0,0]=4 3155 B10R0.74 CCCOCCOC(=O)CC 7a_200000031056_100000210303 [1,0,1,0,0,0|0,0,0]=2 3156 B10R0.74 CCCOCCOC(=O)NC 34a_100000210258_200011997002 [1,0,1,0,0,0|1,0,0]=3 3157 B10R0.74 CCCOCCOC(=O)OC 34a_100010262106_100000210303 [1,0,1,0,0,0|1,0,0]=3 3158 B10R0.74 CCCOCCOC(C)CC 34a_100000752267_100011215416 [1,0,1,0,0,0|1,0,1]=4 3159 B10R0.74 CCCOCCOC(C)CC 7a_100000210228_100011215938 [1,0,1,0,0,0|1,0,1]=4 3160 B10R0.74 CCCOCCOC(C)CC 7a_100000752267_100000758301 [1,0,1,0,0,0|1,0,1]=4 3161 B10R0.74 CCCSCCNC(=O)CC 11a_100020603323_100000210414 [1,0,1,0,0,0|1,1,0]=4 3162 B10R0.74 CCCSCCNC(=O)CC 240690a_100020603323_100000210414 [1,0,1,0,0,0|1,1,0]=4 3163 B10R0.74 CCCSCCNC(=O)CC 527a_100020603323_100000210414 [1,0,1,0,0,0|1,1,0]=4 3164 B10R0.74 CCCSCCOC(=O)NC 62a_100000210303_200011997002 [1,0,1,0,0,0|1,1,0]=4 3165 B10R0.74 CCCSCCOC(=O)NC 62a_200011997002_100000210303 [1,0,1,0,0,0|1,1,0]=4 3166 B10R0.74 CNC(=O)CCCCCCO 240690a_100102657272_100011996774 [1,0,1,0,0,0|2,0,0]=4 3167 B10R0.74 CNC(=O)NCCCCCO 2708a_100102657272_100000762737 [1,0,1,0,0,0|2,0,0]=4 3168 B10R0.74 CNC(=O)NCCCCCO 273464a_100000762737_100102657272 [1,0,1,0,0,0|2,0,0]=4 3169 B10R0.74 CNC(=O)NCCCCCO 273464a_100102657272_100000762737 [1,0,1,0,0,0|2,0,0]=4 3170 B10R0.74 CNC(=O)NCCCCCO 512a_100000762737_100102657272 [1,0,1,0,0,0|2,0,0]=4 3171 B10R0.74 CNC(=O)NCCCCCO 512a_106832991638_100000762737 [1,0,1,0,0,0|2,0,0]=4 3172 B10R0.74 CNC(=O)OCCNCCO 34a_100016990907_200011997002 [1,0,1,0,0,0|2,0,0]=4 3173 B10R0.74 CNC(=O)OCCOCCBr 34a_100000211926_200011997002 [1,0,1,0,0,0|2,0,0]=4 3174 B10R0.74 CNC(=O)OCCOCCN 34a_100000210304_200011997002 [1,0,1,0,0,0|2,0,0]=4 3175 B10R0.74 CNC(=O)OCCSCCO 62a_100000211926_200011997002 [1,0,1,0,0,0|2,0,0]=4 3176 B10R0.74 CNC(=O)OCCSCCO 62a_200011997002_100000211926 [1,0,1,0,0,0|2,0,0]=4 3177 B10R0.74 COC(=O)OCCOCCF 34a_100010262106_100011217306 [1,0,1,0,0,0|2,0,0]=4 3178 B10R0.74 COC(=O)OCCOCCO 34a_100010262106_100000211926 [1,0,1,0,0,0|2,0,0]=4 3179 B10R0.74 COC(=O)OCCOCSC 34a_100010262106_100011218213 [1,0,1,0,0,0|2,0,0]=4 3180 B10R0.74 COC(=O)OCSCCCO 62a_100011215043_100000139417 [1,0,1,0,0,0|2,0,0]=4 3181 B10R0.74 O=C(CF)CCCCCCO 1458a_100011996774_100015361967 [1,0,1,0,0,0|2,0,0]=4 3182 B10R0.74 O=C(CO)CCCCCCO 1458a_100000210174_100000766143 [1,0,1,0,0,0|2,0,0]=4 3183 B10R0.74 O=C(CO)NCCCCCO 240690a_100000762737_100000210174 [1,0,1,0,0,0|2,0,0]=4 3184 B10R0.41 CCC(COCCCF)OC 34a_100011934954_100011934791 [1,0,1,0,0,0|1,0,1]=4 3185 B10R0.41 CCC(COCCCF)OC 7a_100011934954_100011934791 [1,0,1,0,0,0|1,0,1]=4 3186 B10R0.41 CCC(COCCCO)OC 34a_100011934954_100000230001 [1,0,1,0,0,0|1,0,1]=4 3187 B10R0.41 CCC(COCCCO)OC 7a_100011934954_100011215043 [1,0,1,0,0,0|1,0,1]=4 3188 B10R0.41 CCC(COCCOC)OC 34a_100011934954_100011201679 [1,0,1,0,0,0|1,0,1]=4 3189 B10R0.41 CCC(COCCOC)OC 7a_100011934954_100000233755 [1,0,1,0,0,0|1,0,1]=4 3190 B10R0.41 CCC(COCCSC)OC 34a_100011934954_100000212216 [1,0,1,0,0,0|1,0,1]=4 3191 B10R0.41 CCC(COCCSC)OC 7a_100011934954_100000212216 [1,0,1,0,0,0|1,0,1]=4 3192 B10R0.41 CCCCCCC(CC)OC 34a_100011215785_200000210301 [1,0,1,0,0,0|1,0,1]=4 3193 B10R0.41 CCCCCCC(CC)OC 7a_100011215785_200000210301 [1,0,1,0,0,0|1,0,1]=4 3194 B10R0.41 CCCCCCC(CC)O[13CH3] 34a_100011215785_200025704644 [1,0,1,0,0,0|1,0,1]=4 3195 B10R0.41 CCCCCCC(CC)O[13CH3] 7a_100011215785_200025704644 [1,0,1,0,0,0|1,0,1]=4 3196 B10R0.41 CCCCOCC(CC)CC 34a_100000210227_100011215472 [1,0,1,0,0,0|1,0,1]=4 3197 B10R0.41 CCCCOCC(CC)CC 7a_100000210227_100011215472 [1,0,1,0,0,0|1,0,1]=4 3198 B10R0.41 CCCCOCC(CC)CC 7a_100000703878_100000210211 [1,0,1,0,0,0|1,0,1]=4 3199 B10R0.41 CCCCOCC(CC)OC 34a_100011934954_100000210210 [1,0,1,0,0,0|0,0,1]=3 3200 B10R0.41 CCCCOCC(CC)OC 7a_100011934954_100000210211 [1,0,1,0,0,0|0,0,1]=3 3201 B10R0.41 CCCCOCC(OC)OC 34a_100000210227_100000211822 [1,0,1,0,0,0|1,0,1]=4 3202 B10R0.41 CCCCOCC(OC)OC 34a_100011216393_100000210210 [1,0,1,0,0,0|1,0,1]=4 3203 B10R0.41 CCCCOCC(OC)OC 7a_100000210227_100000751394 [1,0,1,0,0,0|1,0,1]=4 3204 B10R0.45 CCC(=O)CCC(OC)OC 1458a_100000210414_100000139399 [1,0,1,0,0,0|2,0,0]=4 3205 B10R0.45 CCC(=O)CCC(OC)OC 1458a_200000082759_100000210202 [1,0,1,0,0,0|2,0,0]=4 3206 B10R0.45 CCC(=O)NCC(CC)CC 11a_100102946423_100000210414 [1,0,1,0,0,0|2,0,0]=4 3207 B10R0.45 CCC(=O)NCC(CC)CC 1626a_100102946423_100000210414 [1,0,1,0,0,0|2,0,0]=4 3208 B10R0.45 CCC(=O)NCC(CC)CC 240690a_100102946423_100000210414 [1,0,1,0,0,0|2,0,0]=4 3209 B10R0.45 CCC(=O)NCC(CC)CC 527a_100102946423_100000210414 [1,0,1,0,0,0|2,0,0]=4 3210 B10R0.45 CCC(=O)NCC(CC)OC 11a_100000731041_100000210414 [1,0,1,0,0,0|1,0,0]=3 3211 B10R0.45 CCC(=O)NCC(CC)OC 1626a_100000731041_100000210414 [1,0,1,0,0,0|1,0,0]=3 3212 B10R0.45 CCC(=O)NCC(CC)OC 240690a_100000731041_100000210414 [1,0,1,0,0,0|1,0,0]=3 3213 B10R0.45 CCC(=O)NCC(CC)OC 527a_100000731041_100000210414 [1,0,1,0,0,0|1,0,0]=3 3214 B10R0.45 CCC(=O)NCC(OC)OC 11a_100000210479_100000210414 [1,0,1,0,0,0|2,0,0]=4 3215 B10R0.45 CCC(=O)NCC(OC)OC 1626a_100000210479_100000210414 [1,0,1,0,0,0|2,0,0]=4 3216 B10R0.45 CCC(=O)NCC(OC)OC 240690a_100000210479_100000210414 [1,0,1,0,0,0|2,0,0]=4 3217 B10R0.45 CCC(=O)NCC(OC)OC 527a_100000210479_100000210414 [1,0,1,0,0,0|2,0,0]=4 3218 B10R0.45 CCC(C)OCC(CC)OC 34a_100011934954_100011215416 [1,0,1,0,0,0|1,0,1]=4 3219 B10R0.45 CCC(C)OCC(CC)OC 7a_100011934954_100000758301 [1,0,1,0,0,0|1,0,1]=4 3220 B10R0.45 CCC(CNC(=O)CO)OC 240690a_100000731041_100000210174 [1,0,1,0,0,0|2,0,0]=4 3221 B10R0.45 CCC(CNC(=O)CO)OC 527a_100000731041_100000210174 [1,0,1,0,0,0|2,0,0]=4 3222 B10R0.45 CCC(CNC(=O)NC)OC 2708a_100000731041_106832991635 [1,0,1,0,0,0|2,0,0]=4 3223 B10R0.45 CCC(CNC(=O)NC)OC 2708a_100102657272_100000731041 [1,0,1,0,0,0|2,0,0]=4 3224 B10R0.45 CCC(CNC(=O)NC)OC 273464a_100000731041_100102657272 [1,0,1,0,0,0|2,0,0]=4 3225 B10R0.45 CCC(CNC(=O)NC)OC 273464a_100102657272_100000731041 [1,0,1,0,0,0|2,0,0]=4 3226 B10R0.45 CCC(CNC(=O)NC)OC 512a_100000731041_100102657272 [1,0,1,0,0,0|2,0,0]=4 3227 B10R0.45 CCC(CNC(=O)NC)OC 512a_106832991638_100000731041 [1,0,1,0,0,0|2,0,0]=4 3228 B10R0.108 CCC(=O)NCC(O)COC 240690a_100000756049_100000210414 [1,0,1,0,0,0|2,0,0]=4 3229 B10R0.108 CCC(=O)NCC(O)COC 527a_100000756049_100000210414 [1,0,1,0,0,0|2,0,0]=4 3230 B10R0.108 CCC(C)CCC(=O)CCF 1458a_100000701222_100011217306 [1,0,1,0,0,0|2,0,0]=4 3231 B10R0.108 CCC(C)CCC(=O)CCO 1458a_100000701222_100000211926 [1,0,1,0,0,0|2,0,0]=4 3232 B10R0.108 CCC(C)CNC(=O)CCO 240690a_100020588543_100011216618 [1,0,1,0,0,0|2,0,0]=4 3233 B10R0.108 CCC(C)CNC(=O)COC 11a_100020588543_100000210968 [1,0,1,0,0,0|2,0,0]=4 3234 B10R0.108 CCC(C)CNC(=O)COC 1626a_100020588543_100000210968 [1,0,1,0,0,0|2,0,0]=4 3235 B10R0.108 CCC(C)CNC(=O)COC 240690a_100020588543_100000210968 [1,0,1,0,0,0|2,0,0]=4 3236 B10R0.108 CCC(C)CNC(=O)COC 527a_100020588543_100000210968 [1,0,1,0,0,0|2,0,0]=4 3237 B10R0.108 CCC(C)CNC(=O)CSC 11a_100020588543_100000184570 [1,0,1,0,0,0|2,0,0]=4 3238 B10R0.108 CCC(C)CNC(=O)CSC 1626a_100020588543_100000184570 [1,0,1,0,0,0|2,0,0]=4 3239 B10R0.108 CCC(C)CNC(=O)CSC 240690a_100020588543_100000184570 [1,0,1,0,0,0|2,0,0]=4 3240 B10R0.108 CCC(C)CNC(=O)CSC 527a_100020588543_100000184570 [1,0,1,0,0,0|2,0,0]=4 3241 B10R0.108 CCC(O)CNC(=O)CCO 240690a_100011218483_100011216618 [1,0,1,0,0,0|2,0,0]=4 3242 B10R0.108 CCC(O)CNC(=O)COC 11a_100011218483_100000210968 [1,0,1,0,0,0|2,0,0]=4 3243 B10R0.108 CCC(O)CNC(=O)COC 240690a_100011218483_100000210968 [1,0,1,0,0,0|2,0,0]=4 3244 B10R0.108 CCC(O)CNC(=O)COC 527a_100011218483_100000210968 [1,0,1,0,0,0|2,0,0]=4 3245 B10R0.108 CCC(O)CNC(=O)CSC 11a_100011218483_100000184570 [1,0,1,0,0,0|2,0,0]=4 3246 B10R0.108 CCC(O)CNC(=O)CSC 240690a_100011218483_100000184570 [1,0,1,0,0,0|2,0,0]=4 3247 B10R0.108 CCC(O)CNC(=O)CSC 527a_100011218483_100000184570 [1,0,1,0,0,0|2,0,0]=4 3248 B10R0.108 CCCC(=O)CCC(C)CC 1458a_100000701222_100000210303 [1,0,1,0,0,0|1,0,0]=3 3249 B10R0.108 CCCC(=O)CCN(C)CC 1458a_100000755305_100000210303 [1,0,1,0,0,0|2,0,0]=4 3250 B10R0.108 CCCC(=O)CNC(C)CC 2230a_100000209981_100000747444 [1,0,1,0,0,0|2,0,0]=4 3251 B10R0.108 CCCC(=O)COC(C)CC 7a_100000210228_100000747444 [1,0,1,0,0,0|2,0,0]=4 3252 B10R0.108 CCCC(=O)CSC(C)CC 62a_100000747444_100000758301 [1,0,1,0,0,0|2,0,0]=4 3253 B10R0.108 CCCC(=O)CSC(C)CC 62a_100000758301_100000747444 [1,0,1,0,0,0|2,0,0]=4 3254 B10R0.108 CCCC(=O)CSC(C)OC 62a_100000747444_100009879195 [1,0,1,0,0,0|2,0,0]=4 3255 B10R0.108 CCCC(=O)CSC(C)OC 62a_100009879195_100000747444 [1,0,1,0,0,0|2,0,0]=4 3256 B10R0.108 CCCC(=O)NCC(C)CC 11a_100020588543_100000211992 [1,0,1,0,0,0|1,0,0]=3 3257 B10R0.108 CCCC(=O)NCC(C)CC 1626a_100020588543_100000211992 [1,0,1,0,0,0|1,0,0]=3 3258 B10R0.108 CCCC(=O)NCC(C)CC 240690a_100020588543_100000211992 [1,0,1,0,0,0|1,0,0]=3 3259 B10R0.108 CCCC(=O)NCC(C)CC 527a_100020588543_100000211992 [1,0,1,0,0,0|1,0,0]=3 3260 B10R0.108 CCCC(=O)NCC(C)CO 240690a_100000744482_100000211992 [1,0,1,0,0,0|2,0,0]=4 3261 B10R0.108 CCCC(=O)NCC(C)CO 527a_100000744482_100000211992 [1,0,1,0,0,0|2,0,0]=4 3262 B10R0.108 CCCC(=O)NCC(O)CC 11a_100011218483_100000211992 [1,0,1,0,0,0|1,0,0]=3 3263 B10R0.108 CCCC(=O)NCC(O)CC 240690a_100011218483_100000211992 [1,0,1,0,0,0|1,0,0]=3 3264 B10R0.108 CCCC(=O)NCC(O)CC 527a_100011218483_100000211992 [1,0,1,0,0,0|1,0,0]=3 3265 B10R0.108 CCCC(=O)NC[C@@H](C)OC 11a_100020591295_100000211992 [1,0,1,0,0,0|1,0,0]=3 3266 B10R0.108 CCCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000211992 [1,0,1,0,0,0|1,0,0]=3 3267 B10R0.108 CCCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000211992 [1,0,1,0,0,0|1,0,0]=3 3268 B10R0.108 CCCC(=O)NC[C@@H](C)OC 527a_100020591295_100000211992 [1,0,1,0,0,0|1,0,0]=3 3269 B10R0.108 CCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000211992 [1,0,1,0,0,0|2,0,0]=4 3270 B10R0.108 CCCC(=O)NC[C@H](O)CO 527a_100020644852_100000211992 [1,0,1,0,0,0|2,0,0]=4 3271 B10R0.108 CCCC(=O)NNC(C)CC 22a_100000718999_100000211992 [1,0,1,0,0,0|2,0,0]=4 3272 B10R0.108 CCCC(=O)OCC(=O)CC 1458a_100000210414_100000034017 [1,0,1,0,0,0|0,0,2]=4 3273 B10R0.108 CCCC(=O)OCN(C)CC 2230a_100000225621_100000034017 [1,0,1,0,0,0|1,0,0]=3 3274 B10R0.108 CCCC(=O)OCN(C)CC 269982a_100000225621_100000034017 [1,0,1,0,0,0|1,0,0]=3 3275 B10R0.108 CCCC(C)OCC(C)CC 34a_100000764384_100000748023 [1,0,1,0,0,0|1,0,1]=4 3276 B10R0.108 CCCC(C)OCC(C)CC 7a_100000764384_100000748023 [1,0,1,0,0,0|1,0,1]=4 3277 B10R0.108 CCCC(C)OCC(C)OC 34a_100000690652_100000766640 [1,0,1,0,0,0|1,0,1]=4 3278 B10R0.108 CCCC(C)OCC(O)CC 34a_100000764384_100011218378 [1,0,1,0,0,0|1,0,1]=4 3279 B10R0.108 CCCC(C)OCC(O)CC 7a_100000764384_100011218378 [1,0,1,0,0,0|1,0,1]=4 3280 B10R0.108 CCCC(C)OC[C@@H](C)CC 34a_100000764384_100009816398 [1,0,1,0,0,0|1,0,1]=4 3281 B10R0.108 CCCC(C)OC[C@@H](C)CC 7a_100000764384_100009816398 [1,0,1,0,0,0|1,0,1]=4 3282 B10R0.108 CCCC(C)OC[C@@H](C)CC 7a_100009816381_100000766640 [1,0,1,0,0,0|1,0,1]=4 3283 B10R0.108 CCNC(=O)CCC(C)CC 11a_100015525214_100000701222 [1,0,1,0,0,0|2,0,0]=4 3284 B10R0.108 CCNC(=O)CCC(C)CC 240690a_100015525214_100000701222 [1,0,1,0,0,0|2,0,0]=4 3285 B10R0.108 CCNC(=O)CCC(C)CC 527a_100015525214_100000701222 [1,0,1,0,0,0|2,0,0]=4 3286 B10R0.108 CCNC(=O)CCC(O)CC 240690a_100015525214_203496584001 [1,0,1,0,0,0|2,0,0]=4 3287 B10R0.108 CCNC(=O)NCC(C)CC 2708a_100015525214_100020588543 [1,0,1,0,0,0|2,0,0]=4 3288 B10R0.108 CCNC(=O)NCC(C)CC 2708a_100020588543_100015525214 [1,0,1,0,0,0|2,0,0]=4 3289 B10R0.108 CCNC(=O)NCC(C)CC 273464a_100015525214_100020588543 [1,0,1,0,0,0|2,0,0]=4 3290 B10R0.108 CCNC(=O)NCC(C)CC 273464a_100020588543_100015525214 [1,0,1,0,0,0|2,0,0]=4 3291 B10R0.108 CCNC(=O)NCC(C)CC 512a_100015525214_100020588543 [1,0,1,0,0,0|2,0,0]=4 3292 B10R0.108 CCNC(=O)NCC(C)CC 512a_100020588543_100015525214 [1,0,1,0,0,0|2,0,0]=4 3293 B10R0.108 CCNC(=O)NCC(O)CC 2708a_100015525214_100011218483 [1,0,1,0,0,0|2,0,0]=4 3294 B10R0.108 CCNC(=O)NCC(O)CC 273464a_100011218483_100015525214 [1,0,1,0,0,0|2,0,0]=4 3295 B10R0.108 CCNC(=O)NCC(O)CC 273464a_100015525214_100011218483 [1,0,1,0,0,0|2,0,0]=4 3296 B10R0.108 CCNC(=O)NCC(O)CC 512a_100011218483_100015525214 [1,0,1,0,0,0|2,0,0]=4 3297 B10R0.108 CCNC(=O)NC[C@@H](C)OC 2708a_100015525214_100020591295 [1,0,1,0,0,0|2,0,0]=4 3298 B10R0.108 CCNC(=O)NC[C@@H](C)OC 2708a_100020591295_100015525214 [1,0,1,0,0,0|2,0,0]=4 3299 B10R0.108 CCNC(=O)NC[C@@H](C)OC 273464a_100015525214_100020591295 [1,0,1,0,0,0|2,0,0]=4 3300 B10R0.108 CCNC(=O)NC[C@@H](C)OC 273464a_100020591295_100015525214 [1,0,1,0,0,0|2,0,0]=4 3301 B10R0.108 CCNC(=O)NC[C@@H](C)OC 512a_100015525214_100020591295 [1,0,1,0,0,0|2,0,0]=4 3302 B10R0.108 CCNC(=O)NC[C@@H](C)OC 512a_100020591295_100015525214 [1,0,1,0,0,0|2,0,0]=4 3303 B10R0.108 CCOC(=O)CCC(C)OC 34a_100138415774_100000748298 [1,0,1,0,0,0|2,0,0]=4 3304 B10R0.108 COCC(=O)NC[C@@H](C)OC 11a_100020591295_100000210968 [1,0,1,0,0,0|2,0,0]=4 3305 B10R0.108 COCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000210968 [1,0,1,0,0,0|2,0,0]=4 3306 B10R0.108 COCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000210968 [1,0,1,0,0,0|2,0,0]=4 3307 B10R0.108 COCC(=O)NC[C@@H](C)OC 527a_100020591295_100000210968 [1,0,1,0,0,0|2,0,0]=4 3308 B10R0.108 CO[C@H](C)CNC(=O)CCO 240690a_100020591295_100011216618 [1,0,1,0,0,0|2,0,0]=4 3309 B10R0.108 CO[C@H](C)CNC(=O)CSC 11a_100020591295_100000184570 [1,0,1,0,0,0|2,0,0]=4 3310 B10R0.108 CO[C@H](C)CNC(=O)CSC 1626a_100020591295_100000184570 [1,0,1,0,0,0|2,0,0]=4 3311 B10R0.108 CO[C@H](C)CNC(=O)CSC 240690a_100020591295_100000184570 [1,0,1,0,0,0|2,0,0]=4 3312 B10R0.108 CO[C@H](C)CNC(=O)CSC 527a_100020591295_100000184570 [1,0,1,0,0,0|2,0,0]=4 3313 B10R1.21 BrCCOCC1CCCC1 34a_100000211926_100000740388 [2,0,0,0,0,0|2,0,0]=4 3314 B10R1.21 BrCCOCC1OCCO1 34a_100000211926_100000755774 [2,0,0,0,0,0|2,0,0]=4 3315 B10R1.21 C#CCOCC1CCCO1 34a_100000210270_100000184674 [2,0,0,0,0,0|0,0,2]=4 3316 B10R1.21 C#CCOCC1CCCO1 7a_100000210270_100000038162 [2,0,0,0,0,0|0,0,2]=4 3317 B10R1.21 C=CCOCC1CCCO1 34a_100000210270_100015514636 [2,0,0,0,0,0|0,0,2]=4 3318 B10R1.21 C=CCOCC1CCCO1 7a_100000210270_100015514636 [2,0,0,0,0,0|0,0,2]=4 3319 B10R1.21 CCCCOC1CCCC1 34a_100000210227_100000179811 [2,0,0,0,0,0|1,0,1]=4 3320 B10R1.21 CCCCOC1CCCC1 34a_100000210269_100000210210 [2,0,0,0,0,0|1,0,1]=4 3321 B10R1.21 CCCCOC1CCCC1 7a_100000210227_100000179811 [2,0,0,0,0,0|1,0,1]=4 3322 B10R1.21 CCCCOC1CCCC1 7a_100000210269_100000210211 [2,0,0,0,0,0|1,0,1]=4 3323 B10R1.21 CCCCOC1CCCO1 34a_100000085407_100000210210 [2,0,0,0,0,0|0,0,1]=3 3324 B10R1.21 CCCNCC1CCCC1 2230a_100000737975_100000210303 [2,0,0,0,0,0|2,0,0]=4 3325 B10R1.21 CCCNCC1CCCC1 269862a_100020643023_100000746403 [2,0,0,0,0,0|2,0,0]=4 3326 B10R1.21 CCCNCC1CCCC1 34a_100000737975_100000210303 [2,0,0,0,0,0|2,0,0]=4 3327 B10R1.21 CCCNCC1OCCO1 2230a_100000036311_100000210303 [2,0,0,0,0,0|2,0,0]=4 3328 B10R1.21 CCCNCC1OCCO1 34a_100000036311_100000210303 [2,0,0,0,0,0|2,0,0]=4 3329 B10R1.21 CCCNC[C@@H]1CCCO1 2230a_100020590478_100000210303 [2,0,0,0,0,0|1,0,0]=3 3330 B10R1.21 CCCNC[C@@H]1CCCO1 34a_100020590478_100000210303 [2,0,0,0,0,0|1,0,0]=3 3331 B10R1.21 CCCOCC1CCCC1 34a_100000210258_100000740388 [2,0,0,0,0,0|1,0,0]=3 3332 B10R1.21 CCCOCC1CCCC1 34a_100000742336_100000210303 [2,0,0,0,0,0|1,0,0]=3 3333 B10R1.21 CCCOCC1CCCC1 7a_100000742336_100000210303 [2,0,0,0,0,0|1,0,0]=3 3334 B10R1.21 CCCOCC1CCCO1 34a_100000210270_100000210303 [2,0,0,0,0,0|0,0,0]=2 3335 B10R1.21 CCCOCC1CCCO1 7a_100000210270_100000210303 [2,0,0,0,0,0|0,0,0]=2 3336 B10R1.21 CCCOCC1CCNC1 34a_100000748654_100000210303 [2,0,0,0,0,0|2,0,0]=4 3337 B10R1.21 CCCOCC1CCOC1 34a_100000210258_100011261433 [2,0,0,0,0,0|2,0,0]=4 3338 B10R1.21 CCCOCC1CCOC1 34a_100000740260_100000210303 [2,0,0,0,0,0|2,0,0]=4 3339 B10R1.21 CCCOCC1COCO1 34a_100011216627_100000210303 [2,0,0,0,0,0|1,0,0]=3 3340 B10R1.21 CCCOCC1OCCO1 34a_100000087154_100000210303 [2,0,0,0,0,0|1,0,0]=3 3341 B10R1.21 CCCOCC1OCCO1 34a_100000210258_100000755774 [2,0,0,0,0,0|1,0,0]=3 3342 B10R1.21 CCCOC[C@H]1CCCN1 34a_100000745186_100000210303 [2,0,0,0,0,0|1,0,0]=3 3343 B10R1.21 CCCSCC1CCCC1 62a_100000210303_100000740388 [2,0,0,0,0,0|1,1,0]=4 3344 B10R1.21 CCCSCC1CCCC1 62a_100000740388_100000210303 [2,0,0,0,0,0|1,1,0]=4 3345 B10R1.21 CCCSCC1CCCO1 62a_100000203698_100000210303 [2,0,0,0,0,0|0,1,0]=3 3346 B10R1.21 CCCSCC1CCCO1 62a_100000210303_100000203698 [2,0,0,0,0,0|0,1,0]=3 3347 B10R1.21 CCCSCC1OCCO1 62a_100000210303_100000755774 [2,0,0,0,0,0|1,1,0]=4 3348 B10R1.21 CCCSCC1OCCO1 62a_100000755774_100000210303 [2,0,0,0,0,0|1,1,0]=4 3349 B10R1.21 COCCOC1CCCO1 34a_100000085407_100011201679 [2,0,0,0,0,0|1,0,1]=4 3350 B10R1.21 COCNC[C@@H]1CCCO1 2230a_100020590478_100000766300 [2,0,0,0,0,0|2,0,0]=4 3351 B10R1.21 COCSCC1CCCO1 62a_100000203698_100000766300 [2,0,0,0,0,0|1,1,0]=4 3352 B10R1.21 COCSCC1CCCO1 62a_100000766300_100000203698 [2,0,0,0,0,0|1,1,0]=4 3353 B10R1.21 CSCCOC1CCCO1 34a_100000085407_100000212216 [2,0,0,0,0,0|1,0,1]=4 3354 B10R1.21 CSCNC[C@@H]1CCCO1 2230a_100020590478_100011218213 [2,0,0,0,0,0|2,0,0]=4 3355 B10R1.21 CSCNC[C@@H]1CCCO1 34a_100020590478_100011218213 [2,0,0,0,0,0|2,0,0]=4 3356 B10R1.21 CSCOCC1CCCC1 34a_100000742336_100011218213 [2,0,0,0,0,0|2,0,0]=4 3357 B10R1.21 CSCOCC1CCCO1 34a_100000210270_100011218213 [2,0,0,0,0,0|1,0,0]=3 3358 B10R1.21 CSCOCC1COCO1 34a_100011216627_100011218213 [2,0,0,0,0,0|2,0,0]=4 3359 B10R1.21 CSCOCC1OCCO1 34a_100000087154_100011218213 [2,0,0,0,0,0|2,0,0]=4 3360 B10R1.21 CSCOC[C@H]1CCCN1 34a_100000745186_100011218213 [2,0,0,0,0,0|2,0,0]=4 3361 B10R1.21 CSCSCC1CCCO1 62a_100000203698_100011218213 [2,0,0,0,0,0|1,1,0]=4 3362 B10R1.21 CSCSCC1CCCO1 62a_100011218213_100000203698 [2,0,0,0,0,0|1,1,0]=4 3363 B10R1.21 FCCCOC1CCCO1 34a_100000085407_100011934791 [2,0,0,0,0,0|1,0,1]=4 3364 B10R1.21 FCCNC[C@@H]1CCCO1 2230a_100020590478_100011217306 [2,0,0,0,0,0|2,0,0]=4 3365 B10R1.21 FCCNC[C@@H]1CCCO1 34a_100020590478_100011217306 [2,0,0,0,0,0|2,0,0]=4 3366 B10R1.21 FCCOCC1CCCC1 34a_100000742336_100011217306 [2,0,0,0,0,0|2,0,0]=4 3367 B10R1.21 FCCOCC1CCCC1 7a_100000742336_100011217306 [2,0,0,0,0,0|2,0,0]=4 3368 B10R1.21 FCCOCC1CCCO1 34a_100000210270_100011217306 [2,0,0,0,0,0|1,0,0]=3 3369 B10R1.21 FCCOCC1CCCO1 7a_100000210270_100011217306 [2,0,0,0,0,0|1,0,0]=3 3370 B10R1.21 FCCOCC1COCO1 34a_100011216627_100011217306 [2,0,0,0,0,0|2,0,0]=4 3371 B10R1.21 FCCOCC1OCCO1 34a_100000087154_100011217306 [2,0,0,0,0,0|2,0,0]=4 3372 B10R1.21 FCCOC[C@H]1CCCN1 34a_100000745186_100011217306 [2,0,0,0,0,0|2,0,0]=4 3373 B10R1.21 FCCSCC1CCCO1 62a_100000203698_100011217306 [2,0,0,0,0,0|1,1,0]=4 3374 B10R1.21 FCCSCC1CCCO1 62a_100011217306_100000203698 [2,0,0,0,0,0|1,1,0]=4 3375 B10R1.21 N#CCOCC1CCCO1 7a_100000210270_100011215382 [2,0,0,0,0,0|1,0,1]=4 3376 B10R1.21 NCCOCC1CCCC1 34a_100000210304_100000740388 [2,0,0,0,0,0|2,0,0]=4 3377 B10R1.21 NCCOCC1OCCO1 34a_100000210304_100000755774 [2,0,0,0,0,0|2,0,0]=4 3378 B10R1.21 O=CCOCC1CCCO1 34a_100000210270_200009817547 [2,0,0,0,0,0|1,0,1]=4 3379 B10R1.21 O=CCOCC1CCCO1 7a_100000210270_200015260668 [2,0,0,0,0,0|1,0,1]=4 3380 B10R1.21 OCCCOC1CCCO1 34a_100000085407_100000230001 [2,0,0,0,0,0|1,0,1]=4 3381 B10R1.21 OCCNCC1CCCO1 2230a_100016997473_100000203698 [2,0,0,0,0,0|2,0,0]=4 3382 B10R1.21 OCCNC[C@@H]1CCCO1 2230a_100020590478_100000211926 [2,0,0,0,0,0|2,0,0]=4 3383 B10R1.21 OCCNC[C@@H]1CCCO1 34a_100020590478_100000211926 [2,0,0,0,0,0|2,0,0]=4 3384 B10R1.21 OCCOCC1CCCC1 34a_100000742336_100000211926 [2,0,0,0,0,0|2,0,0]=4 3385 B10R1.21 OCCOCC1CCCC1 7a_100000742336_100000211926 [2,0,0,0,0,0|2,0,0]=4 3386 B10R1.21 OCCOCC1CCCO1 34a_100000210270_100000211926 [2,0,0,0,0,0|1,0,0]=3 3387 B10R1.21 OCCOCC1CCCO1 7a_100000210270_100000211926 [2,0,0,0,0,0|1,0,0]=3 3388 B10R1.21 OCCOCC1COCO1 34a_100011216627_100000211926 [2,0,0,0,0,0|2,0,0]=4 3389 B10R1.21 OCCOCC1OCCO1 34a_100000087154_100000211926 [2,0,0,0,0,0|2,0,0]=4 3390 B10R1.21 OCCOC[C@H]1CCCN1 34a_100000745186_100000211926 [2,0,0,0,0,0|2,0,0]=4 3391 B10R1.21 OCCSCC1CCCO1 62a_100000203698_100000211926 [2,0,0,0,0,0|1,1,0]=4 3392 B10R1.21 OCCSCC1CCCO1 62a_100000211926_100000203698 [2,0,0,0,0,0|1,1,0]=4 3393 B10R1.66 CC(=O)CCC1CCCC1 1458a_100000070787_100000760354 [2,0,0,0,0,0|2,0,0]=4 3394 B10R1.66 CC(=O)CCC1CCCC1 1458a_100000211120_200000210301 [2,0,0,0,0,0|2,0,0]=4 3395 B10R1.66 CC(=O)CCC1CCCO1 1458a_100011247709_200000210301 [2,0,0,0,0,0|1,0,0]=3 3396 B10R1.66 CC(=O)CCC1OCCO1 1458a_100000070787_100000740749 [2,0,0,0,0,0|2,0,0]=4 3397 B10R1.66 CC(=O)CCC1OCCO1 1458a_100000082924_200000210301 [2,0,0,0,0,0|2,0,0]=4 3398 B10R1.66 CC(=O)CCN1CCCO1 1458a_200015187630_200000210301 [2,0,0,0,0,0|2,0,0]=4 3399 B10R1.66 CC(=O)NCC1CCCC1 11a_100000737975_100015343762 [2,0,0,0,0,0|2,0,0]=4 3400 B10R1.66 CC(=O)NCC1CCCC1 1626a_100000737975_100015343762 [2,0,0,0,0,0|2,0,0]=4 3401 B10R1.66 CC(=O)NCC1CCCC1 240690a_100000737975_100015343762 [2,0,0,0,0,0|2,0,0]=4 3402 B10R1.66 CC(=O)NCC1CCCC1 527a_100000737975_100103153847 [2,0,0,0,0,0|2,0,0]=4 3403 B10R1.66 CC(=O)NCC1OCCO1 11a_100000036311_100015343762 [2,0,0,0,0,0|2,0,0]=4 3404 B10R1.66 CC(=O)NCC1OCCO1 1626a_100000036311_100015343762 [2,0,0,0,0,0|2,0,0]=4 3405 B10R1.66 CC(=O)NCC1OCCO1 527a_100000036311_100103153847 [2,0,0,0,0,0|2,0,0]=4 3406 B10R1.66 CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100015343762 [2,0,0,0,0,0|1,0,0]=3 3407 B10R1.66 CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100015343762 [2,0,0,0,0,0|1,0,0]=3 3408 B10R1.66 CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100015343762 [2,0,0,0,0,0|1,0,0]=3 3409 B10R1.66 CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100103153847 [2,0,0,0,0,0|1,0,0]=3 3410 B10R1.66 CC(=O)OCN1CCCC1 269982a_100000188435_100000076356 [2,0,0,0,0,0|2,0,0]=4 3411 B10R1.66 CC(C)OCC1CCCO1 34a_100000210270_100000210206 [2,0,0,0,0,0|1,0,1]=4 3412 B10R1.66 CC(C)OCC1CCCO1 7a_100000210270_100000210206 [2,0,0,0,0,0|1,0,1]=4 3413 B10R1.66 [13CH3]C(=O)CCC1CCCC1 1458a_100000211120_200025704644 [2,0,0,0,0,0|2,0,0]=4 3414 B10R1.66 [13CH3]C(=O)CCC1CCCO1 1458a_100011247709_200025704644 [2,0,0,0,0,0|1,0,0]=3 3415 B10R1.66 [13CH3]C(=O)CCC1OCCO1 1458a_100000082924_200025704644 [2,0,0,0,0,0|2,0,0]=4 3416 B10R1.66 [13CH3]C(=O)CCN1CCCO1 1458a_200015187630_200025704644 [2,0,0,0,0,0|2,0,0]=4 3417 B12R0.1 C#CCCCCCCC(=O)CCC 1458a_100000034748_100000210303 [0,1,1,0,0,0|2,0,0]=4 3418 B12R0.1 C#CCCCCCCC(=O)CCC 1458a_100000211992_100012276617 [0,1,1,0,0,0|2,0,0]=4 3419 B12R0.1 C#CCCCCOCC(=O)CCC 7a_100000766709_100000747444 [0,1,1,0,0,0|1,0,1]=4 3420 B12R0.1 C#CCCCNCOC(=O)CCC 34a_100000718082_100000034017 [0,1,1,0,0,0|1,0,1]=4 3421 B12R0.1 C#CCCCOCOC(=O)CCC 34a_100000215630_100000034017 [0,1,1,0,0,0|1,0,1]=4 3422 B12R0.1 C#CCCCSCOC(=O)CCC 62a_100011215417_100000034017 [0,1,1,0,0,0|1,0,1]=4 3423 B12R0.1 C#CCOCCOCC(=O)CCC 7a_100000054580_100000747444 [0,1,1,0,0,0|0,0,2]=4 3424 B12R0.1 C=CCCCCCCC(=O)CCC 1458a_100000211992_100011215473 [0,1,1,0,0,0|2,0,0]=4 3425 B12R0.1 C=CCCCCCCC(=O)CCC 1458a_100011809334_100000210303 [0,1,1,0,0,0|2,0,0]=4 3426 B12R0.1 C=CCCCCOCC(=O)CCC 7a_100000766645_100000747444 [0,1,1,0,0,0|1,0,1]=4 3427 B12R0.1 C=CCCCNCOC(=O)CCC 2230a_100000700776_100000034017 [0,1,1,0,0,0|1,0,1]=4 3428 B12R0.1 C=CCCCNCOC(=O)CCC 34a_100000700776_100000034017 [0,1,1,0,0,0|1,0,1]=4 3429 B12R0.1 C=CCCCOCOC(=O)CCC 34a_100000758997_100000034017 [0,1,1,0,0,0|1,0,1]=4 3430 B12R0.1 C=CCCCSCOC(=O)CCC 62a_100011713584_100000034017 [0,1,1,0,0,0|1,0,1]=4 3431 B12R0.1 C=CCOCCOCC(=O)CCC 7a_100000037705_100000747444 [0,1,1,0,0,0|0,0,2]=4 3432 B12R0.1 CC/C=C\CCOCC(=O)CCC 7a_100016288707_100000747444 [0,1,1,0,0,0|1,0,1]=4 3433 B12R0.1 CC/C=C\COCOC(=O)CCC 34a_100016268518_100000034017 [0,1,1,0,0,0|1,0,1]=4 3434 B12R0.1 CC/C=C\CSCOC(=O)CCC 62a_100103147603_100000034017 [0,1,1,0,0,0|1,0,1]=4 3435 B12R0.1 CCC#CCCOCC(=O)CCC 7a_100000036655_100000747444 [0,1,1,0,0,0|1,0,1]=4 3436 B12R0.1 CCC#CCOCOC(=O)CCC 34a_100000032950_100000034017 [0,1,1,0,0,0|1,0,1]=4 3437 B12R0.1 CCC#CCSCOC(=O)CCC 62a_100009813939_100000034017 [0,1,1,0,0,0|1,0,1]=4 3438 B12R0.1 CCC/C=C/COCC(=O)CCC 7a_100016278788_100000747444 [0,1,1,0,0,0|1,0,1]=4 3439 B12R0.1 CCCC#CCOCC(=O)CCC 7a_100000034806_100000747444 [0,1,1,0,0,0|1,0,1]=4 3440 B12R0.1 CCCC(=O)CCCCCCC#N 1458a_100000211992_100009813337 [0,1,1,0,0,0|2,0,0]=4 3441 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100000211992_100000760002 [0,1,1,0,0,0|1,0,0]=3 3442 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100011219782_100000210303 [0,1,1,0,0,0|1,0,0]=3 3443 B12R0.1 CCCC(=O)CCCCCCOC 1458a_100000211992_100011998445 [0,1,1,0,0,0|1,0,0]=3 3444 B12R0.1 CCCC(=O)CCCOCCOC 1458a_100000211992_100011216529 [0,1,1,0,0,0|1,0,0]=3 3445 B12R0.1 CCCC(=O)CNCCCCCO 2230a_100000762737_100000747444 [0,1,1,0,0,0|1,0,0]=3 3446 B12R0.1 CCCC(=O)CNCCOCCO 2230a_100000211614_100000747444 [0,1,1,0,0,0|2,0,0]=4 3447 B12R0.1 CCCC(=O)CNCCSCCO 2230a_100011219999_100000747444 [0,1,1,0,0,0|2,0,0]=4 3448 B12R0.1 CCCC(=O)COCCCCCBr 7a_100000746331_100000747444 [0,1,1,0,0,0|1,0,0]=3 3449 B12R0.1 CCCC(=O)COCCCCCCl 7a_100000746330_100000747444 [0,1,1,0,0,0|1,0,0]=3 3450 B12R0.1 CCCC(=O)COCCCCCI 7a_200012148887_100000747444 [0,1,1,0,0,0|1,0,0]=3 3451 B12R0.1 CCCC(=O)COCCCCSC 7a_100011217163_100000747444 [0,1,1,0,0,0|2,0,0]=4 3452 B12R0.1 CCCC(=O)COCCCOCC 7a_100000757476_100000747444 [0,1,1,0,0,0|2,0,0]=4 3453 B12R0.1 CCCC(=O)COCCCSCC 7a_100011216438_100000747444 [0,1,1,0,0,0|2,0,0]=4 3454 B12R0.1 CCCC(=O)COCCOCCBr 7a_100000692535_100000747444 [0,1,1,0,0,0|1,0,0]=3 3455 B12R0.1 CCCC(=O)COCCOCCCl 7a_100011215305_100000747444 [0,1,1,0,0,0|1,0,0]=3 3456 B12R0.1 CCCC(=O)COCCOCCF 7a_200015357709_100000747444 [0,1,1,0,0,0|1,0,0]=3 3457 B12R0.1 CCCC(=O)COCCOCCI 7a_100012149058_100000747444 [0,1,1,0,0,0|1,0,0]=3 3458 B12R0.1 CCCC(=O)COCCOCCO 1458a_106645077154_100000210303 [0,1,1,0,0,0|1,0,0]=3 3459 B12R0.1 CCCC(=O)CSCCCCCF 62a_100000729378_100000747444 [0,1,1,0,0,0|1,1,0]=4 3460 B12R0.1 CCCC(=O)CSCCCCCF 62a_100000747444_100000729378 [0,1,1,0,0,0|1,1,0]=4 3461 B12R0.1 CCCC(=O)CSCCCCCO 62a_100000746330_100000747444 [0,1,1,0,0,0|0,1,0]=3 3462 B12R0.1 CCCC(=O)CSCCCCCO 62a_100000747444_100000746330 [0,1,1,0,0,0|0,1,0]=3 3463 B12R0.1 CCCC(=O)CSCCCCOC 62a_100000730899_100000747444 [0,1,1,0,0,0|2,0,0]=4 3464 B12R0.1 CCCC(=O)CSCCCCOC 62a_100000747444_100000730899 [0,1,1,0,0,0|2,0,0]=4 3465 B12R0.1 CCCC(=O)CSCCOCCO 62a_100000747444_100011215305 [0,1,1,0,0,0|1,1,0]=4 3466 B12R0.1 CCCC(=O)CSCCOCCO 62a_100011215305_100000747444 [0,1,1,0,0,0|1,1,0]=4 3467 B12R0.1 CCCC(=O)CSCOCCOC 62a_100000231047_100000747444 [0,1,1,0,0,0|2,0,0]=4 3468 B12R0.1 CCCC(=O)CSCOCCOC 62a_100000747444_100000231047 [0,1,1,0,0,0|2,0,0]=4 3469 B12R0.1 CCCC(=O)NCCCCCC#N 11a_100000061152_100000211992 [0,1,1,0,0,0|2,0,0]=4 3470 B12R0.1 CCCC(=O)NCCCCCC#N 1626a_100000061152_100000211992 [0,1,1,0,0,0|2,0,0]=4 3471 B12R0.1 CCCC(=O)NCCCCCC#N 240690a_100000061152_100000211992 [0,1,1,0,0,0|2,0,0]=4 3472 B12R0.1 CCCC(=O)NCCCCCC#N 527a_100000061152_100000211992 [0,1,1,0,0,0|2,0,0]=4 3473 B12R0.1 CCCC(=O)NCCCCCCO 240690a_100000686447_100000211992 [0,1,1,0,0,0|1,0,0]=3 3474 B12R0.1 CCCC(=O)NCCCCCCO 527a_100000686447_100000211992 [0,1,1,0,0,0|1,0,0]=3 3475 B12R0.1 CCCC(=O)NCCCCCOC 11a_100000747528_100000211992 [0,1,1,0,0,0|1,0,0]=3 3476 B12R0.1 CCCC(=O)NCCCCCOC 1626a_100000747528_100000211992 [0,1,1,0,0,0|1,0,0]=3 3477 B12R0.1 CCCC(=O)NCCCCCOC 240690a_100000747528_100000211992 [0,1,1,0,0,0|1,0,0]=3 3478 B12R0.1 CCCC(=O)NCCCCCOC 527a_100000747528_100000211992 [0,1,1,0,0,0|1,0,0]=3 3479 B12R0.1 CCCC(=O)NCCOCCOC 11a_100000745349_100000211992 [0,1,1,0,0,0|1,0,0]=3 3480 B12R0.1 CCCC(=O)NCCOCCOC 1626a_100000745349_100000211992 [0,1,1,0,0,0|1,0,0]=3 3481 B12R0.1 CCCC(=O)NCCOCCOC 240690a_100000745349_100000211992 [0,1,1,0,0,0|1,0,0]=3 3482 B12R0.1 CCCC(=O)NCCOCCOC 527a_100000745349_100000211992 [0,1,1,0,0,0|1,0,0]=3 3483 B12R0.1 CCCC(=O)NN=CCCCCO 4a_100000189770_100000031955 [0,1,1,0,0,0|1,0,1]=4 3484 B12R0.1 CCCC(=O)OCNCCCCO 2230a_100000750430_100000034017 [0,1,1,0,0,0|0,0,0]=2 3485 B12R0.1 CCCC(=O)OCNCCCCO 34a_100000750430_100000034017 [0,1,1,0,0,0|0,0,0]=2 3486 B12R0.1 CCCC(=O)OCNCCCOC 34a_100150723488_100000034017 [0,1,1,0,0,0|1,0,0]=3 3487 B12R0.1 CCCC(=O)OCNCCCSC 2230a_100000749238_100000034017 [0,1,1,0,0,0|1,1,0]=4 3488 B12R0.1 CCCC(=O)OCNCCOCC 2230a_102516460346_100000034017 [0,1,1,0,0,0|2,0,0]=4 3489 B12R0.1 CCCC(=O)OCNCCOCC 34a_102516460346_100000034017 [0,1,1,0,0,0|2,0,0]=4 3490 B12R0.1 CCCC(=O)OCNCCSCC 2230a_100000106463_100000034017 [0,1,1,0,0,0|2,0,0]=4 3491 B12R0.1 CCCC(=O)OCOCCCCBr 34a_100011216708_100000034017 [0,1,1,0,0,0|1,0,0]=3 3492 B12R0.1 CCCC(=O)OCOCCCCCl 34a_100000210776_100000034017 [0,1,1,0,0,0|1,0,0]=3 3493 B12R0.1 CCCC(=O)OCOCCCCF 34a_100011995726_100000034017 [0,1,1,0,0,0|1,0,0]=3 3494 B12R0.1 CCCC(=O)OCOCCCCI 34a_200012148704_100000034017 [0,1,1,0,0,0|1,0,0]=3 3495 B12R0.1 CCCC(=O)OCOCCCCN 34a_100000750430_100000034017 [0,1,1,0,0,0|1,0,0]=3 3496 B12R0.1 CCCC(=O)OCOCCCNC 34a_100000213112_100000034017 [0,1,1,0,0,0|2,0,0]=4 3497 B12R0.1 CCCC(=O)OCOCCCOC 34a_100000740835_100000034017 [0,1,1,0,0,0|1,0,0]=3 3498 B12R0.1 CCCC(=O)OCOCCCSC 34a_100000690336_100000034017 [0,1,1,0,0,0|1,1,0]=4 3499 B12R0.1 CCCC(=O)OCOCCOCC 34a_100000210136_100000034017 [0,1,1,0,0,0|2,0,0]=4 3500 B12R0.1 CCCC(=O)OCOCCSCC 34a_100000212035_100000034017 [0,1,1,0,0,0|2,0,0]=4 3501 B12R0.1 CCCC(=O)OCSCC#CCO 62a_200000047223_100000034017 [0,1,1,0,0,0|0,0,2]=4 3502 B12R0.1 CCCC(=O)OCSCCCC#N 62a_100000687738_100000034017 [0,1,1,0,0,0|1,0,1]=4 3503 B12R0.1 CCCC(=O)OCSCCCC=O 62a_200011292268_100000034017 [0,1,1,0,0,0|0,0,2]=4 3504 B12R0.1 CCCC(=O)OCSCCCCF 62a_100000729493_100000034017 [0,1,1,0,0,0|1,0,0]=3 3505 B12R0.1 CCCC(=O)OCSCCCCO 62a_100000210776_100000034017 [0,1,1,0,0,0|0,0,0]=2 3506 B12R0.1 CCCC(=O)OCSCCCOC 62a_100000709357_100000034017 [0,1,1,0,0,0|1,0,0]=3 3507 B12R0.1 CCCC(=O)OCSCCOCC 62a_100000210147_100000034017 [0,1,1,0,0,0|2,0,0]=4 3508 B12R0.1 CCCC(=O)OCSCCSCC 62a_100000757381_100000034017 [0,1,1,0,0,0|2,0,0]=4 3509 B12R0.1 CCCC(C)COCCCCCO 34a_100000688023_100000746330 [0,1,1,0,0,0|1,0,1]=4 3510 B12R0.1 CCCC(C)COCCCCCO 7a_100000688023_100000746330 [0,1,1,0,0,0|1,0,1]=4 3511 B12R0.1 CCCC(C)OCCCCCCO 34a_100000764384_100000766143 [0,1,1,0,0,0|1,0,1]=4 3512 B12R0.1 CCCC(C)OCCCCCCO 7a_100000764384_100000766143 [0,1,1,0,0,0|1,0,1]=4 3513 B12R0.1 CCCC(C)OCCOCCNC 34a_100000228057_100000766640 [0,1,1,0,0,0|1,0,1]=4 3514 B12R0.1 CCCC(C)OCCOCCOC 34a_100000764384_100000695917 [0,1,1,0,0,0|1,0,1]=4 3515 B12R0.1 CCCC(C)OCCOCCOC 34a_100011215163_100000766640 [0,1,1,0,0,0|1,0,1]=4 3516 B12R0.1 CCCC(C)OCCOCCOC 7a_100000764384_100000695917 [0,1,1,0,0,0|1,0,1]=4 3517 B12R0.1 CCCC(C)OCCOCCOC 7a_100011215163_100000766640 [0,1,1,0,0,0|1,0,1]=4 3518 B12R0.1 CCCCCCC=CC(=O)CCC 1458a_200015324643_100000210303 [0,1,1,0,0,0|2,0,0]=4 3519 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000210188_100000210303 [0,1,1,0,0,0|2,0,0]=4 3520 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000211992_100000210759 [0,1,1,0,0,0|2,0,0]=4 3521 B12R0.1 CCCCCCCNC(=O)CCC 11a_100000229938_100000211992 [0,1,1,0,0,0|2,0,0]=4 3522 B12R0.1 CCCCCCCNC(=O)CCC 1626a_100000229938_100000211992 [0,1,1,0,0,0|2,0,0]=4 3523 B12R0.1 CCCCCCCNC(=O)CCC 240690a_100000229938_100000211992 [0,1,1,0,0,0|2,0,0]=4 3524 B12R0.1 CCCCCCCNC(=O)CCC 527a_100000229938_100000211992 [0,1,1,0,0,0|2,0,0]=4 3525 B12R0.1 CCCCCCNCC(=O)CCC 2230a_100000210581_100000747444 [0,1,1,0,0,0|2,0,0]=4 3526 B12R0.1 CCCCCCOCC(=O)CCC 7a_100000210259_100000747444 [0,1,1,0,0,0|1,0,0]=3 3527 B12R0.1 CCCCCCOCC(=O)NCC 34a_100000210259_100000183381 [0,1,1,0,0,0|2,0,0]=4 3528 B12R0.1 CCCCCCOCC(=O)NCC 7a_100000210259_100000183381 [0,1,1,0,0,0|2,0,0]=4 3529 B12R0.1 CCCCCCOCC(=O)OCC 34a_100000210259_100000188475 [0,1,1,0,0,0|2,0,0]=4 3530 B12R0.1 CCCCCCOCC(=O)OCC 7a_100000210259_100000188475 [0,1,1,0,0,0|2,0,0]=4 3531 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000210314_100000747444 [0,1,1,0,0,0|1,1,0]=4 3532 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000747444_100000210757 [0,1,1,0,0,0|1,1,0]=4 3533 B12R0.1 CCCCCNCOC(=O)CCC 2230a_100000209983_100000034017 [0,1,1,0,0,0|1,0,0]=3 3534 B12R0.1 CCCCCOCOC(=O)CCC 34a_100000210253_100000034017 [0,1,1,0,0,0|1,0,0]=3 3535 B12R0.1 CCCCCSCOC(=O)CCC 62a_100000210326_100000034017 [0,1,1,0,0,0|1,0,0]=3 3536 B12R0.1 CCCCCSCOC(=O)OCC 62a_100000210326_100000075025 [0,1,1,0,0,0|2,0,0]=4 3537 B12R0.1 CCCCOCCCC(=O)OCC 34a_100000210227_100009991533 [0,1,1,0,0,0|2,0,0]=4 3538 B12R0.1 CCCCOCCCC(=O)OCC 7a_100000210227_100011215271 [0,1,1,0,0,0|2,0,0]=4 3539 B12R0.1 CCCCOCCCC(=O)OCC 7a_100012001163_100000210211 [0,1,1,0,0,0|2,0,0]=4 3540 B12R0.1 CCCCOCCNC(=O)OCC 34a_100000158857_100000210210 [0,1,1,0,0,0|2,0,0]=4 3541 B12R0.1 CCCCOCCNC(=O)OCC 7a_100000210227_200011445536 [0,1,1,0,0,0|2,0,0]=4 3542 B12R0.1 CCCCOCCOC(C)CCC 34a_100000210238_100000766640 [0,1,1,0,0,0|1,0,1]=4 3543 B12R0.1 CCCCOCCOC(C)CCC 34a_100000764384_100000743108 [0,1,1,0,0,0|1,0,1]=4 3544 B12R0.1 CCCCOCCOC(C)CCC 7a_100000210238_100000766640 [0,1,1,0,0,0|1,0,1]=4 3545 B12R0.1 CCCCOCCOC(C)CCC 7a_100000764384_100000743108 [0,1,1,0,0,0|1,0,1]=4 3546 B12R0.1 CCCCOCSCC(=O)CCC 62a_100000747444_100011995733 [0,1,1,0,0,0|2,0,0]=4 3547 B12R0.1 CCCCOCSCC(=O)CCC 62a_100011995733_100000747444 [0,1,1,0,0,0|2,0,0]=4 3548 B12R0.1 CCCCSCCNC(=O)CCC 11a_100025743550_100000211992 [0,1,1,0,0,0|1,1,0]=4 3549 B12R0.1 CCCCSCCNC(=O)CCC 1626a_100025743550_100000211992 [0,1,1,0,0,0|1,1,0]=4 3550 B12R0.1 CCCCSCCNC(=O)CCC 240690a_100025743550_100000211992 [0,1,1,0,0,0|1,1,0]=4 3551 B12R0.1 CCCCSCCNC(=O)CCC 527a_100025743550_100000211992 [0,1,1,0,0,0|1,1,0]=4 3552 B12R0.1 CCCOCCCCC(=O)OCC 34a_100000210258_100000750268 [0,1,1,0,0,0|2,0,0]=4 3553 B12R0.1 CCCOCCCNC(=O)CCC 1626a_100011217757_100000211992 [0,1,1,0,0,0|1,0,0]=3 3554 B12R0.1 CCCOCCCNC(=O)CCC 240690a_100011217757_100000211992 [0,1,1,0,0,0|1,0,0]=3 3555 B12R0.1 CCCOCCCNC(=O)CCC 527a_100011217757_100000211992 [0,1,1,0,0,0|1,0,0]=3 3556 B12R0.1 CCCOCCCNC(=O)CCO 240690a_100011217757_100011216618 [0,1,1,0,0,0|2,0,0]=4 3557 B12R0.1 CCCOCCCNC(=O)COC 1626a_100011217757_100000210968 [0,1,1,0,0,0|2,0,0]=4 3558 B12R0.1 CCCOCCCNC(=O)COC 240690a_100011217757_100000210968 [0,1,1,0,0,0|2,0,0]=4 3559 B12R0.1 CCCOCCCNC(=O)COC 527a_100011217757_100000210968 [0,1,1,0,0,0|2,0,0]=4 3560 B12R0.1 CCCOCCCNC(=O)CSC 1626a_100011217757_100000184570 [0,1,1,0,0,0|2,0,0]=4 3561 B12R0.1 CCCOCCCNC(=O)CSC 240690a_100011217757_100000184570 [0,1,1,0,0,0|2,0,0]=4 3562 B12R0.1 CCCOCCCNC(=O)CSC 527a_100011217757_100000184570 [0,1,1,0,0,0|2,0,0]=4 3563 B12R0.1 CCCOCCCNC(=O)NCC 2708a_100011217757_100015525214 [0,1,1,0,0,0|2,0,0]=4 3564 B12R0.1 CCCOCCCNC(=O)NCC 2708a_100015525214_100011217757 [0,1,1,0,0,0|2,0,0]=4 3565 B12R0.1 CCCOCCCNC(=O)NCC 273464a_100011217757_100015525214 [0,1,1,0,0,0|2,0,0]=4 3566 B12R0.1 CCCOCCCNC(=O)NCC 273464a_100015525214_100011217757 [0,1,1,0,0,0|2,0,0]=4 3567 B12R0.1 CCCOCCCNC(=O)NCC 512a_100011217757_100015525214 [0,1,1,0,0,0|2,0,0]=4 3568 B12R0.1 CCCOCCCNC(=O)NCC 512a_100015525214_100011217757 [0,1,1,0,0,0|2,0,0]=4 3569 B12R0.1 CCCOCCNCC(=O)CCC 2230a_100161115042_100000747444 [0,1,1,0,0,0|1,0,0]=3 3570 B12R0.1 CCCOCCNCC(=O)NCC 2230a_100016988866_100011215938 [0,1,1,0,0,0|2,0,0]=4 3571 B12R0.1 CCCOCCNCC(=O)NCC 2230a_100161115042_100000183381 [0,1,1,0,0,0|2,0,0]=4 3572 B12R0.1 CCCOCCNCC(=O)NCC 34a_100161115042_100000183381 [0,1,1,0,0,0|2,0,0]=4 3573 B12R0.1 CCCOCCNCC(=O)OCC 2230a_100161115042_100000188475 [0,1,1,0,0,0|2,0,0]=4 3574 B12R0.1 CCCOCCNCC(=O)OCC 34a_100161115042_100000188475 [0,1,1,0,0,0|2,0,0]=4 3575 B12R0.1 CCCOCCOCC(=O)CCC 7a_100000752267_100000747444 [0,1,1,0,0,0|0,0,0]=2 3576 B12R0.1 CCCOCCOCC(=O)NCC 34a_100000752267_100000183381 [0,1,1,0,0,0|1,0,0]=3 3577 B12R0.1 CCCOCCOCC(=O)NCC 7a_100000752267_100000183381 [0,1,1,0,0,0|1,0,0]=3 3578 B12R0.1 CCCOCCOCC(=O)NCO 34a_100000752267_100000185155 [0,1,1,0,0,0|2,0,0]=4 3579 B12R0.1 CCCOCCOCC(=O)NCO 7a_100000752267_100000185155 [0,1,1,0,0,0|2,0,0]=4 3580 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000210258_100000088970 [0,1,1,0,0,0|1,0,0]=3 3581 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000752267_100000188475 [0,1,1,0,0,0|1,0,0]=3 3582 B12R0.1 CCCOCCOCC(=O)OCC 7a_100000752267_100000188475 [0,1,1,0,0,0|1,0,0]=3 3583 B12R0.1 CCCOCCOCC(C)CCC 34a_100000688023_100011215938 [0,1,1,0,0,0|1,0,1]=4 3584 B12R0.1 CCCOCCOCC(C)CCC 34a_100000752267_100011216630 [0,1,1,0,0,0|1,0,1]=4 3585 B12R0.1 CCCOCCOCC(C)CCC 7a_100000688023_100011215938 [0,1,1,0,0,0|1,0,1]=4 3586 B12R0.1 CCCOCCOCC(C)CCC 7a_100000752267_100011216630 [0,1,1,0,0,0|1,0,1]=4 3587 B12R0.1 CCCOCCOC[C@@H](N)CCC 34a_100000732646_100011215938 [0,1,1,0,0,0|1,0,1]=4 3588 B12R0.1 CCCOCCSCC(=O)CCC 62a_100000747444_100011215938 [0,1,1,0,0,0|0,1,0]=3 3589 B12R0.1 CCCOCCSCC(=O)CCC 62a_100011215938_100000747444 [0,1,1,0,0,0|0,1,0]=3 3590 B12R0.1 CCCOCCSCC(=O)NCC 62a_100000183381_100011215938 [0,1,1,0,0,0|1,1,0]=4 3591 B12R0.1 CCCOCCSCC(=O)NCC 62a_100011215938_100000183381 [0,1,1,0,0,0|1,1,0]=4 3592 B12R0.1 CCCOCCSCC(=O)OCC 62a_100000188475_100011215938 [0,1,1,0,0,0|1,1,0]=4 3593 B12R0.1 CCCOCCSCC(=O)OCC 62a_100011215938_100000188475 [0,1,1,0,0,0|1,1,0]=4 3594 B12R0.1 CCCOCCSCC(=O)OCC 7a_200000230590_100000210303 [0,1,1,0,0,0|1,1,0]=4 3595 B12R0.1 CCCSCCNCC(=O)CCC 2230a_100020603323_100000747444 [0,1,1,0,0,0|1,1,0]=4 3596 B12R0.1 CCCSCCOCC(=O)CCC 7a_200000230433_100000747444 [0,1,1,0,0,0|0,1,0]=3 3597 B12R0.1 CCCSCCOCC(=O)NCC 34a_200000230433_100000183381 [0,1,1,0,0,0|1,1,0]=4 3598 B12R0.1 CCCSCCOCC(=O)NCC 7a_200000230433_100000183381 [0,1,1,0,0,0|1,1,0]=4 3599 B12R0.1 CCCSCCOCC(=O)OCC 34a_200000230433_100000188475 [0,1,1,0,0,0|1,1,0]=4 3600 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000088970_100000210303 [0,1,1,0,0,0|1,1,0]=4 3601 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000210303_100000088970 [0,1,1,0,0,0|1,1,0]=4 3602 B12R0.1 CCCSCCOCC(=O)OCC 7a_200000230433_100000188475 [0,1,1,0,0,0|1,1,0]=4 3603 B12R0.1 CCC[C@H](N)COCCCCCO 34a_100000732646_100000746330 [0,1,1,0,0,0|1,0,1]=4 3604 B12R0.1 CCNC(=O)CCCCCCCO 240690a_100015525214_100011219782 [0,1,1,0,0,0|2,0,0]=4 3605 B12R0.1 CCNC(=O)CCNCCCCO 2230a_100000750430_100000737597 [0,1,1,0,0,0|2,0,0]=4 3606 B12R0.1 CCNC(=O)CCNCCCCO 34a_100025743525_100011216708 [0,1,1,0,0,0|2,0,0]=4 3607 B12R0.1 CCNC(=O)CCSCCCCO 62a_100000210776_100000737597 [0,1,1,0,0,0|2,0,0]=4 3608 B12R0.1 CCNC(=O)CCSCCCCO 62a_100000737597_100000210776 [0,1,1,0,0,0|2,0,0]=4 3609 B12R0.1 CCNC(=O)CNCCCCCO 2230a_100000762737_100000183381 [0,1,1,0,0,0|2,0,0]=4 3610 B12R0.1 CCNC(=O)CNCCCCCO 2230a_100016988866_100000746330 [0,1,1,0,0,0|2,0,0]=4 3611 B12R0.1 CCNC(=O)CNCCCCCO 34a_100000762737_100000183381 [0,1,1,0,0,0|2,0,0]=4 3612 B12R0.1 CCNC(=O)COCCCCCBr 34a_100000746331_100000183381 [0,1,1,0,0,0|2,0,0]=4 3613 B12R0.1 CCNC(=O)COCCCCCBr 7a_100000746331_100000183381 [0,1,1,0,0,0|2,0,0]=4 3614 B12R0.1 CCNC(=O)COCCCCCCl 34a_100000746330_100000183381 [0,1,1,0,0,0|2,0,0]=4 3615 B12R0.1 CCNC(=O)COCCCCCCl 7a_100000746330_100000183381 [0,1,1,0,0,0|2,0,0]=4 3616 B12R0.1 CCNC(=O)COCCCCCI 34a_200012148887_100000183381 [0,1,1,0,0,0|2,0,0]=4 3617 B12R0.1 CCNC(=O)COCCCCCI 7a_200012148887_100000183381 [0,1,1,0,0,0|2,0,0]=4 3618 B12R0.1 CCNC(=O)COCCCCCN 34a_100000762737_100000183381 [0,1,1,0,0,0|2,0,0]=4 3619 B12R0.1 CCNC(=O)COCCOCCBr 34a_100000692535_100000183381 [0,1,1,0,0,0|2,0,0]=4 3620 B12R0.1 CCNC(=O)COCCOCCBr 7a_100000692535_100000183381 [0,1,1,0,0,0|2,0,0]=4 3621 B12R0.1 CCNC(=O)COCCOCCCl 34a_100011215305_100000183381 [0,1,1,0,0,0|2,0,0]=4 3622 B12R0.1 CCNC(=O)COCCOCCCl 7a_100011215305_100000183381 [0,1,1,0,0,0|2,0,0]=4 3623 B12R0.1 CCNC(=O)COCCOCCF 34a_200015357709_100000183381 [0,1,1,0,0,0|2,0,0]=4 3624 B12R0.1 CCNC(=O)COCCOCCF 7a_200015357709_100000183381 [0,1,1,0,0,0|2,0,0]=4 3625 B12R0.1 CCNC(=O)COCCOCCI 34a_100012149058_100000183381 [0,1,1,0,0,0|2,0,0]=4 3626 B12R0.1 CCNC(=O)COCCOCCI 7a_100012149058_100000183381 [0,1,1,0,0,0|2,0,0]=4 3627 B12R0.1 CCNC(=O)COCCOCCN 34a_100000211614_100000183381 [0,1,1,0,0,0|2,0,0]=4 3628 B12R0.1 CCNC(=O)COCCOCCO 240690a_100015525214_106645077154 [0,1,1,0,0,0|2,0,0]=4 3629 B12R0.1 CCNC(=O)CSCCCCCO 62a_100000183381_100000746330 [0,1,1,0,0,0|1,1,0]=4 3630 B12R0.1 CCNC(=O)CSCCCCCO 62a_100000746330_100000183381 [0,1,1,0,0,0|1,1,0]=4 3631 B12R0.1 CCNC(=O)NCCCCCCO 2708a_100015525214_100000686447 [0,1,1,0,0,0|2,0,0]=4 3632 B12R0.1 CCNC(=O)NCCCCCCO 273464a_100000686447_100015525214 [0,1,1,0,0,0|2,0,0]=4 3633 B12R0.1 CCNC(=O)NCCCCCCO 273464a_100015525214_100000686447 [0,1,1,0,0,0|2,0,0]=4 3634 B12R0.1 CCNC(=O)NCCCCCCO 512a_100000686447_100015525214 [0,1,1,0,0,0|2,0,0]=4 3635 B12R0.1 CCNC(=O)NCCCCCCO 512a_100015525214_100000686447 [0,1,1,0,0,0|2,0,0]=4 3636 B12R0.1 CCNC(=O)NCCCCCOC 2708a_100000747528_100015525214 [0,1,1,0,0,0|2,0,0]=4 3637 B12R0.1 CCNC(=O)NCCCCCOC 2708a_100015525214_100000747528 [0,1,1,0,0,0|2,0,0]=4 3638 B12R0.1 CCNC(=O)NCCCCCOC 273464a_100000747528_100015525214 [0,1,1,0,0,0|2,0,0]=4 3639 B12R0.1 CCNC(=O)NCCCCCOC 273464a_100015525214_100000747528 [0,1,1,0,0,0|2,0,0]=4 3640 B12R0.1 CCNC(=O)NCCCCCOC 512a_100000747528_100015525214 [0,1,1,0,0,0|2,0,0]=4 3641 B12R0.1 CCNC(=O)NCCCCCOC 512a_100015525214_100000747528 [0,1,1,0,0,0|2,0,0]=4 3642 B12R0.1 CCNC(=O)NCCOCCOC 2708a_100000745349_100015525214 [0,1,1,0,0,0|2,0,0]=4 3643 B12R0.1 CCNC(=O)NCCOCCOC 2708a_100015525214_100000745349 [0,1,1,0,0,0|2,0,0]=4 3644 B12R0.1 CCNC(=O)NCCOCCOC 273464a_100000745349_100015525214 [0,1,1,0,0,0|2,0,0]=4 3645 B12R0.1 CCNC(=O)NCCOCCOC 273464a_100015525214_100000745349 [0,1,1,0,0,0|2,0,0]=4 3646 B12R0.1 CCNC(=O)NCCOCCOC 512a_100000745349_100015525214 [0,1,1,0,0,0|2,0,0]=4 3647 B12R0.1 CCOC(=O)CCCCCCOC 34a_100138415774_100009814379 [0,1,1,0,0,0|2,0,0]=4 3648 B12R0.1 CCOC(=O)CCCCNCCO 2230a_100016997473_100000750268 [0,1,1,0,0,0|2,0,0]=4 3649 B12R0.1 CCOC(=O)CCCCNCCO 34a_100016990907_100000750268 [0,1,1,0,0,0|2,0,0]=4 3650 B12R0.1 CCOC(=O)CCCCSCCO 62a_100000211926_100000750268 [0,1,1,0,0,0|2,0,0]=4 3651 B12R0.1 CCOC(=O)CCCCSCCO 62a_100000750268_100000211926 [0,1,1,0,0,0|2,0,0]=4 3652 B12R0.1 CCOC(=O)CCCOCCCBr 34a_100011217188_100009991533 [0,1,1,0,0,0|2,0,0]=4 3653 B12R0.1 CCOC(=O)CCCOCCCCl 34a_100000230001_100009991533 [0,1,1,0,0,0|2,0,0]=4 3654 B12R0.1 CCOC(=O)CCCOCCCF 34a_100000759539_100009991533 [0,1,1,0,0,0|2,0,0]=4 3655 B12R0.1 CCOC(=O)CCCOCCCF 7a_100012001163_100011934791 [0,1,1,0,0,0|2,0,0]=4 3656 B12R0.1 CCOC(=O)CCCOCCCN 34a_100000182051_100009991533 [0,1,1,0,0,0|2,0,0]=4 3657 B12R0.1 CCOC(=O)CCCOCCCO 7a_100012001163_100011215043 [0,1,1,0,0,0|2,0,0]=4 3658 B12R0.1 CCOC(=O)CCCOCCOC 34a_100000210237_100009991533 [0,1,1,0,0,0|2,0,0]=4 3659 B12R0.1 CCOC(=O)CCCOCCOC 7a_100012001163_100000233755 [0,1,1,0,0,0|2,0,0]=4 3660 B12R0.1 CCOC(=O)CCCOCCSC 34a_100000230434_100009991533 [0,1,1,0,0,0|2,0,0]=4 3661 B12R0.1 CCOC(=O)CCCOCCSC 7a_100000230434_100011215271 [0,1,1,0,0,0|2,0,0]=4 3662 B12R0.1 CCOC(=O)CCCOCCSC 7a_100012001163_100000212216 [0,1,1,0,0,0|2,0,0]=4 3663 B12R0.1 CCOC(=O)CCCSCCCO 62a_100009991533_100011215043 [0,1,1,0,0,0|2,0,0]=4 3664 B12R0.1 CCOC(=O)CCCSCCCO 62a_100011215043_100009991533 [0,1,1,0,0,0|2,0,0]=4 3665 B12R0.1 CCOC(=O)CCNCCCCO 2230a_100000750430_100011206558 [0,1,1,0,0,0|2,0,0]=4 3666 B12R0.1 CCOC(=O)CCNCCCCO 34a_100000750430_100000765890 [0,1,1,0,0,0|2,0,0]=4 3667 B12R0.1 CCOC(=O)CCSCCCCO 62a_100000210776_100000765890 [0,1,1,0,0,0|2,0,0]=4 3668 B12R0.1 CCOC(=O)CCSCCCCO 62a_100000765890_100000210776 [0,1,1,0,0,0|2,0,0]=4 3669 B12R0.1 CCOC(=O)CNCCCCCO 2230a_100000762737_100000188475 [0,1,1,0,0,0|2,0,0]=4 3670 B12R0.1 CCOC(=O)CNCCCCCO 34a_100000762737_100000188475 [0,1,1,0,0,0|2,0,0]=4 3671 B12R0.1 CCOC(=O)COCCCCCBr 34a_100000746331_100000188475 [0,1,1,0,0,0|2,0,0]=4 3672 B12R0.1 CCOC(=O)COCCCCCBr 7a_100000746331_100000188475 [0,1,1,0,0,0|2,0,0]=4 3673 B12R0.1 CCOC(=O)COCCCCCCl 34a_100000746330_100000188475 [0,1,1,0,0,0|2,0,0]=4 3674 B12R0.1 CCOC(=O)COCCCCCCl 7a_100000746330_100000188475 [0,1,1,0,0,0|2,0,0]=4 3675 B12R0.1 CCOC(=O)COCCCCCI 34a_200012148887_100000188475 [0,1,1,0,0,0|2,0,0]=4 3676 B12R0.1 CCOC(=O)COCCCCCI 7a_200012148887_100000188475 [0,1,1,0,0,0|2,0,0]=4 3677 B12R0.1 CCOC(=O)COCCCCCN 34a_100000762737_100000188475 [0,1,1,0,0,0|2,0,0]=4 3678 B12R0.1 CCOC(=O)COCCNCCO 2230a_100016997473_100000088970 [0,1,1,0,0,0|2,0,0]=4 3679 B12R0.1 CCOC(=O)COCCNCCO 34a_100016990907_100000088970 [0,1,1,0,0,0|2,0,0]=4 3680 B12R0.1 CCOC(=O)COCCOCCBr 34a_100000211926_100000088970 [0,1,1,0,0,0|2,0,0]=4 3681 B12R0.1 CCOC(=O)COCCOCCBr 34a_100000692535_100000188475 [0,1,1,0,0,0|2,0,0]=4 3682 B12R0.1 CCOC(=O)COCCOCCBr 7a_100000692535_100000188475 [0,1,1,0,0,0|2,0,0]=4 3683 B12R0.1 CCOC(=O)COCCOCCCl 34a_100011215305_100000188475 [0,1,1,0,0,0|2,0,0]=4 3684 B12R0.1 CCOC(=O)COCCOCCCl 7a_100011215305_100000188475 [0,1,1,0,0,0|2,0,0]=4 3685 B12R0.1 CCOC(=O)COCCOCCF 34a_200015357709_100000188475 [0,1,1,0,0,0|2,0,0]=4 3686 B12R0.1 CCOC(=O)COCCOCCF 7a_200015357709_100000188475 [0,1,1,0,0,0|2,0,0]=4 3687 B12R0.1 CCOC(=O)COCCOCCI 34a_100012149058_100000188475 [0,1,1,0,0,0|2,0,0]=4 3688 B12R0.1 CCOC(=O)COCCOCCI 7a_100012149058_100000188475 [0,1,1,0,0,0|2,0,0]=4 3689 B12R0.1 CCOC(=O)COCCOCCN 34a_100000210304_100000088970 [0,1,1,0,0,0|2,0,0]=4 3690 B12R0.1 CCOC(=O)COCCOCCN 34a_100000211614_100000188475 [0,1,1,0,0,0|2,0,0]=4 3691 B12R0.1 CCOC(=O)COCCSCCO 62a_100000088970_100000211926 [0,1,1,0,0,0|2,0,0]=4 3692 B12R0.1 CCOC(=O)COCCSCCO 62a_100000211926_100000088970 [0,1,1,0,0,0|2,0,0]=4 3693 B12R0.1 CCOC(=O)CSCCCCCO 62a_100000188475_100000746330 [0,1,1,0,0,0|1,1,0]=4 3694 B12R0.1 CCOC(=O)CSCCCCCO 62a_100000746330_100000188475 [0,1,1,0,0,0|1,1,0]=4 3695 B12R0.1 CCOC(=O)NCCOCCCF 34a_100000158857_100011934791 [0,1,1,0,0,0|2,0,0]=4 3696 B12R0.1 CCOC(=O)NCCOCCCO 34a_100000158857_100000230001 [0,1,1,0,0,0|2,0,0]=4 3697 B12R0.1 CCOC(=O)NCCOCCOC 34a_100000158857_100011201679 [0,1,1,0,0,0|2,0,0]=4 3698 B12R0.1 CCOC(=O)NCCOCCSC 34a_100000158857_100000212216 [0,1,1,0,0,0|2,0,0]=4 3699 B12R0.1 CCOC(=O)NCCOCCSC 7a_100000230434_200011445536 [0,1,1,0,0,0|2,0,0]=4 3700 B12R0.1 CCOC(=O)NCCSCCCO 62a_100011215043_200011445536 [0,1,1,0,0,0|2,0,0]=4 3701 B12R0.1 CCOC(=O)OCSCCCCF 62a_100000729493_100000075025 [0,1,1,0,0,0|2,0,0]=4 3702 B12R0.1 CCOC(=O)OCSCCCCO 62a_100000210776_100000075025 [0,1,1,0,0,0|1,0,0]=3 3703 B12R0.1 CCOC(=O)OCSCCCOC 62a_100000709357_100000075025 [0,1,1,0,0,0|2,0,0]=4 3704 B12R0.1 COCC(=O)CCCCCCCO 1458a_100000210968_100000760002 [0,1,1,0,0,0|2,0,0]=4 3705 B12R0.1 COCC(=O)NCCCCCCO 240690a_100000686447_100000210968 [0,1,1,0,0,0|2,0,0]=4 3706 B12R0.1 COCC(=O)NCCCCCCO 527a_100000686447_100000210968 [0,1,1,0,0,0|2,0,0]=4 3707 B12R0.1 COCCCCCCC(=O)CCO 1458a_100011216618_100011998445 [0,1,1,0,0,0|2,0,0]=4 3708 B12R0.1 COCCCCCCC(=O)COC 1458a_100000210968_100011998445 [0,1,1,0,0,0|2,0,0]=4 3709 B12R0.1 COCCCCCCC(=O)CSC 1458a_100000184570_100011998445 [0,1,1,0,0,0|2,0,0]=4 3710 B12R0.1 COCCCCCNC(=O)CCO 240690a_100000747528_100011216618 [0,1,1,0,0,0|2,0,0]=4 3711 B12R0.1 COCCCCCNC(=O)COC 11a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3712 B12R0.1 COCCCCCNC(=O)COC 1626a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3713 B12R0.1 COCCCCCNC(=O)COC 240690a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3714 B12R0.1 COCCCCCNC(=O)COC 527a_100000747528_100000210968 [0,1,1,0,0,0|2,0,0]=4 3715 B12R0.1 COCCCCCNC(=O)CSC 11a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3716 B12R0.1 COCCCCCNC(=O)CSC 1626a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3717 B12R0.1 COCCCCCNC(=O)CSC 240690a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3718 B12R0.1 COCCCCCNC(=O)CSC 527a_100000747528_100000184570 [0,1,1,0,0,0|2,0,0]=4 3719 B12R0.1 COCCOCCCC(=O)CCO 1458a_100011216618_100011216529 [0,1,1,0,0,0|2,0,0]=4 3720 B12R0.1 COCCOCCCC(=O)COC 1458a_100000210968_100011216529 [0,1,1,0,0,0|2,0,0]=4 3721 B12R0.1 COCCOCCCC(=O)CSC 1458a_100000184570_100011216529 [0,1,1,0,0,0|2,0,0]=4 3722 B12R0.1 COCCOCCNC(=O)CCO 240690a_100000745349_100011216618 [0,1,1,0,0,0|2,0,0]=4 3723 B12R0.1 COCCOCCNC(=O)COC 11a_100000745349_100000210968 [0,1,1,0,0,0|2,0,0]=4 3724 B12R0.1 COCCOCCNC(=O)COC 1626a_100000745349_100000210968 [0,1,1,0,0,0|2,0,0]=4 3725 B12R0.1 COCCOCCNC(=O)COC 240690a_100000745349_100000210968 [0,1,1,0,0,0|2,0,0]=4 3726 B12R0.1 COCCOCCNC(=O)COC 527a_100000745349_100000210968 [0,1,1,0,0,0|2,0,0]=4 3727 B12R0.1 COCCOCCNC(=O)CSC 11a_100000745349_100000184570 [0,1,1,0,0,0|2,0,0]=4 3728 B12R0.1 COCCOCCNC(=O)CSC 1626a_100000745349_100000184570 [0,1,1,0,0,0|2,0,0]=4 3729 B12R0.1 COCCOCCNC(=O)CSC 240690a_100000745349_100000184570 [0,1,1,0,0,0|2,0,0]=4 3730 B12R0.1 COCCOCCNC(=O)CSC 527a_100000745349_100000184570 [0,1,1,0,0,0|2,0,0]=4 3731 B12R0.1 CSCC(=O)CCCCCCCO 1458a_100000184570_100000760002 [0,1,1,0,0,0|2,0,0]=4 3732 B12R0.1 CSCC(=O)NCCCCCCO 240690a_100000686447_100000184570 [0,1,1,0,0,0|2,0,0]=4 3733 B12R0.1 CSCC(=O)NCCCCCCO 527a_100000686447_100000184570 [0,1,1,0,0,0|2,0,0]=4 3734 B12R0.1 O=C(CCF)CCCCCCCO 1458a_100011219782_100011217306 [0,1,1,0,0,0|2,0,0]=4 3735 B12R0.1 O=C(CCF)COCCOCCO 1458a_106645077154_100011217306 [0,1,1,0,0,0|2,0,0]=4 3736 B12R0.1 O=C(CCO)CCCCCCCO 1458a_100011216618_100000760002 [0,1,1,0,0,0|2,0,0]=4 3737 B12R0.1 O=C(CCO)CCCCCCCO 1458a_100011219782_100000211926 [0,1,1,0,0,0|2,0,0]=4 3738 B12R0.1 O=C(CCO)COCCOCCO 1458a_106645077154_100000211926 [0,1,1,0,0,0|2,0,0]=4 3739 B12R0.1 O=C(CCO)NCCCCCCO 240690a_100000686447_100011216618 [0,1,1,0,0,0|2,0,0]=4 3740 B12R0.4 C=C(C)CC(=O)CCCCCCO 1458a_100011996774_100000748629 [0,1,1,0,0,0|1,0,1]=4 3741 B12R0.4 CC(=O)CC(=O)OCCNCCO 34a_100016990907_100000102702 [0,1,1,0,0,0|1,0,1]=4 3742 B12R0.4 CC(=O)CC(=O)OCCOCCBr 34a_100000211926_100000102702 [0,1,1,0,0,0|1,0,1]=4 3743 B12R0.4 CC(=O)CC(=O)OCCOCCN 34a_100000210304_100000102702 [0,1,1,0,0,0|1,0,1]=4 3744 B12R0.4 CC(=O)CC(=O)OCCSCCO 62a_100000102702_100000211926 [0,1,1,0,0,0|1,0,1]=4 3745 B12R0.4 CC(=O)CC(=O)OCCSCCO 62a_100000211926_100000102702 [0,1,1,0,0,0|1,0,1]=4 3746 B12R0.4 CC(C)CC(=O)CCCCCCF 1458a_100000210554_100015922095 [0,1,1,0,0,0|2,0,0]=4 3747 B12R0.4 CC(C)CC(=O)CCCCCCO 1458a_100000210554_100000766143 [0,1,1,0,0,0|1,0,0]=3 3748 B12R0.4 CC(C)CC(=O)CCCCCCO 1458a_100011996774_100000210624 [0,1,1,0,0,0|1,0,0]=3 3749 B12R0.4 CC(C)CC(=O)NCCCCCO 240690a_100000762737_100000210554 [0,1,1,0,0,0|1,0,0]=3 3750 B12R0.4 CC(C)CC(=O)NCCOCCO 240690a_100000211614_100000210554 [0,1,1,0,0,0|2,0,0]=4 3751 B12R0.4 CC(C)CC(=O)NCCSCCO 240690a_100011219999_100000210554 [0,1,1,0,0,0|2,0,0]=4 3752 B12R0.4 CC(C)CC(=O)NCCSCCO 527a_100011219999_100000210554 [0,1,1,0,0,0|2,0,0]=4 3753 B12R0.4 CC(C)CC(C)OCCCCCO 34a_100000211805_100000746330 [0,1,1,0,0,0|1,0,1]=4 3754 B12R0.4 CC(C)CC(C)OCCCCCO 7a_100000211805_100000746330 [0,1,1,0,0,0|1,0,1]=4 3755 B12R0.4 CC(C)NC(=O)CCCCCCO 240690a_100138425928_100011996774 [0,1,1,0,0,0|2,0,0]=4 3756 B12R0.4 CC(C)NC(=O)NCCCCCO 2708a_100138425928_100000762737 [0,1,1,0,0,0|2,0,0]=4 3757 B12R0.4 CC(C)NC(=O)NCCCCCO 273464a_100138425928_100000762737 [0,1,1,0,0,0|2,0,0]=4 3758 B12R0.4 CC(C)NC(=O)NCCCCCO 512a_100000762737_100138425928 [0,1,1,0,0,0|2,0,0]=4 3759 B12R0.4 CC(C)NC(=O)NCCCCCO 512a_100138425928_100000762737 [0,1,1,0,0,0|2,0,0]=4 3760 B12R0.4 CC(C)OC(=O)OCSCCCO 62a_100000003507_100011215043 [0,1,1,0,0,0|2,0,0]=4 3761 B12R0.4 CC(C)OC(=O)OCSCCCO 62a_100011215043_100000003507 [0,1,1,0,0,0|2,0,0]=4 3762 B12R0.4 CC(O)CC(=O)CCCCCCO 1458a_100011996774_100011218427 [0,1,1,0,0,0|1,0,0]=3 3763 B12R0.4 CCCCCCCC(=O)CC(C)C 1458a_100000210554_100000210614 [0,1,1,0,0,0|2,0,0]=4 3764 B12R0.4 CCCCCCCC(=O)CC(C)C 1458a_100000211969_100000210624 [0,1,1,0,0,0|2,0,0]=4 3765 B12R0.4 CCCCCCCC(=O)CC(C)O 1458a_100000211969_100011218427 [0,1,1,0,0,0|2,0,0]=4 3766 B12R0.4 CCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210614 [0,1,1,0,0,0|2,0,0]=4 3767 B12R0.4 CCCCCCNC(=O)CC(C)C 11a_100000210581_100000210554 [0,1,1,0,0,0|2,0,0]=4 3768 B12R0.4 CCCCCCNC(=O)CC(C)C 1626a_100000210581_100000210554 [0,1,1,0,0,0|2,0,0]=4 3769 B12R0.4 CCCCCCNC(=O)CC(C)C 240690a_100000210581_100000210554 [0,1,1,0,0,0|2,0,0]=4 3770 B12R0.4 CCCCCCNC(=O)CC(C)C 527a_100000210581_100000210554 [0,1,1,0,0,0|2,0,0]=4 3771 B12R0.4 CCCCCCNC(=O)C[C@@H](C)O 240690a_100000210581_100011933948 [0,1,1,0,0,0|2,0,0]=4 3772 B12R0.4 CCCOCCNC(=O)CC(C)C 1626a_100161115042_100000210554 [0,1,1,0,0,0|1,0,0]=3 3773 B12R0.4 CCCOCCNC(=O)CC(C)C 240690a_100161115042_100000210554 [0,1,1,0,0,0|1,0,0]=3 3774 B12R0.4 CCCOCCNC(=O)CC(C)C 527a_100161115042_100000210554 [0,1,1,0,0,0|1,0,0]=3 3775 B12R0.4 CCCOCCNC(=O)CN(C)C 240690a_100161115042_100000750896 [0,1,1,0,0,0|2,0,0]=4 3776 B12R0.4 CCCOCCNC(=O)CN(C)C 527a_100161115042_100000750896 [0,1,1,0,0,0|2,0,0]=4 3777 B12R0.4 CCCOCCNC(=O)C[C@@H](C)O 240690a_100161115042_100011933948 [0,1,1,0,0,0|1,0,0]=3 3778 B12R0.4 CCCOCCNC(=O)C[S+](C)C 1626a_100161115042_200159257847 [0,1,1,0,0,0|2,0,0]=4 3779 B12R0.4 CCCOCCNC(=O)C[S+](C)C 240690a_100161115042_200159257847 [0,1,1,0,0,0|2,0,0]=4 3780 B12R0.4 CCCOCCNC(=O)C[S+](C)C 527a_100161115042_200159257847 [0,1,1,0,0,0|2,0,0]=4 3781 B12R0.4 CCCOCCNC(=O)NC(C)C 2708a_100138425928_100161115042 [0,1,1,0,0,0|2,0,0]=4 3782 B12R0.4 CCCOCCNC(=O)NC(C)C 2708a_100161115042_100138425928 [0,1,1,0,0,0|2,0,0]=4 3783 B12R0.4 CCCOCCNC(=O)NC(C)C 273464a_100138425928_100161115042 [0,1,1,0,0,0|2,0,0]=4 3784 B12R0.4 CCCOCCNC(=O)NC(C)C 512a_100138425928_100161115042 [0,1,1,0,0,0|2,0,0]=4 3785 B12R0.4 CCCOCCNC(=O)NC(C)C 512a_100161115042_100138425928 [0,1,1,0,0,0|2,0,0]=4 3786 B12R0.4 CCCOCCOC(=O)CC(=O)C 34a_100000210258_100000102702 [0,1,1,0,0,0|0,0,1]=3 3787 B12R0.4 CCCOCCOC(C)CC(C)C 34a_100000211805_100011215938 [0,1,1,0,0,0|1,0,1]=4 3788 B12R0.4 CCCOCCOC(C)CC(C)C 34a_100000752267_100000731052 [0,1,1,0,0,0|1,0,1]=4 3789 B12R0.4 CCCOCCOC(C)CC(C)C 7a_100000211805_100011215938 [0,1,1,0,0,0|1,0,1]=4 3790 B12R0.4 CCCOCCOC(C)CC(C)C 7a_100000752267_100000731052 [0,1,1,0,0,0|1,0,1]=4 3791 B12R0.4 CCCSCCNC(=O)CC(C)C 11a_100020603323_100000210554 [0,1,1,0,0,0|1,1,0]=4 3792 B12R0.4 CCCSCCNC(=O)CC(C)C 240690a_100020603323_100000210554 [0,1,1,0,0,0|1,1,0]=4 3793 B12R0.4 CCCSCCNC(=O)CC(C)C 527a_100020603323_100000210554 [0,1,1,0,0,0|1,1,0]=4 3794 B12R0.4 CCCSCCNC(=O)C[C@@H](C)O 240690a_100020603323_100011933948 [0,1,1,0,0,0|1,1,0]=4 3795 B12R0.4 CCCSCCOC(=O)CC(=O)C 62a_100000102702_100000210303 [0,1,1,0,0,0|0,1,1]=4 3796 B12R0.4 CCCSCCOC(=O)CC(=O)C 62a_100000210303_100000102702 [0,1,1,0,0,0|0,1,1]=4 3797 B12R0.4 CN(C)CC(=O)CCCCCCO 1458a_100000750896_100000766143 [0,1,1,0,0,0|2,0,0]=4 3798 B12R0.4 CN(C)CC(=O)NCCCCCO 240690a_100000762737_100000750896 [0,1,1,0,0,0|2,0,0]=4 3799 B12R0.4 C[C@@H](O)CC(=O)CCCCCCF 1458a_100011933948_100015922095 [0,1,1,0,0,0|2,0,0]=4 3800 B12R0.4 C[C@@H](O)CC(=O)CCCCCCO 1458a_100011933948_100000766143 [0,1,1,0,0,0|1,0,0]=3 3801 B12R0.4 C[C@@H](O)CC(=O)NCCCCCO 240690a_100000762737_100011933948 [0,1,1,0,0,0|1,0,0]=3 3802 B12R0.4 C[C@@H](O)CC(=O)NCCOCCO 240690a_100000211614_100011933948 [0,1,1,0,0,0|2,0,0]=4 3803 B12R0.4 C[C@@H](O)CC(=O)NCCSCCO 240690a_100011219999_100011933948 [0,1,1,0,0,0|2,0,0]=4 3804 B12R0.4 C[S+](C)CC(=O)CCCCCCO 1458a_200159257847_100000766143 [0,1,1,0,0,0|2,0,0]=4 3805 B12R0.4 C[S+](C)CC(=O)NCCCCCO 240690a_100000762737_200159257847 [0,1,1,0,0,0|2,0,0]=4 3806 B12R0.4 O=C(CCCCCCO)CC(F)F 1458a_100011996774_100011934356 [0,1,1,0,0,0|2,0,0]=4 3807 B12R0.49 CCC(C)C(=O)CCCCCCF 1458a_100011192722_100015922095 [0,1,1,0,0,0|2,0,0]=4 3808 B12R0.49 CCC(C)C(=O)CCCCCCO 1458a_100011192722_100000766143 [0,1,1,0,0,0|1,0,0]=3 3809 B12R0.49 CCC(C)C(=O)CCCCCCO 1458a_100011996774_100000758301 [0,1,1,0,0,0|1,0,0]=3 3810 B12R0.49 CCC(C)C(=O)NCCCCCO 240690a_100000762737_100011192722 [0,1,1,0,0,0|1,0,0]=3 3811 B12R0.49 CCC(C)C(=O)NCCOCCO 240690a_100000211614_100011192722 [0,1,1,0,0,0|2,0,0]=4 3812 B12R0.49 CCC(C)C(=O)NCCSCCO 240690a_100011219999_100011192722 [0,1,1,0,0,0|2,0,0]=4 3813 B12R0.49 CCC(C)C(=O)NCCSCCO 527a_100011219999_100011192722 [0,1,1,0,0,0|2,0,0]=4 3814 B12R0.49 CCC(C)C(C)OCCCCCO 7a_100011215189_100000746330 [0,1,1,0,0,0|1,0,1]=4 3815 B12R0.49 CCC(O)C(=O)CCCCCCF 1458a_100011196387_100015922095 [0,1,1,0,0,0|2,0,0]=4 3816 B12R0.49 CCC(O)C(=O)CCCCCCO 1458a_100011196387_100000766143 [0,1,1,0,0,0|1,0,0]=3 3817 B12R0.49 CCC(O)C(=O)NCCCCCO 240690a_100000762737_100011196387 [0,1,1,0,0,0|1,0,0]=3 3818 B12R0.49 CCC(O)C(=O)NCCOCCO 240690a_100000211614_100011196387 [0,1,1,0,0,0|2,0,0]=4 3819 B12R0.49 CCC(O)C(=O)NCCSCCO 240690a_100011219999_100011196387 [0,1,1,0,0,0|2,0,0]=4 3820 B12R0.49 CCCCCCCC(=O)C(C)CC 1458a_100000211969_100000758301 [0,1,1,0,0,0|2,0,0]=4 3821 B12R0.49 CCCCCCCC(=O)C(C)CC 1458a_100011192722_100000210614 [0,1,1,0,0,0|2,0,0]=4 3822 B12R0.49 CCCCCCCC(=O)C(O)CC 1458a_100011196387_100000210614 [0,1,1,0,0,0|2,0,0]=4 3823 B12R0.49 CCCCCCNC(=O)C(C)CC 11a_100000210581_100011192722 [0,1,1,0,0,0|2,0,0]=4 3824 B12R0.49 CCCCCCNC(=O)C(C)CC 1626a_100000210581_100011192722 [0,1,1,0,0,0|2,0,0]=4 3825 B12R0.49 CCCCCCNC(=O)C(C)CC 240690a_100000210581_100011192722 [0,1,1,0,0,0|2,0,0]=4 3826 B12R0.49 CCCCCCNC(=O)C(C)CC 527a_100000210581_100011192722 [0,1,1,0,0,0|2,0,0]=4 3827 B12R0.49 CCCCCCNC(=O)C(O)CC 240690a_100000210581_100011196387 [0,1,1,0,0,0|2,0,0]=4 3828 B12R0.49 CCCOCCNC(=O)C(C)CC 1626a_100161115042_100011192722 [0,1,1,0,0,0|1,0,0]=3 3829 B12R0.49 CCCOCCNC(=O)C(C)CC 240690a_100161115042_100011192722 [0,1,1,0,0,0|1,0,0]=3 3830 B12R0.49 CCCOCCNC(=O)C(C)CC 527a_100161115042_100011192722 [0,1,1,0,0,0|1,0,0]=3 3831 B12R0.49 CCCOCCNC(=O)C(C)OC 1626a_100161115042_100000743197 [0,1,1,0,0,0|2,0,0]=4 3832 B12R0.49 CCCOCCNC(=O)C(C)OC 240690a_100161115042_100000743197 [0,1,1,0,0,0|2,0,0]=4 3833 B12R0.49 CCCOCCNC(=O)C(C)OC 527a_100161115042_100000743197 [0,1,1,0,0,0|2,0,0]=4 3834 B12R0.49 CCCOCCNC(=O)C(C)SC 1626a_100161115042_100000149566 [0,1,1,0,0,0|2,0,0]=4 3835 B12R0.49 CCCOCCNC(=O)C(C)SC 240690a_100161115042_100000149566 [0,1,1,0,0,0|2,0,0]=4 3836 B12R0.49 CCCOCCNC(=O)C(C)SC 527a_100161115042_100000149566 [0,1,1,0,0,0|2,0,0]=4 3837 B12R0.49 CCCOCCNC(=O)C(O)CC 240690a_100161115042_100011196387 [0,1,1,0,0,0|1,0,0]=3 3838 B12R0.49 CCCOCCNC(=O)C(O)CO 240690a_100161115042_100011215603 [0,1,1,0,0,0|2,0,0]=4 3839 B12R0.49 CCCOCCNC(=O)N(C)CC 2708a_100161115042_100000225621 [0,1,1,0,0,0|2,0,0]=4 3840 B12R0.49 CCCOCCNC(=O)N(C)CC 273464a_100161115042_100000225621 [0,1,1,0,0,0|2,0,0]=4 3841 B12R0.49 CCCOCCOC(C)C(C)CC 7a_100011215189_100011215938 [0,1,1,0,0,0|1,0,1]=4 3842 B12R0.49 CCCSCCNC(=O)C(C)CC 11a_100020603323_100011192722 [0,1,1,0,0,0|1,1,0]=4 3843 B12R0.49 CCCSCCNC(=O)C(C)CC 240690a_100020603323_100011192722 [0,1,1,0,0,0|1,1,0]=4 3844 B12R0.49 CCCSCCNC(=O)C(C)CC 527a_100020603323_100011192722 [0,1,1,0,0,0|1,1,0]=4 3845 B12R0.49 CCCSCCNC(=O)C(O)CC 240690a_100020603323_100011196387 [0,1,1,0,0,0|1,1,0]=4 3846 B12R0.49 CCN(C)C(=O)CCCCCCO 240690a_100000225621_100011996774 [0,1,1,0,0,0|2,0,0]=4 3847 B12R0.49 CCN(C)C(=O)NCCCCCO 273464a_100000762737_100000225621 [0,1,1,0,0,0|2,0,0]=4 3848 B12R0.49 COC(C)C(=O)CCCCCCO 1458a_100000743197_100000766143 [0,1,1,0,0,0|2,0,0]=4 3849 B12R0.49 COC(C)C(=O)NCCCCCO 240690a_100000762737_100000743197 [0,1,1,0,0,0|2,0,0]=4 3850 B12R0.49 CSC(C)C(=O)CCCCCCO 1458a_100000149566_100000766143 [0,1,1,0,0,0|2,0,0]=4 3851 B12R0.49 CSC(C)C(=O)NCCCCCO 240690a_100000762737_100000149566 [0,1,1,0,0,0|2,0,0]=4 3852 B12R0.49 O=C(CCCCCCO)C(O)CO 1458a_100011215603_100000766143 [0,1,1,0,0,0|2,0,0]=4 3853 B12R0.49 O=C(NCCCCCO)C(O)CO 240690a_100000762737_100011215603 [0,1,1,0,0,0|2,0,0]=4 3854 B12R0.101 CCCC(=O)NC[C@H](C)CCCO 240690a_100160569302_100000211992 [0,1,1,0,0,0|1,0,0]=3 3855 B12R0.101 CCCC(=O)NC[C@H](C)CCCO 527a_100160569302_100000211992 [0,1,1,0,0,0|1,0,0]=3 3856 B12R0.101 CCCC(=O)OCN(C)CCCO 2230a_100000213112_100000034017 [0,1,1,0,0,0|1,0,0]=3 3857 B12R0.101 CCCC(=O)OCN(C)CCCO 269982a_100000213112_100000034017 [0,1,1,0,0,0|1,0,0]=3 3858 B12R0.101 CCCCC(=O)COC(=O)CCC 1458a_100000210183_100000034017 [0,1,1,0,0,0|1,0,1]=4 3859 B12R0.101 CCCCC(C)CCC(=O)CCC 1458a_100000033779_100000210303 [0,1,1,0,0,0|2,0,0]=4 3860 B12R0.101 CCCCN(C)COC(=O)CCC 2230a_100000207549_100000034017 [0,1,1,0,0,0|2,0,0]=4 3861 B12R0.101 CCCCN(C)COC(=O)CCC 269982a_100000207549_100000034017 [0,1,1,0,0,0|2,0,0]=4 3862 B12R0.101 CCCOC(C)CCC(=O)OCC 34a_100000210258_100000748298 [0,1,1,0,0,0|2,0,0]=4 3863 B12R0.101 CCCOC(C)CNC(=O)CCC 11a_100015185124_100000211992 [0,1,1,0,0,0|1,0,0]=3 3864 B12R0.101 CCCOC(C)CNC(=O)CCC 1626a_100015185124_100000211992 [0,1,1,0,0,0|1,0,0]=3 3865 B12R0.101 CCCOC(C)CNC(=O)CCC 240690a_100015185124_100000211992 [0,1,1,0,0,0|1,0,0]=3 3866 B12R0.101 CCCOC(C)CNC(=O)CCC 527a_100015185124_100000211992 [0,1,1,0,0,0|1,0,0]=3 3867 B12R0.101 CCCOC(C)CNC(=O)CCO 240690a_100015185124_100011216618 [0,1,1,0,0,0|2,0,0]=4 3868 B12R0.101 CCCOC(C)CNC(=O)COC 11a_100015185124_100000210968 [0,1,1,0,0,0|2,0,0]=4 3869 B12R0.101 CCCOC(C)CNC(=O)COC 1626a_100015185124_100000210968 [0,1,1,0,0,0|2,0,0]=4 3870 B12R0.101 CCCOC(C)CNC(=O)COC 240690a_100015185124_100000210968 [0,1,1,0,0,0|2,0,0]=4 3871 B12R0.101 CCCOC(C)CNC(=O)COC 527a_100015185124_100000210968 [0,1,1,0,0,0|2,0,0]=4 3872 B12R0.101 CCCOC(C)CNC(=O)CSC 11a_100015185124_100000184570 [0,1,1,0,0,0|2,0,0]=4 3873 B12R0.101 CCCOC(C)CNC(=O)CSC 1626a_100015185124_100000184570 [0,1,1,0,0,0|2,0,0]=4 3874 B12R0.101 CCCOC(C)CNC(=O)CSC 240690a_100015185124_100000184570 [0,1,1,0,0,0|2,0,0]=4 3875 B12R0.101 CCCOC(C)CNC(=O)CSC 527a_100015185124_100000184570 [0,1,1,0,0,0|2,0,0]=4 3876 B12R0.101 CCCOC(C)CNC(=O)NCC 2708a_100015185124_100015525214 [0,1,1,0,0,0|2,0,0]=4 3877 B12R0.101 CCCOC(C)CNC(=O)NCC 2708a_100015525214_100015185124 [0,1,1,0,0,0|2,0,0]=4 3878 B12R0.101 CCCOC(C)CNC(=O)NCC 273464a_100015185124_100015525214 [0,1,1,0,0,0|2,0,0]=4 3879 B12R0.101 CCCOC(C)CNC(=O)NCC 273464a_100015525214_100015185124 [0,1,1,0,0,0|2,0,0]=4 3880 B12R0.101 CCCOC(C)CNC(=O)NCC 512a_100015185124_100015525214 [0,1,1,0,0,0|2,0,0]=4 3881 B12R0.101 CCCOC(C)CNC(=O)NCC 512a_100015525214_100015185124 [0,1,1,0,0,0|2,0,0]=4 3882 B12R0.101 CCNC(=O)NC[C@H](C)CCCO 2708a_100015525214_100160569302 [0,1,1,0,0,0|2,0,0]=4 3883 B12R0.101 CCNC(=O)NC[C@H](C)CCCO 273464a_100015525214_100160569302 [0,1,1,0,0,0|2,0,0]=4 3884 B12R0.101 CCNC(=O)NC[C@H](C)CCCO 273464a_100160569302_100015525214 [0,1,1,0,0,0|2,0,0]=4 3885 B12R0.101 CCNC(=O)NC[C@H](C)CCCO 512a_100015525214_100160569302 [0,1,1,0,0,0|2,0,0]=4 3886 B12R0.101 CCNC(=O)NC[C@H](C)CCCO 512a_100160569302_100015525214 [0,1,1,0,0,0|2,0,0]=4 3887 B12R0.101 COCC(=O)NC[C@H](C)CCCO 240690a_100160569302_100000210968 [0,1,1,0,0,0|2,0,0]=4 3888 B12R0.101 COCC(=O)NC[C@H](C)CCCO 527a_100160569302_100000210968 [0,1,1,0,0,0|2,0,0]=4 3889 B12R0.101 CSCC(=O)NC[C@H](C)CCCO 240690a_100160569302_100000184570 [0,1,1,0,0,0|2,0,0]=4 3890 B12R0.101 CSCC(=O)NC[C@H](C)CCCO 527a_100160569302_100000184570 [0,1,1,0,0,0|2,0,0]=4 3891 B12R0.101 C[C@H](CCCO)CNC(=O)CCO 240690a_100160569302_100011216618 [0,1,1,0,0,0|2,0,0]=4 3892 B12R0.114 CCCC(=O)N(C)CCCCCO 240690a_100000722520_100000211992 [0,1,1,0,0,0|1,0,0]=3 3893 B12R0.114 CCCC(=O)N(C)CCOCCO 240690a_100000228057_100000211992 [0,1,1,0,0,0|2,0,0]=4 3894 B12R0.114 CCCCCCC(C)C(=O)CCC 1458a_100000211992_100011215978 [0,1,1,0,0,0|2,0,0]=4 3895 B12R0.114 CCCCCCC(O)C(=O)CCC 1458a_100011215828_100000210303 [0,1,1,0,0,0|2,0,0]=4 3896 B12R0.114 CCCCCCN(C)C(=O)CCC 11a_106256046315_100000211992 [0,1,1,0,0,0|2,0,0]=4 3897 B12R0.114 CCCCCCN(C)C(=O)CCC 1626a_106256046315_100000211992 [0,1,1,0,0,0|2,0,0]=4 3898 B12R0.114 CCCCCCN(C)C(=O)CCC 240690a_106256046315_100000211992 [0,1,1,0,0,0|2,0,0]=4 3899 B12R0.114 CCCCCCN(C)C(=O)CCC 527a_106256046315_100000211992 [0,1,1,0,0,0|2,0,0]=4 3900 B12R0.114 CCCOCCC(=O)C(=O)NCC 1458a_200011297158_100011215938 [0,1,1,0,0,0|2,0,0]=4 3901 B12R0.114 CCNC(=O)C(=O)CCCCCO 1458a_200011297158_100000746330 [0,1,1,0,0,0|2,0,0]=4 3902 B12R0.114 CCNC(=O)N(C)CCCCCO 2708a_100015525214_100000722520 [0,1,1,0,0,0|2,0,0]=4 3903 B12R0.114 CCNC(=O)N(C)CCCCCO 273464a_100015525214_100000722520 [0,1,1,0,0,0|2,0,0]=4 3904 B12R0.114 CN(CCCCCO)C(=O)CCO 240690a_100000722520_100011216618 [0,1,1,0,0,0|2,0,0]=4 3905 B12R0.114 COCC(=O)N(C)CCCCCO 240690a_100000722520_100000210968 [0,1,1,0,0,0|2,0,0]=4 3906 B12R0.114 CSCC(=O)N(C)CCCCCO 240690a_100000722520_100000184570 [0,1,1,0,0,0|2,0,0]=4 3907 B12R0.121 C#CC(CCC)OCCCCCO 34a_200011217317_100000746330 [0,1,1,0,0,0|1,0,1]=4 3908 B12R0.121 C#CC(CCC)OCCCCCO 7a_200011217317_100000746330 [0,1,1,0,0,0|1,0,1]=4 3909 B12R0.121 C#CC(CCC)OCCOCCC 34a_200011217317_100011215938 [0,1,1,0,0,0|1,0,1]=4 3910 B12R0.121 C#CC(CCC)OCCOCCC 7a_200011217317_100011215938 [0,1,1,0,0,0|1,0,1]=4 3911 B12R0.121 C=CC(CCC)OCCCCCO 34a_100011216692_100000746330 [0,1,1,0,0,0|1,0,1]=4 3912 B12R0.121 C=CC(CCC)OCCCCCO 7a_100011216692_100000746330 [0,1,1,0,0,0|1,0,1]=4 3913 B12R0.121 C=CC(CCC)OCCOCCC 34a_100011216692_100011215938 [0,1,1,0,0,0|1,0,1]=4 3914 B12R0.121 C=CC(CCC)OCCOCCC 7a_100011216692_100011215938 [0,1,1,0,0,0|1,0,1]=4 3915 B12R0.121 CCCC(C#N)OCCCCCO 34a_100000686963_100000746330 [0,1,1,0,0,0|1,0,1]=4 3916 B12R0.121 CCCC(C#N)OCCCCCO 7a_100000686963_100000746330 [0,1,1,0,0,0|1,0,1]=4 3917 B12R0.121 CCCC(CC)OCCCCCO 34a_100000687864_100000746330 [0,1,1,0,0,0|1,0,1]=4 3918 B12R0.121 CCCC(CC)OCCCCCO 7a_100000687864_100000746330 [0,1,1,0,0,0|1,0,1]=4 3919 B12R0.121 CCCOCCOC(C#N)CCC 34a_100000686963_100011215938 [0,1,1,0,0,0|1,0,1]=4 3920 B12R0.121 CCCOCCOC(C#N)CCC 7a_100000686963_100011215938 [0,1,1,0,0,0|1,0,1]=4 3921 B12R0.121 CCCOCCOC(CC)CCC 34a_100000687864_100011215938 [0,1,1,0,0,0|1,0,1]=4 3922 B12R0.121 CCCOCCOC(CC)CCC 7a_100000687864_100011215938 [0,1,1,0,0,0|1,0,1]=4 3923 B12R0.121 CCCOCCOC(CC)CCC 7a_100000752267_100011219200 [0,1,1,0,0,0|1,0,1]=4 3924 B12R0.206 C#CCCC(=O)CCCCCCO 1458a_100000692101_100000766143 [0,1,1,0,0,0|1,0,1]=4 3925 B12R0.206 C#CCCC(=O)CCCCCCO 1458a_100011996774_100000753159 [0,1,1,0,0,0|1,0,1]=4 3926 B12R0.206 C#CCCC(=O)NCCCCCO 240690a_100000762737_100000692101 [0,1,1,0,0,0|1,0,1]=4 3927 B12R0.206 C#CCCC(=O)NCCOCCC 1626a_100161115042_100000692101 [0,1,1,0,0,0|1,0,1]=4 3928 B12R0.206 C#CCCC(=O)NCCOCCC 240690a_100161115042_100000692101 [0,1,1,0,0,0|1,0,1]=4 3929 B12R0.206 C#CCCC(=O)NCCOCCC 527a_100161115042_100000692101 [0,1,1,0,0,0|1,0,1]=4 3930 B12R0.206 C/C=C/CC(=O)CCCCCCO 1458a_100011996774_100102629194 [0,1,1,0,0,0|1,0,1]=4 3931 B12R0.206 C=CCCC(=O)CCCCCCO 1458a_100000749702_100000766143 [0,1,1,0,0,0|1,0,1]=4 3932 B12R0.206 C=CCCC(=O)CCCCCCO 1458a_100011996774_100000754431 [0,1,1,0,0,0|1,0,1]=4 3933 B12R0.206 C=CCCC(=O)NCCCCCO 240690a_100000762737_100000749702 [0,1,1,0,0,0|1,0,1]=4 3934 B12R0.206 C=CCCC(=O)NCCOCCC 1626a_100161115042_100000749702 [0,1,1,0,0,0|1,0,1]=4 3935 B12R0.206 C=CCCC(=O)NCCOCCC 240690a_100161115042_100000749702 [0,1,1,0,0,0|1,0,1]=4 3936 B12R0.206 C=CCCC(=O)NCCOCCC 527a_100161115042_100000749702 [0,1,1,0,0,0|1,0,1]=4 3937 B12R0.206 CC#CCC(=O)CCCCCCO 1458a_100011996774_100000748600 [0,1,1,0,0,0|1,0,1]=4 3938 B12R0.206 CC(CCCCl)OCCCCCO 34a_200000718107_100000746330 [0,1,1,0,0,0|1,0,1]=4 3939 B12R0.206 CC(CCCCl)OCCCCCO 7a_200000718107_100000746330 [0,1,1,0,0,0|1,0,1]=4 3940 B12R0.206 CC=CCC(=O)CCCCCCO 1458a_100011996774_100000070051 [0,1,1,0,0,0|1,0,1]=4 3941 B12R0.206 CC=CCC(=O)CCCCCCO 1458a_100121576822_100000766143 [0,1,1,0,0,0|1,0,1]=4 3942 B12R0.206 CC=CCC(=O)NCCCCCO 240690a_100000762737_100121576822 [0,1,1,0,0,0|1,0,1]=4 3943 B12R0.206 CC=CCC(=O)NCCOCCC 1626a_100161115042_100121576822 [0,1,1,0,0,0|1,0,1]=4 3944 B12R0.206 CC=CCC(=O)NCCOCCC 240690a_100161115042_100121576822 [0,1,1,0,0,0|1,0,1]=4 3945 B12R0.206 CC=CCC(=O)NCCOCCC 527a_100161115042_100121576822 [0,1,1,0,0,0|1,0,1]=4 3946 B12R0.206 CCC#CC(=O)CCCCCCO 1458a_100011827653_100000766143 [0,1,1,0,0,0|1,0,1]=4 3947 B12R0.206 CCC=CC(=O)CCCCCCO 1458a_100000212282_100000766143 [0,1,1,0,0,0|1,0,1]=4 3948 B12R0.206 CCC=CC(=O)NCCCCCO 240690a_100000762737_100000212282 [0,1,1,0,0,0|1,0,1]=4 3949 B12R0.206 CCC=CC(=O)NCCOCCC 1626a_100161115042_100000212282 [0,1,1,0,0,0|1,0,1]=4 3950 B12R0.206 CCC=CC(=O)NCCOCCC 240690a_100161115042_100000212282 [0,1,1,0,0,0|1,0,1]=4 3951 B12R0.206 CCCCC(=O)CCCCCCF 1458a_100000210183_100015922095 [0,1,1,0,0,0|2,0,0]=4 3952 B12R0.206 CCCCC(=O)CCCCCCO 1458a_100000210183_100000766143 [0,1,1,0,0,0|1,0,0]=3 3953 B12R0.206 CCCCC(=O)CCCCCCO 1458a_100011996774_100000210211 [0,1,1,0,0,0|1,0,0]=3 3954 B12R0.206 CCCCC(=O)NCCCCCO 240690a_100000762737_100000210183 [0,1,1,0,0,0|1,0,0]=3 3955 B12R0.206 CCCCC(=O)NCCOCCC 1626a_100161115042_100000210183 [0,1,1,0,0,0|1,0,0]=3 3956 B12R0.206 CCCCC(=O)NCCOCCC 240690a_100161115042_100000210183 [0,1,1,0,0,0|1,0,0]=3 3957 B12R0.206 CCCCC(=O)NCCOCCC 527a_100161115042_100000210183 [0,1,1,0,0,0|1,0,0]=3 3958 B12R0.206 CCCCC(=O)NCCOCCO 240690a_100000211614_100000210183 [0,1,1,0,0,0|2,0,0]=4 3959 B12R0.206 CCCCC(=O)NCCSCCC 11a_100020603323_100000210183 [0,1,1,0,0,0|1,1,0]=4 3960 B12R0.206 CCCCC(=O)NCCSCCC 240690a_100020603323_100000210183 [0,1,1,0,0,0|1,1,0]=4 3961 B12R0.206 CCCCC(=O)NCCSCCC 527a_100020603323_100000210183 [0,1,1,0,0,0|1,1,0]=4 3962 B12R0.206 CCCCC(=O)NCCSCCO 240690a_100011219999_100000210183 [0,1,1,0,0,0|2,0,0]=4 3963 B12R0.206 CCCCC(=O)NCCSCCO 527a_100011219999_100000210183 [0,1,1,0,0,0|2,0,0]=4 3964 B12R0.206 CCCCC(C)OCCCCCO 34a_100000687866_100000746330 [0,1,1,0,0,0|1,0,1]=4 3965 B12R0.206 CCCCC(C)OCCCCCO 7a_100000687866_100000746330 [0,1,1,0,0,0|1,0,1]=4 3966 B12R0.206 CCCCC(C)OCCOCCC 34a_100000687866_100011215938 [0,1,1,0,0,0|1,0,1]=4 3967 B12R0.206 CCCCC(C)OCCOCCC 34a_100000752267_200011215066 [0,1,1,0,0,0|1,0,1]=4 3968 B12R0.206 CCCCC(C)OCCOCCC 7a_100000687866_100011215938 [0,1,1,0,0,0|1,0,1]=4 3969 B12R0.206 CCCCC(C)OCCOCCC 7a_100000752267_200011215066 [0,1,1,0,0,0|1,0,1]=4 3970 B12R0.206 CCCCCCCC(=O)CCCC 1458a_100000210183_100000210614 [0,1,1,0,0,0|2,0,0]=4 3971 B12R0.206 CCCCCCCC(=O)CCCC 1458a_100000211969_100000210211 [0,1,1,0,0,0|2,0,0]=4 3972 B12R0.206 CCCCCCCC(=O)CCCF 1458a_100000211969_100011934791 [0,1,1,0,0,0|2,0,0]=4 3973 B12R0.206 CCCCCCCC(=O)CCCO 1458a_100000211969_100011215043 [0,1,1,0,0,0|2,0,0]=4 3974 B12R0.206 CCCCCCCC(=O)CCOC 1458a_100000211969_100000233755 [0,1,1,0,0,0|2,0,0]=4 3975 B12R0.206 CCCCCCCC(=O)CCOC 1458a_100000749529_100000210614 [0,1,1,0,0,0|2,0,0]=4 3976 B12R0.206 CCCCCCCC(=O)CCSC 1458a_100000174002_100000210614 [0,1,1,0,0,0|2,0,0]=4 3977 B12R0.206 CCCCCCCC(=O)CCSC 1458a_100000211969_100000751147 [0,1,1,0,0,0|2,0,0]=4 3978 B12R0.206 CCCCCCCC(=O)COCC 1458a_100000211967_100000210614 [0,1,1,0,0,0|2,0,0]=4 3979 B12R0.206 CCCCCCCC(=O)CSCC 1458a_100000230394_100000210614 [0,1,1,0,0,0|2,0,0]=4 3980 B12R0.206 CCCCCCCC(=O)NCCC 11a_100020643023_100000211969 [0,1,1,0,0,0|2,0,0]=4 3981 B12R0.206 CCCCCCCC(=O)NCCC 1626a_100020643023_100000211969 [0,1,1,0,0,0|2,0,0]=4 3982 B12R0.206 CCCCCCCC(=O)NCCC 240690a_100020643023_100000211969 [0,1,1,0,0,0|2,0,0]=4 3983 B12R0.206 CCCCCCCC(=O)NCCC 527a_100020643023_100000211969 [0,1,1,0,0,0|2,0,0]=4 3984 B12R0.206 CCCCCCNC(=O)CCCC 11a_100000210581_100000210183 [0,1,1,0,0,0|2,0,0]=4 3985 B12R0.206 CCCCCCNC(=O)CCCC 1626a_100000210581_100000210183 [0,1,1,0,0,0|2,0,0]=4 3986 B12R0.206 CCCCCCNC(=O)CCCC 240690a_100000210581_100000210183 [0,1,1,0,0,0|2,0,0]=4 3987 B12R0.206 CCCCCCNC(=O)CCCC 527a_100000210581_100000210183 [0,1,1,0,0,0|2,0,0]=4 3988 B12R0.206 CCCCCCNC(=O)CCOC 11a_100000210581_100000749529 [0,1,1,0,0,0|2,0,0]=4 3989 B12R0.206 CCCCCCNC(=O)CCOC 1626a_100000210581_100000749529 [0,1,1,0,0,0|2,0,0]=4 3990 B12R0.206 CCCCCCNC(=O)CCOC 240690a_100000210581_100000749529 [0,1,1,0,0,0|2,0,0]=4 3991 B12R0.206 CCCCCCNC(=O)CCOC 527a_100000210581_100000749529 [0,1,1,0,0,0|2,0,0]=4 3992 B12R0.206 CCCCCCNC(=O)CCSC 11a_100000210581_100000174002 [0,1,1,0,0,0|2,0,0]=4 3993 B12R0.206 CCCCCCNC(=O)CCSC 1626a_100000210581_100000174002 [0,1,1,0,0,0|2,0,0]=4 3994 B12R0.206 CCCCCCNC(=O)CCSC 240690a_100000210581_100000174002 [0,1,1,0,0,0|2,0,0]=4 3995 B12R0.206 CCCCCCNC(=O)CCSC 527a_100000210581_100000174002 [0,1,1,0,0,0|2,0,0]=4 3996 B12R0.206 CCCCCCNC(=O)CNCC 2230a_100015525214_100000230325 [0,1,1,0,0,0|2,0,0]=4 3997 B12R0.206 CCCCCCNC(=O)COCC 11a_100000210581_100000211967 [0,1,1,0,0,0|2,0,0]=4 3998 B12R0.206 CCCCCCNC(=O)COCC 1626a_100000210581_100000211967 [0,1,1,0,0,0|2,0,0]=4 3999 B12R0.206 CCCCCCNC(=O)COCC 240690a_100000210581_100000211967 [0,1,1,0,0,0|2,0,0]=4 4000 B12R0.206 CCCCCCNC(=O)COCC 34a_100121572206_100000230325 [0,1,1,0,0,0|2,0,0]=4 4001 B12R0.206 CCCCCCNC(=O)COCC 527a_100000210581_100000211967 [0,1,1,0,0,0|2,0,0]=4 4002 B12R0.206 CCCCCCNC(=O)CSCC 11a_100000210581_100000230394 [0,1,1,0,0,0|2,0,0]=4 4003 B12R0.206 CCCCCCNC(=O)CSCC 1626a_100000210581_100000230394 [0,1,1,0,0,0|2,0,0]=4 4004 B12R0.206 CCCCCCNC(=O)CSCC 240690a_100000210581_100000230394 [0,1,1,0,0,0|2,0,0]=4 4005 B12R0.206 CCCCCCNC(=O)CSCC 527a_100000210581_100000230394 [0,1,1,0,0,0|2,0,0]=4 4006 B12R0.206 CCCCCCNC(=O)CSCC 62a_100000230325_100000210202 [0,1,1,0,0,0|2,0,0]=4 4007 B12R0.206 CCCCCCNC(=O)NCCC 2708a_100000210581_100020643023 [0,1,1,0,0,0|2,0,0]=4 4008 B12R0.206 CCCCCCNC(=O)NCCC 2708a_100020643023_100000210581 [0,1,1,0,0,0|2,0,0]=4 4009 B12R0.206 CCCCCCNC(=O)NCCC 273464a_100000210581_100020643023 [0,1,1,0,0,0|2,0,0]=4 4010 B12R0.206 CCCCCCNC(=O)NCCC 273464a_100020643023_100000210581 [0,1,1,0,0,0|2,0,0]=4 4011 B12R0.206 CCCCCCNC(=O)NCCC 512a_100000210581_100020643023 [0,1,1,0,0,0|2,0,0]=4 4012 B12R0.206 CCCCCCNC(=O)NCCC 512a_100020643023_100000210581 [0,1,1,0,0,0|2,0,0]=4 4013 B12R0.206 CCCCNCOC(=O)OCCC 7a_106832991798_200000139673 [0,1,1,0,0,0|2,0,0]=4 4014 B12R0.206 CCCCOCOC(=O)OCCC 34a_100000210227_200000139673 [0,1,1,0,0,0|2,0,0]=4 4015 B12R0.206 CCCCOCOC(=O)OCCC 7a_100000210227_200000139673 [0,1,1,0,0,0|2,0,0]=4 4016 B12R0.206 CCCCSCOC(=O)OCCC 62a_100000210211_200000139673 [0,1,1,0,0,0|2,0,0]=4 4017 B12R0.206 CCCNC(=O)CCCCCCO 240690a_100020643023_100011996774 [0,1,1,0,0,0|1,0,0]=3 4018 B12R0.206 CCCNC(=O)CCCNCCO 2230a_100016997473_100011194427 [0,1,1,0,0,0|2,0,0]=4 4019 B12R0.206 CCCNC(=O)CCCSCCC 62a_100000210303_100011194427 [0,1,1,0,0,0|1,1,0]=4 4020 B12R0.206 CCCNC(=O)CCCSCCC 62a_100011194427_100000210303 [0,1,1,0,0,0|1,1,0]=4 4021 B12R0.206 CCCNC(=O)CCCSCCO 62a_100000211926_100011194427 [0,1,1,0,0,0|2,0,0]=4 4022 B12R0.206 CCCNC(=O)CCCSCCO 62a_100011194427_100000211926 [0,1,1,0,0,0|2,0,0]=4 4023 B12R0.206 CCCNC(=O)CNCCCCO 2230a_100000174927_100000210776 [0,1,1,0,0,0|2,0,0]=4 4024 B12R0.206 CCCNC(=O)CNCCCCO 2230a_100000750430_100000183358 [0,1,1,0,0,0|2,0,0]=4 4025 B12R0.206 CCCNC(=O)CNCCCCO 34a_100000750430_100000183358 [0,1,1,0,0,0|2,0,0]=4 4026 B12R0.206 CCCNC(=O)CSCCCCO 62a_100000183358_100000210776 [0,1,1,0,0,0|2,0,0]=4 4027 B12R0.206 CCCNC(=O)CSCCCCO 62a_100000210776_100000183358 [0,1,1,0,0,0|2,0,0]=4 4028 B12R0.206 CCCNC(=O)NCCCCCO 2708a_100020643023_100000762737 [0,1,1,0,0,0|1,0,0]=3 4029 B12R0.206 CCCNC(=O)NCCCCCO 273464a_100000762737_100020643023 [0,1,1,0,0,0|1,0,0]=3 4030 B12R0.206 CCCNC(=O)NCCCCCO 273464a_100020643023_100000762737 [0,1,1,0,0,0|1,0,0]=3 4031 B12R0.206 CCCNC(=O)NCCCCCO 512a_100000762737_100020643023 [0,1,1,0,0,0|1,0,0]=3 4032 B12R0.206 CCCNC(=O)NCCCCCO 512a_100020643023_100000762737 [0,1,1,0,0,0|1,0,0]=3 4033 B12R0.206 CCCNC(=O)NCCOCCC 2708a_100020643023_100161115042 [0,1,1,0,0,0|1,0,0]=3 4034 B12R0.206 CCCNC(=O)NCCOCCC 2708a_100161115042_100020643023 [0,1,1,0,0,0|1,0,0]=3 4035 B12R0.206 CCCNC(=O)NCCOCCC 273464a_100020643023_100161115042 [0,1,1,0,0,0|1,0,0]=3 4036 B12R0.206 CCCNC(=O)NCCOCCC 273464a_100161115042_100020643023 [0,1,1,0,0,0|1,0,0]=3 4037 B12R0.206 CCCNC(=O)NCCOCCC 512a_100020643023_100161115042 [0,1,1,0,0,0|1,0,0]=3 4038 B12R0.206 CCCNC(=O)NCCOCCC 512a_100161115042_100020643023 [0,1,1,0,0,0|1,0,0]=3 4039 B12R0.206 CCCNC(=O)NCCOCCO 2708a_100020643023_100000211614 [0,1,1,0,0,0|2,0,0]=4 4040 B12R0.206 CCCNC(=O)NCCOCCO 273464a_100000211614_100020643023 [0,1,1,0,0,0|2,0,0]=4 4041 B12R0.206 CCCNC(=O)NCCOCCO 273464a_100020643023_100000211614 [0,1,1,0,0,0|2,0,0]=4 4042 B12R0.206 CCCNC(=O)NCCOCCO 512a_100000211614_100020643023 [0,1,1,0,0,0|2,0,0]=4 4043 B12R0.206 CCCNC(=O)NCCSCCC 2708a_100020603323_100020643023 [0,1,1,0,0,0|1,1,0]=4 4044 B12R0.206 CCCNC(=O)NCCSCCC 2708a_100020643023_100020603323 [0,1,1,0,0,0|1,1,0]=4 4045 B12R0.206 CCCNC(=O)NCCSCCC 273464a_100020603323_100020643023 [0,1,1,0,0,0|1,1,0]=4 4046 B12R0.206 CCCNC(=O)NCCSCCC 273464a_100020643023_100020603323 [0,1,1,0,0,0|1,1,0]=4 4047 B12R0.206 CCCNC(=O)NCCSCCC 512a_100020603323_100020643023 [0,1,1,0,0,0|1,1,0]=4 4048 B12R0.206 CCCNC(=O)NCCSCCC 512a_100020643023_100020603323 [0,1,1,0,0,0|1,1,0]=4 4049 B12R0.206 CCCNC(=O)NCCSCCO 2708a_100020643023_100011219999 [0,1,1,0,0,0|2,0,0]=4 4050 B12R0.206 CCCNC(=O)NCCSCCO 273464a_100011219999_100020643023 [0,1,1,0,0,0|2,0,0]=4 4051 B12R0.206 CCCNC(=O)NCCSCCO 273464a_100020643023_100011219999 [0,1,1,0,0,0|2,0,0]=4 4052 B12R0.206 CCCNC(=O)NCCSCCO 512a_100011219999_100020643023 [0,1,1,0,0,0|2,0,0]=4 4053 B12R0.206 CCCNC(=O)NCCSCCO 512a_100020643023_100011219999 [0,1,1,0,0,0|2,0,0]=4 4054 B12R0.206 CCCOC(=O)CNCCCCO 2230a_100000750430_200011215008 [0,1,1,0,0,0|2,0,0]=4 4055 B12R0.206 CCCOC(=O)CNCCCCO 34a_100000750430_200011215008 [0,1,1,0,0,0|2,0,0]=4 4056 B12R0.206 CCCOC(=O)CSCCCCO 62a_100000210776_200011215008 [0,1,1,0,0,0|2,0,0]=4 4057 B12R0.206 CCCOC(=O)CSCCCCO 62a_200011215008_100000210776 [0,1,1,0,0,0|2,0,0]=4 4058 B12R0.206 CCCOC(=O)OCNCCCF 34a_100015189416_200000139673 [0,1,1,0,0,0|2,0,0]=4 4059 B12R0.206 CCCOC(=O)OCOCCCBr 34a_100011217188_200000139673 [0,1,1,0,0,0|2,0,0]=4 4060 B12R0.206 CCCOC(=O)OCOCCCCl 34a_100000230001_200000139673 [0,1,1,0,0,0|2,0,0]=4 4061 B12R0.206 CCCOC(=O)OCOCCCF 34a_100000759539_200000139673 [0,1,1,0,0,0|2,0,0]=4 4062 B12R0.206 CCCOC(=O)OCOCCCN 34a_100000182051_200000139673 [0,1,1,0,0,0|2,0,0]=4 4063 B12R0.206 CCCOC(=O)OCSCCCF 62a_100011934791_200000139673 [0,1,1,0,0,0|2,0,0]=4 4064 B12R0.206 CCCOC(=O)OCSCCCO 62a_100011215043_200000139673 [0,1,1,0,0,0|1,0,0]=3 4065 B12R0.206 CCCOCCNC(=O)CCC#N 1626a_100161115042_100011934036 [0,1,1,0,0,0|1,0,1]=4 4066 B12R0.206 CCCOCCNC(=O)CCC#N 240690a_100161115042_100011934036 [0,1,1,0,0,0|1,0,1]=4 4067 B12R0.206 CCCOCCNC(=O)CCC#N 527a_100161115042_100011934036 [0,1,1,0,0,0|1,0,1]=4 4068 B12R0.206 CCCOCCNC(=O)CCOC 1626a_100161115042_100000749529 [0,1,1,0,0,0|1,0,0]=3 4069 B12R0.206 CCCOCCNC(=O)CCOC 240690a_100161115042_100000749529 [0,1,1,0,0,0|1,0,0]=3 4070 B12R0.206 CCCOCCNC(=O)CCOC 527a_100161115042_100000749529 [0,1,1,0,0,0|1,0,0]=3 4071 B12R0.206 CCCOCCNC(=O)CCSC 1626a_100161115042_100000174002 [0,1,1,0,0,0|1,0,0]=3 4072 B12R0.206 CCCOCCNC(=O)CCSC 240690a_100161115042_100000174002 [0,1,1,0,0,0|1,0,0]=3 4073 B12R0.206 CCCOCCNC(=O)CCSC 527a_100161115042_100000174002 [0,1,1,0,0,0|1,0,0]=3 4074 B12R0.206 CCCOCCNC(=O)COCC 1626a_100161115042_100000211967 [0,1,1,0,0,0|1,0,0]=3 4075 B12R0.206 CCCOCCNC(=O)COCC 240690a_100161115042_100000211967 [0,1,1,0,0,0|1,0,0]=3 4076 B12R0.206 CCCOCCNC(=O)COCC 527a_100161115042_100000211967 [0,1,1,0,0,0|1,0,0]=3 4077 B12R0.206 CCCOCCNC(=O)CSCC 1626a_100161115042_100000230394 [0,1,1,0,0,0|1,0,0]=3 4078 B12R0.206 CCCOCCNC(=O)CSCC 240690a_100161115042_100000230394 [0,1,1,0,0,0|1,0,0]=3 4079 B12R0.206 CCCOCCNC(=O)CSCC 527a_100161115042_100000230394 [0,1,1,0,0,0|1,0,0]=3 4080 B12R0.206 CCCOCCNC(=O)NCCF 2708a_100161115042_100000724931 [0,1,1,0,0,0|2,0,0]=4 4081 B12R0.206 CCCOCCNC(=O)NCCF 273464a_100000724931_100161115042 [0,1,1,0,0,0|2,0,0]=4 4082 B12R0.206 CCCOCCNC(=O)NCCF 273464a_100161115042_100000724931 [0,1,1,0,0,0|2,0,0]=4 4083 B12R0.206 CCCOCCNC(=O)NCCF 512a_100161115042_100000724931 [0,1,1,0,0,0|2,0,0]=4 4084 B12R0.206 CCCOCCNC(=O)NCCO 2708a_100161115042_100000210304 [0,1,1,0,0,0|2,0,0]=4 4085 B12R0.206 CCCOCCNC(=O)NCCO 273464a_100000210304_100161115042 [0,1,1,0,0,0|2,0,0]=4 4086 B12R0.206 CCCOCCNC(=O)NCCO 273464a_100161115042_100000210304 [0,1,1,0,0,0|2,0,0]=4 4087 B12R0.206 CCCOCCNC(=O)NCCO 512a_100161115042_100000210304 [0,1,1,0,0,0|2,0,0]=4 4088 B12R0.206 CCCOCCNC(=O)NNCC 273464a_100161115042_100000756455 [0,1,1,0,0,0|2,0,0]=4 4089 B12R0.206 CCCOCCNC(=O)NNCC 512a_100000756455_100161115042 [0,1,1,0,0,0|2,0,0]=4 4090 B12R0.206 CCCOCCNC(=O)NNCC 512a_100161115042_100000756455 [0,1,1,0,0,0|2,0,0]=4 4091 B12R0.206 CCCOCCOC(C)CCCCl 34a_200000718107_100011215938 [0,1,1,0,0,0|1,0,1]=4 4092 B12R0.206 CCCOCCOC(C)CCCCl 7a_200000718107_100011215938 [0,1,1,0,0,0|1,0,1]=4 4093 B12R0.206 CCCOCCOC(C)COCC 34a_100000718985_100011215938 [0,1,1,0,0,0|1,0,1]=4 4094 B12R0.206 CCCOCCOC(C)COCC 7a_100000718985_100011215938 [0,1,1,0,0,0|1,0,1]=4 4095 B12R0.206 CCCSCCNC(=O)CCOC 11a_100020603323_100000749529 [0,1,1,0,0,0|1,1,0]=4 4096 B12R0.206 CCCSCCNC(=O)CCOC 240690a_100020603323_100000749529 [0,1,1,0,0,0|1,1,0]=4 4097 B12R0.206 CCCSCCNC(=O)CCOC 527a_100020603323_100000749529 [0,1,1,0,0,0|1,1,0]=4 4098 B12R0.206 CCCSCCNC(=O)CCSC 11a_100020603323_100000174002 [0,1,1,0,0,0|1,1,0]=4 4099 B12R0.206 CCCSCCNC(=O)CCSC 240690a_100020603323_100000174002 [0,1,1,0,0,0|1,1,0]=4 4100 B12R0.206 CCCSCCNC(=O)CCSC 527a_100020603323_100000174002 [0,1,1,0,0,0|1,1,0]=4 4101 B12R0.206 CCCSCCNC(=O)COCC 11a_100020603323_100000211967 [0,1,1,0,0,0|1,1,0]=4 4102 B12R0.206 CCCSCCNC(=O)COCC 240690a_100020603323_100000211967 [0,1,1,0,0,0|1,1,0]=4 4103 B12R0.206 CCCSCCNC(=O)COCC 527a_100020603323_100000211967 [0,1,1,0,0,0|1,1,0]=4 4104 B12R0.206 CCCSCCNC(=O)CSCC 11a_100020603323_100000230394 [0,1,1,0,0,0|1,1,0]=4 4105 B12R0.206 CCCSCCNC(=O)CSCC 240690a_100020603323_100000230394 [0,1,1,0,0,0|1,1,0]=4 4106 B12R0.206 CCCSCCNC(=O)CSCC 527a_100020603323_100000230394 [0,1,1,0,0,0|1,1,0]=4 4107 B12R0.206 CCNNC(=O)NCCCCCO 273464a_100000762737_100000756455 [0,1,1,0,0,0|2,0,0]=4 4108 B12R0.206 CCNNC(=O)NCCCCCO 512a_100000756455_100000762737 [0,1,1,0,0,0|2,0,0]=4 4109 B12R0.206 CCNNC(=O)NCCCCCO 512a_100000762737_100000756455 [0,1,1,0,0,0|2,0,0]=4 4110 B12R0.206 CCOCC(=O)CCCCCCF 1458a_100000211967_100015922095 [0,1,1,0,0,0|2,0,0]=4 4111 B12R0.206 CCOCC(=O)CCCCCCO 1458a_100000211967_100000766143 [0,1,1,0,0,0|1,0,0]=3 4112 B12R0.206 CCOCC(=O)NCCCCCO 240690a_100000762737_100000211967 [0,1,1,0,0,0|1,0,0]=3 4113 B12R0.206 CCOCC(=O)NCCOCCO 240690a_100000211614_100000211967 [0,1,1,0,0,0|2,0,0]=4 4114 B12R0.206 CCOCC(=O)NCCSCCO 240690a_100011219999_100000211967 [0,1,1,0,0,0|2,0,0]=4 4115 B12R0.206 CCOCC(=O)NCCSCCO 527a_100011219999_100000211967 [0,1,1,0,0,0|2,0,0]=4 4116 B12R0.206 CCOCC(C)OCCCCCO 34a_100000718985_100000746330 [0,1,1,0,0,0|1,0,1]=4 4117 B12R0.206 CCOCC(C)OCCCCCO 7a_100000718985_100000746330 [0,1,1,0,0,0|1,0,1]=4 4118 B12R0.206 CCSCC(=O)CCCCCCF 1458a_100000230394_100015922095 [0,1,1,0,0,0|2,0,0]=4 4119 B12R0.206 CCSCC(=O)CCCCCCO 1458a_100000230394_100000766143 [0,1,1,0,0,0|1,0,0]=3 4120 B12R0.206 CCSCC(=O)NCCCCCO 240690a_100000762737_100000230394 [0,1,1,0,0,0|1,0,0]=3 4121 B12R0.206 CCSCC(=O)NCCOCCO 240690a_100000211614_100000230394 [0,1,1,0,0,0|2,0,0]=4 4122 B12R0.206 CCSCC(=O)NCCSCCO 240690a_100011219999_100000230394 [0,1,1,0,0,0|2,0,0]=4 4123 B12R0.206 CCSCC(=O)NCCSCCO 527a_100011219999_100000230394 [0,1,1,0,0,0|2,0,0]=4 4124 B12R0.206 COCCC(=O)CCCCCCF 1458a_100000749529_100015922095 [0,1,1,0,0,0|2,0,0]=4 4125 B12R0.206 COCCC(=O)CCCCCCO 1458a_100000749529_100000766143 [0,1,1,0,0,0|1,0,0]=3 4126 B12R0.206 COCCC(=O)CCCCCCO 1458a_100011996774_100000233755 [0,1,1,0,0,0|1,0,0]=3 4127 B12R0.206 COCCC(=O)NCCCCCO 240690a_100000762737_100000749529 [0,1,1,0,0,0|1,0,0]=3 4128 B12R0.206 COCCC(=O)NCCOCCO 240690a_100000211614_100000749529 [0,1,1,0,0,0|2,0,0]=4 4129 B12R0.206 COCCC(=O)NCCSCCO 240690a_100011219999_100000749529 [0,1,1,0,0,0|2,0,0]=4 4130 B12R0.206 COCCC(=O)NCCSCCO 527a_100011219999_100000749529 [0,1,1,0,0,0|2,0,0]=4 4131 B12R0.206 CSCCC(=O)CCCCCCF 1458a_100000174002_100015922095 [0,1,1,0,0,0|2,0,0]=4 4132 B12R0.206 CSCCC(=O)CCCCCCO 1458a_100000174002_100000766143 [0,1,1,0,0,0|1,0,0]=3 4133 B12R0.206 CSCCC(=O)CCCCCCO 1458a_100011996774_100000751147 [0,1,1,0,0,0|1,0,0]=3 4134 B12R0.206 CSCCC(=O)NCCCCCO 240690a_100000762737_100000174002 [0,1,1,0,0,0|1,0,0]=3 4135 B12R0.206 CSCCC(=O)NCCOCCO 240690a_100000211614_100000174002 [0,1,1,0,0,0|2,0,0]=4 4136 B12R0.206 CSCCC(=O)NCCSCCO 240690a_100011219999_100000174002 [0,1,1,0,0,0|2,0,0]=4 4137 B12R0.206 CSCCC(=O)NCCSCCO 527a_100011219999_100000174002 [0,1,1,0,0,0|2,0,0]=4 4138 B12R0.206 N#CCCC(=O)CCCCCCO 1458a_100011934036_100000766143 [0,1,1,0,0,0|1,0,1]=4 4139 B12R0.206 N#CCCC(=O)CCCCCCO 1458a_100011996774_100011215226 [0,1,1,0,0,0|1,0,1]=4 4140 B12R0.206 N#CCCC(=O)NCCCCCO 240690a_100000762737_100011934036 [0,1,1,0,0,0|1,0,1]=4 4141 B12R0.206 O=C(CCCCCCO)NCCF 240690a_100000724931_100011996774 [0,1,1,0,0,0|2,0,0]=4 4142 B12R0.206 O=C(CCCCCCO)NCCO 240690a_100000210304_100011996774 [0,1,1,0,0,0|2,0,0]=4 4143 B12R0.206 O=C(CCCF)CCCCCCO 1458a_100011996774_100011934791 [0,1,1,0,0,0|1,0,0]=3 4144 B12R0.206 O=C(CCCO)CCCCCCO 1458a_100011996774_100011215043 [0,1,1,0,0,0|1,0,0]=3 4145 B12R0.206 O=C(NCCF)NCCCCCO 273464a_100000724931_100000762737 [0,1,1,0,0,0|2,0,0]=4 4146 B12R0.206 O=C(NCCF)NCCCCCO 273464a_100000762737_100000724931 [0,1,1,0,0,0|2,0,0]=4 4147 B12R0.206 O=C(NCCF)NCCCCCO 512a_100000762737_100000724931 [0,1,1,0,0,0|2,0,0]=4 4148 B12R0.206 O=C(NCCO)NCCCCCO 273464a_100000210304_100000762737 [0,1,1,0,0,0|2,0,0]=4 4149 B12R0.206 O=C(NCCO)NCCCCCO 273464a_100000762737_100000210304 [0,1,1,0,0,0|2,0,0]=4 4150 B12R0.206 O=C(NCCO)NCCCCCO 512a_100000762737_100000210304 [0,1,1,0,0,0|2,0,0]=4 4151 B12R0.239 CCCC(=O)CC(=O)CCCCO 1458a_100000695505_100000747444 [0,1,1,0,0,0|1,0,1]=4 4152 B12R0.239 CCCC(=O)CN(C)CCCCO 2230a_100000717598_100000747444 [0,1,1,0,0,0|2,0,0]=4 4153 B12R0.239 CCCC(=O)CN(C)CCCCO 269982a_100000717598_100000747444 [0,1,1,0,0,0|2,0,0]=4 4154 B12R0.239 CCCCCC(C)NC(=O)CCC 11a_100000211957_100000211992 [0,1,1,0,0,0|2,0,0]=4 4155 B12R0.239 CCCCCC(C)NC(=O)CCC 1626a_100000211957_100000211992 [0,1,1,0,0,0|2,0,0]=4 4156 B12R0.239 CCCCCC(C)NC(=O)CCC 240690a_100000211957_100000211992 [0,1,1,0,0,0|2,0,0]=4 4157 B12R0.239 CCCCCC(C)NC(=O)CCC 527a_100000211957_100000211992 [0,1,1,0,0,0|2,0,0]=4 4158 B12R0.239 CCCCCC(C)OC(=O)CNC 2230a_106832991635_200000092394 [0,1,1,0,0,0|2,0,0]=4 4159 B12R0.239 CCCCCC(C)OC(=O)CNC 34a_100102657272_200000092394 [0,1,1,0,0,0|2,0,0]=4 4160 B12R0.239 CCCCCC(C)OC(=O)CNC 7a_106832991635_200000092394 [0,1,1,0,0,0|2,0,0]=4 4161 B12R0.239 CCCCCC(C)OC(=O)COC 34a_100138415774_200000092394 [0,1,1,0,0,0|2,0,0]=4 4162 B12R0.239 CCCCCC(C)OC(=O)CSC 62a_200000092394_200000210301 [0,1,1,0,0,0|2,0,0]=4 4163 B12R0.239 CCCCCC(C)OC(=O)CSC 62a_200000210301_200000092394 [0,1,1,0,0,0|2,0,0]=4 4164 B12R0.239 CCCCCC(C)OC(=O)CS[13CH3] 62a_200000092394_200025704644 [0,1,1,0,0,0|2,0,0]=4 4165 B12R0.239 CCCCCC(C)OC(=O)CS[13CH3] 62a_200025704644_200000092394 [0,1,1,0,0,0|2,0,0]=4 4166 B12R0.239 CCCOCC(=O)CC(=O)CCC 1458a_100000745993_100000747444 [0,1,1,0,0,0|1,0,1]=4 4167 B12R0.239 CCCOC[C@@H](O)CC(=O)OCC 34a_100000210258_100000688340 [0,1,1,0,0,0|2,0,0]=4 4168 B12R0.239 CCOC(=O)OC(C)SCCCO 62a_100000036008_100011215043 [0,1,1,0,0,0|2,0,0]=4 4169 B12R0.239 CCOC(=O)OC(C)SCCCO 62a_100011215043_100000036008 [0,1,1,0,0,0|2,0,0]=4 4170 B12R0.276 CCCC(=O)CNCCC(C)CO 2230a_106354213184_100000747444 [0,1,1,0,0,0|2,0,0]=4 4171 B12R0.276 CCCC(=O)OCNCC(C)CC 2230a_100020588543_100000034017 [0,1,1,0,0,0|2,0,0]=4 4172 B12R0.276 CCCC(=O)OCNCC(C)CO 34a_100000744482_100000034017 [0,1,1,0,0,0|1,0,0]=3 4173 B12R0.276 CCCC(=O)OCNCC(O)CC 2230a_100011218483_100000034017 [0,1,1,0,0,0|2,0,0]=4 4174 B12R0.276 CCCC(=O)OCNC[C@@H](F)CO 34a_100015665980_100000034017 [0,1,1,0,0,0|1,0,0]=3 4175 B12R0.276 CCCC(=O)OCNC[C@H](O)CO 2230a_100020644852_100000034017 [0,1,1,0,0,0|1,0,0]=3 4176 B12R0.276 CCCC(=O)OCOCC(C)CN 34a_100000744482_100000034017 [0,1,1,0,0,0|2,0,0]=4 4177 B12R0.276 CCCC(=O)OCOCC(Cl)CCl 34a_100000033668_100000034017 [0,1,1,0,0,0|2,0,0]=4 4178 B12R0.276 CCCC(=O)OCOC[C@H](F)CN 34a_100015665980_100000034017 [0,1,1,0,0,0|2,0,0]=4 4179 B12R0.276 CCCC(=O)OCSCC(C)CC 62a_100000748023_100000034017 [0,1,1,0,0,0|2,0,0]=4 4180 B12R0.276 CCCC(=O)OCSCC(O)CC 62a_100011218378_100000034017 [0,1,1,0,0,0|2,0,0]=4 4181 B12R0.276 CCCC(=O)OCSCC(O)CO 62a_100011219619_100000034017 [0,1,1,0,0,0|1,0,0]=3 4182 B12R0.276 CCCC(=O)OCSC[C@@H](C)CC 62a_100009816398_100000034017 [0,1,1,0,0,0|2,0,0]=4 4183 B12R0.276 CCCC(=O)OCSC[C@@H](C)CO 62a_100000059175_100000034017 [0,1,1,0,0,0|1,0,0]=3 4184 B12R0.276 CCCC(=O)OCSC[C@@H](O)CF 62a_100015614560_100000034017 [0,1,1,0,0,0|2,0,0]=4 4185 B12R0.276 CCCC(=O)OCSC[C@@H](O)CO 62a_100009815848_100000034017 [0,1,1,0,0,0|1,0,0]=3 4186 B12R0.276 CCOC(=O)CCCOC(C)CC 7a_100000210228_100011215271 [0,1,1,0,0,0|2,0,0]=4 4187 B12R0.276 CCOC(=O)CCCOC(C)CC 7a_100012001163_100000758301 [0,1,1,0,0,0|2,0,0]=4 4188 B12R0.276 CCOC(=O)NCCOC(C)CC 34a_100000158857_100011215416 [0,1,1,0,0,0|2,0,0]=4 4189 B12R0.276 CCOC(=O)NCCOC(C)CC 7a_100000210228_200011445536 [0,1,1,0,0,0|2,0,0]=4 4190 B12R0.276 CCOC(=O)OCSCC(O)CO 62a_100011219619_100000075025 [0,1,1,0,0,0|2,0,0]=4 4191 B12R0.276 CCOC(=O)OCSC[C@@H](C)CO 62a_100000059175_100000075025 [0,1,1,0,0,0|2,0,0]=4 4192 B12R0.276 CCOC(=O)OCSC[C@@H](O)CO 62a_100009815848_100000075025 [0,1,1,0,0,0|2,0,0]=4 4193 B12R0.277 CCCC(=O)CCCCCB(O)O 1458a_100000211992_200009817188 [0,1,1,0,0,0|2,0,0]=4 4194 B12R0.277 CCCC(=O)CCCCCC(C)C 1458a_100000211992_100000210682 [0,1,1,0,0,0|2,0,0]=4 4195 B12R0.277 CCCC(=O)CCCCCC(C)C 1458a_100000766313_100000210303 [0,1,1,0,0,0|2,0,0]=4 4196 B12R0.277 CCCC(=O)CSCCCC(C)O 62a_100000747444_200000718107 [0,1,1,0,0,0|2,0,0]=4 4197 B12R0.277 CCCC(=O)CSCCCC(C)O 62a_200000718107_100000747444 [0,1,1,0,0,0|2,0,0]=4 4198 B12R0.277 CCCC(=O)OCNCCC(C)O 2230a_200000755665_100000034017 [0,1,1,0,0,0|1,0,0]=3 4199 B12R0.277 CCCC(=O)OCOCCC(C)Br 34a_100009893172_100000034017 [0,1,1,0,0,0|2,0,0]=4 4200 B12R0.277 CCCC(=O)OCOCCC(C)C 34a_100000210254_100000034017 [0,1,1,0,0,0|2,0,0]=4 4201 B12R0.277 CCCC(=O)OCOCCC(F)F 34a_100103093639_100000034017 [0,1,1,0,0,0|2,0,0]=4 4202 B12R0.277 CCCC(=O)OCOCC[C@@H](C)N 34a_100000706166_100000034017 [0,1,1,0,0,0|2,0,0]=4 4203 B12R0.277 CCCC(=O)OCSCCC(C)C 62a_100000210312_100000034017 [0,1,1,0,0,0|2,0,0]=4 4204 B12R0.277 CCCC(=O)OCSCCC(C)O 62a_100012276601_100000034017 [0,1,1,0,0,0|1,0,0]=3 4205 B12R0.277 CCCC(C)OCCOCC(C)C 34a_100000703358_100000766640 [0,1,1,0,0,0|1,0,1]=4 4206 B12R0.277 CCCC(C)OCCOCC(C)C 7a_100000703358_100000766640 [0,1,1,0,0,0|1,0,1]=4 4207 B12R0.277 CCOC(=O)CCCOCC(C)Br 34a_100012180447_100009991533 [0,1,1,0,0,0|2,0,0]=4 4208 B12R0.277 CCOC(=O)CCCOCC(C)C 34a_100000210257_100009991533 [0,1,1,0,0,0|2,0,0]=4 4209 B12R0.277 CCOC(=O)CCCOCC(C)C 7a_100012001163_100000210760 [0,1,1,0,0,0|2,0,0]=4 4210 B12R0.277 CCOC(=O)CCCOCC(C)F 34a_100015925927_100009991533 [0,1,1,0,0,0|2,0,0]=4 4211 B12R0.277 CCOC(=O)CCCOCC(C)O 7a_100012001163_100011218427 [0,1,1,0,0,0|2,0,0]=4 4212 B12R0.277 CCOC(=O)CCCOC[C@@H](C)Cl 34a_100016084084_100009991533 [0,1,1,0,0,0|2,0,0]=4 4213 B12R0.277 CCOC(=O)CCCOC[C@@H](C)N 34a_100000737577_100009991533 [0,1,1,0,0,0|2,0,0]=4 4214 B12R0.277 CCOC(=O)CCCOC[C@@H](C)O 7a_100012001163_100009817552 [0,1,1,0,0,0|2,0,0]=4 4215 B12R0.277 CCOC(=O)NCCOCC(C)C 34a_100000158857_100000210624 [0,1,1,0,0,0|2,0,0]=4 4216 B12R0.277 CCOC(=O)NCCOCC(C)O 34a_100000158857_100011218427 [0,1,1,0,0,0|2,0,0]=4 4217 B12R0.277 CCOC(=O)NCCOC[C@@H](C)O 34a_100000158857_100009817552 [0,1,1,0,0,0|2,0,0]=4 4218 B12R0.277 CCOC(=O)OCSCCC(C)O 62a_100012276601_100000075025 [0,1,1,0,0,0|2,0,0]=4 4219 B12R0.285 CCCC(=O)OCNC(C)CCC 2230a_100000741246_100000034017 [0,1,1,0,0,0|2,0,0]=4 4220 B12R0.285 CCCC(=O)OCN[C@H](C)CCO 2230a_100000706166_100000034017 [0,1,1,0,0,0|1,0,0]=3 4221 B12R0.285 CCCC(=O)OCN[C@H](C)CCO 34a_100000706166_100000034017 [0,1,1,0,0,0|1,0,0]=3 4222 B12R0.285 CCCC(=O)OCOC(C)CCBr 34a_100012276601_100000034017 [0,1,1,0,0,0|2,0,0]=4 4223 B12R0.285 CCCC(=O)OCOC(C)CCC 34a_100000764384_100000034017 [0,1,1,0,0,0|2,0,0]=4 4224 B12R0.285 CCCC(=O)OCSC(C)CCC 62a_100000766640_100000034017 [0,1,1,0,0,0|2,0,0]=4 4225 B12R0.285 CCCC(=O)OCSC(C)CCO 62a_100009893172_100000034017 [0,1,1,0,0,0|1,0,0]=3 4226 B12R0.285 CCOC(=O)OCSC(C)CCO 62a_100009893172_100000075025 [0,1,1,0,0,0|2,0,0]=4 4227 B12R0.434 CCCC(C)(C)OCCCCCO 7a_100000748436_100000746330 [0,1,1,0,0,0|1,0,1]=4 4228 B12R0.434 CCCOCCNS(=O)(=O)CCC 270084a_100161115042_100000211391 [0,1,1,0,0,0|2,0,0]=4 4229 B12R0.434 CCCOCCNS(=O)(=O)CCC 274078a_100161115042_100000211391 [0,1,1,0,0,0|2,0,0]=4 4230 B12R0.434 CCCOCCNS(=O)(=O)CCC 40a_100161115042_100000054278 [0,1,1,0,0,0|2,0,0]=4 4231 B12R0.434 CCCOCCOC(C)(C)CCC 7a_100000748436_100011215938 [0,1,1,0,0,0|1,0,1]=4 4232 B12R0.434 CCCS(=O)(=O)NCCCCCO 270084a_100000762737_100000211391 [0,1,1,0,0,0|2,0,0]=4 4233 B12R0.434 CCCS(=O)(=O)NCCCCCO 274078a_100000762737_100000211391 [0,1,1,0,0,0|2,0,0]=4 4234 B12R0.434 CCCS(=O)(=O)NCCCCCO 40a_100000762737_100000054278 [0,1,1,0,0,0|2,0,0]=4 4235 B12R0.17 CCCC(=O)NCC(CC)N(C)C 11a_100000738386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4236 B12R0.17 CCCC(=O)NCC(CC)N(C)C 1626a_100000738386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4237 B12R0.17 CCCC(=O)NCC(CC)N(C)C 240690a_100000738386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4238 B12R0.17 CCCC(=O)OCN(CC)C(C)C 2230a_100000223864_100000034017 [0,1,1,0,0,0|2,0,0]=4 4239 B12R0.17 CCCC(=O)OCN(CC)C(C)C 269982a_100000223864_100000034017 [0,1,1,0,0,0|2,0,0]=4 4240 B12R0.33 CCC(CC)CNC(=O)CC(C)C 11a_100102946423_100000210554 [0,1,1,0,0,0|2,0,0]=4 4241 B12R0.33 CCC(CC)CNC(=O)CC(C)C 1626a_100102946423_100000210554 [0,1,1,0,0,0|2,0,0]=4 4242 B12R0.33 CCC(CC)CNC(=O)CC(C)C 240690a_100102946423_100000210554 [0,1,1,0,0,0|2,0,0]=4 4243 B12R0.33 CCC(CC)CNC(=O)CC(C)C 527a_100102946423_100000210554 [0,1,1,0,0,0|2,0,0]=4 4244 B12R0.33 CCC(CC)CNC(=O)C[C@@H](C)O 240690a_100102946423_100011933948 [0,1,1,0,0,0|2,0,0]=4 4245 B12R0.33 CCC(CNC(=O)CC(C)C)OC 11a_100000731041_100000210554 [0,1,1,0,0,0|1,0,0]=3 4246 B12R0.33 CCC(CNC(=O)CC(C)C)OC 1626a_100000731041_100000210554 [0,1,1,0,0,0|1,0,0]=3 4247 B12R0.33 CCC(CNC(=O)CC(C)C)OC 240690a_100000731041_100000210554 [0,1,1,0,0,0|1,0,0]=3 4248 B12R0.33 CCC(CNC(=O)CC(C)C)OC 527a_100000731041_100000210554 [0,1,1,0,0,0|1,0,0]=3 4249 B12R0.33 CCC(CNC(=O)CN(C)C)OC 11a_100000731041_100000750896 [0,1,1,0,0,0|2,0,0]=4 4250 B12R0.33 CCC(CNC(=O)CN(C)C)OC 240690a_100000731041_100000750896 [0,1,1,0,0,0|2,0,0]=4 4251 B12R0.33 CCC(CNC(=O)CN(C)C)OC 527a_100000731041_100000750896 [0,1,1,0,0,0|2,0,0]=4 4252 B12R0.33 CCC(CNC(=O)C[C@@H](C)O)OC 240690a_100000731041_100011933948 [0,1,1,0,0,0|1,0,0]=3 4253 B12R0.33 CCC(CNC(=O)C[S+](C)C)OC 11a_100000731041_200159257847 [0,1,1,0,0,0|2,0,0]=4 4254 B12R0.33 CCC(CNC(=O)C[S+](C)C)OC 1626a_100000731041_200159257847 [0,1,1,0,0,0|2,0,0]=4 4255 B12R0.33 CCC(CNC(=O)C[S+](C)C)OC 240690a_100000731041_200159257847 [0,1,1,0,0,0|2,0,0]=4 4256 B12R0.33 CCC(CNC(=O)C[S+](C)C)OC 527a_100000731041_200159257847 [0,1,1,0,0,0|2,0,0]=4 4257 B12R0.33 CCC(CNC(=O)NC(C)C)OC 2708a_100000731041_100138425928 [0,1,1,0,0,0|2,0,0]=4 4258 B12R0.33 CCC(CNC(=O)NC(C)C)OC 2708a_100138425928_100000731041 [0,1,1,0,0,0|2,0,0]=4 4259 B12R0.33 CCC(CNC(=O)NC(C)C)OC 273464a_100138425928_100000731041 [0,1,1,0,0,0|2,0,0]=4 4260 B12R0.33 CCC(CNC(=O)NC(C)C)OC 512a_100000731041_100138425928 [0,1,1,0,0,0|2,0,0]=4 4261 B12R0.33 CCC(CNC(=O)NC(C)C)OC 512a_100138425928_100000731041 [0,1,1,0,0,0|2,0,0]=4 4262 B12R0.33 CCC(COC(C)CC(C)C)OC 34a_100011934954_100000731052 [0,1,1,0,0,0|1,0,1]=4 4263 B12R0.33 CCC(COC(C)CC(C)C)OC 7a_100011934954_100000731052 [0,1,1,0,0,0|1,0,1]=4 4264 B12R0.33 COC(CCC(=O)CC(C)C)OC 1458a_100000210554_100000139399 [0,1,1,0,0,0|2,0,0]=4 4265 B12R0.33 COC(CCC(=O)CC(C)C)OC 1458a_200000082759_100000210624 [0,1,1,0,0,0|2,0,0]=4 4266 B12R0.33 COC(CCC(=O)CC(C)O)OC 1458a_200000082759_100011218427 [0,1,1,0,0,0|2,0,0]=4 4267 B12R0.33 COC(CCC(=O)C[C@@H](C)O)OC 1458a_100011933948_100000139399 [0,1,1,0,0,0|2,0,0]=4 4268 B12R0.33 COC(CNC(=O)CC(C)C)OC 11a_100000210479_100000210554 [0,1,1,0,0,0|2,0,0]=4 4269 B12R0.33 COC(CNC(=O)CC(C)C)OC 1626a_100000210479_100000210554 [0,1,1,0,0,0|2,0,0]=4 4270 B12R0.33 COC(CNC(=O)CC(C)C)OC 240690a_100000210479_100000210554 [0,1,1,0,0,0|2,0,0]=4 4271 B12R0.33 COC(CNC(=O)CC(C)C)OC 527a_100000210479_100000210554 [0,1,1,0,0,0|2,0,0]=4 4272 B12R0.33 COC(CNC(=O)C[C@@H](C)O)OC 240690a_100000210479_100011933948 [0,1,1,0,0,0|2,0,0]=4 4273 B12R0.71 CCCC(=O)CC(=O)C(CC)OC 1458a_100000747056_100000747444 [0,1,1,0,0,0|1,0,1]=4 4274 B12R0.74 CCCC(=O)CNC(CC)COC 2230a_100000757820_100000747444 [0,1,1,0,0,0|2,0,0]=4 4275 B12R0.74 CCCC(=O)COC(CC)COC 7a_200011214946_100000747444 [0,1,1,0,0,0|2,0,0]=4 4276 B12R0.74 CCCC(=O)NCC(CC)OCC 11a_100015183923_100000211992 [0,1,1,0,0,0|1,0,0]=3 4277 B12R0.74 CCCC(=O)NCC(CC)OCC 1626a_100015183923_100000211992 [0,1,1,0,0,0|1,0,0]=3 4278 B12R0.74 CCCC(=O)NCC(CC)OCC 240690a_100015183923_100000211992 [0,1,1,0,0,0|1,0,0]=3 4279 B12R0.74 CCCC(=O)NCC(CC)OCC 527a_100015183923_100000211992 [0,1,1,0,0,0|1,0,0]=3 4280 B12R0.74 CCCC(=O)OCN(CC)CCC 2230a_100000226822_100000034017 [0,1,1,0,0,0|2,0,0]=4 4281 B12R0.74 CCCC(=O)OCN(CC)CCC 269982a_100000226822_100000034017 [0,1,1,0,0,0|2,0,0]=4 4282 B12R0.74 CCCC(=O)OCN(CC)CCO 2230a_100000210973_100000034017 [0,1,1,0,0,0|2,0,0]=4 4283 B12R0.74 CCCC(=O)OCN(CC)CCO 269982a_100000210973_100000034017 [0,1,1,0,0,0|2,0,0]=4 4284 B12R0.74 CCNC(=O)NCC(CC)OCC 2708a_100015183923_100015525214 [0,1,1,0,0,0|2,0,0]=4 4285 B12R0.74 CCNC(=O)NCC(CC)OCC 2708a_100015525214_100015183923 [0,1,1,0,0,0|2,0,0]=4 4286 B12R0.74 CCNC(=O)NCC(CC)OCC 273464a_100015183923_100015525214 [0,1,1,0,0,0|2,0,0]=4 4287 B12R0.74 CCNC(=O)NCC(CC)OCC 273464a_100015525214_100015183923 [0,1,1,0,0,0|2,0,0]=4 4288 B12R0.74 CCNC(=O)NCC(CC)OCC 512a_100015183923_100015525214 [0,1,1,0,0,0|2,0,0]=4 4289 B12R0.74 CCNC(=O)NCC(CC)OCC 512a_100015525214_100015183923 [0,1,1,0,0,0|2,0,0]=4 4290 B12R0.74 CCOC(CC)CNC(=O)CCO 240690a_100015183923_100011216618 [0,1,1,0,0,0|2,0,0]=4 4291 B12R0.74 CCOC(CC)CNC(=O)COC 11a_100015183923_100000210968 [0,1,1,0,0,0|2,0,0]=4 4292 B12R0.74 CCOC(CC)CNC(=O)COC 1626a_100015183923_100000210968 [0,1,1,0,0,0|2,0,0]=4 4293 B12R0.74 CCOC(CC)CNC(=O)COC 240690a_100015183923_100000210968 [0,1,1,0,0,0|2,0,0]=4 4294 B12R0.74 CCOC(CC)CNC(=O)COC 527a_100015183923_100000210968 [0,1,1,0,0,0|2,0,0]=4 4295 B12R0.74 CCOC(CC)CNC(=O)CSC 11a_100015183923_100000184570 [0,1,1,0,0,0|2,0,0]=4 4296 B12R0.74 CCOC(CC)CNC(=O)CSC 1626a_100015183923_100000184570 [0,1,1,0,0,0|2,0,0]=4 4297 B12R0.74 CCOC(CC)CNC(=O)CSC 240690a_100015183923_100000184570 [0,1,1,0,0,0|2,0,0]=4 4298 B12R0.74 CCOC(CC)CNC(=O)CSC 527a_100015183923_100000184570 [0,1,1,0,0,0|2,0,0]=4 4299 B12R0.133 C#CCCC(=O)NCC(CC)OC 11a_100000731041_100000692101 [0,1,1,0,0,0|1,0,1]=4 4300 B12R0.133 C#CCCC(=O)NCC(CC)OC 1626a_100000731041_100000692101 [0,1,1,0,0,0|1,0,1]=4 4301 B12R0.133 C#CCCC(=O)NCC(CC)OC 240690a_100000731041_100000692101 [0,1,1,0,0,0|1,0,1]=4 4302 B12R0.133 C#CCCC(=O)NCC(CC)OC 527a_100000731041_100000692101 [0,1,1,0,0,0|1,0,1]=4 4303 B12R0.133 C=CCCC(=O)NCC(CC)OC 11a_100000731041_100000749702 [0,1,1,0,0,0|1,0,1]=4 4304 B12R0.133 C=CCCC(=O)NCC(CC)OC 1626a_100000731041_100000749702 [0,1,1,0,0,0|1,0,1]=4 4305 B12R0.133 C=CCCC(=O)NCC(CC)OC 240690a_100000731041_100000749702 [0,1,1,0,0,0|1,0,1]=4 4306 B12R0.133 C=CCCC(=O)NCC(CC)OC 527a_100000731041_100000749702 [0,1,1,0,0,0|1,0,1]=4 4307 B12R0.133 CC=CCC(=O)NCC(CC)OC 11a_100000731041_100121576822 [0,1,1,0,0,0|1,0,1]=4 4308 B12R0.133 CC=CCC(=O)NCC(CC)OC 1626a_100000731041_100121576822 [0,1,1,0,0,0|1,0,1]=4 4309 B12R0.133 CC=CCC(=O)NCC(CC)OC 240690a_100000731041_100121576822 [0,1,1,0,0,0|1,0,1]=4 4310 B12R0.133 CC=CCC(=O)NCC(CC)OC 527a_100000731041_100121576822 [0,1,1,0,0,0|1,0,1]=4 4311 B12R0.133 CCC(CC)CNC(=O)CCOC 11a_100102946423_100000749529 [0,1,1,0,0,0|2,0,0]=4 4312 B12R0.133 CCC(CC)CNC(=O)CCOC 1626a_100102946423_100000749529 [0,1,1,0,0,0|2,0,0]=4 4313 B12R0.133 CCC(CC)CNC(=O)CCOC 240690a_100102946423_100000749529 [0,1,1,0,0,0|2,0,0]=4 4314 B12R0.133 CCC(CC)CNC(=O)CCOC 527a_100102946423_100000749529 [0,1,1,0,0,0|2,0,0]=4 4315 B12R0.133 CCC(CC)CNC(=O)CCSC 11a_100102946423_100000174002 [0,1,1,0,0,0|2,0,0]=4 4316 B12R0.133 CCC(CC)CNC(=O)CCSC 1626a_100102946423_100000174002 [0,1,1,0,0,0|2,0,0]=4 4317 B12R0.133 CCC(CC)CNC(=O)CCSC 240690a_100102946423_100000174002 [0,1,1,0,0,0|2,0,0]=4 4318 B12R0.133 CCC(CC)CNC(=O)CCSC 527a_100102946423_100000174002 [0,1,1,0,0,0|2,0,0]=4 4319 B12R0.133 CCC(CNC(=O)CCC#N)OC 11a_100000731041_100011934036 [0,1,1,0,0,0|1,0,1]=4 4320 B12R0.133 CCC(CNC(=O)CCC#N)OC 1626a_100000731041_100011934036 [0,1,1,0,0,0|1,0,1]=4 4321 B12R0.133 CCC(CNC(=O)CCC#N)OC 240690a_100000731041_100011934036 [0,1,1,0,0,0|1,0,1]=4 4322 B12R0.133 CCC(CNC(=O)CCC#N)OC 527a_100000731041_100011934036 [0,1,1,0,0,0|1,0,1]=4 4323 B12R0.133 CCC(CNC(=O)CCOC)OC 11a_100000731041_100000749529 [0,1,1,0,0,0|1,0,0]=3 4324 B12R0.133 CCC(CNC(=O)CCOC)OC 1626a_100000731041_100000749529 [0,1,1,0,0,0|1,0,0]=3 4325 B12R0.133 CCC(CNC(=O)CCOC)OC 240690a_100000731041_100000749529 [0,1,1,0,0,0|1,0,0]=3 4326 B12R0.133 CCC(CNC(=O)CCOC)OC 527a_100000731041_100000749529 [0,1,1,0,0,0|1,0,0]=3 4327 B12R0.133 CCC(CNC(=O)CCSC)OC 11a_100000731041_100000174002 [0,1,1,0,0,0|1,0,0]=3 4328 B12R0.133 CCC(CNC(=O)CCSC)OC 1626a_100000731041_100000174002 [0,1,1,0,0,0|1,0,0]=3 4329 B12R0.133 CCC(CNC(=O)CCSC)OC 240690a_100000731041_100000174002 [0,1,1,0,0,0|1,0,0]=3 4330 B12R0.133 CCC(CNC(=O)CCSC)OC 527a_100000731041_100000174002 [0,1,1,0,0,0|1,0,0]=3 4331 B12R0.133 CCC(CNC(=O)NCCF)OC 2708a_100000731041_100000724931 [0,1,1,0,0,0|2,0,0]=4 4332 B12R0.133 CCC(CNC(=O)NCCF)OC 273464a_100000724931_100000731041 [0,1,1,0,0,0|2,0,0]=4 4333 B12R0.133 CCC(CNC(=O)NCCF)OC 273464a_100000731041_100000724931 [0,1,1,0,0,0|2,0,0]=4 4334 B12R0.133 CCC(CNC(=O)NCCF)OC 512a_100000731041_100000724931 [0,1,1,0,0,0|2,0,0]=4 4335 B12R0.133 CCC(CNC(=O)NCCO)OC 2708a_100000731041_100000210304 [0,1,1,0,0,0|2,0,0]=4 4336 B12R0.133 CCC(CNC(=O)NCCO)OC 273464a_100000210304_100000731041 [0,1,1,0,0,0|2,0,0]=4 4337 B12R0.133 CCC(CNC(=O)NCCO)OC 273464a_100000731041_100000210304 [0,1,1,0,0,0|2,0,0]=4 4338 B12R0.133 CCC(CNC(=O)NCCO)OC 512a_100000731041_100000210304 [0,1,1,0,0,0|2,0,0]=4 4339 B12R0.133 CCC=CC(=O)NCC(CC)OC 11a_100000731041_100000212282 [0,1,1,0,0,0|1,0,1]=4 4340 B12R0.133 CCC=CC(=O)NCC(CC)OC 1626a_100000731041_100000212282 [0,1,1,0,0,0|1,0,1]=4 4341 B12R0.133 CCC=CC(=O)NCC(CC)OC 240690a_100000731041_100000212282 [0,1,1,0,0,0|1,0,1]=4 4342 B12R0.133 CCCCC(=O)CCC(OC)OC 1458a_100000210183_100000139399 [0,1,1,0,0,0|2,0,0]=4 4343 B12R0.133 CCCCC(=O)CCC(OC)OC 1458a_200000082759_100000210211 [0,1,1,0,0,0|2,0,0]=4 4344 B12R0.133 CCCCC(=O)NCC(CC)CC 11a_100102946423_100000210183 [0,1,1,0,0,0|2,0,0]=4 4345 B12R0.133 CCCCC(=O)NCC(CC)CC 1626a_100102946423_100000210183 [0,1,1,0,0,0|2,0,0]=4 4346 B12R0.133 CCCCC(=O)NCC(CC)CC 240690a_100102946423_100000210183 [0,1,1,0,0,0|2,0,0]=4 4347 B12R0.133 CCCCC(=O)NCC(CC)CC 527a_100102946423_100000210183 [0,1,1,0,0,0|2,0,0]=4 4348 B12R0.133 CCCCC(=O)NCC(CC)OC 11a_100000731041_100000210183 [0,1,1,0,0,0|1,0,0]=3 4349 B12R0.133 CCCCC(=O)NCC(CC)OC 1626a_100000731041_100000210183 [0,1,1,0,0,0|1,0,0]=3 4350 B12R0.133 CCCCC(=O)NCC(CC)OC 240690a_100000731041_100000210183 [0,1,1,0,0,0|1,0,0]=3 4351 B12R0.133 CCCCC(=O)NCC(CC)OC 527a_100000731041_100000210183 [0,1,1,0,0,0|1,0,0]=3 4352 B12R0.133 CCCCC(=O)NCC(OC)OC 11a_100000210479_100000210183 [0,1,1,0,0,0|2,0,0]=4 4353 B12R0.133 CCCCC(=O)NCC(OC)OC 1626a_100000210479_100000210183 [0,1,1,0,0,0|2,0,0]=4 4354 B12R0.133 CCCCC(=O)NCC(OC)OC 240690a_100000210479_100000210183 [0,1,1,0,0,0|2,0,0]=4 4355 B12R0.133 CCCCC(=O)NCC(OC)OC 527a_100000210479_100000210183 [0,1,1,0,0,0|2,0,0]=4 4356 B12R0.133 CCCCC(C)OCC(CC)OC 34a_100011934954_200011215066 [0,1,1,0,0,0|1,0,1]=4 4357 B12R0.133 CCCCC(C)OCC(CC)OC 7a_100011934954_200011215066 [0,1,1,0,0,0|1,0,1]=4 4358 B12R0.133 CCCNC(=O)CCC(OC)OC 11a_100020643023_200000082759 [0,1,1,0,0,0|2,0,0]=4 4359 B12R0.133 CCCNC(=O)CCC(OC)OC 1626a_100020643023_200000082759 [0,1,1,0,0,0|2,0,0]=4 4360 B12R0.133 CCCNC(=O)CCC(OC)OC 240690a_100020643023_200000082759 [0,1,1,0,0,0|2,0,0]=4 4361 B12R0.133 CCCNC(=O)CCC(OC)OC 527a_100020643023_200000082759 [0,1,1,0,0,0|2,0,0]=4 4362 B12R0.133 CCCNC(=O)NCC(CC)CC 2708a_100020643023_100102946423 [0,1,1,0,0,0|2,0,0]=4 4363 B12R0.133 CCCNC(=O)NCC(CC)CC 2708a_100102946423_100020643023 [0,1,1,0,0,0|2,0,0]=4 4364 B12R0.133 CCCNC(=O)NCC(CC)CC 273464a_100020643023_100102946423 [0,1,1,0,0,0|2,0,0]=4 4365 B12R0.133 CCCNC(=O)NCC(CC)CC 273464a_100102946423_100020643023 [0,1,1,0,0,0|2,0,0]=4 4366 B12R0.133 CCCNC(=O)NCC(CC)CC 512a_100020643023_100102946423 [0,1,1,0,0,0|2,0,0]=4 4367 B12R0.133 CCCNC(=O)NCC(CC)CC 512a_100102946423_100020643023 [0,1,1,0,0,0|2,0,0]=4 4368 B12R0.133 CCCNC(=O)NCC(CC)OC 2708a_100000731041_100020643023 [0,1,1,0,0,0|1,0,0]=3 4369 B12R0.133 CCCNC(=O)NCC(CC)OC 2708a_100020643023_100000731041 [0,1,1,0,0,0|1,0,0]=3 4370 B12R0.133 CCCNC(=O)NCC(CC)OC 273464a_100000731041_100020643023 [0,1,1,0,0,0|1,0,0]=3 4371 B12R0.133 CCCNC(=O)NCC(CC)OC 273464a_100020643023_100000731041 [0,1,1,0,0,0|1,0,0]=3 4372 B12R0.133 CCCNC(=O)NCC(CC)OC 512a_100000731041_100020643023 [0,1,1,0,0,0|1,0,0]=3 4373 B12R0.133 CCCNC(=O)NCC(CC)OC 512a_100020643023_100000731041 [0,1,1,0,0,0|1,0,0]=3 4374 B12R0.133 CCCNC(=O)NCC(OC)OC 2708a_100000210479_100020643023 [0,1,1,0,0,0|2,0,0]=4 4375 B12R0.133 CCCNC(=O)NCC(OC)OC 273464a_100000210479_100020643023 [0,1,1,0,0,0|2,0,0]=4 4376 B12R0.133 CCCNC(=O)NCC(OC)OC 273464a_100020643023_100000210479 [0,1,1,0,0,0|2,0,0]=4 4377 B12R0.133 CCCNC(=O)NCC(OC)OC 512a_100000210479_100020643023 [0,1,1,0,0,0|2,0,0]=4 4378 B12R0.133 CCCNC(=O)NCC(OC)OC 512a_100020643023_100000210479 [0,1,1,0,0,0|2,0,0]=4 4379 B12R0.133 CCCOC(=O)OCN(CC)CC 269956a_100000042499_200000139673 [0,1,1,0,0,0|2,0,0]=4 4380 B12R0.133 CCCOC(=O)OCN(CC)CC 269982a_100000724800_200000139673 [0,1,1,0,0,0|2,0,0]=4 4381 B12R0.133 CCNNC(=O)NCC(CC)OC 273464a_100000731041_100000756455 [0,1,1,0,0,0|2,0,0]=4 4382 B12R0.133 CCNNC(=O)NCC(CC)OC 512a_100000731041_100000756455 [0,1,1,0,0,0|2,0,0]=4 4383 B12R0.133 CCNNC(=O)NCC(CC)OC 512a_100000756455_100000731041 [0,1,1,0,0,0|2,0,0]=4 4384 B12R0.133 CCOCC(=O)CCC(OC)OC 1458a_100000211967_100000139399 [0,1,1,0,0,0|2,0,0]=4 4385 B12R0.133 CCOCC(=O)NCC(CC)CC 11a_100102946423_100000211967 [0,1,1,0,0,0|2,0,0]=4 4386 B12R0.133 CCOCC(=O)NCC(CC)CC 1626a_100102946423_100000211967 [0,1,1,0,0,0|2,0,0]=4 4387 B12R0.133 CCOCC(=O)NCC(CC)CC 240690a_100102946423_100000211967 [0,1,1,0,0,0|2,0,0]=4 4388 B12R0.133 CCOCC(=O)NCC(CC)CC 527a_100102946423_100000211967 [0,1,1,0,0,0|2,0,0]=4 4389 B12R0.133 CCOCC(=O)NCC(CC)OC 11a_100000731041_100000211967 [0,1,1,0,0,0|1,0,0]=3 4390 B12R0.133 CCOCC(=O)NCC(CC)OC 1626a_100000731041_100000211967 [0,1,1,0,0,0|1,0,0]=3 4391 B12R0.133 CCOCC(=O)NCC(CC)OC 240690a_100000731041_100000211967 [0,1,1,0,0,0|1,0,0]=3 4392 B12R0.133 CCOCC(=O)NCC(CC)OC 527a_100000731041_100000211967 [0,1,1,0,0,0|1,0,0]=3 4393 B12R0.133 CCOCC(=O)NCC(OC)OC 11a_100000210479_100000211967 [0,1,1,0,0,0|2,0,0]=4 4394 B12R0.133 CCOCC(=O)NCC(OC)OC 1626a_100000210479_100000211967 [0,1,1,0,0,0|2,0,0]=4 4395 B12R0.133 CCOCC(=O)NCC(OC)OC 240690a_100000210479_100000211967 [0,1,1,0,0,0|2,0,0]=4 4396 B12R0.133 CCOCC(=O)NCC(OC)OC 527a_100000210479_100000211967 [0,1,1,0,0,0|2,0,0]=4 4397 B12R0.133 CCSCC(=O)CCC(OC)OC 1458a_100000230394_100000139399 [0,1,1,0,0,0|2,0,0]=4 4398 B12R0.133 CCSCC(=O)NCC(CC)CC 11a_100102946423_100000230394 [0,1,1,0,0,0|2,0,0]=4 4399 B12R0.133 CCSCC(=O)NCC(CC)CC 1626a_100102946423_100000230394 [0,1,1,0,0,0|2,0,0]=4 4400 B12R0.133 CCSCC(=O)NCC(CC)CC 240690a_100102946423_100000230394 [0,1,1,0,0,0|2,0,0]=4 4401 B12R0.133 CCSCC(=O)NCC(CC)CC 527a_100102946423_100000230394 [0,1,1,0,0,0|2,0,0]=4 4402 B12R0.133 CCSCC(=O)NCC(CC)OC 11a_100000731041_100000230394 [0,1,1,0,0,0|1,0,0]=3 4403 B12R0.133 CCSCC(=O)NCC(CC)OC 1626a_100000731041_100000230394 [0,1,1,0,0,0|1,0,0]=3 4404 B12R0.133 CCSCC(=O)NCC(CC)OC 240690a_100000731041_100000230394 [0,1,1,0,0,0|1,0,0]=3 4405 B12R0.133 CCSCC(=O)NCC(CC)OC 527a_100000731041_100000230394 [0,1,1,0,0,0|1,0,0]=3 4406 B12R0.133 CCSCC(=O)NCC(OC)OC 11a_100000210479_100000230394 [0,1,1,0,0,0|2,0,0]=4 4407 B12R0.133 CCSCC(=O)NCC(OC)OC 1626a_100000210479_100000230394 [0,1,1,0,0,0|2,0,0]=4 4408 B12R0.133 CCSCC(=O)NCC(OC)OC 240690a_100000210479_100000230394 [0,1,1,0,0,0|2,0,0]=4 4409 B12R0.133 CCSCC(=O)NCC(OC)OC 527a_100000210479_100000230394 [0,1,1,0,0,0|2,0,0]=4 4410 B12R0.133 COC(CCC(=O)CCCF)OC 1458a_200000082759_100011934791 [0,1,1,0,0,0|2,0,0]=4 4411 B12R0.133 COC(CCC(=O)CCCO)OC 1458a_200000082759_100011215043 [0,1,1,0,0,0|2,0,0]=4 4412 B12R0.133 COC(CCC(=O)CCSC)OC 1458a_100000174002_100000139399 [0,1,1,0,0,0|2,0,0]=4 4413 B12R0.133 COC(CCC(=O)CCSC)OC 1458a_200000082759_100000751147 [0,1,1,0,0,0|2,0,0]=4 4414 B12R0.133 COC(CNC(=O)CCSC)OC 11a_100000210479_100000174002 [0,1,1,0,0,0|2,0,0]=4 4415 B12R0.133 COC(CNC(=O)CCSC)OC 1626a_100000210479_100000174002 [0,1,1,0,0,0|2,0,0]=4 4416 B12R0.133 COC(CNC(=O)CCSC)OC 240690a_100000210479_100000174002 [0,1,1,0,0,0|2,0,0]=4 4417 B12R0.133 COC(CNC(=O)CCSC)OC 527a_100000210479_100000174002 [0,1,1,0,0,0|2,0,0]=4 4418 B12R0.133 COCCC(=O)CCC(OC)OC 1458a_100000749529_100000139399 [0,1,1,0,0,0|2,0,0]=4 4419 B12R0.133 COCCC(=O)CCC(OC)OC 1458a_200000082759_100000233755 [0,1,1,0,0,0|2,0,0]=4 4420 B12R0.133 COCCC(=O)NCC(OC)OC 11a_100000210479_100000749529 [0,1,1,0,0,0|2,0,0]=4 4421 B12R0.133 COCCC(=O)NCC(OC)OC 1626a_100000210479_100000749529 [0,1,1,0,0,0|2,0,0]=4 4422 B12R0.133 COCCC(=O)NCC(OC)OC 240690a_100000210479_100000749529 [0,1,1,0,0,0|2,0,0]=4 4423 B12R0.133 COCCC(=O)NCC(OC)OC 527a_100000210479_100000749529 [0,1,1,0,0,0|2,0,0]=4 4424 B12R0.195 CCCC(=O)N(C)CC(OC)OC 11a_100000225562_100000211992 [0,1,1,0,0,0|2,0,0]=4 4425 B12R0.195 CCCC(=O)N(C)CC(OC)OC 1626a_100000225562_100000211992 [0,1,1,0,0,0|2,0,0]=4 4426 B12R0.195 CCCC(=O)N(C)CC(OC)OC 240690a_100000225562_100000211992 [0,1,1,0,0,0|2,0,0]=4 4427 B12R0.195 CCCC(=O)N(C)CC(OC)OC 527a_100000225562_100000211992 [0,1,1,0,0,0|2,0,0]=4 4428 B12R0.344 CCC(C)C(=O)CCC(OC)OC 1458a_100011192722_100000139399 [0,1,1,0,0,0|2,0,0]=4 4429 B12R0.344 CCC(C)C(=O)CCC(OC)OC 1458a_200000082759_100000758301 [0,1,1,0,0,0|2,0,0]=4 4430 B12R0.344 CCC(C)C(=O)NCC(OC)OC 11a_100000210479_100011192722 [0,1,1,0,0,0|2,0,0]=4 4431 B12R0.344 CCC(C)C(=O)NCC(OC)OC 1626a_100000210479_100011192722 [0,1,1,0,0,0|2,0,0]=4 4432 B12R0.344 CCC(C)C(=O)NCC(OC)OC 240690a_100000210479_100011192722 [0,1,1,0,0,0|2,0,0]=4 4433 B12R0.344 CCC(C)C(=O)NCC(OC)OC 527a_100000210479_100011192722 [0,1,1,0,0,0|2,0,0]=4 4434 B12R0.344 CCC(CC)CNC(=O)C(C)CC 11a_100102946423_100011192722 [0,1,1,0,0,0|2,0,0]=4 4435 B12R0.344 CCC(CC)CNC(=O)C(C)CC 1626a_100102946423_100011192722 [0,1,1,0,0,0|2,0,0]=4 4436 B12R0.344 CCC(CC)CNC(=O)C(C)CC 240690a_100102946423_100011192722 [0,1,1,0,0,0|2,0,0]=4 4437 B12R0.344 CCC(CC)CNC(=O)C(C)CC 527a_100102946423_100011192722 [0,1,1,0,0,0|2,0,0]=4 4438 B12R0.344 CCC(CC)CNC(=O)C(O)CC 240690a_100102946423_100011196387 [0,1,1,0,0,0|2,0,0]=4 4439 B12R0.344 CCC(CNC(=O)C(C)CC)OC 11a_100000731041_100011192722 [0,1,1,0,0,0|1,0,0]=3 4440 B12R0.344 CCC(CNC(=O)C(C)CC)OC 1626a_100000731041_100011192722 [0,1,1,0,0,0|1,0,0]=3 4441 B12R0.344 CCC(CNC(=O)C(C)CC)OC 240690a_100000731041_100011192722 [0,1,1,0,0,0|1,0,0]=3 4442 B12R0.344 CCC(CNC(=O)C(C)CC)OC 527a_100000731041_100011192722 [0,1,1,0,0,0|1,0,0]=3 4443 B12R0.344 CCC(CNC(=O)C(C)OC)OC 11a_100000731041_100000743197 [0,1,1,0,0,0|2,0,0]=4 4444 B12R0.344 CCC(CNC(=O)C(C)OC)OC 1626a_100000731041_100000743197 [0,1,1,0,0,0|2,0,0]=4 4445 B12R0.344 CCC(CNC(=O)C(C)OC)OC 240690a_100000731041_100000743197 [0,1,1,0,0,0|2,0,0]=4 4446 B12R0.344 CCC(CNC(=O)C(C)OC)OC 527a_100000731041_100000743197 [0,1,1,0,0,0|2,0,0]=4 4447 B12R0.344 CCC(CNC(=O)C(C)SC)OC 11a_100000731041_100000149566 [0,1,1,0,0,0|2,0,0]=4 4448 B12R0.344 CCC(CNC(=O)C(C)SC)OC 1626a_100000731041_100000149566 [0,1,1,0,0,0|2,0,0]=4 4449 B12R0.344 CCC(CNC(=O)C(C)SC)OC 240690a_100000731041_100000149566 [0,1,1,0,0,0|2,0,0]=4 4450 B12R0.344 CCC(CNC(=O)C(C)SC)OC 527a_100000731041_100000149566 [0,1,1,0,0,0|2,0,0]=4 4451 B12R0.344 CCC(CNC(=O)C(O)CC)OC 240690a_100000731041_100011196387 [0,1,1,0,0,0|1,0,0]=3 4452 B12R0.344 CCC(CNC(=O)C(O)CO)OC 240690a_100000731041_100011215603 [0,1,1,0,0,0|2,0,0]=4 4453 B12R0.344 CCC(CNC(=O)N(C)CC)OC 2708a_100000731041_100000225621 [0,1,1,0,0,0|2,0,0]=4 4454 B12R0.344 CCC(CNC(=O)N(C)CC)OC 273464a_100000731041_100000225621 [0,1,1,0,0,0|2,0,0]=4 4455 B12R0.344 CCC(O)C(=O)CCC(OC)OC 1458a_100011196387_100000139399 [0,1,1,0,0,0|2,0,0]=4 4456 B12R0.344 CCC(O)C(=O)NCC(OC)OC 240690a_100000210479_100011196387 [0,1,1,0,0,0|2,0,0]=4 4457 B12R0.429 CCCS(=O)(=O)NCC(CC)OC 270084a_100000731041_100000211391 [0,1,1,0,0,0|2,0,0]=4 4458 B12R0.429 CCCS(=O)(=O)NCC(CC)OC 274078a_100000731041_100000211391 [0,1,1,0,0,0|2,0,0]=4 4459 B12R0.429 CCCS(=O)(=O)NCC(CC)OC 40a_100000731041_100000054278 [0,1,1,0,0,0|2,0,0]=4 4460 B12R0.446 CCCC(=O)NCC(C)(OC)OC 11a_100000732740_100000211992 [0,1,1,0,0,0|2,0,0]=4 4461 B12R0.446 CCCC(=O)NCC(C)(OC)OC 1626a_100000732740_100000211992 [0,1,1,0,0,0|2,0,0]=4 4462 B12R0.446 CCCC(=O)NCC(C)(OC)OC 527a_100000732740_100000211992 [0,1,1,0,0,0|2,0,0]=4 4463 B12R0.552 CCCC(CC)OCC(CC)OC 7a_100011934954_100011219200 [0,1,1,0,0,0|1,0,1]=4 4464 B12R0.69 CCCC(=O)CC(=O)C(C)OCC 1458a_100000739345_100000747444 [0,1,1,0,0,0|1,0,1]=4 4465 B12R0.69 CCCC(=O)CC(=O)[C@@H](O)CCC 1458a_100009822183_100000747444 [0,1,1,0,0,0|1,0,1]=4 4466 B12R0.69 CCCC(=O)N(C)CC(O)COC 240690a_100000739405_100000211992 [0,1,1,0,0,0|2,0,0]=4 4467 B12R0.69 CCCC(=O)N(C)CC(O)COC 527a_100000739405_100000211992 [0,1,1,0,0,0|2,0,0]=4 4468 B12R0.79 CCC(C)C(=O)NCC(O)COC 240690a_100000756049_100011192722 [0,1,1,0,0,0|2,0,0]=4 4469 B12R0.79 CCC(C)C(=O)NCC(O)COC 527a_100000756049_100011192722 [0,1,1,0,0,0|2,0,0]=4 4470 B12R0.79 CCC(O)C(=O)NCC(O)COC 240690a_100000756049_100011196387 [0,1,1,0,0,0|2,0,0]=4 4471 B12R0.79 CCCC(=O)OCC(=O)C(C)CC 1458a_100011192722_100000034017 [0,1,1,0,0,0|0,0,2]=4 4472 B12R0.79 CCCC(=O)OCC(=O)C(O)CC 1458a_100011196387_100000034017 [0,1,1,0,0,0|0,0,2]=4 4473 B12R0.79 CCCC(=O)OCN(C)C(C)CC 2230a_100000741768_100000034017 [0,1,1,0,0,0|2,0,0]=4 4474 B12R0.79 CCCC(=O)OCN(C)C(C)CC 269982a_100000741768_100000034017 [0,1,1,0,0,0|2,0,0]=4 4475 B12R0.272 CCCC(=O)NCC(O)CN(C)C 240690a_100000737402_100000211992 [0,1,1,0,0,0|2,0,0]=4 4476 B12R0.272 CCCC(=O)NCC(O)CN(C)C 527a_100000737402_100000211992 [0,1,1,0,0,0|2,0,0]=4 4477 B12R0.272 CCCC(=O)OCC(=O)CC(C)C 1458a_100000210554_100000034017 [0,1,1,0,0,0|0,0,2]=4 4478 B12R0.272 CCCC(=O)OCC(=O)C[C@@H](C)O 1458a_100011933948_100000034017 [0,1,1,0,0,0|0,0,2]=4 4479 B12R0.272 CCCC(=O)OCN(C)CC(C)C 2230a_100000747067_100000034017 [0,1,1,0,0,0|2,0,0]=4 4480 B12R0.272 CCCC(=O)OCN(C)CC(C)C 269982a_100000747067_100000034017 [0,1,1,0,0,0|2,0,0]=4 4481 B12R0.272 CCCC(=O)OCN(C)CC(C)O 2230a_100000227577_100000034017 [0,1,1,0,0,0|2,0,0]=4 4482 B12R0.272 CCCC(=O)OCN(C)CC(C)O 269982a_100000227577_100000034017 [0,1,1,0,0,0|2,0,0]=4 4483 B12R0.272 CCOC(=O)CCC(C)OC(C)C 34a_100000212225_100000748298 [0,1,1,0,0,0|2,0,0]=4 4484 B12R0.272 COCC(O)CNC(=O)CC(C)C 240690a_100000756049_100000210554 [0,1,1,0,0,0|2,0,0]=4 4485 B12R0.272 COCC(O)CNC(=O)CC(C)C 527a_100000756049_100000210554 [0,1,1,0,0,0|2,0,0]=4 4486 B12R0.272 COCC(O)CNC(=O)C[C@@H](C)O 240690a_100000756049_100011933948 [0,1,1,0,0,0|2,0,0]=4 4487 B12R1.7 CCCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000210210 [1,1,0,0,0,0|1,0,1]=4 4488 B12R1.35 CCCCNC(C)C1CCCO1 2230a_100025754208_100000210211 [1,1,0,0,0,0|1,0,1]=4 4489 B12R1.35 CCCCNC(C)C1CCCO1 34a_100025754208_100000210210 [1,1,0,0,0,0|1,0,1]=4 4490 B12R1.35 CCCCOC(C)C1CCCC1 34a_100011216366_100000210210 [1,1,0,0,0,0|1,0,1]=4 4491 B12R1.35 CCCCOC(C)C1CCCC1 7a_100011216366_100000210211 [1,1,0,0,0,0|1,0,1]=4 4492 B12R1.37 BrCCCCOCC1CCCC1 34a_100011216708_100000740388 [1,1,0,0,0,0|1,0,1]=4 4493 B12R1.37 BrCCCCOCC1OCCO1 34a_100011216708_100000755774 [1,1,0,0,0,0|1,0,1]=4 4494 B12R1.37 C#CCCCOCC1CCCO1 34a_100000210270_100000695029 [1,1,0,0,0,0|0,0,2]=4 4495 B12R1.37 C#CCCCOCC1CCCO1 7a_100000210270_100011215417 [1,1,0,0,0,0|0,0,2]=4 4496 B12R1.37 C#CCCCOCC1CCCO1 7a_100000215630_100000203698 [1,1,0,0,0,0|0,0,2]=4 4497 B12R1.37 C=CCCCOCC1CCCO1 34a_100000210270_100000757094 [1,1,0,0,0,0|0,0,2]=4 4498 B12R1.37 C=CCCCOCC1CCCO1 7a_100000210270_100000757094 [1,1,0,0,0,0|0,0,2]=4 4499 B12R1.37 C=CCCCOCC1CCCO1 7a_100000758997_100000203698 [1,1,0,0,0,0|0,0,2]=4 4500 B12R1.37 CC/C=C\CCOC1CCCO1 34a_100000085407_100015370543 [1,1,0,0,0,0|1,0,1]=4 4501 B12R1.37 CC/C=C\CNC[C@@H]1CCCO1 2230a_100020590478_100103147603 [1,1,0,0,0,0|1,0,1]=4 4502 B12R1.37 CC/C=C\CNC[C@@H]1CCCO1 34a_100020590478_100103147603 [1,1,0,0,0,0|1,0,1]=4 4503 B12R1.37 CC/C=C\COCC1CCCC1 34a_100000742336_100103147603 [1,1,0,0,0,0|1,0,1]=4 4504 B12R1.37 CC/C=C\COCC1CCCC1 34a_100016268518_100000740388 [1,1,0,0,0,0|1,0,1]=4 4505 B12R1.37 CC/C=C\COCC1CCCC1 7a_100000742336_100103147603 [1,1,0,0,0,0|1,0,1]=4 4506 B12R1.37 CC/C=C\COCC1CCCO1 34a_100000210270_100103147603 [1,1,0,0,0,0|0,0,1]=3 4507 B12R1.37 CC/C=C\COCC1CCCO1 7a_100000210270_100103147603 [1,1,0,0,0,0|0,0,1]=3 4508 B12R1.37 CC/C=C\COCC1COCO1 34a_100011216627_100103147603 [1,1,0,0,0,0|1,0,1]=4 4509 B12R1.37 CC/C=C\COCC1OCCO1 34a_100000087154_100103147603 [1,1,0,0,0,0|1,0,1]=4 4510 B12R1.37 CC/C=C\COCC1OCCO1 34a_100016268518_100000755774 [1,1,0,0,0,0|1,0,1]=4 4511 B12R1.37 CC/C=C\COC[C@H]1CCCN1 34a_100000745186_100103147603 [1,1,0,0,0,0|1,0,1]=4 4512 B12R1.37 CC/C=C\CSCC1CCCO1 62a_100000203698_100103147603 [1,1,0,0,0,0|0,1,1]=4 4513 B12R1.37 CC/C=C\CSCC1CCCO1 62a_100103147603_100000203698 [1,1,0,0,0,0|0,1,1]=4 4514 B12R1.37 CCC#CCOCC1CCCO1 34a_100000210270_100009813939 [1,1,0,0,0,0|0,0,2]=4 4515 B12R1.37 CCC#CCOCC1CCCO1 7a_100000210270_100009813939 [1,1,0,0,0,0|0,0,2]=4 4516 B12R1.37 CCC/C=C/COC1CCCC1 34a_100016278788_100000179811 [1,1,0,0,0,0|2,0,0]=4 4517 B12R1.37 CCC/C=C/COC1CCCC1 7a_100016278788_100000179811 [1,1,0,0,0,0|2,0,0]=4 4518 B12R1.37 CCCCCCOC1CCCO1 34a_100000085407_100000210314 [1,1,0,0,0,0|1,0,1]=4 4519 B12R1.37 CCCCCNCC1CCCO1 2230a_100000209983_100000203698 [1,1,0,0,0,0|1,0,1]=4 4520 B12R1.37 CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210326 [1,1,0,0,0,0|1,0,1]=4 4521 B12R1.37 CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000718602 [1,1,0,0,0,0|1,0,1]=4 4522 B12R1.37 CCCCCOCC1CCCC1 34a_100000210253_100000740388 [1,1,0,0,0,0|1,0,1]=4 4523 B12R1.37 CCCCCOCC1CCCC1 34a_100000742336_100000718602 [1,1,0,0,0,0|1,0,1]=4 4524 B12R1.37 CCCCCOCC1CCCC1 7a_100000210253_100000740388 [1,1,0,0,0,0|1,0,1]=4 4525 B12R1.37 CCCCCOCC1CCCC1 7a_100000742336_100000210326 [1,1,0,0,0,0|1,0,1]=4 4526 B12R1.37 CCCCCOCC1CCCO1 34a_100000210270_100000718602 [1,1,0,0,0,0|0,0,1]=3 4527 B12R1.37 CCCCCOCC1CCCO1 7a_100000210253_100000203698 [1,1,0,0,0,0|0,0,1]=3 4528 B12R1.37 CCCCCOCC1CCCO1 7a_100000210270_100000210326 [1,1,0,0,0,0|0,0,1]=3 4529 B12R1.37 CCCCCOCC1COCO1 34a_100011216627_100000718602 [1,1,0,0,0,0|1,0,1]=4 4530 B12R1.37 CCCCCOCC1OCCO1 34a_100000087154_100000718602 [1,1,0,0,0,0|1,0,1]=4 4531 B12R1.37 CCCCCOCC1OCCO1 34a_100000210253_100000755774 [1,1,0,0,0,0|1,0,1]=4 4532 B12R1.37 CCCCCOCC1OCCO1 7a_100000210253_100000755774 [1,1,0,0,0,0|1,0,1]=4 4533 B12R1.37 CCCCCOC[C@H]1CCCN1 34a_100000745186_100000718602 [1,1,0,0,0,0|1,0,1]=4 4534 B12R1.37 CCCCCSCC1CCCO1 62a_100000203698_100000210326 [1,1,0,0,0,0|0,1,1]=4 4535 B12R1.37 CCCCCSCC1CCCO1 62a_100000210326_100000203698 [1,1,0,0,0,0|0,1,1]=4 4536 B12R1.37 CCCCOCCC1CCCC1 34a_100000210227_100000760354 [1,1,0,0,0,0|1,0,1]=4 4537 B12R1.37 CCCCOCCC1CCCC1 34a_100000749090_100000210210 [1,1,0,0,0,0|1,0,1]=4 4538 B12R1.37 CCCCOCCC1CCCC1 7a_100000210227_100000760354 [1,1,0,0,0,0|1,0,1]=4 4539 B12R1.37 CCCCOCCC1CCCC1 7a_100000749090_100000210211 [1,1,0,0,0,0|1,0,1]=4 4540 B12R1.37 CCCCOCCC1OCCO1 34a_100000210227_100000740749 [1,1,0,0,0,0|1,0,1]=4 4541 B12R1.37 CCCCOCCC1OCCO1 7a_100000210227_100000740749 [1,1,0,0,0,0|1,0,1]=4 4542 B12R1.37 CCCCOCNC1CCCC1 2230a_100000211070_100011995733 [1,1,0,0,0,0|1,0,1]=4 4543 B12R1.37 CCCCOCNC1CCCC1 34a_100000211070_100011995733 [1,1,0,0,0,0|1,0,1]=4 4544 B12R1.37 CCCCOCOC1CCCC1 34a_100000210269_100011995733 [1,1,0,0,0,0|1,0,1]=4 4545 B12R1.37 CCCCOCOC1CCCO1 34a_100000085407_100011995733 [1,1,0,0,0,0|0,0,1]=3 4546 B12R1.37 CCCCOCSC1CCCC1 62a_100011217020_100011995733 [1,1,0,0,0,0|1,0,1]=4 4547 B12R1.37 CCCCOCSC1CCCC1 62a_100011995733_100000179811 [1,1,0,0,0,0|1,0,1]=4 4548 B12R1.37 CCCOCCOC1CCCO1 34a_100000085407_100011215938 [1,1,0,0,0,0|2,0,0]=4 4549 B12R1.37 CCOCCNCC1CCCO1 2230a_102516460346_100000203698 [1,1,0,0,0,0|1,0,1]=4 4550 B12R1.37 CCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215890 [1,1,0,0,0,0|1,0,1]=4 4551 B12R1.37 CCOCCNC[C@@H]1CCCO1 34a_100020590478_100000210147 [1,1,0,0,0,0|1,0,1]=4 4552 B12R1.37 CCOCCOCC1CCCC1 34a_100000210136_100000740388 [1,1,0,0,0,0|1,0,1]=4 4553 B12R1.37 CCOCCOCC1CCCC1 34a_100000742336_100000210147 [1,1,0,0,0,0|1,0,1]=4 4554 B12R1.37 CCOCCOCC1CCCC1 7a_100000210136_100000740388 [1,1,0,0,0,0|1,0,1]=4 4555 B12R1.37 CCOCCOCC1CCCC1 7a_100000742336_100011215890 [1,1,0,0,0,0|1,0,1]=4 4556 B12R1.37 CCOCCOCC1CCCO1 34a_100000210270_100000210147 [1,1,0,0,0,0|0,0,1]=3 4557 B12R1.37 CCOCCOCC1CCCO1 7a_100000210136_100000203698 [1,1,0,0,0,0|0,0,1]=3 4558 B12R1.37 CCOCCOCC1CCCO1 7a_100000210270_100011215890 [1,1,0,0,0,0|0,0,1]=3 4559 B12R1.37 CCOCCOCC1COCO1 34a_100011216627_100000210147 [1,1,0,0,0,0|1,0,1]=4 4560 B12R1.37 CCOCCOCC1OCCO1 34a_100000087154_100000210147 [1,1,0,0,0,0|1,0,1]=4 4561 B12R1.37 CCOCCOCC1OCCO1 34a_100000210136_100000755774 [1,1,0,0,0,0|1,0,1]=4 4562 B12R1.37 CCOCCOCC1OCCO1 7a_100000210136_100000755774 [1,1,0,0,0,0|1,0,1]=4 4563 B12R1.37 CCOCCOC[C@H]1CCCN1 34a_100000745186_100000210147 [1,1,0,0,0,0|1,0,1]=4 4564 B12R1.37 CCOCCSCC1CCCO1 62a_100000203698_100011215890 [1,1,0,0,0,0|0,1,1]=4 4565 B12R1.37 CCOCCSCC1CCCO1 62a_100000210147_100000203698 [1,1,0,0,0,0|0,1,1]=4 4566 B12R1.37 CCSCCNCC1CCCO1 2230a_100000106463_100000203698 [1,1,0,0,0,0|1,0,1]=4 4567 B12R1.37 CCSCCNC[C@@H]1CCCO1 2230a_100020590478_100000757381 [1,1,0,0,0,0|1,0,1]=4 4568 B12R1.37 CCSCCNC[C@@H]1CCCO1 34a_100020590478_100000757381 [1,1,0,0,0,0|1,0,1]=4 4569 B12R1.37 CCSCCOCC1CCCC1 34a_100000212035_100000740388 [1,1,0,0,0,0|1,0,1]=4 4570 B12R1.37 CCSCCOCC1CCCC1 34a_100000742336_100000757381 [1,1,0,0,0,0|1,0,1]=4 4571 B12R1.37 CCSCCOCC1CCCC1 7a_100000212035_100000740388 [1,1,0,0,0,0|1,0,1]=4 4572 B12R1.37 CCSCCOCC1CCCC1 7a_100000742336_100000757381 [1,1,0,0,0,0|1,0,1]=4 4573 B12R1.37 CCSCCOCC1CCCO1 34a_100000210270_100000757381 [1,1,0,0,0,0|0,0,1]=3 4574 B12R1.37 CCSCCOCC1CCCO1 7a_100000210270_100000757381 [1,1,0,0,0,0|0,0,1]=3 4575 B12R1.37 CCSCCOCC1CCCO1 7a_100000212035_100000203698 [1,1,0,0,0,0|0,0,1]=3 4576 B12R1.37 CCSCCOCC1COCO1 34a_100011216627_100000757381 [1,1,0,0,0,0|1,0,1]=4 4577 B12R1.37 CCSCCOCC1OCCO1 34a_100000087154_100000757381 [1,1,0,0,0,0|1,0,1]=4 4578 B12R1.37 CCSCCOCC1OCCO1 34a_100000212035_100000755774 [1,1,0,0,0,0|1,0,1]=4 4579 B12R1.37 CCSCCOCC1OCCO1 7a_100000212035_100000755774 [1,1,0,0,0,0|1,0,1]=4 4580 B12R1.37 CCSCCOC[C@H]1CCCN1 34a_100000745186_100000757381 [1,1,0,0,0,0|1,0,1]=4 4581 B12R1.37 CCSCCSCC1CCCO1 62a_100000203698_100000757381 [1,1,0,0,0,0|0,1,1]=4 4582 B12R1.37 CCSCCSCC1CCCO1 62a_100000757381_100000203698 [1,1,0,0,0,0|0,1,1]=4 4583 B12R1.37 CNCCCOCC1CCCC1 34a_100000213112_100000740388 [1,1,0,0,0,0|1,0,1]=4 4584 B12R1.37 CNCCCOCC1OCCO1 34a_100000213112_100000755774 [1,1,0,0,0,0|1,0,1]=4 4585 B12R1.37 COCCCNC[C@@H]1CCCO1 2230a_100020590478_100000740836 [1,1,0,0,0,0|1,0,1]=4 4586 B12R1.37 COCCCNC[C@@H]1CCCO1 34a_100020590478_100000740836 [1,1,0,0,0,0|1,0,1]=4 4587 B12R1.37 COCCCOCC1CCCC1 34a_100000740835_100000740388 [1,1,0,0,0,0|1,0,1]=4 4588 B12R1.37 COCCCOCC1CCCC1 34a_100000742336_100000740836 [1,1,0,0,0,0|1,0,1]=4 4589 B12R1.37 COCCCOCC1CCCC1 7a_100000742336_100000740836 [1,1,0,0,0,0|1,0,1]=4 4590 B12R1.37 COCCCOCC1CCCO1 34a_100000210270_100000740836 [1,1,0,0,0,0|0,0,1]=3 4591 B12R1.37 COCCCOCC1CCCO1 7a_100000210270_100000740836 [1,1,0,0,0,0|0,0,1]=3 4592 B12R1.37 COCCCOCC1COCO1 34a_100011216627_100000740836 [1,1,0,0,0,0|1,0,1]=4 4593 B12R1.37 COCCCOCC1OCCO1 34a_100000087154_100000740836 [1,1,0,0,0,0|1,0,1]=4 4594 B12R1.37 COCCCOCC1OCCO1 34a_100000740835_100000755774 [1,1,0,0,0,0|1,0,1]=4 4595 B12R1.37 COCCCOC[C@H]1CCCN1 34a_100000745186_100000740836 [1,1,0,0,0,0|1,0,1]=4 4596 B12R1.37 COCCCSCC1CCCO1 62a_100000203698_100000709357 [1,1,0,0,0,0|0,1,1]=4 4597 B12R1.37 COCCCSCC1CCCO1 62a_100000709357_100000203698 [1,1,0,0,0,0|0,1,1]=4 4598 B12R1.37 CSCCCNCC1CCCO1 2230a_100000749238_100000203698 [1,1,0,0,0,0|1,0,1]=4 4599 B12R1.37 CSCCCOCC1CCCC1 34a_100000690336_100000740388 [1,1,0,0,0,0|1,0,1]=4 4600 B12R1.37 CSCCCOCC1CCCC1 7a_100000690336_100000740388 [1,1,0,0,0,0|1,0,1]=4 4601 B12R1.37 CSCCCOCC1CCCO1 7a_100000690336_100000203698 [1,1,0,0,0,0|0,0,1]=3 4602 B12R1.37 CSCCCOCC1OCCO1 34a_100000690336_100000755774 [1,1,0,0,0,0|1,0,1]=4 4603 B12R1.37 CSCCCOCC1OCCO1 7a_100000690336_100000755774 [1,1,0,0,0,0|1,0,1]=4 4604 B12R1.37 ClCCCCOCC1CCCC1 34a_100000210776_100000740388 [1,1,0,0,0,0|1,0,1]=4 4605 B12R1.37 ClCCCCOCC1CCCC1 7a_100000210776_100000740388 [1,1,0,0,0,0|1,0,1]=4 4606 B12R1.37 ClCCCCOCC1CCCO1 7a_100000210776_100000203698 [1,1,0,0,0,0|0,0,1]=3 4607 B12R1.37 ClCCCCOCC1OCCO1 34a_100000210776_100000755774 [1,1,0,0,0,0|1,0,1]=4 4608 B12R1.37 ClCCCCOCC1OCCO1 7a_100000210776_100000755774 [1,1,0,0,0,0|1,0,1]=4 4609 B12R1.37 FCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729493 [1,1,0,0,0,0|1,0,1]=4 4610 B12R1.37 FCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729493 [1,1,0,0,0,0|1,0,1]=4 4611 B12R1.37 FCCCCOCC1CCCC1 34a_100000742336_100000729493 [1,1,0,0,0,0|1,0,1]=4 4612 B12R1.37 FCCCCOCC1CCCC1 34a_100011995726_100000740388 [1,1,0,0,0,0|1,0,1]=4 4613 B12R1.37 FCCCCOCC1CCCC1 7a_100000742336_100000729493 [1,1,0,0,0,0|1,0,1]=4 4614 B12R1.37 FCCCCOCC1CCCC1 7a_100011995726_100000740388 [1,1,0,0,0,0|1,0,1]=4 4615 B12R1.37 FCCCCOCC1CCCO1 34a_100000210270_100000729493 [1,1,0,0,0,0|0,0,1]=3 4616 B12R1.37 FCCCCOCC1CCCO1 7a_100000210270_100000729493 [1,1,0,0,0,0|0,0,1]=3 4617 B12R1.37 FCCCCOCC1CCCO1 7a_100011995726_100000203698 [1,1,0,0,0,0|0,0,1]=3 4618 B12R1.37 FCCCCOCC1COCO1 34a_100011216627_100000729493 [1,1,0,0,0,0|1,0,1]=4 4619 B12R1.37 FCCCCOCC1OCCO1 34a_100000087154_100000729493 [1,1,0,0,0,0|1,0,1]=4 4620 B12R1.37 FCCCCOCC1OCCO1 34a_100011995726_100000755774 [1,1,0,0,0,0|1,0,1]=4 4621 B12R1.37 FCCCCOCC1OCCO1 7a_100011995726_100000755774 [1,1,0,0,0,0|1,0,1]=4 4622 B12R1.37 FCCCCOC[C@H]1CCCN1 34a_100000745186_100000729493 [1,1,0,0,0,0|1,0,1]=4 4623 B12R1.37 FCCCCSCC1CCCO1 62a_100000203698_100000729493 [1,1,0,0,0,0|0,1,1]=4 4624 B12R1.37 FCCCCSCC1CCCO1 62a_100000729493_100000203698 [1,1,0,0,0,0|0,1,1]=4 4625 B12R1.37 ICCCCOCC1CCCC1 34a_200012148704_100000740388 [1,1,0,0,0,0|1,0,1]=4 4626 B12R1.37 ICCCCOCC1OCCO1 34a_200012148704_100000755774 [1,1,0,0,0,0|1,0,1]=4 4627 B12R1.37 N#CCCCOCC1CCCO1 7a_100000210270_100000687738 [1,1,0,0,0,0|0,0,2]=4 4628 B12R1.37 NCCCCOCC1CCCC1 34a_100000750430_100000740388 [1,1,0,0,0,0|1,0,1]=4 4629 B12R1.37 NCCCCOCC1OCCO1 34a_100000750430_100000755774 [1,1,0,0,0,0|1,0,1]=4 4630 B12R1.37 O=CCCCOCC1CCCO1 7a_100000210270_200011292268 [1,1,0,0,0,0|0,0,2]=4 4631 B12R1.37 OCCCCNCC1CCCO1 2230a_100000750430_100000203698 [1,1,0,0,0,0|1,0,1]=4 4632 B12R1.37 OCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210776 [1,1,0,0,0,0|1,0,1]=4 4633 B12R1.37 OCCCCNC[C@@H]1CCCO1 34a_100020590478_100011216708 [1,1,0,0,0,0|1,0,1]=4 4634 B12R1.37 OCCCCOCC1CCCC1 34a_100000742336_100011216708 [1,1,0,0,0,0|1,0,1]=4 4635 B12R1.37 OCCCCOCC1CCCC1 7a_100000742336_100000210776 [1,1,0,0,0,0|1,0,1]=4 4636 B12R1.37 OCCCCOCC1CCCO1 34a_100000210270_100011216708 [1,1,0,0,0,0|0,0,1]=3 4637 B12R1.37 OCCCCOCC1CCCO1 7a_100000210270_100000210776 [1,1,0,0,0,0|0,0,1]=3 4638 B12R1.37 OCCCCOCC1COCO1 34a_100011216627_100011216708 [1,1,0,0,0,0|1,0,1]=4 4639 B12R1.37 OCCCCOCC1OCCO1 34a_100000087154_100011216708 [1,1,0,0,0,0|1,0,1]=4 4640 B12R1.37 OCCCCOC[C@H]1CCCN1 34a_100000745186_100011216708 [1,1,0,0,0,0|1,0,1]=4 4641 B12R1.37 OCCCCSCC1CCCO1 62a_100000203698_100000210776 [1,1,0,0,0,0|0,1,1]=4 4642 B12R1.37 OCCCCSCC1CCCO1 62a_100000210776_100000203698 [1,1,0,0,0,0|0,1,1]=4 4643 B12R1.53 CCC=CC(=O)CC1CCCO1 1458a_100000212282_100000203698 [1,1,0,0,0,0|1,0,1]=4 4644 B12R1.53 CCCCC(=O)CC1CCCO1 1458a_100000210183_100000203698 [1,1,0,0,0,0|1,0,1]=4 4645 B12R1.53 CCCCN(C)CC1CCCO1 2230a_100000207549_100000203698 [1,1,0,0,0,0|1,0,1]=4 4646 B12R1.53 CCCCN(C)CC1CCCO1 2230a_100102946541_100000210211 [1,1,0,0,0,0|1,0,1]=4 4647 B12R1.53 CCCCN(C)CC1CCCO1 269982a_100000207549_100000183445 [1,1,0,0,0,0|1,0,1]=4 4648 B12R1.53 CCCCN(C)CC1CCCO1 269982a_100102946541_100000210211 [1,1,0,0,0,0|1,0,1]=4 4649 B12R1.53 CCCCN(C)CC1CCCO1 34a_100102946541_100000210210 [1,1,0,0,0,0|1,0,1]=4 4650 B12R1.255 C=C(C)CCOCC1CCCO1 34a_100000210270_100000730704 [1,1,0,0,0,0|0,0,2]=4 4651 B12R1.255 C=C(C)CCOCC1CCCO1 7a_100000210270_100000730704 [1,1,0,0,0,0|0,0,2]=4 4652 B12R1.255 CC(=O)CCOCC1CCCO1 7a_100000210270_100000053229 [1,1,0,0,0,0|0,0,2]=4 4653 B12R1.255 CC(=O)CCOCC1CCCO1 7a_100000759926_100000203698 [1,1,0,0,0,0|0,0,2]=4 4654 B12R1.255 CC(Br)CCOCC1CCCC1 34a_100009893172_100000740388 [1,1,0,0,0,0|1,0,1]=4 4655 B12R1.255 CC(Br)CCOCC1OCCO1 34a_100009893172_100000755774 [1,1,0,0,0,0|1,0,1]=4 4656 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 2230a_100020590478_100000210312 [1,1,0,0,0,0|1,0,1]=4 4657 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 269862a_100020590478_100000185833 [1,1,0,0,0,0|1,0,1]=4 4658 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 34a_100020590478_100000210312 [1,1,0,0,0,0|1,0,1]=4 4659 B12R1.255 CC(C)CCOCC1CCCC1 34a_100000210254_100000740388 [1,1,0,0,0,0|1,0,1]=4 4660 B12R1.255 CC(C)CCOCC1CCCC1 34a_100000742336_100000210312 [1,1,0,0,0,0|1,0,1]=4 4661 B12R1.255 CC(C)CCOCC1CCCC1 7a_100000210254_100000740388 [1,1,0,0,0,0|1,0,1]=4 4662 B12R1.255 CC(C)CCOCC1CCCC1 7a_100000742336_100000210626 [1,1,0,0,0,0|1,0,1]=4 4663 B12R1.255 CC(C)CCOCC1CCCO1 34a_100000210270_100000210312 [1,1,0,0,0,0|0,0,1]=3 4664 B12R1.255 CC(C)CCOCC1CCCO1 7a_100000210254_100000203698 [1,1,0,0,0,0|0,0,1]=3 4665 B12R1.255 CC(C)CCOCC1CCCO1 7a_100000210270_100000210626 [1,1,0,0,0,0|0,0,1]=3 4666 B12R1.255 CC(C)CCOCC1COCO1 34a_100011216627_100000210312 [1,1,0,0,0,0|1,0,1]=4 4667 B12R1.255 CC(C)CCOCC1OCCO1 34a_100000087154_100000210312 [1,1,0,0,0,0|1,0,1]=4 4668 B12R1.255 CC(C)CCOCC1OCCO1 34a_100000210254_100000755774 [1,1,0,0,0,0|1,0,1]=4 4669 B12R1.255 CC(C)CCOCC1OCCO1 7a_100000210254_100000755774 [1,1,0,0,0,0|1,0,1]=4 4670 B12R1.255 CC(C)CCOC[C@H]1CCCN1 34a_100000745186_100000210312 [1,1,0,0,0,0|1,0,1]=4 4671 B12R1.255 CC(C)CCSCC1CCCO1 62a_100000203698_100000210312 [1,1,0,0,0,0|0,1,1]=4 4672 B12R1.255 CC(C)CCSCC1CCCO1 62a_100000210312_100000203698 [1,1,0,0,0,0|0,1,1]=4 4673 B12R1.255 CC(C)OCOCC1CCCO1 34a_100000210270_100000709892 [1,1,0,0,0,0|1,0,1]=4 4674 B12R1.255 CC(O)CCNCC1CCCO1 2230a_200000755665_100000203698 [1,1,0,0,0,0|1,0,1]=4 4675 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 2230a_100020590478_100012276601 [1,1,0,0,0,0|1,0,1]=4 4676 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 34a_100020590478_100012276601 [1,1,0,0,0,0|1,0,1]=4 4677 B12R1.255 CC(O)CCOCC1CCCC1 34a_100000742336_100012276601 [1,1,0,0,0,0|1,0,1]=4 4678 B12R1.255 CC(O)CCOCC1CCCC1 7a_100000742336_100012276601 [1,1,0,0,0,0|1,0,1]=4 4679 B12R1.255 CC(O)CCOCC1CCCO1 34a_100000210270_100012276601 [1,1,0,0,0,0|0,0,1]=3 4680 B12R1.255 CC(O)CCOCC1CCCO1 7a_100000210270_100012276601 [1,1,0,0,0,0|0,0,1]=3 4681 B12R1.255 CC(O)CCOCC1COCO1 34a_100011216627_100012276601 [1,1,0,0,0,0|1,0,1]=4 4682 B12R1.255 CC(O)CCOCC1OCCO1 34a_100000087154_100012276601 [1,1,0,0,0,0|1,0,1]=4 4683 B12R1.255 CC(O)CCOC[C@H]1CCCN1 34a_100000745186_100012276601 [1,1,0,0,0,0|1,0,1]=4 4684 B12R1.255 CC(O)CCSCC1CCCO1 62a_100000203698_100012276601 [1,1,0,0,0,0|0,1,1]=4 4685 B12R1.255 CC(O)CCSCC1CCCO1 62a_100012276601_100000203698 [1,1,0,0,0,0|0,1,1]=4 4686 B12R1.255 CN(C)CCOCC1CCCO1 7a_100000210270_100000755713 [1,1,0,0,0,0|1,0,1]=4 4687 B12R1.255 C[C@@H](N)CCOCC1CCCC1 34a_100000706166_100000740388 [1,1,0,0,0,0|1,0,1]=4 4688 B12R1.255 C[C@@H](N)CCOCC1OCCO1 34a_100000706166_100000755774 [1,1,0,0,0,0|1,0,1]=4 4689 B12R1.372 CCCCOCC1CCCN1C 34a_100000743107_100000210210 [1,1,0,0,0,0|1,0,1]=4 4690 B12R1.477 CCC(=O)COCC1CCCO1 1458a_100011223388_100000210202 [1,1,0,0,0,0|0,0,2]=4 4691 B12R1.477 CCC(=O)COCC1CCCO1 7a_100000210270_100000747405 [1,1,0,0,0,0|0,0,2]=4 4692 B12R1.477 CCC(C)CNCC1CCCO1 2230a_100020588543_100000203698 [1,1,0,0,0,0|1,0,1]=4 4693 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 2230a_100020590478_100000748023 [1,1,0,0,0,0|1,0,1]=4 4694 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 270004a_100020590478_100000243153 [1,1,0,0,0,0|1,0,1]=4 4695 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 34a_100020590478_100000748023 [1,1,0,0,0,0|1,0,1]=4 4696 B12R1.477 CCC(C)COCC1CCCC1 34a_100000742336_100000748023 [1,1,0,0,0,0|1,0,1]=4 4697 B12R1.477 CCC(C)COCC1CCCC1 7a_100000742336_100000748023 [1,1,0,0,0,0|1,0,1]=4 4698 B12R1.477 CCC(C)COCC1CCCO1 34a_100000210270_100000748023 [1,1,0,0,0,0|0,0,1]=3 4699 B12R1.477 CCC(C)COCC1CCCO1 7a_100000210270_100000748023 [1,1,0,0,0,0|0,0,1]=3 4700 B12R1.477 CCC(C)COCC1COCO1 34a_100011216627_100000748023 [1,1,0,0,0,0|1,0,1]=4 4701 B12R1.477 CCC(C)COCC1OCCO1 34a_100000087154_100000748023 [1,1,0,0,0,0|1,0,1]=4 4702 B12R1.477 CCC(C)COC[C@H]1CCCN1 34a_100000745186_100000748023 [1,1,0,0,0,0|1,0,1]=4 4703 B12R1.477 CCC(C)CSCC1CCCO1 62a_100000203698_100000748023 [1,1,0,0,0,0|0,1,1]=4 4704 B12R1.477 CCC(C)CSCC1CCCO1 62a_100000748023_100000203698 [1,1,0,0,0,0|0,1,1]=4 4705 B12R1.477 CCC(O)CNCC1CCCO1 2230a_100011218483_100000203698 [1,1,0,0,0,0|1,0,1]=4 4706 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 2230a_100020590478_100011218378 [1,1,0,0,0,0|1,0,1]=4 4707 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 34a_100020590478_100011218378 [1,1,0,0,0,0|1,0,1]=4 4708 B12R1.477 CCC(O)COCC1CCCC1 34a_100000742336_100011218378 [1,1,0,0,0,0|1,0,1]=4 4709 B12R1.477 CCC(O)COCC1CCCC1 7a_100000742336_100011218378 [1,1,0,0,0,0|1,0,1]=4 4710 B12R1.477 CCC(O)COCC1CCCO1 34a_100000210270_100011218378 [1,1,0,0,0,0|0,0,1]=3 4711 B12R1.477 CCC(O)COCC1CCCO1 7a_100000210270_100011218378 [1,1,0,0,0,0|0,0,1]=3 4712 B12R1.477 CCC(O)COCC1COCO1 34a_100011216627_100011218378 [1,1,0,0,0,0|1,0,1]=4 4713 B12R1.477 CCC(O)COCC1OCCO1 34a_100000087154_100011218378 [1,1,0,0,0,0|1,0,1]=4 4714 B12R1.477 CCC(O)COC[C@H]1CCCN1 34a_100000745186_100011218378 [1,1,0,0,0,0|1,0,1]=4 4715 B12R1.477 CCC(O)CSCC1CCCO1 62a_100000203698_100011218378 [1,1,0,0,0,0|0,1,1]=4 4716 B12R1.477 CCC(O)CSCC1CCCO1 62a_100011218378_100000203698 [1,1,0,0,0,0|0,1,1]=4 4717 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 2230a_100020590478_100009816398 [1,1,0,0,0,0|1,0,1]=4 4718 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 34a_100020590478_100009816398 [1,1,0,0,0,0|1,0,1]=4 4719 B12R1.477 CC[C@H](C)COCC1CCCC1 34a_100000742336_100009816398 [1,1,0,0,0,0|1,0,1]=4 4720 B12R1.477 CC[C@H](C)COCC1CCCC1 7a_100000742336_100009816398 [1,1,0,0,0,0|1,0,1]=4 4721 B12R1.477 CC[C@H](C)COCC1CCCC1 7a_100009816381_100000740388 [1,1,0,0,0,0|1,0,1]=4 4722 B12R1.477 CC[C@H](C)COCC1CCCO1 34a_100000210270_100009816398 [1,1,0,0,0,0|0,0,1]=3 4723 B12R1.477 CC[C@H](C)COCC1CCCO1 7a_100000210270_100009816398 [1,1,0,0,0,0|0,0,1]=3 4724 B12R1.477 CC[C@H](C)COCC1CCCO1 7a_100009816381_100000203698 [1,1,0,0,0,0|0,0,1]=3 4725 B12R1.477 CC[C@H](C)COCC1COCO1 34a_100011216627_100009816398 [1,1,0,0,0,0|1,0,1]=4 4726 B12R1.477 CC[C@H](C)COCC1OCCO1 34a_100000087154_100009816398 [1,1,0,0,0,0|1,0,1]=4 4727 B12R1.477 CC[C@H](C)COCC1OCCO1 7a_100009816381_100000755774 [1,1,0,0,0,0|1,0,1]=4 4728 B12R1.477 CC[C@H](C)COC[C@H]1CCCN1 34a_100000745186_100009816398 [1,1,0,0,0,0|1,0,1]=4 4729 B12R1.477 CC[C@H](C)CSCC1CCCO1 62a_100000203698_100009816398 [1,1,0,0,0,0|0,1,1]=4 4730 B12R1.477 CC[C@H](C)CSCC1CCCO1 62a_100009816398_100000203698 [1,1,0,0,0,0|0,1,1]=4 4731 B12R1.477 C[C@@H](CO)COCC1CCCO1 34a_100000210270_100000059175 [1,1,0,0,0,0|1,0,1]=4 4732 B12R1.477 C[C@@H](CO)COCC1CCCO1 7a_100000210270_100000059175 [1,1,0,0,0,0|1,0,1]=4 4733 B12R1.477 OCC(O)COCC1CCCO1 34a_100000210270_100011219619 [1,1,0,0,0,0|1,0,1]=4 4734 B12R1.477 OCC(O)COCC1CCCO1 7a_100000210270_100011219619 [1,1,0,0,0,0|1,0,1]=4 4735 B12R1.477 OC[C@H](O)COCC1CCCO1 34a_100000210270_100009815848 [1,1,0,0,0,0|1,0,1]=4 4736 B12R1.477 OC[C@H](O)COCC1CCCO1 7a_100000210270_100009815848 [1,1,0,0,0,0|1,0,1]=4 4737 B12R1.477 O[C@@H](CF)COCC1CCCO1 34a_100000210270_100015614560 [1,1,0,0,0,0|1,0,1]=4 4738 B12R1.477 O[C@@H](CF)COCC1CCCO1 7a_100000210270_100015614560 [1,1,0,0,0,0|1,0,1]=4 4739 B12R1.1758 CCCCOCC1(CCCC1)N 34a_100000749328_100000210210 [1,1,0,0,0,0|1,0,1]=4 4740 B12R1.1758 CCCCOC[C@@]1(CCCN1)C 34a_100016195882_100000210210 [1,1,0,0,0,0|1,0,1]=4 4741 B12R1.15 CC(NC(=O)CO)C1CCCO1 240690a_100025754208_100000210174 [1,1,0,0,0,0|2,0,0]=4 4742 B12R1.15 CC(NC(=O)CO)C1CCCO1 527a_100025754208_100000210174 [1,1,0,0,0,0|2,0,0]=4 4743 B12R1.15 CCC(=O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100000747405 [1,1,0,0,0,0|1,0,1]=4 4744 B12R1.15 CCC(=O)NC(C)C1CCCC1 11a_100015185923_100000210414 [1,1,0,0,0,0|2,0,0]=4 4745 B12R1.15 CCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000210414 [1,1,0,0,0,0|2,0,0]=4 4746 B12R1.15 CCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000210414 [1,1,0,0,0,0|2,0,0]=4 4747 B12R1.15 CCC(=O)NC(C)C1CCCC1 527a_100015185923_100000210414 [1,1,0,0,0,0|2,0,0]=4 4748 B12R1.15 CCC(=O)NC(C)C1CCCO1 11a_100025754208_100000210414 [1,1,0,0,0,0|1,0,0]=3 4749 B12R1.15 CCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000210414 [1,1,0,0,0,0|1,0,0]=3 4750 B12R1.15 CCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000210414 [1,1,0,0,0,0|1,0,0]=3 4751 B12R1.15 CCC(=O)NC(C)C1CCCO1 527a_100025754208_100000210414 [1,1,0,0,0,0|1,0,0]=3 4752 B12R1.15 CNC(=O)NC(C)C1CCCO1 2708a_100025754208_106832991635 [1,1,0,0,0,0|2,0,0]=4 4753 B12R1.15 CNC(=O)NC(C)C1CCCO1 2708a_100102657272_100025754208 [1,1,0,0,0,0|2,0,0]=4 4754 B12R1.15 CNC(=O)NC(C)C1CCCO1 273464a_100025754208_100102657272 [1,1,0,0,0,0|2,0,0]=4 4755 B12R1.15 CNC(=O)NC(C)C1CCCO1 273464a_100102657272_100025754208 [1,1,0,0,0,0|2,0,0]=4 4756 B12R1.15 CNC(=O)NC(C)C1CCCO1 512a_100025754208_100102657272 [1,1,0,0,0,0|2,0,0]=4 4757 B12R1.15 CNC(=O)NC(C)C1CCCO1 512a_106832991638_100025754208 [1,1,0,0,0,0|2,0,0]=4 4758 B12R1.108 CCC(=O)N(C)CC1CCCO1 11a_100102946541_100000210414 [1,1,0,0,0,0|1,0,0]=3 4759 B12R1.108 CCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000210414 [1,1,0,0,0,0|1,0,0]=3 4760 B12R1.108 CCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000210414 [1,1,0,0,0,0|1,0,0]=3 4761 B12R1.108 CCC(=O)N(C)CC1CCCO1 527a_100102946541_100000210414 [1,1,0,0,0,0|1,0,0]=3 4762 B12R1.108 CCC(=O)N(C)CC1OCCO1 11a_200000032744_100000210414 [1,1,0,0,0,0|2,0,0]=4 4763 B12R1.108 CCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000210414 [1,1,0,0,0,0|2,0,0]=4 4764 B12R1.108 CCC(=O)N(C)CC1OCCO1 527a_200000032744_100000210414 [1,1,0,0,0,0|2,0,0]=4 4765 B12R1.108 CN(CC1CCCO1)C(=O)CO 240690a_100102946541_100000210174 [1,1,0,0,0,0|2,0,0]=4 4766 B12R1.108 CN(CC1CCCO1)C(=O)CO 527a_100102946541_100000210174 [1,1,0,0,0,0|2,0,0]=4 4767 B12R1.108 CNC(=O)C(=O)CC1CCCO1 1458a_100011218921_100000203698 [1,1,0,0,0,0|2,0,0]=4 4768 B12R1.108 CNC(=O)N(C)CC1CCCO1 2708a_100102657272_100102946541 [1,1,0,0,0,0|2,0,0]=4 4769 B12R1.108 CNC(=O)N(C)CC1CCCO1 273464a_100102657272_100102946541 [1,1,0,0,0,0|2,0,0]=4 4770 B12R1.196 CCC(C)(C)OCC1CCCO1 7a_100000210230_100000203698 [1,1,0,0,0,0|1,0,1]=4 4771 B12R1.196 CCC(C)(C)OCC1CCCO1 7a_100000210270_100000210677 [1,1,0,0,0,0|1,0,1]=4 4772 B12R1.196 CCS(=O)(=O)NC[C@@H]1CCCO1 270084a_100020590478_100000211323 [1,1,0,0,0,0|2,0,0]=4 4773 B12R1.196 CCS(=O)(=O)NC[C@@H]1CCCO1 274078a_100020590478_100000211323 [1,1,0,0,0,0|2,0,0]=4 4774 B12R1.196 CCS(=O)(=O)NC[C@@H]1CCCO1 40a_100020590478_100000053943 [1,1,0,0,0,0|2,0,0]=4 4775 B12R1.264 C=C(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000185857 [1,1,0,0,0,0|1,0,1]=4 4776 B12R1.264 C=C(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000185857 [1,1,0,0,0,0|1,0,1]=4 4777 B12R1.264 CC(C)C(=O)CCC1CCCC1 1458a_100000210198_100000760354 [1,1,0,0,0,0|2,0,0]=4 4778 B12R1.264 CC(C)C(=O)CCC1CCCC1 1458a_100000211120_100000210206 [1,1,0,0,0,0|2,0,0]=4 4779 B12R1.264 CC(C)C(=O)CCC1CCCO1 1458a_100011247709_100000210206 [1,1,0,0,0,0|1,0,0]=3 4780 B12R1.264 CC(C)C(=O)CCC1OCCO1 1458a_100000082924_100000210206 [1,1,0,0,0,0|2,0,0]=4 4781 B12R1.264 CC(C)C(=O)CCC1OCCO1 1458a_100000210198_100000740749 [1,1,0,0,0,0|2,0,0]=4 4782 B12R1.264 CC(C)C(=O)CCN1CCCO1 1458a_200015187630_100000210206 [1,1,0,0,0,0|2,0,0]=4 4783 B12R1.264 CC(C)C(=O)COC1CCCO1 34a_100000085407_100000753385 [1,1,0,0,0,0|2,0,0]=4 4784 B12R1.264 CC(C)C(=O)NCC1CCCC1 11a_100000737975_100000210198 [1,1,0,0,0,0|2,0,0]=4 4785 B12R1.264 CC(C)C(=O)NCC1CCCC1 1626a_100000737975_100000210198 [1,1,0,0,0,0|2,0,0]=4 4786 B12R1.264 CC(C)C(=O)NCC1CCCC1 240690a_100000737975_100000210198 [1,1,0,0,0,0|2,0,0]=4 4787 B12R1.264 CC(C)C(=O)NCC1CCCC1 527a_100000737975_100000210198 [1,1,0,0,0,0|2,0,0]=4 4788 B12R1.264 CC(C)C(=O)NCC1OCCO1 11a_100000036311_100000210198 [1,1,0,0,0,0|2,0,0]=4 4789 B12R1.264 CC(C)C(=O)NCC1OCCO1 1626a_100000036311_100000210198 [1,1,0,0,0,0|2,0,0]=4 4790 B12R1.264 CC(C)C(=O)NCC1OCCO1 527a_100000036311_100000210198 [1,1,0,0,0,0|2,0,0]=4 4791 B12R1.264 CC(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210198 [1,1,0,0,0,0|1,0,0]=3 4792 B12R1.264 CC(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210198 [1,1,0,0,0,0|1,0,0]=3 4793 B12R1.264 CC(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210198 [1,1,0,0,0,0|1,0,0]=3 4794 B12R1.264 CC(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210198 [1,1,0,0,0,0|1,0,0]=3 4795 B12R1.264 CC(C)C(C)OCC1CCCO1 7a_100000748068_100000203698 [1,1,0,0,0,0|1,0,1]=4 4796 B12R1.264 CC(F)C(=O)CCC1CCCC1 1458a_100000062450_100000760354 [1,1,0,0,0,0|2,0,0]=4 4797 B12R1.264 CC(F)C(=O)CCC1OCCO1 1458a_100000062450_100000740749 [1,1,0,0,0,0|2,0,0]=4 4798 B12R1.264 CC(F)C(=O)NCC1CCCC1 11a_100000737975_100000062450 [1,1,0,0,0,0|2,0,0]=4 4799 B12R1.264 CC(F)C(=O)NCC1CCCC1 1626a_100000737975_100000062450 [1,1,0,0,0,0|2,0,0]=4 4800 B12R1.264 CC(F)C(=O)NCC1CCCC1 240690a_100000737975_100000062450 [1,1,0,0,0,0|2,0,0]=4 4801 B12R1.264 CC(F)C(=O)NCC1CCCC1 527a_100000737975_100000062450 [1,1,0,0,0,0|2,0,0]=4 4802 B12R1.264 CC(F)C(=O)NCC1OCCO1 11a_100000036311_100000062450 [1,1,0,0,0,0|2,0,0]=4 4803 B12R1.264 CC(F)C(=O)NCC1OCCO1 1626a_100000036311_100000062450 [1,1,0,0,0,0|2,0,0]=4 4804 B12R1.264 CC(F)C(=O)NCC1OCCO1 527a_100000036311_100000062450 [1,1,0,0,0,0|2,0,0]=4 4805 B12R1.264 CC(F)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000062450 [1,1,0,0,0,0|1,0,0]=3 4806 B12R1.264 CC(F)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000062450 [1,1,0,0,0,0|1,0,0]=3 4807 B12R1.264 CC(F)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000062450 [1,1,0,0,0,0|1,0,0]=3 4808 B12R1.264 CC(F)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000062450 [1,1,0,0,0,0|1,0,0]=3 4809 B12R1.264 CN(C)C(=O)CCC1CCCO1 11a_100102631434_100011247709 [1,1,0,0,0,0|2,0,0]=4 4810 B12R1.264 CN(C)C(=O)CCC1CCCO1 1626a_100102631434_100011247709 [1,1,0,0,0,0|2,0,0]=4 4811 B12R1.264 CN(C)C(=O)CCC1CCCO1 240690a_100102631434_100011247709 [1,1,0,0,0,0|2,0,0]=4 4812 B12R1.264 CN(C)C(=O)CCC1CCCO1 527a_100102631434_100011247709 [1,1,0,0,0,0|2,0,0]=4 4813 B12R1.264 CN(C)C(=O)NC[C@@H]1CCCO1 2708a_100020590478_100102631434 [1,1,0,0,0,0|2,0,0]=4 4814 B12R1.264 C[C@@H](O)C(=O)CCC1CCCC1 1458a_100000717761_100000760354 [1,1,0,0,0,0|2,0,0]=4 4815 B12R1.264 C[C@@H](O)C(=O)CCC1OCCO1 1458a_100000717761_100000740749 [1,1,0,0,0,0|2,0,0]=4 4816 B12R1.264 C[C@@H](O)C(=O)NCC1CCCC1 240690a_100000737975_100000717761 [1,1,0,0,0,0|2,0,0]=4 4817 B12R1.264 C[C@@H](O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000717761 [1,1,0,0,0,0|1,0,0]=3 4818 B12R1.264 C[C@H](O)C(=O)CCC1CCCC1 1458a_217856618621_100000760354 [1,1,0,0,0,0|2,0,0]=4 4819 B12R1.264 C[C@H](O)C(=O)CCC1OCCO1 1458a_217856618621_100000740749 [1,1,0,0,0,0|2,0,0]=4 4820 B12R1.264 C[C@H](O)C(=O)NCC1CCCC1 1626a_100000737975_217856618621 [1,1,0,0,0,0|2,0,0]=4 4821 B12R1.264 C[C@H](O)C(=O)NCC1CCCC1 240690a_100000737975_217856618621 [1,1,0,0,0,0|2,0,0]=4 4822 B12R1.264 C[C@H](O)C(=O)NCC1OCCO1 1626a_100000036311_217856618621 [1,1,0,0,0,0|2,0,0]=4 4823 B12R1.264 C[C@H](O)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_217856618621 [1,1,0,0,0,0|1,0,0]=3 4824 B12R1.264 C[C@H](O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_217856618621 [1,1,0,0,0,0|1,0,0]=3 4825 B12R1.264 O=C(NC[C@@H]1CCCO1)C(F)F 11a_100020590478_100000210393 [1,1,0,0,0,0|2,0,0]=4 4826 B12R1.264 O=C(NC[C@@H]1CCCO1)C(F)F 1626a_100020590478_100000210393 [1,1,0,0,0,0|2,0,0]=4 4827 B12R1.264 O=C(NC[C@@H]1CCCO1)C(F)F 240690a_100020590478_100000210393 [1,1,0,0,0,0|2,0,0]=4 4828 B12R1.264 O=C(NC[C@@H]1CCCO1)C(F)F 527a_100020590478_100000210393 [1,1,0,0,0,0|2,0,0]=4 4829 B12R1.264 O=C(NC[C@@H]1CCCO1)C(O)O 240690a_100020590478_100000233687 [1,1,0,0,0,0|2,0,0]=4 4830 B12R1.297 C#CC(CC)OCC1CCCO1 7a_100000758843_100000203698 [1,1,0,0,0,0|1,0,1]=4 4831 B12R1.297 C=CC(CC)OCC1CCCO1 7a_100000766422_100000203698 [1,1,0,0,0,0|1,0,1]=4 4832 B12R1.297 CCC(CC)OCC1CCCO1 7a_100000210270_100000210505 [1,1,0,0,0,0|1,0,1]=4 4833 B12R1.297 CCC(CC)OCC1CCCO1 7a_100000688536_100000203698 [1,1,0,0,0,0|1,0,1]=4 4834 B12R1.353 CCC(=O)CCC1CCCN1C 1458a_100000210414_100000005710 [1,1,0,0,0,0|2,0,0]=4 4835 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000210414 [1,1,0,0,0,0|2,0,0]=4 4836 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000210414 [1,1,0,0,0,0|2,0,0]=4 4837 B12R1.1677 CCC(=O)CCC1(OCCO1)C 1458a_100000210414_100000758764 [1,1,0,0,0,0|2,0,0]=4 4838 B12R1.1677 CCC(=O)NCC1(CCCC1)O 11a_100000737848_100000210414 [1,1,0,0,0,0|2,0,0]=4 4839 B12R1.1677 CCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000210414 [1,1,0,0,0,0|2,0,0]=4 4840 B12R1.1677 CCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000210414 [1,1,0,0,0,0|2,0,0]=4 4841 B12R1.1677 CCC(=O)NCC1(CCCC1)O 527a_100000737848_100000210414 [1,1,0,0,0,0|2,0,0]=4 4842 B12R1.1677 CCC(=O)NCC1(OCCO1)C 11a_100000691740_100000210414 [1,1,0,0,0,0|2,0,0]=4 4843 B12R1.1677 CCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000210414 [1,1,0,0,0,0|2,0,0]=4 4844 B12R1.1677 CCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000210414 [1,1,0,0,0,0|2,0,0]=4 4845 B12R1.1677 CCC(=O)NCC1(OCCO1)C 527a_100000691740_100000210414 [1,1,0,0,0,0|2,0,0]=4 4846 B12R1.31 CCCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210303 [0,1,0,0,1,0|1,0,1]=4 4847 B12R1.31 CCCC(=O)CC1CCN(C1)C 1458a_100000211992_200000690779 [0,1,0,0,1,0|2,0,0]=4 4848 B12R1.31 CCCC(=O)CC1CNC(=O)O1 1458a_100000211992_100000181169 [0,1,0,0,1,0|1,0,1]=4 4849 B12R1.31 CCCC(=O)CC1COC(=O)O1 1458a_100000211992_100000073702 [0,1,0,0,1,0|1,0,1]=4 4850 B12R1.31 CCCC(=O)CN1CCC(C1)O 2230a_100011215560_100000747444 [0,1,0,0,1,0|2,0,0]=4 4851 B12R1.31 CCCC(=O)CN1CCC(C1)O 269982a_100011215560_100000747444 [0,1,0,0,1,0|2,0,0]=4 4852 B12R1.31 CCCC(=O)CN1CC[C@@H](C1)F 2230a_100015203821_100000747444 [0,1,0,0,1,0|2,0,0]=4 4853 B12R1.31 CCCC(=O)CN1CC[C@@H](C1)F 269982a_100015203821_100000747444 [0,1,0,0,1,0|2,0,0]=4 4854 B12R1.31 CCCC(=O)CN1CC[C@H](C1)C 2230a_100016987628_100000747444 [0,1,0,0,1,0|2,0,0]=4 4855 B12R1.31 CCCC(=O)CN1CC[C@H](C1)C 269982a_100016987628_100000747444 [0,1,0,0,1,0|2,0,0]=4 4856 B12R1.31 CCCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000211992_100015189358 [0,1,0,0,1,0|1,0,1]=4 4857 B12R1.31 CCCC(=O)N[C@H]1CC[C@H](C1)O 1626a_100015195300_100000211992 [0,1,0,0,1,0|2,0,0]=4 4858 B12R1.31 CCCC(=O)N[C@H]1CC[C@H](C1)O 240690a_100015195300_100000211992 [0,1,0,0,1,0|2,0,0]=4 4859 B12R1.55 CCCC(=O)C(C)N1CCCC1 1458a_100025750167_100000210303 [0,1,0,0,1,0|2,0,0]=4 4860 B12R1.55 CCCC(=O)N(C)C1CCCC1 11a_100000207505_100000211992 [0,1,0,0,1,0|2,0,0]=4 4861 B12R1.55 CCCC(=O)N(C)C1CCCC1 1626a_100000207505_100000211992 [0,1,0,0,1,0|2,0,0]=4 4862 B12R1.55 CCCC(=O)N(C)C1CCCC1 240690a_100000207505_100000211992 [0,1,0,0,1,0|2,0,0]=4 4863 B12R1.55 CCCC(=O)N(C)C1CCCC1 527a_100000207505_100000211992 [0,1,0,0,1,0|2,0,0]=4 4864 B12R1.72 CCCN(CC)CC1CCCO1 2230a_100000186375_100000210303 [0,1,0,0,1,0|2,0,0]=4 4865 B12R1.72 CCCN(CC)CC1CCCO1 2230a_100000226822_100000203698 [0,1,0,0,1,0|2,0,0]=4 4866 B12R1.72 CCCN(CC)CC1CCCO1 2230a_100000226859_100000210202 [0,1,0,0,1,0|2,0,0]=4 4867 B12R1.72 CCCN(CC)CC1CCCO1 269982a_100000186375_100000210303 [0,1,0,0,1,0|2,0,0]=4 4868 B12R1.72 CCCN(CC)CC1CCCO1 269982a_100000226822_100000183445 [0,1,0,0,1,0|2,0,0]=4 4869 B12R1.72 CCCN(CC)CC1CCCO1 269982a_100000226859_100000204670 [0,1,0,0,1,0|2,0,0]=4 4870 B12R1.72 CCCN(CC)CC1CCCO1 34a_100000186375_100000210303 [0,1,0,0,1,0|2,0,0]=4 4871 B12R1.72 CCCN(CC)CC1CCCO1 34a_100000226859_100000210202 [0,1,0,0,1,0|2,0,0]=4 4872 B12R1.72 CCCN(CF)CC1CCCO1 269982a_100000226859_100015361967 [0,1,0,0,1,0|2,0,0]=4 4873 B12R1.72 CCCN(CF)CC1CCCO1 34a_100000226859_100015361967 [0,1,0,0,1,0|2,0,0]=4 4874 B12R1.260 C=C(C)CC(=O)CC1CCCC1 1458a_100000210891_100000748629 [0,1,0,0,1,0|1,0,1]=4 4875 B12R1.260 CC(=CC(=O)CC1CCCO1)C 1458a_100000211388_100000203698 [0,1,0,0,1,0|0,0,2]=4 4876 B12R1.260 CC(=CC(=O)CC1CCCO1)Cl 1458a_200042562850_100000203698 [0,1,0,0,1,0|0,0,2]=4 4877 B12R1.260 CC(=CC(=O)CC1CCCO1)I 1458a_100025716642_100000203698 [0,1,0,0,1,0|0,0,2]=4 4878 B12R1.260 CC(C)CC(=O)CC1=CCCC1 1458a_100000050221_100000210624 [0,1,0,0,1,0|1,0,1]=4 4879 B12R1.260 CC(C)CC(=O)CC1C=CCC1 1458a_100000212241_100000210624 [0,1,0,0,1,0|1,0,1]=4 4880 B12R1.260 CC(C)CC(=O)CC1CCCC1 1458a_100000210554_100000740388 [0,1,0,0,1,0|1,0,0]=3 4881 B12R1.260 CC(C)CC(=O)CC1CCCC1 1458a_100000210891_100000210624 [0,1,0,0,1,0|1,0,0]=3 4882 B12R1.260 CC(C)CC(=O)CC1CCCO1 1458a_100000210554_100000203698 [0,1,0,0,1,0|0,0,0]=2 4883 B12R1.260 CC(C)CC(=O)CC1CCOC1 1458a_100000210554_100000702531 [0,1,0,0,1,0|2,0,0]=4 4884 B12R1.260 CC(C)CC(=O)CC1CCOC1 1458a_100011218419_100000210624 [0,1,0,0,1,0|2,0,0]=4 4885 B12R1.260 CC(C)CC(=O)CC1OCCO1 1458a_100000210554_100000755774 [0,1,0,0,1,0|1,0,0]=3 4886 B12R1.260 CC(C)CC(=O)CN1CCCC1 1458a_100000740243_100000210624 [0,1,0,0,1,0|2,0,0]=4 4887 B12R1.260 CC(C)CC(=O)NC1CCCC1 11a_100000211070_100000210554 [0,1,0,0,1,0|2,0,0]=4 4888 B12R1.260 CC(C)CC(=O)NC1CCCC1 1626a_100000211070_100000210554 [0,1,0,0,1,0|2,0,0]=4 4889 B12R1.260 CC(C)CC(=O)NC1CCCC1 240690a_100000211070_100000210554 [0,1,0,0,1,0|2,0,0]=4 4890 B12R1.260 CC(C)CC(=O)NC1CCCC1 527a_100000211070_100000210554 [0,1,0,0,1,0|2,0,0]=4 4891 B12R1.260 CC(C)CC(C)OC1CCCO1 34a_100000085407_100000731052 [0,1,0,0,1,0|1,0,1]=4 4892 B12R1.260 CC(C)CN(C)CC1CCCO1 2230a_100000747067_100000203698 [0,1,0,0,1,0|2,0,0]=4 4893 B12R1.260 CC(C)CN(C)CC1CCCO1 2230a_100102946541_100000210760 [0,1,0,0,1,0|2,0,0]=4 4894 B12R1.260 CC(C)CN(C)CC1CCCO1 269982a_100000747067_100000183445 [0,1,0,0,1,0|2,0,0]=4 4895 B12R1.260 CC(C)CN(C)CC1CCCO1 269982a_100102946541_100000210624 [0,1,0,0,1,0|2,0,0]=4 4896 B12R1.260 CC(C)CN(C)CC1CCCO1 270004a_100102946541_100000210432 [0,1,0,0,1,0|2,0,0]=4 4897 B12R1.260 CC(C)CN(C)CC1CCCO1 34a_100102946541_100000210624 [0,1,0,0,1,0|2,0,0]=4 4898 B12R1.260 CC(C)NC(=O)CC1CCCC1 11a_100138425928_100000210891 [0,1,0,0,1,0|2,0,0]=4 4899 B12R1.260 CC(C)NC(=O)CC1CCCC1 1626a_100138425928_100000210891 [0,1,0,0,1,0|2,0,0]=4 4900 B12R1.260 CC(C)NC(=O)CC1CCCC1 240690a_100138425928_100000210891 [0,1,0,0,1,0|2,0,0]=4 4901 B12R1.260 CC(C)NC(=O)CC1CCCC1 527a_100138425928_100000210891 [0,1,0,0,1,0|2,0,0]=4 4902 B12R1.260 CC(O)CC(=O)CC1=CCCC1 1458a_100000050221_100011218427 [0,1,0,0,1,0|1,0,1]=4 4903 B12R1.260 CC(O)CC(=O)CC1C=CCC1 1458a_100000212241_100011218427 [0,1,0,0,1,0|1,0,1]=4 4904 B12R1.260 CC(O)CC(=O)CC1CCCC1 1458a_100000210891_100011218427 [0,1,0,0,1,0|1,0,0]=3 4905 B12R1.260 CC(O)CC(=O)CC1CCOC1 1458a_100011218419_100011218427 [0,1,0,0,1,0|2,0,0]=4 4906 B12R1.260 CC(O)CC(=O)CN1CCCC1 1458a_100000740243_100011218427 [0,1,0,0,1,0|2,0,0]=4 4907 B12R1.260 CC(O)CN(C)CC1CCCO1 2230a_100000227577_100000203698 [0,1,0,0,1,0|2,0,0]=4 4908 B12R1.260 CC(O)CN(C)CC1CCCO1 2230a_100102946541_100011218427 [0,1,0,0,1,0|2,0,0]=4 4909 B12R1.260 CC(O)CN(C)CC1CCCO1 269982a_100000227577_100000183445 [0,1,0,0,1,0|2,0,0]=4 4910 B12R1.260 CC(O)CN(C)CC1CCCO1 269982a_100102946541_100011218427 [0,1,0,0,1,0|2,0,0]=4 4911 B12R1.260 CC(O)CN(C)CC1CCCO1 34a_100102946541_100011218427 [0,1,0,0,1,0|2,0,0]=4 4912 B12R1.260 CN(C)CC(=O)CC1CCCC1 1458a_100000750896_100000740388 [0,1,0,0,1,0|2,0,0]=4 4913 B12R1.260 CN(C)CC(=O)CC1CCCO1 1458a_100000750896_100000203698 [0,1,0,0,1,0|1,0,0]=3 4914 B12R1.260 CN(C)CC(=O)CC1OCCO1 1458a_100000750896_100000755774 [0,1,0,0,1,0|2,0,0]=4 4915 B12R1.260 C[C@@H](O)CC(=O)CC1CCCC1 1458a_100011933948_100000740388 [0,1,0,0,1,0|1,0,0]=3 4916 B12R1.260 C[C@@H](O)CC(=O)CC1CCCO1 1458a_100011933948_100000203698 [0,1,0,0,1,0|0,0,0]=2 4917 B12R1.260 C[C@@H](O)CC(=O)CC1CCOC1 1458a_100011933948_100000702531 [0,1,0,0,1,0|2,0,0]=4 4918 B12R1.260 C[C@@H](O)CC(=O)CC1OCCO1 1458a_100011933948_100000755774 [0,1,0,0,1,0|1,0,0]=3 4919 B12R1.260 C[C@@H](O)CC(=O)NC1CCCC1 240690a_100000211070_100011933948 [0,1,0,0,1,0|2,0,0]=4 4920 B12R1.260 C[C@@H](O)CN(C)CC1CCCO1 2230a_100102946541_100009817552 [0,1,0,0,1,0|2,0,0]=4 4921 B12R1.260 C[C@@H](O)CN(C)CC1CCCO1 269982a_100102946541_100009817552 [0,1,0,0,1,0|2,0,0]=4 4922 B12R1.260 C[C@@H](O)CN(C)CC1CCCO1 34a_100102946541_100009817552 [0,1,0,0,1,0|2,0,0]=4 4923 B12R1.260 C[S+](C)CC(=O)CC1CCCC1 1458a_200159257847_100000740388 [0,1,0,0,1,0|2,0,0]=4 4924 B12R1.260 C[S+](C)CC(=O)CC1CCCO1 1458a_200159257847_100000203698 [0,1,0,0,1,0|1,0,0]=3 4925 B12R1.260 C[S+](C)CC(=O)CC1OCCO1 1458a_200159257847_100000755774 [0,1,0,0,1,0|2,0,0]=4 4926 B12R1.260 NC(=O)CC(=O)CC1CCCO1 1458a_100134613110_100000203698 [0,1,0,0,1,0|1,0,1]=4 4927 B12R1.260 O=C(CC(F)F)CC1CCCC1 1458a_100000210891_100011934356 [0,1,0,0,1,0|2,0,0]=4 4928 B12R1.318 CCCC(=O)CN1CCCC1=O 1458a_100000189602_100000210303 [0,1,0,0,1,0|2,0,0]=4 4929 B12R1.318 CCCC(=O)CN1CCC[C@@H]1C 2230a_100020605311_100000747444 [0,1,0,0,1,0|2,0,0]=4 4930 B12R1.318 CCCC(=O)CN1CCC[C@@H]1C 269982a_100020605311_100000747444 [0,1,0,0,1,0|2,0,0]=4 4931 B12R1.318 CCCC(=O)CN1CCC[C@H]1C 2230a_100015189458_100000747444 [0,1,0,0,1,0|2,0,0]=4 4932 B12R1.318 CCCC(=O)CN1CCC[C@H]1C 269982a_100015189458_100000747444 [0,1,0,0,1,0|2,0,0]=4 4933 B12R1.318 CCCC(=O)N[C@H]1CCC[C@@H]1O 11a_100000748460_100000211992 [0,1,0,0,1,0|2,0,0]=4 4934 B12R1.318 CCCC(=O)N[C@H]1CCC[C@@H]1O 240690a_100000748460_100000211992 [0,1,0,0,1,0|2,0,0]=4 4935 B12R1.1618 CC1(OCCO1)CC(=O)CCF 1458a_100000137474_100011217306 [0,1,0,0,1,0|2,0,0]=4 4936 B12R1.1618 CC1(OCCO1)CC(=O)CCO 1458a_100000137474_100000211926 [0,1,0,0,1,0|2,0,0]=4 4937 B12R1.1618 CCCC(=O)CC1(OCCO1)C 1458a_100000137474_100000210303 [0,1,0,0,1,0|1,0,0]=3 4938 B12R1.1618 CCNC(=O)CC1(OCCO1)C 11a_100015525214_100000137474 [0,1,0,0,1,0|2,0,0]=4 4939 B12R1.1618 CCNC(=O)CC1(OCCO1)C 527a_100015525214_100000137474 [0,1,0,0,1,0|2,0,0]=4 4940 B12R1.137 C#CC(CCC)OCC1CCC1 34a_200011217317_100000763275 [0,1,0,0,1,0|1,0,1]=4 4941 B12R1.137 C#CC(CCC)OCC1CCC1 7a_200011217317_100000763275 [0,1,0,0,1,0|1,0,1]=4 4942 B12R1.137 C#CC(CCC)OCC1CCO1 34a_200011217317_100000103362 [0,1,0,0,1,0|1,0,1]=4 4943 B12R1.137 C#CC(CCC)OCC1CCO1 7a_200011217317_100000103362 [0,1,0,0,1,0|1,0,1]=4 4944 B12R1.137 C=CC(CCC)OCC1CCC1 34a_100011216692_100000763275 [0,1,0,0,1,0|1,0,1]=4 4945 B12R1.137 C=CC(CCC)OCC1CCC1 7a_100011216692_100000763275 [0,1,0,0,1,0|1,0,1]=4 4946 B12R1.137 C=CC(CCC)OCC1CCO1 34a_100011216692_100000103362 [0,1,0,0,1,0|1,0,1]=4 4947 B12R1.137 C=CC(CCC)OCC1CCO1 7a_100011216692_100000103362 [0,1,0,0,1,0|1,0,1]=4 4948 B12R1.137 CCCC(C#N)OCC1CCC1 34a_100000686963_100000763275 [0,1,0,0,1,0|1,0,1]=4 4949 B12R1.137 CCCC(C#N)OCC1CCC1 7a_100000686963_100000763275 [0,1,0,0,1,0|1,0,1]=4 4950 B12R1.137 CCCC(C#N)OCC1CCO1 34a_100000686963_100000103362 [0,1,0,0,1,0|1,0,1]=4 4951 B12R1.137 CCCC(C#N)OCC1CCO1 7a_100000686963_100000103362 [0,1,0,0,1,0|1,0,1]=4 4952 B12R1.137 CCCC(CC)OCC1CCC1 34a_100000687864_100000763275 [0,1,0,0,1,0|1,0,1]=4 4953 B12R1.137 CCCC(CC)OCC1CCC1 7a_100000687864_100000763275 [0,1,0,0,1,0|1,0,1]=4 4954 B12R1.137 CCCC(CC)OCC1CCO1 34a_100000687864_100000103362 [0,1,0,0,1,0|1,0,1]=4 4955 B12R1.137 CCCC(CC)OCC1CCO1 7a_100000687864_100000103362 [0,1,0,0,1,0|1,0,1]=4 4956 B12R1.311 CCCC(=O)CCC1CCC1=O 1458a_100000211992_200016118888 [0,1,0,0,1,0|1,0,1]=4 4957 B12R1.311 CCCC(=O)OCN1CCC1C 269982a_100000755817_100000034017 [0,1,0,0,1,0|1,0,0]=3 4958 B12R1.311 CCCC(=O)OCN1CCC1C 34a_100000755817_100000034017 [0,1,0,0,1,0|1,0,0]=3 4959 B12R1.463 C#CCCC(=O)NCC1CCC1 11a_100000738700_100000692101 [0,1,0,0,1,0|1,0,1]=4 4960 B12R1.463 C#CCCC(=O)NCC1CCC1 1626a_100000738700_100000692101 [0,1,0,0,1,0|1,0,1]=4 4961 B12R1.463 C#CCCC(=O)NCC1CCC1 240690a_100000738700_100000692101 [0,1,0,0,1,0|1,0,1]=4 4962 B12R1.463 C#CCCC(=O)NCC1CCC1 527a_100000738700_100000692101 [0,1,0,0,1,0|1,0,1]=4 4963 B12R1.463 C#CCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000692101 [0,1,0,0,1,0|1,0,1]=4 4964 B12R1.463 C#CCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000692101 [0,1,0,0,1,0|1,0,1]=4 4965 B12R1.463 C#CCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000692101 [0,1,0,0,1,0|1,0,1]=4 4966 B12R1.463 C#CCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000692101 [0,1,0,0,1,0|1,0,1]=4 4967 B12R1.463 C=CCCC(=O)NCC1CCC1 11a_100000738700_100000749702 [0,1,0,0,1,0|1,0,1]=4 4968 B12R1.463 C=CCCC(=O)NCC1CCC1 1626a_100000738700_100000749702 [0,1,0,0,1,0|1,0,1]=4 4969 B12R1.463 C=CCCC(=O)NCC1CCC1 240690a_100000738700_100000749702 [0,1,0,0,1,0|1,0,1]=4 4970 B12R1.463 C=CCCC(=O)NCC1CCC1 527a_100000738700_100000749702 [0,1,0,0,1,0|1,0,1]=4 4971 B12R1.463 C=CCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000749702 [0,1,0,0,1,0|1,0,1]=4 4972 B12R1.463 C=CCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000749702 [0,1,0,0,1,0|1,0,1]=4 4973 B12R1.463 C=CCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000749702 [0,1,0,0,1,0|1,0,1]=4 4974 B12R1.463 C=CCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000749702 [0,1,0,0,1,0|1,0,1]=4 4975 B12R1.463 CC(CCCCl)OCC1CCC1 34a_200000718107_100000763275 [0,1,0,0,1,0|1,0,1]=4 4976 B12R1.463 CC(CCCCl)OCC1CCC1 7a_200000718107_100000763275 [0,1,0,0,1,0|1,0,1]=4 4977 B12R1.463 CC(CCCCl)OCC1CCO1 34a_200000718107_100000103362 [0,1,0,0,1,0|1,0,1]=4 4978 B12R1.463 CC(CCCCl)OCC1CCO1 7a_200000718107_100000103362 [0,1,0,0,1,0|1,0,1]=4 4979 B12R1.463 CC=CCC(=O)NCC1CCC1 11a_100000738700_100121576822 [0,1,0,0,1,0|1,0,1]=4 4980 B12R1.463 CC=CCC(=O)NCC1CCC1 1626a_100000738700_100121576822 [0,1,0,0,1,0|1,0,1]=4 4981 B12R1.463 CC=CCC(=O)NCC1CCC1 240690a_100000738700_100121576822 [0,1,0,0,1,0|1,0,1]=4 4982 B12R1.463 CC=CCC(=O)NCC1CCC1 527a_100000738700_100121576822 [0,1,0,0,1,0|1,0,1]=4 4983 B12R1.463 CC=CCC(=O)NC[C@@H]1CCO1 11a_100020831831_100121576822 [0,1,0,0,1,0|1,0,1]=4 4984 B12R1.463 CC=CCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100121576822 [0,1,0,0,1,0|1,0,1]=4 4985 B12R1.463 CC=CCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100121576822 [0,1,0,0,1,0|1,0,1]=4 4986 B12R1.463 CC=CCC(=O)NC[C@@H]1CCO1 527a_100020831831_100121576822 [0,1,0,0,1,0|1,0,1]=4 4987 B12R1.463 CCC=CC(=O)NCC1CCC1 11a_100000738700_100000212282 [0,1,0,0,1,0|1,0,1]=4 4988 B12R1.463 CCC=CC(=O)NCC1CCC1 1626a_100000738700_100000212282 [0,1,0,0,1,0|1,0,1]=4 4989 B12R1.463 CCC=CC(=O)NCC1CCC1 240690a_100000738700_100000212282 [0,1,0,0,1,0|1,0,1]=4 4990 B12R1.463 CCC=CC(=O)NC[C@@H]1CCO1 11a_100020831831_100000212282 [0,1,0,0,1,0|1,0,1]=4 4991 B12R1.463 CCC=CC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000212282 [0,1,0,0,1,0|1,0,1]=4 4992 B12R1.463 CCC=CC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000212282 [0,1,0,0,1,0|1,0,1]=4 4993 B12R1.463 CCCCC(=O)NCC1CCC1 11a_100000738700_100000210183 [0,1,0,0,1,0|1,0,0]=3 4994 B12R1.463 CCCCC(=O)NCC1CCC1 1626a_100000738700_100000210183 [0,1,0,0,1,0|1,0,0]=3 4995 B12R1.463 CCCCC(=O)NCC1CCC1 240690a_100000738700_100000210183 [0,1,0,0,1,0|1,0,0]=3 4996 B12R1.463 CCCCC(=O)NCC1CCC1 527a_100000738700_100000210183 [0,1,0,0,1,0|1,0,0]=3 4997 B12R1.463 CCCCC(=O)NCC1COC1 11a_100015281925_100000210183 [0,1,0,0,1,0|2,0,0]=4 4998 B12R1.463 CCCCC(=O)NCC1COC1 1626a_100015281925_100000210183 [0,1,0,0,1,0|2,0,0]=4 4999 B12R1.463 CCCCC(=O)NCC1COC1 240690a_100015281925_100000210183 [0,1,0,0,1,0|2,0,0]=4 5000 B12R1.463 CCCCC(=O)NCC1COC1 527a_100015281925_100000210183 [0,1,0,0,1,0|2,0,0]=4 5001 B12R1.463 CCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210183 [0,1,0,0,1,0|1,0,0]=3 5002 B12R1.463 CCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210183 [0,1,0,0,1,0|1,0,0]=3 5003 B12R1.463 CCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210183 [0,1,0,0,1,0|1,0,0]=3 5004 B12R1.463 CCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210183 [0,1,0,0,1,0|1,0,0]=3 5005 B12R1.463 CCCCC(=O)NNC1CCC1 22a_100000736358_100000210183 [0,1,0,0,1,0|2,0,0]=4 5006 B12R1.463 CCCCC(C)OCC1CCC1 34a_100000687866_100000763275 [0,1,0,0,1,0|1,0,1]=4 5007 B12R1.463 CCCCC(C)OCC1CCC1 34a_100000760304_200011215066 [0,1,0,0,1,0|1,0,1]=4 5008 B12R1.463 CCCCC(C)OCC1CCC1 7a_100000687866_100000763275 [0,1,0,0,1,0|1,0,1]=4 5009 B12R1.463 CCCCC(C)OCC1CCO1 34a_100000039022_200011215066 [0,1,0,0,1,0|1,0,1]=4 5010 B12R1.463 CCCCC(C)OCC1CCO1 34a_100000687866_100000103362 [0,1,0,0,1,0|1,0,1]=4 5011 B12R1.463 CCCCC(C)OCC1CCO1 7a_100000687866_100000103362 [0,1,0,0,1,0|1,0,1]=4 5012 B12R1.463 CCCNC(=O)CNC1CCC1 2230a_100000749019_100000183358 [0,1,0,0,1,0|2,0,0]=4 5013 B12R1.463 CCCNC(=O)CNC1CCC1 270004a_100000174927_100000241760 [0,1,0,0,1,0|2,0,0]=4 5014 B12R1.463 CCCNC(=O)CNC1CCC1 34a_100000749019_100000183358 [0,1,0,0,1,0|2,0,0]=4 5015 B12R1.463 CCCNC(=O)COC1CCC1 34a_100000748187_100000183358 [0,1,0,0,1,0|2,0,0]=4 5016 B12R1.463 CCCNC(=O)CSC1CCC1 62a_100000183358_100000749161 [0,1,0,0,1,0|2,0,0]=4 5017 B12R1.463 CCCNC(=O)NCC1CCC1 2708a_100000738700_100020643023 [0,1,0,0,1,0|1,0,0]=3 5018 B12R1.463 CCCNC(=O)NCC1CCC1 2708a_100020643023_100000738700 [0,1,0,0,1,0|1,0,0]=3 5019 B12R1.463 CCCNC(=O)NCC1CCC1 273464a_100000738700_100020643023 [0,1,0,0,1,0|1,0,0]=3 5020 B12R1.463 CCCNC(=O)NCC1CCC1 273464a_100020643023_100000738700 [0,1,0,0,1,0|1,0,0]=3 5021 B12R1.463 CCCNC(=O)NCC1CCC1 512a_100000738700_100020643023 [0,1,0,0,1,0|1,0,0]=3 5022 B12R1.463 CCCNC(=O)NCC1CCC1 512a_100020643023_100000738700 [0,1,0,0,1,0|1,0,0]=3 5023 B12R1.463 CCCNC(=O)NCC1COC1 2708a_100015281925_100020643023 [0,1,0,0,1,0|2,0,0]=4 5024 B12R1.463 CCCNC(=O)NCC1COC1 2708a_100020643023_100015281925 [0,1,0,0,1,0|2,0,0]=4 5025 B12R1.463 CCCNC(=O)NCC1COC1 273464a_100015281925_100020643023 [0,1,0,0,1,0|2,0,0]=4 5026 B12R1.463 CCCNC(=O)NCC1COC1 273464a_100020643023_100015281925 [0,1,0,0,1,0|2,0,0]=4 5027 B12R1.463 CCCNC(=O)NCC1COC1 512a_100015281925_100020643023 [0,1,0,0,1,0|2,0,0]=4 5028 B12R1.463 CCCNC(=O)NCC1COC1 512a_100020643023_100015281925 [0,1,0,0,1,0|2,0,0]=4 5029 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 2708a_100020643023_100020831831 [0,1,0,0,1,0|1,0,0]=3 5030 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 2708a_100020831831_100020643023 [0,1,0,0,1,0|1,0,0]=3 5031 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 273464a_100020643023_100020831831 [0,1,0,0,1,0|1,0,0]=3 5032 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100020643023 [0,1,0,0,1,0|1,0,0]=3 5033 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 512a_100020643023_100020831831 [0,1,0,0,1,0|1,0,0]=3 5034 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 512a_100020831831_100020643023 [0,1,0,0,1,0|1,0,0]=3 5035 B12R1.463 CCCNC(=O)NNC1CCC1 273464a_100020643023_100000736358 [0,1,0,0,1,0|2,0,0]=4 5036 B12R1.463 CCCNC(=O)NNC1CCC1 512a_100000736358_100020643023 [0,1,0,0,1,0|2,0,0]=4 5037 B12R1.463 CCCNC(=O)NNC1CCC1 512a_100020643023_100000736358 [0,1,0,0,1,0|2,0,0]=4 5038 B12R1.463 CCCOC(=O)CNC1CCC1 2230a_100000749019_200011215008 [0,1,0,0,1,0|2,0,0]=4 5039 B12R1.463 CCCOC(=O)CNC1CCC1 34a_100000749019_200011215008 [0,1,0,0,1,0|2,0,0]=4 5040 B12R1.463 CCCOC(=O)COC1CCC1 34a_100000748187_200011215008 [0,1,0,0,1,0|2,0,0]=4 5041 B12R1.463 CCCOC(=O)CSC1CCC1 62a_200011215008_100000749161 [0,1,0,0,1,0|2,0,0]=4 5042 B12R1.463 CCCOC(=O)OCN1CCC1 269982a_100000754969_200000139673 [0,1,0,0,1,0|1,0,0]=3 5043 B12R1.463 CCNNC(=O)NCC1CCC1 273464a_100000738700_100000756455 [0,1,0,0,1,0|2,0,0]=4 5044 B12R1.463 CCNNC(=O)NCC1CCC1 512a_100000738700_100000756455 [0,1,0,0,1,0|2,0,0]=4 5045 B12R1.463 CCNNC(=O)NCC1CCC1 512a_100000756455_100000738700 [0,1,0,0,1,0|2,0,0]=4 5046 B12R1.463 CCNNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100000756455 [0,1,0,0,1,0|2,0,0]=4 5047 B12R1.463 CCNNC(=O)NC[C@@H]1CCO1 512a_100000756455_100020831831 [0,1,0,0,1,0|2,0,0]=4 5048 B12R1.463 CCNNC(=O)NC[C@@H]1CCO1 512a_100020831831_100000756455 [0,1,0,0,1,0|2,0,0]=4 5049 B12R1.463 CCOCC(=O)NCC1CCC1 11a_100000738700_100000211967 [0,1,0,0,1,0|1,0,0]=3 5050 B12R1.463 CCOCC(=O)NCC1CCC1 1626a_100000738700_100000211967 [0,1,0,0,1,0|1,0,0]=3 5051 B12R1.463 CCOCC(=O)NCC1CCC1 240690a_100000738700_100000211967 [0,1,0,0,1,0|1,0,0]=3 5052 B12R1.463 CCOCC(=O)NCC1CCC1 527a_100000738700_100000211967 [0,1,0,0,1,0|1,0,0]=3 5053 B12R1.463 CCOCC(=O)NCC1COC1 11a_100015281925_100000211967 [0,1,0,0,1,0|2,0,0]=4 5054 B12R1.463 CCOCC(=O)NCC1COC1 1626a_100015281925_100000211967 [0,1,0,0,1,0|2,0,0]=4 5055 B12R1.463 CCOCC(=O)NCC1COC1 240690a_100015281925_100000211967 [0,1,0,0,1,0|2,0,0]=4 5056 B12R1.463 CCOCC(=O)NCC1COC1 527a_100015281925_100000211967 [0,1,0,0,1,0|2,0,0]=4 5057 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000211967 [0,1,0,0,1,0|1,0,0]=3 5058 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000211967 [0,1,0,0,1,0|1,0,0]=3 5059 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000211967 [0,1,0,0,1,0|1,0,0]=3 5060 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000211967 [0,1,0,0,1,0|1,0,0]=3 5061 B12R1.463 CCOCC(=O)NNC1CCC1 22a_100000736358_100000211967 [0,1,0,0,1,0|2,0,0]=4 5062 B12R1.463 CCOCC(C)OCC1CCC1 34a_100000718985_100000763275 [0,1,0,0,1,0|1,0,1]=4 5063 B12R1.463 CCOCC(C)OCC1CCC1 7a_100000718985_100000763275 [0,1,0,0,1,0|1,0,1]=4 5064 B12R1.463 CCOCC(C)OCC1CCO1 34a_100000718985_100000103362 [0,1,0,0,1,0|1,0,1]=4 5065 B12R1.463 CCOCC(C)OCC1CCO1 7a_100000718985_100000103362 [0,1,0,0,1,0|1,0,1]=4 5066 B12R1.463 CCSCC(=O)NCC1CCC1 11a_100000738700_100000230394 [0,1,0,0,1,0|1,0,0]=3 5067 B12R1.463 CCSCC(=O)NCC1CCC1 1626a_100000738700_100000230394 [0,1,0,0,1,0|1,0,0]=3 5068 B12R1.463 CCSCC(=O)NCC1CCC1 240690a_100000738700_100000230394 [0,1,0,0,1,0|1,0,0]=3 5069 B12R1.463 CCSCC(=O)NCC1CCC1 527a_100000738700_100000230394 [0,1,0,0,1,0|1,0,0]=3 5070 B12R1.463 CCSCC(=O)NCC1COC1 11a_100015281925_100000230394 [0,1,0,0,1,0|2,0,0]=4 5071 B12R1.463 CCSCC(=O)NCC1COC1 1626a_100015281925_100000230394 [0,1,0,0,1,0|2,0,0]=4 5072 B12R1.463 CCSCC(=O)NCC1COC1 240690a_100015281925_100000230394 [0,1,0,0,1,0|2,0,0]=4 5073 B12R1.463 CCSCC(=O)NCC1COC1 527a_100015281925_100000230394 [0,1,0,0,1,0|2,0,0]=4 5074 B12R1.463 CCSCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000230394 [0,1,0,0,1,0|1,0,0]=3 5075 B12R1.463 CCSCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000230394 [0,1,0,0,1,0|1,0,0]=3 5076 B12R1.463 CCSCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000230394 [0,1,0,0,1,0|1,0,0]=3 5077 B12R1.463 CCSCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000230394 [0,1,0,0,1,0|1,0,0]=3 5078 B12R1.463 CCSCC(=O)NNC1CCC1 22a_100000736358_100000230394 [0,1,0,0,1,0|2,0,0]=4 5079 B12R1.463 COCCC(=O)NCC1CCC1 11a_100000738700_100000749529 [0,1,0,0,1,0|1,0,0]=3 5080 B12R1.463 COCCC(=O)NCC1CCC1 1626a_100000738700_100000749529 [0,1,0,0,1,0|1,0,0]=3 5081 B12R1.463 COCCC(=O)NCC1CCC1 240690a_100000738700_100000749529 [0,1,0,0,1,0|1,0,0]=3 5082 B12R1.463 COCCC(=O)NCC1CCC1 527a_100000738700_100000749529 [0,1,0,0,1,0|1,0,0]=3 5083 B12R1.463 COCCC(=O)NCC1COC1 11a_100015281925_100000749529 [0,1,0,0,1,0|2,0,0]=4 5084 B12R1.463 COCCC(=O)NCC1COC1 1626a_100015281925_100000749529 [0,1,0,0,1,0|2,0,0]=4 5085 B12R1.463 COCCC(=O)NCC1COC1 240690a_100015281925_100000749529 [0,1,0,0,1,0|2,0,0]=4 5086 B12R1.463 COCCC(=O)NCC1COC1 527a_100015281925_100000749529 [0,1,0,0,1,0|2,0,0]=4 5087 B12R1.463 COCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000749529 [0,1,0,0,1,0|1,0,0]=3 5088 B12R1.463 COCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000749529 [0,1,0,0,1,0|1,0,0]=3 5089 B12R1.463 COCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000749529 [0,1,0,0,1,0|1,0,0]=3 5090 B12R1.463 COCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000749529 [0,1,0,0,1,0|1,0,0]=3 5091 B12R1.463 COCCC(=O)NNC1CCC1 22a_100000736358_100000749529 [0,1,0,0,1,0|2,0,0]=4 5092 B12R1.463 CSCCC(=O)NCC1CCC1 11a_100000738700_100000174002 [0,1,0,0,1,0|1,0,0]=3 5093 B12R1.463 CSCCC(=O)NCC1CCC1 1626a_100000738700_100000174002 [0,1,0,0,1,0|1,0,0]=3 5094 B12R1.463 CSCCC(=O)NCC1CCC1 240690a_100000738700_100000174002 [0,1,0,0,1,0|1,0,0]=3 5095 B12R1.463 CSCCC(=O)NCC1CCC1 527a_100000738700_100000174002 [0,1,0,0,1,0|1,0,0]=3 5096 B12R1.463 CSCCC(=O)NCC1COC1 11a_100015281925_100000174002 [0,1,0,0,1,0|2,0,0]=4 5097 B12R1.463 CSCCC(=O)NCC1COC1 1626a_100015281925_100000174002 [0,1,0,0,1,0|2,0,0]=4 5098 B12R1.463 CSCCC(=O)NCC1COC1 240690a_100015281925_100000174002 [0,1,0,0,1,0|2,0,0]=4 5099 B12R1.463 CSCCC(=O)NCC1COC1 527a_100015281925_100000174002 [0,1,0,0,1,0|2,0,0]=4 5100 B12R1.463 CSCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000174002 [0,1,0,0,1,0|1,0,0]=3 5101 B12R1.463 CSCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000174002 [0,1,0,0,1,0|1,0,0]=3 5102 B12R1.463 CSCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000174002 [0,1,0,0,1,0|1,0,0]=3 5103 B12R1.463 CSCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000174002 [0,1,0,0,1,0|1,0,0]=3 5104 B12R1.463 CSCCC(=O)NNC1CCC1 22a_100000736358_100000174002 [0,1,0,0,1,0|2,0,0]=4 5105 B12R1.463 N#CCCC(=O)NCC1CCC1 11a_100000738700_100011934036 [0,1,0,0,1,0|1,0,1]=4 5106 B12R1.463 N#CCCC(=O)NCC1CCC1 1626a_100000738700_100011934036 [0,1,0,0,1,0|1,0,1]=4 5107 B12R1.463 N#CCCC(=O)NCC1CCC1 240690a_100000738700_100011934036 [0,1,0,0,1,0|1,0,1]=4 5108 B12R1.463 N#CCCC(=O)NCC1CCC1 527a_100000738700_100011934036 [0,1,0,0,1,0|1,0,1]=4 5109 B12R1.463 N#CCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100011934036 [0,1,0,0,1,0|1,0,1]=4 5110 B12R1.463 N#CCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100011934036 [0,1,0,0,1,0|1,0,1]=4 5111 B12R1.463 N#CCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100011934036 [0,1,0,0,1,0|1,0,1]=4 5112 B12R1.463 N#CCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100011934036 [0,1,0,0,1,0|1,0,1]=4 5113 B12R1.463 O=C(NCCF)NCC1CCC1 2708a_100000738700_100000724931 [0,1,0,0,1,0|2,0,0]=4 5114 B12R1.463 O=C(NCCF)NCC1CCC1 273464a_100000724931_100000738700 [0,1,0,0,1,0|2,0,0]=4 5115 B12R1.463 O=C(NCCF)NCC1CCC1 273464a_100000738700_100000724931 [0,1,0,0,1,0|2,0,0]=4 5116 B12R1.463 O=C(NCCF)NCC1CCC1 512a_100000738700_100000724931 [0,1,0,0,1,0|2,0,0]=4 5117 B12R1.463 O=C(NCCF)NC[C@@H]1CCO1 2708a_100020831831_100000724931 [0,1,0,0,1,0|2,0,0]=4 5118 B12R1.463 O=C(NCCF)NC[C@@H]1CCO1 273464a_100000724931_100020831831 [0,1,0,0,1,0|2,0,0]=4 5119 B12R1.463 O=C(NCCF)NC[C@@H]1CCO1 273464a_100020831831_100000724931 [0,1,0,0,1,0|2,0,0]=4 5120 B12R1.463 O=C(NCCF)NC[C@@H]1CCO1 512a_100020831831_100000724931 [0,1,0,0,1,0|2,0,0]=4 5121 B12R1.463 O=C(NCCO)NCC1CCC1 2708a_100000738700_100000210304 [0,1,0,0,1,0|2,0,0]=4 5122 B12R1.463 O=C(NCCO)NCC1CCC1 273464a_100000210304_100000738700 [0,1,0,0,1,0|2,0,0]=4 5123 B12R1.463 O=C(NCCO)NCC1CCC1 273464a_100000738700_100000210304 [0,1,0,0,1,0|2,0,0]=4 5124 B12R1.463 O=C(NCCO)NCC1CCC1 512a_100000738700_100000210304 [0,1,0,0,1,0|2,0,0]=4 5125 B12R1.463 O=C(NCCO)NC[C@@H]1CCO1 2708a_100020831831_100000210304 [0,1,0,0,1,0|2,0,0]=4 5126 B12R1.463 O=C(NCCO)NC[C@@H]1CCO1 273464a_100000210304_100020831831 [0,1,0,0,1,0|2,0,0]=4 5127 B12R1.463 O=C(NCCO)NC[C@@H]1CCO1 273464a_100020831831_100000210304 [0,1,0,0,1,0|2,0,0]=4 5128 B12R1.463 O=C(NCCO)NC[C@@H]1CCO1 512a_100020831831_100000210304 [0,1,0,0,1,0|2,0,0]=4 5129 B12R1.467 C=C1CC(C1)CNC(=O)CCC 11a_100102567296_100000211992 [0,1,0,0,1,0|1,0,1]=4 5130 B12R1.467 C=C1CC(C1)CNC(=O)CCC 1626a_100102567296_100000211992 [0,1,0,0,1,0|1,0,1]=4 5131 B12R1.467 C=C1CC(C1)CNC(=O)CCC 240690a_100102567296_100000211992 [0,1,0,0,1,0|1,0,1]=4 5132 B12R1.467 C=C1CC(C1)CNC(=O)CCC 527a_100102567296_100000211992 [0,1,0,0,1,0|1,0,1]=4 5133 B12R1.467 CCCC(=O)CNC1CC(C1)F 2230a_100016993743_100000747444 [0,1,0,0,1,0|2,0,0]=4 5134 B12R1.467 CCCC(=O)CN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000747444 [0,1,0,0,1,0|2,0,0]=4 5135 B12R1.467 CCCC(=O)NCC1CC(C1)O 11a_100016992100_100000211992 [0,1,0,0,1,0|1,0,0]=3 5136 B12R1.467 CCCC(=O)NCC1CC(C1)O 240690a_100016992100_100000211992 [0,1,0,0,1,0|1,0,0]=3 5137 B12R1.467 CCCC(=O)NCC1CN(C1)C 240690a_100000723568_100000211992 [0,1,0,0,1,0|2,0,0]=4 5138 B12R1.467 CCCC(=O)OCN1CC(C1)C 2230a_100000702820_100000034017 [0,1,0,0,1,0|1,0,0]=3 5139 B12R1.467 CCCC(=O)OCN1CC(C1)C 269982a_100000702820_100000034017 [0,1,0,0,1,0|1,0,0]=3 5140 B12R1.467 CCCC(=O)OCN1CC(C1)C 34a_100000702820_100000034017 [0,1,0,0,1,0|1,0,0]=3 5141 B12R1.467 CCCC(=O)OCN1CC(C1)F 2230a_100000690557_100000034017 [0,1,0,0,1,0|1,0,0]=3 5142 B12R1.467 CCCC(=O)OCN1CC(C1)F 269982a_100000690557_100000034017 [0,1,0,0,1,0|1,0,0]=3 5143 B12R1.467 CCCC(=O)OCN1CC(C1)F 34a_100000690557_100000034017 [0,1,0,0,1,0|1,0,0]=3 5144 B12R1.467 CCCC(=O)OCN1CC(C1)O 269982a_100000749847_100000034017 [0,1,0,0,1,0|1,0,0]=3 5145 B12R1.467 CCCC(C)OCC1CC(C1)Cl 34a_100009874164_100000766640 [0,1,0,0,1,0|1,0,1]=4 5146 B12R1.467 CCNC(=O)NCC1CC(C1)O 2708a_100015525214_100016992100 [0,1,0,0,1,0|2,0,0]=4 5147 B12R1.467 CCNC(=O)NCC1CC(C1)O 2708a_100016992100_100015525214 [0,1,0,0,1,0|2,0,0]=4 5148 B12R1.467 CCNC(=O)NCC1CC(C1)O 273464a_100015525214_100016992100 [0,1,0,0,1,0|2,0,0]=4 5149 B12R1.467 CCNC(=O)NCC1CC(C1)O 273464a_100016992100_100015525214 [0,1,0,0,1,0|2,0,0]=4 5150 B12R1.467 CCNC(=O)NCC1CC(C1)O 512a_100015525214_100016992100 [0,1,0,0,1,0|2,0,0]=4 5151 B12R1.467 CCNC(=O)NCC1CC(C1)O 512a_100016992100_100015525214 [0,1,0,0,1,0|2,0,0]=4 5152 B12R1.467 COCC(=O)NCC1CC(C1)O 11a_100016992100_100000210968 [0,1,0,0,1,0|2,0,0]=4 5153 B12R1.467 COCC(=O)NCC1CC(C1)O 240690a_100016992100_100000210968 [0,1,0,0,1,0|2,0,0]=4 5154 B12R1.467 CSCC(=O)NCC1CC(C1)O 11a_100016992100_100000184570 [0,1,0,0,1,0|2,0,0]=4 5155 B12R1.467 CSCC(=O)NCC1CC(C1)O 240690a_100016992100_100000184570 [0,1,0,0,1,0|2,0,0]=4 5156 B12R1.467 O=C(CCO)NCC1CC(C1)O 240690a_100016992100_100011216618 [0,1,0,0,1,0|2,0,0]=4 5157 B12R1.470 CCC(C)C(=O)NCC1CCC1 11a_100000738700_100011192722 [0,1,0,0,1,0|1,0,0]=3 5158 B12R1.470 CCC(C)C(=O)NCC1CCC1 1626a_100000738700_100011192722 [0,1,0,0,1,0|1,0,0]=3 5159 B12R1.470 CCC(C)C(=O)NCC1CCC1 240690a_100000738700_100011192722 [0,1,0,0,1,0|1,0,0]=3 5160 B12R1.470 CCC(C)C(=O)NCC1CCC1 527a_100000738700_100011192722 [0,1,0,0,1,0|1,0,0]=3 5161 B12R1.470 CCC(C)C(=O)NCC1COC1 11a_100015281925_100011192722 [0,1,0,0,1,0|2,0,0]=4 5162 B12R1.470 CCC(C)C(=O)NCC1COC1 1626a_100015281925_100011192722 [0,1,0,0,1,0|2,0,0]=4 5163 B12R1.470 CCC(C)C(=O)NCC1COC1 240690a_100015281925_100011192722 [0,1,0,0,1,0|2,0,0]=4 5164 B12R1.470 CCC(C)C(=O)NCC1COC1 527a_100015281925_100011192722 [0,1,0,0,1,0|2,0,0]=4 5165 B12R1.470 CCC(C)C(=O)NC[C@@H]1CCO1 11a_100020831831_100011192722 [0,1,0,0,1,0|1,0,0]=3 5166 B12R1.470 CCC(C)C(=O)NC[C@@H]1CCO1 1626a_100020831831_100011192722 [0,1,0,0,1,0|1,0,0]=3 5167 B12R1.470 CCC(C)C(=O)NC[C@@H]1CCO1 240690a_100020831831_100011192722 [0,1,0,0,1,0|1,0,0]=3 5168 B12R1.470 CCC(C)C(=O)NC[C@@H]1CCO1 527a_100020831831_100011192722 [0,1,0,0,1,0|1,0,0]=3 5169 B12R1.470 CCC(C)C(=O)NNC1CCC1 22a_100000736358_100011192722 [0,1,0,0,1,0|2,0,0]=4 5170 B12R1.470 CCC(C)C(C)OCC1CCC1 7a_100011215189_100000763275 [0,1,0,0,1,0|1,0,1]=4 5171 B12R1.470 CCC(C)C(C)OCC1CCO1 7a_100011215189_100000103362 [0,1,0,0,1,0|1,0,1]=4 5172 B12R1.470 CCC(O)C(=O)NCC1CCC1 240690a_100000738700_100011196387 [0,1,0,0,1,0|1,0,0]=3 5173 B12R1.470 CCC(O)C(=O)NCC1COC1 240690a_100015281925_100011196387 [0,1,0,0,1,0|2,0,0]=4 5174 B12R1.470 CCC(O)C(=O)NC[C@@H]1CCO1 240690a_100020831831_100011196387 [0,1,0,0,1,0|1,0,0]=3 5175 B12R1.470 CCC(O)C(=O)NNC1CCC1 22a_100000736358_100011196387 [0,1,0,0,1,0|2,0,0]=4 5176 B12R1.470 CCN(C)C(=O)NCC1CCC1 2708a_100000738700_100000225621 [0,1,0,0,1,0|2,0,0]=4 5177 B12R1.470 CCN(C)C(=O)NCC1CCC1 273464a_100000738700_100000225621 [0,1,0,0,1,0|2,0,0]=4 5178 B12R1.470 CCN(C)C(=O)NC[C@@H]1CCO1 2708a_100020831831_100000225621 [0,1,0,0,1,0|2,0,0]=4 5179 B12R1.470 CCN(C)C(=O)NC[C@@H]1CCO1 273464a_100020831831_100000225621 [0,1,0,0,1,0|2,0,0]=4 5180 B12R1.470 COC(C)C(=O)NCC1CCC1 11a_100000738700_100000743197 [0,1,0,0,1,0|2,0,0]=4 5181 B12R1.470 COC(C)C(=O)NCC1CCC1 1626a_100000738700_100000743197 [0,1,0,0,1,0|2,0,0]=4 5182 B12R1.470 COC(C)C(=O)NCC1CCC1 240690a_100000738700_100000743197 [0,1,0,0,1,0|2,0,0]=4 5183 B12R1.470 COC(C)C(=O)NCC1CCC1 527a_100000738700_100000743197 [0,1,0,0,1,0|2,0,0]=4 5184 B12R1.470 COC(C)C(=O)NC[C@@H]1CCO1 11a_100020831831_100000743197 [0,1,0,0,1,0|2,0,0]=4 5185 B12R1.470 COC(C)C(=O)NC[C@@H]1CCO1 1626a_100020831831_100000743197 [0,1,0,0,1,0|2,0,0]=4 5186 B12R1.470 COC(C)C(=O)NC[C@@H]1CCO1 240690a_100020831831_100000743197 [0,1,0,0,1,0|2,0,0]=4 5187 B12R1.470 COC(C)C(=O)NC[C@@H]1CCO1 527a_100020831831_100000743197 [0,1,0,0,1,0|2,0,0]=4 5188 B12R1.470 CSC(C)C(=O)NCC1CCC1 11a_100000738700_100000149566 [0,1,0,0,1,0|2,0,0]=4 5189 B12R1.470 CSC(C)C(=O)NCC1CCC1 1626a_100000738700_100000149566 [0,1,0,0,1,0|2,0,0]=4 5190 B12R1.470 CSC(C)C(=O)NCC1CCC1 240690a_100000738700_100000149566 [0,1,0,0,1,0|2,0,0]=4 5191 B12R1.470 CSC(C)C(=O)NCC1CCC1 527a_100000738700_100000149566 [0,1,0,0,1,0|2,0,0]=4 5192 B12R1.470 CSC(C)C(=O)NC[C@@H]1CCO1 11a_100020831831_100000149566 [0,1,0,0,1,0|2,0,0]=4 5193 B12R1.470 CSC(C)C(=O)NC[C@@H]1CCO1 1626a_100020831831_100000149566 [0,1,0,0,1,0|2,0,0]=4 5194 B12R1.470 CSC(C)C(=O)NC[C@@H]1CCO1 240690a_100020831831_100000149566 [0,1,0,0,1,0|2,0,0]=4 5195 B12R1.470 CSC(C)C(=O)NC[C@@H]1CCO1 527a_100020831831_100000149566 [0,1,0,0,1,0|2,0,0]=4 5196 B12R1.470 O=C(NCC1CCC1)C(O)CO 240690a_100000738700_100011215603 [0,1,0,0,1,0|2,0,0]=4 5197 B12R1.470 O=C(NC[C@@H]1CCO1)C(O)CO 240690a_100020831831_100011215603 [0,1,0,0,1,0|2,0,0]=4 5198 B12R1.515 CCCC(C)(C)OCC1CCC1 7a_100000748436_100000763275 [0,1,0,0,1,0|1,0,1]=4 5199 B12R1.515 CCCC(C)(C)OCC1CCO1 7a_100000748436_100000103362 [0,1,0,0,1,0|1,0,1]=4 5200 B12R1.515 CCCS(=O)(=O)NCC1CCC1 270084a_100000738700_100000211391 [0,1,0,0,1,0|2,0,0]=4 5201 B12R1.515 CCCS(=O)(=O)NCC1CCC1 274078a_100000738700_100000211391 [0,1,0,0,1,0|2,0,0]=4 5202 B12R1.515 CCCS(=O)(=O)NCC1CCC1 40a_100000738700_100000054278 [0,1,0,0,1,0|2,0,0]=4 5203 B12R1.515 CCCS(=O)(=O)NC[C@@H]1CCO1 270084a_100020831831_100000211391 [0,1,0,0,1,0|2,0,0]=4 5204 B12R1.515 CCCS(=O)(=O)NC[C@@H]1CCO1 274078a_100020831831_100000211391 [0,1,0,0,1,0|2,0,0]=4 5205 B12R1.515 CCCS(=O)(=O)NC[C@@H]1CCO1 40a_100020831831_100000054278 [0,1,0,0,1,0|2,0,0]=4 5206 B12R1.519 CC(NC(=O)CCO)C1CCC1 240690a_100016994624_100011216618 [0,1,0,0,1,0|2,0,0]=4 5207 B12R1.519 CCCC(=O)CC(=O)C1CCC1 1458a_100000209988_100000747444 [0,1,0,0,1,0|1,0,1]=4 5208 B12R1.519 CCCC(=O)CC(=O)C1CCC1 1458a_100000211992_100000686122 [0,1,0,0,1,0|1,0,1]=4 5209 B12R1.519 CCCC(=O)CC(=O)C1CCO1 1458a_100000089072_100000747444 [0,1,0,0,1,0|1,0,1]=4 5210 B12R1.519 CCCC(=O)CN(C)C1CCC1 2230a_100000758072_100000747444 [0,1,0,0,1,0|2,0,0]=4 5211 B12R1.519 CCCC(=O)CN(C)C1CCC1 269982a_100000758072_100000747444 [0,1,0,0,1,0|2,0,0]=4 5212 B12R1.519 CCCC(=O)NC(C)C1CCC1 11a_100016994624_100000211992 [0,1,0,0,1,0|1,0,0]=3 5213 B12R1.519 CCCC(=O)NC(C)C1CCC1 1626a_100016994624_100000211992 [0,1,0,0,1,0|1,0,0]=3 5214 B12R1.519 CCCC(=O)NC(C)C1CCC1 240690a_100016994624_100000211992 [0,1,0,0,1,0|1,0,0]=3 5215 B12R1.519 CCCC(=O)NC(C)C1CCC1 527a_100016994624_100000211992 [0,1,0,0,1,0|1,0,0]=3 5216 B12R1.519 CCCC(C)OC(C)C1CCC1 34a_100000766398_100000766640 [0,1,0,0,1,0|1,0,1]=4 5217 B12R1.519 CCCC(C)OC(C)C1CCC1 7a_100000766398_100000766640 [0,1,0,0,1,0|1,0,1]=4 5218 B12R1.519 CCNC(=O)NC(C)C1CCC1 2708a_100015525214_100016994624 [0,1,0,0,1,0|2,0,0]=4 5219 B12R1.519 CCNC(=O)NC(C)C1CCC1 2708a_100016994624_100015525214 [0,1,0,0,1,0|2,0,0]=4 5220 B12R1.519 CCNC(=O)NC(C)C1CCC1 273464a_100015525214_100016994624 [0,1,0,0,1,0|2,0,0]=4 5221 B12R1.519 CCNC(=O)NC(C)C1CCC1 273464a_100016994624_100015525214 [0,1,0,0,1,0|2,0,0]=4 5222 B12R1.519 CCNC(=O)NC(C)C1CCC1 512a_100015525214_100016994624 [0,1,0,0,1,0|2,0,0]=4 5223 B12R1.519 CCNC(=O)NC(C)C1CCC1 512a_100016994624_100015525214 [0,1,0,0,1,0|2,0,0]=4 5224 B12R1.519 CCOC(=O)OC(C)N1CCC1 269982a_100000754969_100000036008 [0,1,0,0,1,0|2,0,0]=4 5225 B12R1.519 COCC(=O)NC(C)C1CCC1 11a_100016994624_100000210968 [0,1,0,0,1,0|2,0,0]=4 5226 B12R1.519 COCC(=O)NC(C)C1CCC1 1626a_100016994624_100000210968 [0,1,0,0,1,0|2,0,0]=4 5227 B12R1.519 COCC(=O)NC(C)C1CCC1 240690a_100016994624_100000210968 [0,1,0,0,1,0|2,0,0]=4 5228 B12R1.519 COCC(=O)NC(C)C1CCC1 527a_100016994624_100000210968 [0,1,0,0,1,0|2,0,0]=4 5229 B12R1.519 CSCC(=O)NC(C)C1CCC1 11a_100016994624_100000184570 [0,1,0,0,1,0|2,0,0]=4 5230 B12R1.519 CSCC(=O)NC(C)C1CCC1 1626a_100016994624_100000184570 [0,1,0,0,1,0|2,0,0]=4 5231 B12R1.519 CSCC(=O)NC(C)C1CCC1 240690a_100016994624_100000184570 [0,1,0,0,1,0|2,0,0]=4 5232 B12R1.519 CSCC(=O)NC(C)C1CCC1 527a_100016994624_100000184570 [0,1,0,0,1,0|2,0,0]=4 5233 B12R1.555 CCCC(=O)N(C)CC1CCC1 11a_200000750244_100000211992 [0,1,0,0,1,0|1,0,0]=3 5234 B12R1.555 CCCC(=O)N(C)CC1CCC1 1626a_200000750244_100000211992 [0,1,0,0,1,0|1,0,0]=3 5235 B12R1.555 CCCC(=O)N(C)CC1CCC1 240690a_200000750244_100000211992 [0,1,0,0,1,0|1,0,0]=3 5236 B12R1.555 CCCC(=O)N(C)CC1CCC1 527a_200000750244_100000211992 [0,1,0,0,1,0|1,0,0]=3 5237 B12R1.555 CCNC(=O)C(=O)CC1CCC1 1458a_200011297158_100000763275 [0,1,0,0,1,0|2,0,0]=4 5238 B12R1.555 CCNC(=O)C(=O)CC1CCO1 1458a_200011297158_100000103362 [0,1,0,0,1,0|2,0,0]=4 5239 B12R1.555 CCNC(=O)N(C)CC1CCC1 2708a_100015525214_200000750244 [0,1,0,0,1,0|2,0,0]=4 5240 B12R1.555 CCNC(=O)N(C)CC1CCC1 273464a_100015525214_200000750244 [0,1,0,0,1,0|2,0,0]=4 5241 B12R1.555 CN(CC1CCC1)C(=O)CCO 240690a_200000750244_100011216618 [0,1,0,0,1,0|2,0,0]=4 5242 B12R1.555 COCC(=O)N(C)CC1CCC1 11a_200000750244_100000210968 [0,1,0,0,1,0|2,0,0]=4 5243 B12R1.555 COCC(=O)N(C)CC1CCC1 1626a_200000750244_100000210968 [0,1,0,0,1,0|2,0,0]=4 5244 B12R1.555 COCC(=O)N(C)CC1CCC1 240690a_200000750244_100000210968 [0,1,0,0,1,0|2,0,0]=4 5245 B12R1.555 COCC(=O)N(C)CC1CCC1 527a_200000750244_100000210968 [0,1,0,0,1,0|2,0,0]=4 5246 B12R1.555 CSCC(=O)N(C)CC1CCC1 11a_200000750244_100000184570 [0,1,0,0,1,0|2,0,0]=4 5247 B12R1.555 CSCC(=O)N(C)CC1CCC1 1626a_200000750244_100000184570 [0,1,0,0,1,0|2,0,0]=4 5248 B12R1.555 CSCC(=O)N(C)CC1CCC1 240690a_200000750244_100000184570 [0,1,0,0,1,0|2,0,0]=4 5249 B12R1.555 CSCC(=O)N(C)CC1CCC1 527a_200000750244_100000184570 [0,1,0,0,1,0|2,0,0]=4 5250 B12R1.1376 CC(C)CC(=O)NCC1CCC1 11a_100000738700_100000210554 [0,1,0,0,1,0|1,0,0]=3 5251 B12R1.1376 CC(C)CC(=O)NCC1CCC1 1626a_100000738700_100000210554 [0,1,0,0,1,0|1,0,0]=3 5252 B12R1.1376 CC(C)CC(=O)NCC1CCC1 240690a_100000738700_100000210554 [0,1,0,0,1,0|1,0,0]=3 5253 B12R1.1376 CC(C)CC(=O)NCC1CCC1 527a_100000738700_100000210554 [0,1,0,0,1,0|1,0,0]=3 5254 B12R1.1376 CC(C)CC(=O)NCC1COC1 11a_100015281925_100000210554 [0,1,0,0,1,0|2,0,0]=4 5255 B12R1.1376 CC(C)CC(=O)NCC1COC1 1626a_100015281925_100000210554 [0,1,0,0,1,0|2,0,0]=4 5256 B12R1.1376 CC(C)CC(=O)NCC1COC1 240690a_100015281925_100000210554 [0,1,0,0,1,0|2,0,0]=4 5257 B12R1.1376 CC(C)CC(=O)NCC1COC1 527a_100015281925_100000210554 [0,1,0,0,1,0|2,0,0]=4 5258 B12R1.1376 CC(C)CC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210554 [0,1,0,0,1,0|1,0,0]=3 5259 B12R1.1376 CC(C)CC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210554 [0,1,0,0,1,0|1,0,0]=3 5260 B12R1.1376 CC(C)CC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210554 [0,1,0,0,1,0|1,0,0]=3 5261 B12R1.1376 CC(C)CC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210554 [0,1,0,0,1,0|1,0,0]=3 5262 B12R1.1376 CC(C)CC(=O)NNC1CCC1 22a_100000736358_100000210554 [0,1,0,0,1,0|2,0,0]=4 5263 B12R1.1376 CC(C)CC(C)OCC1CCC1 34a_100000211805_100000763275 [0,1,0,0,1,0|1,0,1]=4 5264 B12R1.1376 CC(C)CC(C)OCC1CCC1 34a_100000760304_100000731052 [0,1,0,0,1,0|1,0,1]=4 5265 B12R1.1376 CC(C)CC(C)OCC1CCC1 7a_100000211805_100000763275 [0,1,0,0,1,0|1,0,1]=4 5266 B12R1.1376 CC(C)CC(C)OCC1CCO1 34a_100000039022_100000731052 [0,1,0,0,1,0|1,0,1]=4 5267 B12R1.1376 CC(C)CC(C)OCC1CCO1 34a_100000211805_100000103362 [0,1,0,0,1,0|1,0,1]=4 5268 B12R1.1376 CC(C)CC(C)OCC1CCO1 7a_100000211805_100000103362 [0,1,0,0,1,0|1,0,1]=4 5269 B12R1.1376 CC(C)NC(=O)NCC1CCC1 2708a_100000738700_100138425928 [0,1,0,0,1,0|2,0,0]=4 5270 B12R1.1376 CC(C)NC(=O)NCC1CCC1 2708a_100138425928_100000738700 [0,1,0,0,1,0|2,0,0]=4 5271 B12R1.1376 CC(C)NC(=O)NCC1CCC1 273464a_100138425928_100000738700 [0,1,0,0,1,0|2,0,0]=4 5272 B12R1.1376 CC(C)NC(=O)NCC1CCC1 512a_100000738700_100138425928 [0,1,0,0,1,0|2,0,0]=4 5273 B12R1.1376 CC(C)NC(=O)NCC1CCC1 512a_100138425928_100000738700 [0,1,0,0,1,0|2,0,0]=4 5274 B12R1.1376 CC(C)NC(=O)NC[C@@H]1CCO1 2708a_100020831831_100138425928 [0,1,0,0,1,0|2,0,0]=4 5275 B12R1.1376 CC(C)NC(=O)NC[C@@H]1CCO1 2708a_100138425928_100020831831 [0,1,0,0,1,0|2,0,0]=4 5276 B12R1.1376 CC(C)NC(=O)NC[C@@H]1CCO1 273464a_100138425928_100020831831 [0,1,0,0,1,0|2,0,0]=4 5277 B12R1.1376 CC(C)NC(=O)NC[C@@H]1CCO1 512a_100020831831_100138425928 [0,1,0,0,1,0|2,0,0]=4 5278 B12R1.1376 CC(C)NC(=O)NC[C@@H]1CCO1 512a_100138425928_100020831831 [0,1,0,0,1,0|2,0,0]=4 5279 B12R1.1376 CC(C)OC(=O)OCN1CCC1 269982a_100000754969_100010125566 [0,1,0,0,1,0|2,0,0]=4 5280 B12R1.1376 CN(C)CC(=O)NCC1CCC1 11a_100000738700_100000750896 [0,1,0,0,1,0|2,0,0]=4 5281 B12R1.1376 CN(C)CC(=O)NCC1CCC1 240690a_100000738700_100000750896 [0,1,0,0,1,0|2,0,0]=4 5282 B12R1.1376 CN(C)CC(=O)NCC1CCC1 527a_100000738700_100000750896 [0,1,0,0,1,0|2,0,0]=4 5283 B12R1.1376 CN(C)CC(=O)NC[C@@H]1CCO1 11a_100020831831_100000750896 [0,1,0,0,1,0|2,0,0]=4 5284 B12R1.1376 CN(C)CC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000750896 [0,1,0,0,1,0|2,0,0]=4 5285 B12R1.1376 CN(C)CC(=O)NC[C@@H]1CCO1 527a_100020831831_100000750896 [0,1,0,0,1,0|2,0,0]=4 5286 B12R1.1376 C[C@@H](O)CC(=O)NCC1CCC1 240690a_100000738700_100011933948 [0,1,0,0,1,0|1,0,0]=3 5287 B12R1.1376 C[C@@H](O)CC(=O)NCC1COC1 240690a_100015281925_100011933948 [0,1,0,0,1,0|2,0,0]=4 5288 B12R1.1376 C[C@@H](O)CC(=O)NC[C@@H]1CCO1 240690a_100020831831_100011933948 [0,1,0,0,1,0|1,0,0]=3 5289 B12R1.1376 C[C@@H](O)CC(=O)NNC1CCC1 22a_100000736358_100011933948 [0,1,0,0,1,0|2,0,0]=4 5290 B12R1.1376 C[S+](C)CC(=O)NCC1CCC1 11a_100000738700_200159257847 [0,1,0,0,1,0|2,0,0]=4 5291 B12R1.1376 C[S+](C)CC(=O)NCC1CCC1 1626a_100000738700_200159257847 [0,1,0,0,1,0|2,0,0]=4 5292 B12R1.1376 C[S+](C)CC(=O)NCC1CCC1 240690a_100000738700_200159257847 [0,1,0,0,1,0|2,0,0]=4 5293 B12R1.1376 C[S+](C)CC(=O)NCC1CCC1 527a_100000738700_200159257847 [0,1,0,0,1,0|2,0,0]=4 5294 B12R1.1376 C[S+](C)CC(=O)NC[C@@H]1CCO1 11a_100020831831_200159257847 [0,1,0,0,1,0|2,0,0]=4 5295 B12R1.1376 C[S+](C)CC(=O)NC[C@@H]1CCO1 1626a_100020831831_200159257847 [0,1,0,0,1,0|2,0,0]=4 5296 B12R1.1376 C[S+](C)CC(=O)NC[C@@H]1CCO1 240690a_100020831831_200159257847 [0,1,0,0,1,0|2,0,0]=4 5297 B12R1.1376 C[S+](C)CC(=O)NC[C@@H]1CCO1 527a_100020831831_200159257847 [0,1,0,0,1,0|2,0,0]=4 5298 B12R1.1573 CC1(CCC1)CNC(=O)CCO 240690a_100000706607_100011216618 [0,1,0,0,1,0|2,0,0]=4 5299 B12R1.1573 CCCC(=O)CNC1(CCC1)C 2230a_100000692455_100000747444 [0,1,0,0,1,0|2,0,0]=4 5300 B12R1.1573 CCCC(=O)COC1(CCC1)C 7a_100000759064_100000747444 [0,1,0,0,1,0|2,0,0]=4 5301 B12R1.1573 CCCC(=O)NCC1(CCC1)C 11a_100000706607_100000211992 [0,1,0,0,1,0|1,0,0]=3 5302 B12R1.1573 CCCC(=O)NCC1(CCC1)C 1626a_100000706607_100000211992 [0,1,0,0,1,0|1,0,0]=3 5303 B12R1.1573 CCCC(=O)NCC1(CCC1)C 240690a_100000706607_100000211992 [0,1,0,0,1,0|1,0,0]=3 5304 B12R1.1573 CCCC(=O)NCC1(CCC1)C 527a_100000706607_100000211992 [0,1,0,0,1,0|1,0,0]=3 5305 B12R1.1573 CCCC(=O)NCC1(CCC1)O 11a_100000752638_100000211992 [0,1,0,0,1,0|1,0,0]=3 5306 B12R1.1573 CCCC(=O)NCC1(CCC1)O 1626a_100000752638_100000211992 [0,1,0,0,1,0|1,0,0]=3 5307 B12R1.1573 CCCC(=O)NCC1(CCC1)O 240690a_100000752638_100000211992 [0,1,0,0,1,0|1,0,0]=3 5308 B12R1.1573 CCCC(=O)NCC1(CCC1)O 527a_100000752638_100000211992 [0,1,0,0,1,0|1,0,0]=3 5309 B12R1.1573 CCCC(=O)NCC1(COC1)C 1626a_100020631278_100000211992 [0,1,0,0,1,0|2,0,0]=4 5310 B12R1.1573 CCCC(=O)NCC1(COC1)C 527a_100020631278_100000211992 [0,1,0,0,1,0|2,0,0]=4 5311 B12R1.1573 CCCC(=O)NCC1(COC1)O 11a_100010264505_100000211992 [0,1,0,0,1,0|2,0,0]=4 5312 B12R1.1573 CCCC(=O)NCC1(COC1)O 240690a_100010264505_100000211992 [0,1,0,0,1,0|2,0,0]=4 5313 B12R1.1573 CCCC(=O)NCC1(COC1)O 527a_100010264505_100000211992 [0,1,0,0,1,0|2,0,0]=4 5314 B12R1.1573 CCCC(C)OCC1(CCC1)C 34a_100000764384_100000726658 [0,1,0,0,1,0|1,0,1]=4 5315 B12R1.1573 CCCC(C)OCC1(CCC1)C 7a_100000764384_100000726658 [0,1,0,0,1,0|1,0,1]=4 5316 B12R1.1573 CCNC(=O)NCC1(CCC1)C 2708a_100000706607_100015525214 [0,1,0,0,1,0|2,0,0]=4 5317 B12R1.1573 CCNC(=O)NCC1(CCC1)C 2708a_100015525214_100000706607 [0,1,0,0,1,0|2,0,0]=4 5318 B12R1.1573 CCNC(=O)NCC1(CCC1)C 273464a_100000706607_100015525214 [0,1,0,0,1,0|2,0,0]=4 5319 B12R1.1573 CCNC(=O)NCC1(CCC1)C 273464a_100015525214_100000706607 [0,1,0,0,1,0|2,0,0]=4 5320 B12R1.1573 CCNC(=O)NCC1(CCC1)C 512a_100000706607_100015525214 [0,1,0,0,1,0|2,0,0]=4 5321 B12R1.1573 CCNC(=O)NCC1(CCC1)C 512a_100015525214_100000706607 [0,1,0,0,1,0|2,0,0]=4 5322 B12R1.1573 CCNC(=O)NCC1(CCC1)O 2708a_100000752638_100015525214 [0,1,0,0,1,0|2,0,0]=4 5323 B12R1.1573 CCNC(=O)NCC1(CCC1)O 2708a_100015525214_100000752638 [0,1,0,0,1,0|2,0,0]=4 5324 B12R1.1573 CCNC(=O)NCC1(CCC1)O 273464a_100015525214_100000752638 [0,1,0,0,1,0|2,0,0]=4 5325 B12R1.1573 CCNC(=O)NCC1(CCC1)O 512a_100000752638_100015525214 [0,1,0,0,1,0|2,0,0]=4 5326 B12R1.1573 CCNC(=O)NCC1(CCC1)O 512a_100015525214_100000752638 [0,1,0,0,1,0|2,0,0]=4 5327 B12R1.1573 COCC(=O)NCC1(CCC1)C 11a_100000706607_100000210968 [0,1,0,0,1,0|2,0,0]=4 5328 B12R1.1573 COCC(=O)NCC1(CCC1)C 1626a_100000706607_100000210968 [0,1,0,0,1,0|2,0,0]=4 5329 B12R1.1573 COCC(=O)NCC1(CCC1)C 240690a_100000706607_100000210968 [0,1,0,0,1,0|2,0,0]=4 5330 B12R1.1573 COCC(=O)NCC1(CCC1)C 527a_100000706607_100000210968 [0,1,0,0,1,0|2,0,0]=4 5331 B12R1.1573 COCC(=O)NCC1(CCC1)O 11a_100000752638_100000210968 [0,1,0,0,1,0|2,0,0]=4 5332 B12R1.1573 COCC(=O)NCC1(CCC1)O 1626a_100000752638_100000210968 [0,1,0,0,1,0|2,0,0]=4 5333 B12R1.1573 COCC(=O)NCC1(CCC1)O 240690a_100000752638_100000210968 [0,1,0,0,1,0|2,0,0]=4 5334 B12R1.1573 COCC(=O)NCC1(CCC1)O 527a_100000752638_100000210968 [0,1,0,0,1,0|2,0,0]=4 5335 B12R1.1573 CSCC(=O)NCC1(CCC1)C 11a_100000706607_100000184570 [0,1,0,0,1,0|2,0,0]=4 5336 B12R1.1573 CSCC(=O)NCC1(CCC1)C 1626a_100000706607_100000184570 [0,1,0,0,1,0|2,0,0]=4 5337 B12R1.1573 CSCC(=O)NCC1(CCC1)C 240690a_100000706607_100000184570 [0,1,0,0,1,0|2,0,0]=4 5338 B12R1.1573 CSCC(=O)NCC1(CCC1)C 527a_100000706607_100000184570 [0,1,0,0,1,0|2,0,0]=4 5339 B12R1.1573 CSCC(=O)NCC1(CCC1)O 11a_100000752638_100000184570 [0,1,0,0,1,0|2,0,0]=4 5340 B12R1.1573 CSCC(=O)NCC1(CCC1)O 1626a_100000752638_100000184570 [0,1,0,0,1,0|2,0,0]=4 5341 B12R1.1573 CSCC(=O)NCC1(CCC1)O 240690a_100000752638_100000184570 [0,1,0,0,1,0|2,0,0]=4 5342 B12R1.1573 CSCC(=O)NCC1(CCC1)O 527a_100000752638_100000184570 [0,1,0,0,1,0|2,0,0]=4 5343 B12R1.1573 O=C(CCO)NCC1(CCC1)O 240690a_100000752638_100011216618 [0,1,0,0,1,0|2,0,0]=4 5344 B14R1.29 CCCC(=O)CC(=O)C1CCCCO1 1458a_100000748299_100000747444 [0,1,0,0,0,1|1,0,1]=4 5345 B14R1.29 CCCC(=O)CC(=O)C1CCCOC1 1458a_100000741522_100000747444 [0,1,0,0,0,1|1,0,1]=4 5346 B14R1.29 CCCC(=O)CC(=O)C1COCCO1 1458a_100000045528_100000747444 [0,1,0,0,0,1|1,0,1]=4 5347 B14R1.29 CCCC(=O)N[C@H](C)C1CCCCC1 11a_100025707633_100000211992 [0,1,0,0,0,1|2,0,0]=4 5348 B14R1.29 CCCC(=O)N[C@H](C)C1CCCCC1 1626a_100025707633_100000211992 [0,1,0,0,0,1|2,0,0]=4 5349 B14R1.29 CCCC(=O)N[C@H](C)C1CCCCC1 240690a_100025707633_100000211992 [0,1,0,0,0,1|2,0,0]=4 5350 B14R1.29 CCCC(=O)N[C@H](C)C1CCCCC1 527a_100025707633_100000211992 [0,1,0,0,0,1|2,0,0]=4 5351 B14R1.29 CCOC(=O)OC(C)N1CCCOC1 269982a_100000131196_100000036008 [0,1,0,0,0,1|2,0,0]=4 5352 B14R1.32 CCCC(=O)CCC1CCCN(C1)C 1458a_100015186358_100000210303 [0,1,0,0,0,1|2,0,0]=4 5353 B14R1.32 CCCC(=O)NCC1CCCC(C1)O 1626a_100011254705_100000211992 [0,1,0,0,0,1|2,0,0]=4 5354 B14R1.32 CCCC(=O)NCC1CCCC(C1)O 240690a_100011254705_100000211992 [0,1,0,0,0,1|2,0,0]=4 5355 B14R1.32 CCCC(=O)NCC1CCCC(C1)O 527a_100011254705_100000211992 [0,1,0,0,0,1|2,0,0]=4 5356 B14R1.32 CCCC(=O)NCC1CN(CCO1)C 11a_100000747556_100000211992 [0,1,0,0,0,1|1,0,0]=3 5357 B14R1.32 CCCC(=O)NCC1CN(CCO1)C 240690a_100000747556_100000211992 [0,1,0,0,0,1|1,0,0]=3 5358 B14R1.32 CCCC(=O)NCC1CN(CCO1)C 527a_100000747556_100000211992 [0,1,0,0,0,1|1,0,0]=3 5359 B14R1.32 CCCC(=O)NC[C@@H]1CCCN(C1)C 240690a_100016993746_100000211992 [0,1,0,0,0,1|2,0,0]=4 5360 B14R1.32 CCCC(=O)NC[C@@H]1CCCN(C1)C 527a_100016993746_100000211992 [0,1,0,0,0,1|2,0,0]=4 5361 B14R1.32 CCCC(=O)OCN1CCCC(C1)F 2230a_100000697950_100000034017 [0,1,0,0,0,1|2,0,0]=4 5362 B14R1.32 CCCC(=O)OCN1CCCC(C1)F 269982a_100000697950_100000034017 [0,1,0,0,0,1|2,0,0]=4 5363 B14R1.32 CCCC(=O)OCN1CCCC(C1)F 34a_100000697950_100000034017 [0,1,0,0,0,1|2,0,0]=4 5364 B14R1.32 CCCC(=O)OCN1CCCC(C1)O 2230a_100000211013_100000034017 [0,1,0,0,0,1|2,0,0]=4 5365 B14R1.32 CCCC(=O)OCN1CCCC(C1)O 269982a_100000211013_100000034017 [0,1,0,0,0,1|2,0,0]=4 5366 B14R1.32 CCCC(=O)OCN1CCC[C@@H](C1)C 2230a_100000717927_100000034017 [0,1,0,0,0,1|2,0,0]=4 5367 B14R1.32 CCCC(=O)OCN1CCC[C@@H](C1)C 269982a_100000717927_100000034017 [0,1,0,0,0,1|2,0,0]=4 5368 B14R1.32 CCCC(=O)OCN1CCC[C@@H](C1)C 34a_100000717927_100000034017 [0,1,0,0,0,1|2,0,0]=4 5369 B14R1.32 CCCC(=O)OCN1CCOC(C1)C 2230a_100000729577_100000034017 [0,1,0,0,0,1|2,0,0]=4 5370 B14R1.32 CCCC(=O)OCN1CCOC(C1)C 269982a_100000729577_100000034017 [0,1,0,0,0,1|2,0,0]=4 5371 B14R1.32 CCCC(=O)OCN1CCOC(C1)C 34a_100000729577_100000034017 [0,1,0,0,0,1|2,0,0]=4 5372 B14R1.32 CCCC(=O)OCN1CCOC(C1)O 2230a_100000688207_100000034017 [0,1,0,0,0,1|2,0,0]=4 5373 B14R1.32 CCCC(=O)OCN1CCOC(C1)O 269982a_100000688207_100000034017 [0,1,0,0,0,1|2,0,0]=4 5374 B14R1.32 CCNC(=O)NCC1CN(CCO1)C 2708a_100000747556_100015525214 [0,1,0,0,0,1|2,0,0]=4 5375 B14R1.32 CCNC(=O)NCC1CN(CCO1)C 2708a_100015525214_100000747556 [0,1,0,0,0,1|2,0,0]=4 5376 B14R1.32 CCNC(=O)NCC1CN(CCO1)C 273464a_100000747556_100015525214 [0,1,0,0,0,1|2,0,0]=4 5377 B14R1.32 CCNC(=O)NCC1CN(CCO1)C 273464a_100015525214_100000747556 [0,1,0,0,0,1|2,0,0]=4 5378 B14R1.32 CCNC(=O)NCC1CN(CCO1)C 512a_100000747556_100015525214 [0,1,0,0,0,1|2,0,0]=4 5379 B14R1.32 CCNC(=O)NCC1CN(CCO1)C 512a_100015525214_100000747556 [0,1,0,0,0,1|2,0,0]=4 5380 B14R1.32 CN1CCOC(C1)CNC(=O)CCO 240690a_100000747556_100011216618 [0,1,0,0,0,1|2,0,0]=4 5381 B14R1.32 COCC(=O)NCC1CN(CCO1)C 11a_100000747556_100000210968 [0,1,0,0,0,1|2,0,0]=4 5382 B14R1.32 COCC(=O)NCC1CN(CCO1)C 240690a_100000747556_100000210968 [0,1,0,0,0,1|2,0,0]=4 5383 B14R1.32 COCC(=O)NCC1CN(CCO1)C 527a_100000747556_100000210968 [0,1,0,0,0,1|2,0,0]=4 5384 B14R1.32 CSCC(=O)NCC1CN(CCO1)C 11a_100000747556_100000184570 [0,1,0,0,0,1|2,0,0]=4 5385 B14R1.32 CSCC(=O)NCC1CN(CCO1)C 240690a_100000747556_100000184570 [0,1,0,0,0,1|2,0,0]=4 5386 B14R1.32 CSCC(=O)NCC1CN(CCO1)C 527a_100000747556_100000184570 [0,1,0,0,0,1|2,0,0]=4 5387 B14R1.60 CCCC(=O)C(C)CC1CCCCC1 1458a_200011416370_100000210303 [0,1,0,0,0,1|2,0,0]=4 5388 B14R1.60 CCCC(=O)N(C)CC1CCCCC1 11a_100000736448_100000211992 [0,1,0,0,0,1|2,0,0]=4 5389 B14R1.60 CCCC(=O)N(C)CC1CCCCC1 1626a_100000736448_100000211992 [0,1,0,0,0,1|2,0,0]=4 5390 B14R1.60 CCCC(=O)N(C)CC1CCCCC1 240690a_100000736448_100000211992 [0,1,0,0,0,1|2,0,0]=4 5391 B14R1.60 CCCC(=O)N(C)CC1CCCCC1 527a_100000736448_100000211992 [0,1,0,0,0,1|2,0,0]=4 5392 B14R1.60 CCCC(=O)N(C)CC1CCCCO1 11a_100000225654_100000211992 [0,1,0,0,0,1|1,0,0]=3 5393 B14R1.60 CCCC(=O)N(C)CC1CCCCO1 1626a_100000225654_100000211992 [0,1,0,0,0,1|1,0,0]=3 5394 B14R1.60 CCCC(=O)N(C)CC1CCCCO1 240690a_100000225654_100000211992 [0,1,0,0,0,1|1,0,0]=3 5395 B14R1.60 CCCC(=O)N(C)CC1CCCCO1 527a_100000225654_100000211992 [0,1,0,0,0,1|1,0,0]=3 5396 B14R1.60 CCCC(=O)N(C)CC1CCOCC1 11a_100025706683_100000211992 [0,1,0,0,0,1|2,0,0]=4 5397 B14R1.60 CCCC(=O)N(C)CC1CCOCC1 1626a_100025706683_100000211992 [0,1,0,0,0,1|2,0,0]=4 5398 B14R1.60 CCCC(=O)N(C)CC1CCOCC1 240690a_100025706683_100000211992 [0,1,0,0,0,1|2,0,0]=4 5399 B14R1.60 CCCC(=O)N(C)CC1CCOCC1 527a_100025706683_100000211992 [0,1,0,0,0,1|2,0,0]=4 5400 B14R1.60 CCCC(=O)N(C)CC1CCSCC1 11a_100011935259_100000211992 [0,1,0,0,0,1|2,0,0]=4 5401 B14R1.60 CCCC(=O)N(C)CC1CCSCC1 240690a_100011935259_100000211992 [0,1,0,0,0,1|2,0,0]=4 5402 B14R1.60 CCCC(=O)N(C)CC1CCSCC1 527a_100011935259_100000211992 [0,1,0,0,0,1|2,0,0]=4 5403 B14R1.60 CCCC(=O)N(C)CC1COCCO1 11a_100011398995_100000211992 [0,1,0,0,0,1|1,0,0]=3 5404 B14R1.60 CCCC(=O)N(C)CC1COCCO1 1626a_100011398995_100000211992 [0,1,0,0,0,1|1,0,0]=3 5405 B14R1.60 CCCC(=O)N(C)CC1COCCO1 240690a_100011398995_100000211992 [0,1,0,0,0,1|1,0,0]=3 5406 B14R1.60 CCCC(=O)N(C)CC1COCCO1 527a_100011398995_100000211992 [0,1,0,0,0,1|1,0,0]=3 5407 B14R1.60 CCCC(=O)[C@H](O)CC1CCCCC1 1458a_100016183741_100000210303 [0,1,0,0,0,1|2,0,0]=4 5408 B14R1.60 CCNC(=O)C(=O)CC1CCCCO1 1458a_200011297158_100000211543 [0,1,0,0,0,1|2,0,0]=4 5409 B14R1.60 CCNC(=O)C(=O)CC1CCCOC1 1458a_200011297158_100000741521 [0,1,0,0,0,1|2,0,0]=4 5410 B14R1.60 CCNC(=O)N(C)CC1CCCCO1 2708a_100015525214_100000225654 [0,1,0,0,0,1|2,0,0]=4 5411 B14R1.60 CCNC(=O)N(C)CC1CCCCO1 273464a_100015525214_100000225654 [0,1,0,0,0,1|2,0,0]=4 5412 B14R1.60 CCNC(=O)N(C)CC1COCCO1 2708a_100015525214_100011398995 [0,1,0,0,0,1|2,0,0]=4 5413 B14R1.60 CCNC(=O)N(C)CC1COCCO1 273464a_100015525214_100011398995 [0,1,0,0,0,1|2,0,0]=4 5414 B14R1.60 CN(CC1CCCCO1)C(=O)CCO 240690a_100000225654_100011216618 [0,1,0,0,0,1|2,0,0]=4 5415 B14R1.60 CN(CC1COCCO1)C(=O)CCO 240690a_100011398995_100011216618 [0,1,0,0,0,1|2,0,0]=4 5416 B14R1.60 COCC(=O)N(C)CC1CCCCO1 11a_100000225654_100000210968 [0,1,0,0,0,1|2,0,0]=4 5417 B14R1.60 COCC(=O)N(C)CC1CCCCO1 1626a_100000225654_100000210968 [0,1,0,0,0,1|2,0,0]=4 5418 B14R1.60 COCC(=O)N(C)CC1CCCCO1 240690a_100000225654_100000210968 [0,1,0,0,0,1|2,0,0]=4 5419 B14R1.60 COCC(=O)N(C)CC1CCCCO1 527a_100000225654_100000210968 [0,1,0,0,0,1|2,0,0]=4 5420 B14R1.60 COCC(=O)N(C)CC1COCCO1 11a_100011398995_100000210968 [0,1,0,0,0,1|2,0,0]=4 5421 B14R1.60 COCC(=O)N(C)CC1COCCO1 1626a_100011398995_100000210968 [0,1,0,0,0,1|2,0,0]=4 5422 B14R1.60 COCC(=O)N(C)CC1COCCO1 240690a_100011398995_100000210968 [0,1,0,0,0,1|2,0,0]=4 5423 B14R1.60 COCC(=O)N(C)CC1COCCO1 527a_100011398995_100000210968 [0,1,0,0,0,1|2,0,0]=4 5424 B14R1.60 CSCC(=O)N(C)CC1CCCCO1 11a_100000225654_100000184570 [0,1,0,0,0,1|2,0,0]=4 5425 B14R1.60 CSCC(=O)N(C)CC1CCCCO1 1626a_100000225654_100000184570 [0,1,0,0,0,1|2,0,0]=4 5426 B14R1.60 CSCC(=O)N(C)CC1CCCCO1 240690a_100000225654_100000184570 [0,1,0,0,0,1|2,0,0]=4 5427 B14R1.60 CSCC(=O)N(C)CC1CCCCO1 527a_100000225654_100000184570 [0,1,0,0,0,1|2,0,0]=4 5428 B14R1.60 CSCC(=O)N(C)CC1COCCO1 11a_100011398995_100000184570 [0,1,0,0,0,1|2,0,0]=4 5429 B14R1.60 CSCC(=O)N(C)CC1COCCO1 1626a_100011398995_100000184570 [0,1,0,0,0,1|2,0,0]=4 5430 B14R1.60 CSCC(=O)N(C)CC1COCCO1 240690a_100011398995_100000184570 [0,1,0,0,0,1|2,0,0]=4 5431 B14R1.60 CSCC(=O)N(C)CC1COCCO1 527a_100011398995_100000184570 [0,1,0,0,0,1|2,0,0]=4 5432 B14R1.156 C#CCCC(=O)CCC1OCCCO1 1458a_100000692101_100000764188 [0,1,0,0,0,1|1,0,1]=4 5433 B14R1.156 C#CCCC(=O)NCC1CCCCO1 11a_100000174945_100000692101 [0,1,0,0,0,1|1,0,1]=4 5434 B14R1.156 C#CCCC(=O)NCC1CCCCO1 1626a_100000174945_100000692101 [0,1,0,0,0,1|1,0,1]=4 5435 B14R1.156 C#CCCC(=O)NCC1CCCCO1 240690a_100000174945_100000692101 [0,1,0,0,0,1|1,0,1]=4 5436 B14R1.156 C#CCCC(=O)NCC1CCCCO1 527a_100000174945_100000692101 [0,1,0,0,0,1|1,0,1]=4 5437 B14R1.156 C#CCCC(=O)NCC1CCCOC1 11a_100000720124_100000692101 [0,1,0,0,0,1|1,0,1]=4 5438 B14R1.156 C#CCCC(=O)NCC1CCCOC1 1626a_100000720124_100000692101 [0,1,0,0,0,1|1,0,1]=4 5439 B14R1.156 C#CCCC(=O)NCC1CCCOC1 240690a_100000720124_100000692101 [0,1,0,0,0,1|1,0,1]=4 5440 B14R1.156 C#CCCC(=O)NCC1CCCOC1 527a_100000720124_100000692101 [0,1,0,0,0,1|1,0,1]=4 5441 B14R1.156 C#CCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000692101 [0,1,0,0,0,1|1,0,1]=4 5442 B14R1.156 C#CCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000692101 [0,1,0,0,0,1|1,0,1]=4 5443 B14R1.156 C#CCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000692101 [0,1,0,0,0,1|1,0,1]=4 5444 B14R1.156 C#CCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000692101 [0,1,0,0,0,1|1,0,1]=4 5445 B14R1.156 C=CCCC(=O)CCC1OCCCO1 1458a_100000749702_100000764188 [0,1,0,0,0,1|1,0,1]=4 5446 B14R1.156 C=CCCC(=O)NCC1CCCCO1 11a_100000174945_100000749702 [0,1,0,0,0,1|1,0,1]=4 5447 B14R1.156 C=CCCC(=O)NCC1CCCCO1 1626a_100000174945_100000749702 [0,1,0,0,0,1|1,0,1]=4 5448 B14R1.156 C=CCCC(=O)NCC1CCCCO1 240690a_100000174945_100000749702 [0,1,0,0,0,1|1,0,1]=4 5449 B14R1.156 C=CCCC(=O)NCC1CCCCO1 527a_100000174945_100000749702 [0,1,0,0,0,1|1,0,1]=4 5450 B14R1.156 C=CCCC(=O)NCC1CCCOC1 11a_100000720124_100000749702 [0,1,0,0,0,1|1,0,1]=4 5451 B14R1.156 C=CCCC(=O)NCC1CCCOC1 1626a_100000720124_100000749702 [0,1,0,0,0,1|1,0,1]=4 5452 B14R1.156 C=CCCC(=O)NCC1CCCOC1 240690a_100000720124_100000749702 [0,1,0,0,0,1|1,0,1]=4 5453 B14R1.156 C=CCCC(=O)NCC1CCCOC1 527a_100000720124_100000749702 [0,1,0,0,0,1|1,0,1]=4 5454 B14R1.156 C=CCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000749702 [0,1,0,0,0,1|1,0,1]=4 5455 B14R1.156 C=CCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000749702 [0,1,0,0,0,1|1,0,1]=4 5456 B14R1.156 C=CCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000749702 [0,1,0,0,0,1|1,0,1]=4 5457 B14R1.156 C=CCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000749702 [0,1,0,0,0,1|1,0,1]=4 5458 B14R1.156 CC(CCCCl)OCC1CCCCO1 34a_200000718107_100000211543 [0,1,0,0,0,1|1,0,1]=4 5459 B14R1.156 CC(CCCCl)OCC1CCCCO1 7a_200000718107_100000211543 [0,1,0,0,0,1|1,0,1]=4 5460 B14R1.156 CC(CCCCl)OCC1CCCOC1 34a_200000718107_100000741521 [0,1,0,0,0,1|1,0,1]=4 5461 B14R1.156 CC(CCCCl)OCC1CCCOC1 7a_200000718107_100000741521 [0,1,0,0,0,1|1,0,1]=4 5462 B14R1.156 CC=CCC(=O)CCC1OCCCO1 1458a_100121576822_100000764188 [0,1,0,0,0,1|1,0,1]=4 5463 B14R1.156 CC=CCC(=O)NCC1CCCCO1 11a_100000174945_100121576822 [0,1,0,0,0,1|1,0,1]=4 5464 B14R1.156 CC=CCC(=O)NCC1CCCCO1 1626a_100000174945_100121576822 [0,1,0,0,0,1|1,0,1]=4 5465 B14R1.156 CC=CCC(=O)NCC1CCCCO1 240690a_100000174945_100121576822 [0,1,0,0,0,1|1,0,1]=4 5466 B14R1.156 CC=CCC(=O)NCC1CCCCO1 527a_100000174945_100121576822 [0,1,0,0,0,1|1,0,1]=4 5467 B14R1.156 CC=CCC(=O)NCC1CCCOC1 11a_100000720124_100121576822 [0,1,0,0,0,1|1,0,1]=4 5468 B14R1.156 CC=CCC(=O)NCC1CCCOC1 1626a_100000720124_100121576822 [0,1,0,0,0,1|1,0,1]=4 5469 B14R1.156 CC=CCC(=O)NCC1CCCOC1 240690a_100000720124_100121576822 [0,1,0,0,0,1|1,0,1]=4 5470 B14R1.156 CC=CCC(=O)NCC1CCCOC1 527a_100000720124_100121576822 [0,1,0,0,0,1|1,0,1]=4 5471 B14R1.156 CC=CCC(=O)NC[C@H]1COCCO1 11a_100010981119_100121576822 [0,1,0,0,0,1|1,0,1]=4 5472 B14R1.156 CC=CCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100121576822 [0,1,0,0,0,1|1,0,1]=4 5473 B14R1.156 CC=CCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100121576822 [0,1,0,0,0,1|1,0,1]=4 5474 B14R1.156 CC=CCC(=O)NC[C@H]1COCCO1 527a_100010981119_100121576822 [0,1,0,0,0,1|1,0,1]=4 5475 B14R1.156 CCC#CC(=O)CCC1OCCCO1 1458a_100011827653_100000764188 [0,1,0,0,0,1|1,0,1]=4 5476 B14R1.156 CCC=CC(=O)CCC1OCCCO1 1458a_100000212282_100000764188 [0,1,0,0,0,1|1,0,1]=4 5477 B14R1.156 CCC=CC(=O)NCC1CCCCO1 11a_100000174945_100000212282 [0,1,0,0,0,1|1,0,1]=4 5478 B14R1.156 CCC=CC(=O)NCC1CCCCO1 1626a_100000174945_100000212282 [0,1,0,0,0,1|1,0,1]=4 5479 B14R1.156 CCC=CC(=O)NCC1CCCCO1 240690a_100000174945_100000212282 [0,1,0,0,0,1|1,0,1]=4 5480 B14R1.156 CCC=CC(=O)NCC1CCCOC1 11a_100000720124_100000212282 [0,1,0,0,0,1|1,0,1]=4 5481 B14R1.156 CCC=CC(=O)NCC1CCCOC1 1626a_100000720124_100000212282 [0,1,0,0,0,1|1,0,1]=4 5482 B14R1.156 CCC=CC(=O)NCC1CCCOC1 240690a_100000720124_100000212282 [0,1,0,0,0,1|1,0,1]=4 5483 B14R1.156 CCC=CC(=O)NC[C@H]1COCCO1 11a_100010981119_100000212282 [0,1,0,0,0,1|1,0,1]=4 5484 B14R1.156 CCC=CC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000212282 [0,1,0,0,0,1|1,0,1]=4 5485 B14R1.156 CCC=CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000212282 [0,1,0,0,0,1|1,0,1]=4 5486 B14R1.156 CCCCC(=O)CCC1CCCCC1 1458a_100000210183_100011273959 [0,1,0,0,0,1|2,0,0]=4 5487 B14R1.156 CCCCC(=O)CCC1CCCCC1 1458a_100000211375_100000210211 [0,1,0,0,0,1|2,0,0]=4 5488 B14R1.156 CCCCC(=O)CCC1CCOCC1 1458a_100000210183_100011934994 [0,1,0,0,0,1|2,0,0]=4 5489 B14R1.156 CCCCC(=O)CCC1OCCCO1 1458a_100000210183_100000764188 [0,1,0,0,0,1|1,0,0]=3 5490 B14R1.156 CCCCC(=O)CCN1CCCCO1 1458a_200015184090_100000210211 [0,1,0,0,0,1|2,0,0]=4 5491 B14R1.156 CCCCC(=O)NCC1CCCCC1 11a_100000210473_100000210183 [0,1,0,0,0,1|2,0,0]=4 5492 B14R1.156 CCCCC(=O)NCC1CCCCC1 1626a_100000210473_100000210183 [0,1,0,0,0,1|2,0,0]=4 5493 B14R1.156 CCCCC(=O)NCC1CCCCC1 240690a_100000210473_100000210183 [0,1,0,0,0,1|2,0,0]=4 5494 B14R1.156 CCCCC(=O)NCC1CCCCC1 527a_100000210473_100000210183 [0,1,0,0,0,1|2,0,0]=4 5495 B14R1.156 CCCCC(=O)NCC1CCCCO1 11a_100000174945_100000210183 [0,1,0,0,0,1|1,0,0]=3 5496 B14R1.156 CCCCC(=O)NCC1CCCCO1 1626a_100000174945_100000210183 [0,1,0,0,0,1|1,0,0]=3 5497 B14R1.156 CCCCC(=O)NCC1CCCCO1 240690a_100000174945_100000210183 [0,1,0,0,0,1|1,0,0]=3 5498 B14R1.156 CCCCC(=O)NCC1CCCCO1 527a_100000174945_100000210183 [0,1,0,0,0,1|1,0,0]=3 5499 B14R1.156 CCCCC(=O)NCC1CCCOC1 11a_100000720124_100000210183 [0,1,0,0,0,1|1,0,0]=3 5500 B14R1.156 CCCCC(=O)NCC1CCCOC1 1626a_100000720124_100000210183 [0,1,0,0,0,1|1,0,0]=3 5501 B14R1.156 CCCCC(=O)NCC1CCCOC1 240690a_100000720124_100000210183 [0,1,0,0,0,1|1,0,0]=3 5502 B14R1.156 CCCCC(=O)NCC1CCCOC1 527a_100000720124_100000210183 [0,1,0,0,0,1|1,0,0]=3 5503 B14R1.156 CCCCC(=O)NCC1CCOCC1 11a_100000746373_100000210183 [0,1,0,0,0,1|2,0,0]=4 5504 B14R1.156 CCCCC(=O)NCC1CCOCC1 1626a_100000746373_100000210183 [0,1,0,0,0,1|2,0,0]=4 5505 B14R1.156 CCCCC(=O)NCC1CCOCC1 240690a_100000746373_100000210183 [0,1,0,0,0,1|2,0,0]=4 5506 B14R1.156 CCCCC(=O)NCC1CCOCC1 527a_100000746373_100000210183 [0,1,0,0,0,1|2,0,0]=4 5507 B14R1.156 CCCCC(=O)NCC1CCSCC1 11a_100015188806_100000210183 [0,1,0,0,0,1|2,0,0]=4 5508 B14R1.156 CCCCC(=O)NCC1CCSCC1 240690a_100015188806_100000210183 [0,1,0,0,0,1|2,0,0]=4 5509 B14R1.156 CCCCC(=O)NCC1CCSCC1 527a_100015188806_100000210183 [0,1,0,0,0,1|2,0,0]=4 5510 B14R1.156 CCCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000210183 [0,1,0,0,0,1|1,0,0]=3 5511 B14R1.156 CCCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000210183 [0,1,0,0,0,1|1,0,0]=3 5512 B14R1.156 CCCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000210183 [0,1,0,0,0,1|1,0,0]=3 5513 B14R1.156 CCCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000210183 [0,1,0,0,0,1|1,0,0]=3 5514 B14R1.156 CCCCC(C)OCC1CCCCO1 34a_100000211370_200011215066 [0,1,0,0,0,1|1,0,1]=4 5515 B14R1.156 CCCCC(C)OCC1CCCCO1 34a_100000687866_100000211543 [0,1,0,0,0,1|1,0,1]=4 5516 B14R1.156 CCCCC(C)OCC1CCCCO1 7a_100000211370_200011215066 [0,1,0,0,0,1|1,0,1]=4 5517 B14R1.156 CCCCC(C)OCC1CCCCO1 7a_100000687866_100000211543 [0,1,0,0,0,1|1,0,1]=4 5518 B14R1.156 CCCCC(C)OCC1CCCOC1 34a_100000687866_100000741521 [0,1,0,0,0,1|1,0,1]=4 5519 B14R1.156 CCCCC(C)OCC1CCCOC1 34a_100000741520_200011215066 [0,1,0,0,0,1|1,0,1]=4 5520 B14R1.156 CCCCC(C)OCC1CCCOC1 7a_100000687866_100000741521 [0,1,0,0,0,1|1,0,1]=4 5521 B14R1.156 CCCCC(C)OC[C@@H]1CNCCO1 34a_100015189573_200011215066 [0,1,0,0,0,1|1,0,1]=4 5522 B14R1.156 CCCCC(C)OC[C@H]1COCCO1 34a_100009875890_200011215066 [0,1,0,0,0,1|1,0,1]=4 5523 B14R1.156 CCCNC(=O)CCC1CCCCC1 11a_100020643023_100000211375 [0,1,0,0,0,1|2,0,0]=4 5524 B14R1.156 CCCNC(=O)CCC1CCCCC1 1626a_100020643023_100000211375 [0,1,0,0,0,1|2,0,0]=4 5525 B14R1.156 CCCNC(=O)CCC1CCCCC1 240690a_100020643023_100000211375 [0,1,0,0,0,1|2,0,0]=4 5526 B14R1.156 CCCNC(=O)CCC1CCCCC1 527a_100020643023_100000211375 [0,1,0,0,0,1|2,0,0]=4 5527 B14R1.156 CCCNC(=O)CCN1CCCCO1 240690a_100020643023_200015184090 [0,1,0,0,0,1|2,0,0]=4 5528 B14R1.156 CCCNC(=O)CNC1CCCOC1 2230a_100000719290_100000183358 [0,1,0,0,0,1|2,0,0]=4 5529 B14R1.156 CCCNC(=O)CNC1CCCOC1 270004a_100000174927_100000753404 [0,1,0,0,0,1|2,0,0]=4 5530 B14R1.156 CCCNC(=O)CNC1CCCOC1 34a_100000719290_100000183358 [0,1,0,0,0,1|2,0,0]=4 5531 B14R1.156 CCCNC(=O)COC1CCCCO1 34a_100000033831_100000183358 [0,1,0,0,0,1|2,0,0]=4 5532 B14R1.156 CCCNC(=O)COC1CCCOC1 34a_100000754041_100000183358 [0,1,0,0,0,1|2,0,0]=4 5533 B14R1.156 CCCNC(=O)CSC1CCCOC1 62a_100000183358_100000693364 [0,1,0,0,0,1|2,0,0]=4 5534 B14R1.156 CCCNC(=O)NCC1CCCCC1 2708a_100000210473_100020643023 [0,1,0,0,0,1|2,0,0]=4 5535 B14R1.156 CCCNC(=O)NCC1CCCCC1 2708a_100020643023_100000210473 [0,1,0,0,0,1|2,0,0]=4 5536 B14R1.156 CCCNC(=O)NCC1CCCCC1 273464a_100000210473_100020643023 [0,1,0,0,0,1|2,0,0]=4 5537 B14R1.156 CCCNC(=O)NCC1CCCCC1 273464a_100020643023_100000210473 [0,1,0,0,0,1|2,0,0]=4 5538 B14R1.156 CCCNC(=O)NCC1CCCCC1 512a_100020643023_100000210473 [0,1,0,0,0,1|2,0,0]=4 5539 B14R1.156 CCCNC(=O)NCC1CCCCO1 2708a_100000174945_100020643023 [0,1,0,0,0,1|1,0,0]=3 5540 B14R1.156 CCCNC(=O)NCC1CCCCO1 2708a_100020643023_100000174945 [0,1,0,0,0,1|1,0,0]=3 5541 B14R1.156 CCCNC(=O)NCC1CCCCO1 273464a_100000174945_100020643023 [0,1,0,0,0,1|1,0,0]=3 5542 B14R1.156 CCCNC(=O)NCC1CCCCO1 273464a_100020643023_100000174945 [0,1,0,0,0,1|1,0,0]=3 5543 B14R1.156 CCCNC(=O)NCC1CCCCO1 512a_100000174945_100020643023 [0,1,0,0,0,1|1,0,0]=3 5544 B14R1.156 CCCNC(=O)NCC1CCCCO1 512a_100020643023_100000174945 [0,1,0,0,0,1|1,0,0]=3 5545 B14R1.156 CCCNC(=O)NCC1CCCOC1 2708a_100000720124_100020643023 [0,1,0,0,0,1|1,0,0]=3 5546 B14R1.156 CCCNC(=O)NCC1CCCOC1 2708a_100020643023_100000720124 [0,1,0,0,0,1|1,0,0]=3 5547 B14R1.156 CCCNC(=O)NCC1CCCOC1 273464a_100000720124_100020643023 [0,1,0,0,0,1|1,0,0]=3 5548 B14R1.156 CCCNC(=O)NCC1CCCOC1 273464a_100020643023_100000720124 [0,1,0,0,0,1|1,0,0]=3 5549 B14R1.156 CCCNC(=O)NCC1CCCOC1 512a_100000720124_100020643023 [0,1,0,0,0,1|1,0,0]=3 5550 B14R1.156 CCCNC(=O)NCC1CCCOC1 512a_100020643023_100000720124 [0,1,0,0,0,1|1,0,0]=3 5551 B14R1.156 CCCNC(=O)NCC1CCOCC1 2708a_100000746373_100020643023 [0,1,0,0,0,1|2,0,0]=4 5552 B14R1.156 CCCNC(=O)NCC1CCOCC1 2708a_100020643023_100000746373 [0,1,0,0,0,1|2,0,0]=4 5553 B14R1.156 CCCNC(=O)NCC1CCOCC1 273464a_100000746373_100020643023 [0,1,0,0,0,1|2,0,0]=4 5554 B14R1.156 CCCNC(=O)NCC1CCOCC1 273464a_100020643023_100000746373 [0,1,0,0,0,1|2,0,0]=4 5555 B14R1.156 CCCNC(=O)NCC1CCOCC1 512a_100000746373_100020643023 [0,1,0,0,0,1|2,0,0]=4 5556 B14R1.156 CCCNC(=O)NCC1CCOCC1 512a_100020643023_100000746373 [0,1,0,0,0,1|2,0,0]=4 5557 B14R1.156 CCCNC(=O)NCC1CCSCC1 2708a_100015188806_100020643023 [0,1,0,0,0,1|2,0,0]=4 5558 B14R1.156 CCCNC(=O)NCC1CCSCC1 2708a_100020643023_100015188806 [0,1,0,0,0,1|2,0,0]=4 5559 B14R1.156 CCCNC(=O)NCC1CCSCC1 273464a_100015188806_100020643023 [0,1,0,0,0,1|2,0,0]=4 5560 B14R1.156 CCCNC(=O)NCC1CCSCC1 273464a_100020643023_100015188806 [0,1,0,0,0,1|2,0,0]=4 5561 B14R1.156 CCCNC(=O)NCC1CCSCC1 512a_100015188806_100020643023 [0,1,0,0,0,1|2,0,0]=4 5562 B14R1.156 CCCNC(=O)NCC1CCSCC1 512a_100020643023_100015188806 [0,1,0,0,0,1|2,0,0]=4 5563 B14R1.156 CCCNC(=O)NC[C@H]1COCCO1 2708a_100010981119_100020643023 [0,1,0,0,0,1|1,0,0]=3 5564 B14R1.156 CCCNC(=O)NC[C@H]1COCCO1 2708a_100020643023_100010981119 [0,1,0,0,0,1|1,0,0]=3 5565 B14R1.156 CCCNC(=O)NC[C@H]1COCCO1 273464a_100010981119_100020643023 [0,1,0,0,0,1|1,0,0]=3 5566 B14R1.156 CCCNC(=O)NC[C@H]1COCCO1 273464a_100020643023_100010981119 [0,1,0,0,0,1|1,0,0]=3 5567 B14R1.156 CCCNC(=O)NC[C@H]1COCCO1 512a_100010981119_100020643023 [0,1,0,0,0,1|1,0,0]=3 5568 B14R1.156 CCCNC(=O)NC[C@H]1COCCO1 512a_100020643023_100010981119 [0,1,0,0,0,1|1,0,0]=3 5569 B14R1.156 CCCOC(=O)CNC1CCCOC1 2230a_100000719290_200011215008 [0,1,0,0,0,1|2,0,0]=4 5570 B14R1.156 CCCOC(=O)CNC1CCCOC1 34a_100000719290_200011215008 [0,1,0,0,0,1|2,0,0]=4 5571 B14R1.156 CCCOC(=O)COC1CCCCO1 34a_100000033831_200011215008 [0,1,0,0,0,1|2,0,0]=4 5572 B14R1.156 CCCOC(=O)COC1CCCOC1 34a_100000754041_200011215008 [0,1,0,0,0,1|2,0,0]=4 5573 B14R1.156 CCCOC(=O)CSC1CCCOC1 62a_200011215008_100000693364 [0,1,0,0,0,1|2,0,0]=4 5574 B14R1.156 CCCOC(=O)OCN1CCCOC1 269982a_100000131196_200000139673 [0,1,0,0,0,1|1,0,0]=3 5575 B14R1.156 CCCOC(=O)OCN1CCCOC1 34a_100000131196_200000139673 [0,1,0,0,0,1|1,0,0]=3 5576 B14R1.156 CCCOC(=O)OCN1CCOCC1 269982a_100015191051_200000139673 [0,1,0,0,0,1|2,0,0]=4 5577 B14R1.156 CCCOC(=O)OCN1CCOCC1 34a_100015191051_200000139673 [0,1,0,0,0,1|2,0,0]=4 5578 B14R1.156 CCCOC(=O)OCN1CCSCC1 269982a_100000737611_200000139673 [0,1,0,0,0,1|2,0,0]=4 5579 B14R1.156 CCNCC(=O)NCC1CCCCC1 2230a_100015525214_100000183341 [0,1,0,0,0,1|2,0,0]=4 5580 B14R1.156 CCNNC(=O)NCC1CCCCO1 273464a_100000174945_100000756455 [0,1,0,0,0,1|2,0,0]=4 5581 B14R1.156 CCNNC(=O)NCC1CCCCO1 512a_100000174945_100000756455 [0,1,0,0,0,1|2,0,0]=4 5582 B14R1.156 CCNNC(=O)NCC1CCCCO1 512a_100000756455_100000174945 [0,1,0,0,0,1|2,0,0]=4 5583 B14R1.156 CCNNC(=O)NCC1CCCOC1 273464a_100000720124_100000756455 [0,1,0,0,0,1|2,0,0]=4 5584 B14R1.156 CCNNC(=O)NCC1CCCOC1 512a_100000720124_100000756455 [0,1,0,0,0,1|2,0,0]=4 5585 B14R1.156 CCNNC(=O)NCC1CCCOC1 512a_100000756455_100000720124 [0,1,0,0,0,1|2,0,0]=4 5586 B14R1.156 CCNNC(=O)NC[C@H]1COCCO1 273464a_100010981119_100000756455 [0,1,0,0,0,1|2,0,0]=4 5587 B14R1.156 CCNNC(=O)NC[C@H]1COCCO1 512a_100000756455_100010981119 [0,1,0,0,0,1|2,0,0]=4 5588 B14R1.156 CCNNC(=O)NC[C@H]1COCCO1 512a_100010981119_100000756455 [0,1,0,0,0,1|2,0,0]=4 5589 B14R1.156 CCOCC(=O)CCC1CCCCC1 1458a_100000211967_100011273959 [0,1,0,0,0,1|2,0,0]=4 5590 B14R1.156 CCOCC(=O)CCC1CCOCC1 1458a_100000211967_100011934994 [0,1,0,0,0,1|2,0,0]=4 5591 B14R1.156 CCOCC(=O)CCC1OCCCO1 1458a_100000211967_100000764188 [0,1,0,0,0,1|1,0,0]=3 5592 B14R1.156 CCOCC(=O)NCC1CCCCC1 11a_100000210473_100000211967 [0,1,0,0,0,1|2,0,0]=4 5593 B14R1.156 CCOCC(=O)NCC1CCCCC1 1626a_100000210473_100000211967 [0,1,0,0,0,1|2,0,0]=4 5594 B14R1.156 CCOCC(=O)NCC1CCCCC1 240690a_100000210473_100000211967 [0,1,0,0,0,1|2,0,0]=4 5595 B14R1.156 CCOCC(=O)NCC1CCCCC1 34a_100121572206_100000183341 [0,1,0,0,0,1|2,0,0]=4 5596 B14R1.156 CCOCC(=O)NCC1CCCCC1 527a_100000210473_100000211967 [0,1,0,0,0,1|2,0,0]=4 5597 B14R1.156 CCOCC(=O)NCC1CCCCO1 11a_100000174945_100000211967 [0,1,0,0,0,1|1,0,0]=3 5598 B14R1.156 CCOCC(=O)NCC1CCCCO1 1626a_100000174945_100000211967 [0,1,0,0,0,1|1,0,0]=3 5599 B14R1.156 CCOCC(=O)NCC1CCCCO1 240690a_100000174945_100000211967 [0,1,0,0,0,1|1,0,0]=3 5600 B14R1.156 CCOCC(=O)NCC1CCCCO1 527a_100000174945_100000211967 [0,1,0,0,0,1|1,0,0]=3 5601 B14R1.156 CCOCC(=O)NCC1CCCOC1 11a_100000720124_100000211967 [0,1,0,0,0,1|1,0,0]=3 5602 B14R1.156 CCOCC(=O)NCC1CCCOC1 1626a_100000720124_100000211967 [0,1,0,0,0,1|1,0,0]=3 5603 B14R1.156 CCOCC(=O)NCC1CCCOC1 240690a_100000720124_100000211967 [0,1,0,0,0,1|1,0,0]=3 5604 B14R1.156 CCOCC(=O)NCC1CCCOC1 527a_100000720124_100000211967 [0,1,0,0,0,1|1,0,0]=3 5605 B14R1.156 CCOCC(=O)NCC1CCOCC1 11a_100000746373_100000211967 [0,1,0,0,0,1|2,0,0]=4 5606 B14R1.156 CCOCC(=O)NCC1CCOCC1 1626a_100000746373_100000211967 [0,1,0,0,0,1|2,0,0]=4 5607 B14R1.156 CCOCC(=O)NCC1CCOCC1 240690a_100000746373_100000211967 [0,1,0,0,0,1|2,0,0]=4 5608 B14R1.156 CCOCC(=O)NCC1CCOCC1 527a_100000746373_100000211967 [0,1,0,0,0,1|2,0,0]=4 5609 B14R1.156 CCOCC(=O)NCC1CCSCC1 11a_100015188806_100000211967 [0,1,0,0,0,1|2,0,0]=4 5610 B14R1.156 CCOCC(=O)NCC1CCSCC1 240690a_100015188806_100000211967 [0,1,0,0,0,1|2,0,0]=4 5611 B14R1.156 CCOCC(=O)NCC1CCSCC1 527a_100015188806_100000211967 [0,1,0,0,0,1|2,0,0]=4 5612 B14R1.156 CCOCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000211967 [0,1,0,0,0,1|1,0,0]=3 5613 B14R1.156 CCOCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000211967 [0,1,0,0,0,1|1,0,0]=3 5614 B14R1.156 CCOCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000211967 [0,1,0,0,0,1|1,0,0]=3 5615 B14R1.156 CCOCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000211967 [0,1,0,0,0,1|1,0,0]=3 5616 B14R1.156 CCOCC(C)OCC1CCCCO1 34a_100000718985_100000211543 [0,1,0,0,0,1|1,0,1]=4 5617 B14R1.156 CCOCC(C)OCC1CCCCO1 7a_100000718985_100000211543 [0,1,0,0,0,1|1,0,1]=4 5618 B14R1.156 CCOCC(C)OCC1CCCOC1 34a_100000718985_100000741521 [0,1,0,0,0,1|1,0,1]=4 5619 B14R1.156 CCOCC(C)OCC1CCCOC1 7a_100000718985_100000741521 [0,1,0,0,0,1|1,0,1]=4 5620 B14R1.156 CCSCC(=O)CCC1CCCCC1 1458a_100000230394_100011273959 [0,1,0,0,0,1|2,0,0]=4 5621 B14R1.156 CCSCC(=O)CCC1CCOCC1 1458a_100000230394_100011934994 [0,1,0,0,0,1|2,0,0]=4 5622 B14R1.156 CCSCC(=O)CCC1OCCCO1 1458a_100000230394_100000764188 [0,1,0,0,0,1|1,0,0]=3 5623 B14R1.156 CCSCC(=O)NCC1CCCCC1 11a_100000210473_100000230394 [0,1,0,0,0,1|2,0,0]=4 5624 B14R1.156 CCSCC(=O)NCC1CCCCC1 1626a_100000210473_100000230394 [0,1,0,0,0,1|2,0,0]=4 5625 B14R1.156 CCSCC(=O)NCC1CCCCC1 240690a_100000210473_100000230394 [0,1,0,0,0,1|2,0,0]=4 5626 B14R1.156 CCSCC(=O)NCC1CCCCC1 527a_100000210473_100000230394 [0,1,0,0,0,1|2,0,0]=4 5627 B14R1.156 CCSCC(=O)NCC1CCCCC1 62a_100000183341_100000210202 [0,1,0,0,0,1|2,0,0]=4 5628 B14R1.156 CCSCC(=O)NCC1CCCCC1 62a_100000210202_100000183341 [0,1,0,0,0,1|2,0,0]=4 5629 B14R1.156 CCSCC(=O)NCC1CCCCO1 11a_100000174945_100000230394 [0,1,0,0,0,1|1,0,0]=3 5630 B14R1.156 CCSCC(=O)NCC1CCCCO1 1626a_100000174945_100000230394 [0,1,0,0,0,1|1,0,0]=3 5631 B14R1.156 CCSCC(=O)NCC1CCCCO1 240690a_100000174945_100000230394 [0,1,0,0,0,1|1,0,0]=3 5632 B14R1.156 CCSCC(=O)NCC1CCCCO1 527a_100000174945_100000230394 [0,1,0,0,0,1|1,0,0]=3 5633 B14R1.156 CCSCC(=O)NCC1CCCOC1 11a_100000720124_100000230394 [0,1,0,0,0,1|1,0,0]=3 5634 B14R1.156 CCSCC(=O)NCC1CCCOC1 1626a_100000720124_100000230394 [0,1,0,0,0,1|1,0,0]=3 5635 B14R1.156 CCSCC(=O)NCC1CCCOC1 240690a_100000720124_100000230394 [0,1,0,0,0,1|1,0,0]=3 5636 B14R1.156 CCSCC(=O)NCC1CCCOC1 527a_100000720124_100000230394 [0,1,0,0,0,1|1,0,0]=3 5637 B14R1.156 CCSCC(=O)NCC1CCOCC1 11a_100000746373_100000230394 [0,1,0,0,0,1|2,0,0]=4 5638 B14R1.156 CCSCC(=O)NCC1CCOCC1 1626a_100000746373_100000230394 [0,1,0,0,0,1|2,0,0]=4 5639 B14R1.156 CCSCC(=O)NCC1CCOCC1 240690a_100000746373_100000230394 [0,1,0,0,0,1|2,0,0]=4 5640 B14R1.156 CCSCC(=O)NCC1CCOCC1 527a_100000746373_100000230394 [0,1,0,0,0,1|2,0,0]=4 5641 B14R1.156 CCSCC(=O)NCC1CCSCC1 11a_100015188806_100000230394 [0,1,0,0,0,1|2,0,0]=4 5642 B14R1.156 CCSCC(=O)NCC1CCSCC1 240690a_100015188806_100000230394 [0,1,0,0,0,1|2,0,0]=4 5643 B14R1.156 CCSCC(=O)NCC1CCSCC1 527a_100015188806_100000230394 [0,1,0,0,0,1|2,0,0]=4 5644 B14R1.156 CCSCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000230394 [0,1,0,0,0,1|1,0,0]=3 5645 B14R1.156 CCSCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000230394 [0,1,0,0,0,1|1,0,0]=3 5646 B14R1.156 CCSCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000230394 [0,1,0,0,0,1|1,0,0]=3 5647 B14R1.156 CCSCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000230394 [0,1,0,0,0,1|1,0,0]=3 5648 B14R1.156 COCCC(=O)CCC1CCCCC1 1458a_100000211375_100000233755 [0,1,0,0,0,1|2,0,0]=4 5649 B14R1.156 COCCC(=O)CCC1CCCCC1 1458a_100000749529_100011273959 [0,1,0,0,0,1|2,0,0]=4 5650 B14R1.156 COCCC(=O)CCC1CCOCC1 1458a_100000749529_100011934994 [0,1,0,0,0,1|2,0,0]=4 5651 B14R1.156 COCCC(=O)CCC1OCCCO1 1458a_100000749529_100000764188 [0,1,0,0,0,1|1,0,0]=3 5652 B14R1.156 COCCC(=O)CCN1CCCCO1 1458a_200015184090_100000233755 [0,1,0,0,0,1|2,0,0]=4 5653 B14R1.156 COCCC(=O)NCC1CCCCC1 11a_100000210473_100000749529 [0,1,0,0,0,1|2,0,0]=4 5654 B14R1.156 COCCC(=O)NCC1CCCCC1 1626a_100000210473_100000749529 [0,1,0,0,0,1|2,0,0]=4 5655 B14R1.156 COCCC(=O)NCC1CCCCC1 240690a_100000210473_100000749529 [0,1,0,0,0,1|2,0,0]=4 5656 B14R1.156 COCCC(=O)NCC1CCCCC1 527a_100000210473_100000749529 [0,1,0,0,0,1|2,0,0]=4 5657 B14R1.156 COCCC(=O)NCC1CCCCO1 11a_100000174945_100000749529 [0,1,0,0,0,1|1,0,0]=3 5658 B14R1.156 COCCC(=O)NCC1CCCCO1 1626a_100000174945_100000749529 [0,1,0,0,0,1|1,0,0]=3 5659 B14R1.156 COCCC(=O)NCC1CCCCO1 240690a_100000174945_100000749529 [0,1,0,0,0,1|1,0,0]=3 5660 B14R1.156 COCCC(=O)NCC1CCCCO1 527a_100000174945_100000749529 [0,1,0,0,0,1|1,0,0]=3 5661 B14R1.156 COCCC(=O)NCC1CCCOC1 11a_100000720124_100000749529 [0,1,0,0,0,1|1,0,0]=3 5662 B14R1.156 COCCC(=O)NCC1CCCOC1 1626a_100000720124_100000749529 [0,1,0,0,0,1|1,0,0]=3 5663 B14R1.156 COCCC(=O)NCC1CCCOC1 240690a_100000720124_100000749529 [0,1,0,0,0,1|1,0,0]=3 5664 B14R1.156 COCCC(=O)NCC1CCCOC1 527a_100000720124_100000749529 [0,1,0,0,0,1|1,0,0]=3 5665 B14R1.156 COCCC(=O)NCC1CCOCC1 11a_100000746373_100000749529 [0,1,0,0,0,1|2,0,0]=4 5666 B14R1.156 COCCC(=O)NCC1CCOCC1 1626a_100000746373_100000749529 [0,1,0,0,0,1|2,0,0]=4 5667 B14R1.156 COCCC(=O)NCC1CCOCC1 240690a_100000746373_100000749529 [0,1,0,0,0,1|2,0,0]=4 5668 B14R1.156 COCCC(=O)NCC1CCOCC1 527a_100000746373_100000749529 [0,1,0,0,0,1|2,0,0]=4 5669 B14R1.156 COCCC(=O)NCC1CCSCC1 11a_100015188806_100000749529 [0,1,0,0,0,1|2,0,0]=4 5670 B14R1.156 COCCC(=O)NCC1CCSCC1 240690a_100015188806_100000749529 [0,1,0,0,0,1|2,0,0]=4 5671 B14R1.156 COCCC(=O)NCC1CCSCC1 527a_100015188806_100000749529 [0,1,0,0,0,1|2,0,0]=4 5672 B14R1.156 COCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000749529 [0,1,0,0,0,1|1,0,0]=3 5673 B14R1.156 COCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000749529 [0,1,0,0,0,1|1,0,0]=3 5674 B14R1.156 COCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000749529 [0,1,0,0,0,1|1,0,0]=3 5675 B14R1.156 COCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000749529 [0,1,0,0,0,1|1,0,0]=3 5676 B14R1.156 CSCCC(=O)CCC1CCCCC1 1458a_100000174002_100011273959 [0,1,0,0,0,1|2,0,0]=4 5677 B14R1.156 CSCCC(=O)CCC1CCCCC1 1458a_100000211375_100000751147 [0,1,0,0,0,1|2,0,0]=4 5678 B14R1.156 CSCCC(=O)CCC1CCOCC1 1458a_100000174002_100011934994 [0,1,0,0,0,1|2,0,0]=4 5679 B14R1.156 CSCCC(=O)CCC1OCCCO1 1458a_100000174002_100000764188 [0,1,0,0,0,1|1,0,0]=3 5680 B14R1.156 CSCCC(=O)CCN1CCCCO1 1458a_200015184090_100000751147 [0,1,0,0,0,1|2,0,0]=4 5681 B14R1.156 CSCCC(=O)NCC1CCCCC1 11a_100000210473_100000174002 [0,1,0,0,0,1|2,0,0]=4 5682 B14R1.156 CSCCC(=O)NCC1CCCCC1 1626a_100000210473_100000174002 [0,1,0,0,0,1|2,0,0]=4 5683 B14R1.156 CSCCC(=O)NCC1CCCCC1 240690a_100000210473_100000174002 [0,1,0,0,0,1|2,0,0]=4 5684 B14R1.156 CSCCC(=O)NCC1CCCCC1 527a_100000210473_100000174002 [0,1,0,0,0,1|2,0,0]=4 5685 B14R1.156 CSCCC(=O)NCC1CCCCO1 11a_100000174945_100000174002 [0,1,0,0,0,1|1,0,0]=3 5686 B14R1.156 CSCCC(=O)NCC1CCCCO1 1626a_100000174945_100000174002 [0,1,0,0,0,1|1,0,0]=3 5687 B14R1.156 CSCCC(=O)NCC1CCCCO1 240690a_100000174945_100000174002 [0,1,0,0,0,1|1,0,0]=3 5688 B14R1.156 CSCCC(=O)NCC1CCCCO1 527a_100000174945_100000174002 [0,1,0,0,0,1|1,0,0]=3 5689 B14R1.156 CSCCC(=O)NCC1CCCOC1 11a_100000720124_100000174002 [0,1,0,0,0,1|1,0,0]=3 5690 B14R1.156 CSCCC(=O)NCC1CCCOC1 1626a_100000720124_100000174002 [0,1,0,0,0,1|1,0,0]=3 5691 B14R1.156 CSCCC(=O)NCC1CCCOC1 240690a_100000720124_100000174002 [0,1,0,0,0,1|1,0,0]=3 5692 B14R1.156 CSCCC(=O)NCC1CCCOC1 527a_100000720124_100000174002 [0,1,0,0,0,1|1,0,0]=3 5693 B14R1.156 CSCCC(=O)NCC1CCOCC1 11a_100000746373_100000174002 [0,1,0,0,0,1|2,0,0]=4 5694 B14R1.156 CSCCC(=O)NCC1CCOCC1 1626a_100000746373_100000174002 [0,1,0,0,0,1|2,0,0]=4 5695 B14R1.156 CSCCC(=O)NCC1CCOCC1 240690a_100000746373_100000174002 [0,1,0,0,0,1|2,0,0]=4 5696 B14R1.156 CSCCC(=O)NCC1CCOCC1 527a_100000746373_100000174002 [0,1,0,0,0,1|2,0,0]=4 5697 B14R1.156 CSCCC(=O)NCC1CCSCC1 11a_100015188806_100000174002 [0,1,0,0,0,1|2,0,0]=4 5698 B14R1.156 CSCCC(=O)NCC1CCSCC1 240690a_100015188806_100000174002 [0,1,0,0,0,1|2,0,0]=4 5699 B14R1.156 CSCCC(=O)NCC1CCSCC1 527a_100015188806_100000174002 [0,1,0,0,0,1|2,0,0]=4 5700 B14R1.156 CSCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000174002 [0,1,0,0,0,1|1,0,0]=3 5701 B14R1.156 CSCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000174002 [0,1,0,0,0,1|1,0,0]=3 5702 B14R1.156 CSCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000174002 [0,1,0,0,0,1|1,0,0]=3 5703 B14R1.156 CSCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000174002 [0,1,0,0,0,1|1,0,0]=3 5704 B14R1.156 N#CCCC(=O)CCC1OCCCO1 1458a_100011934036_100000764188 [0,1,0,0,0,1|1,0,1]=4 5705 B14R1.156 N#CCCC(=O)NCC1CCCCO1 11a_100000174945_100011934036 [0,1,0,0,0,1|1,0,1]=4 5706 B14R1.156 N#CCCC(=O)NCC1CCCCO1 1626a_100000174945_100011934036 [0,1,0,0,0,1|1,0,1]=4 5707 B14R1.156 N#CCCC(=O)NCC1CCCCO1 240690a_100000174945_100011934036 [0,1,0,0,0,1|1,0,1]=4 5708 B14R1.156 N#CCCC(=O)NCC1CCCCO1 527a_100000174945_100011934036 [0,1,0,0,0,1|1,0,1]=4 5709 B14R1.156 N#CCCC(=O)NCC1CCCOC1 11a_100000720124_100011934036 [0,1,0,0,0,1|1,0,1]=4 5710 B14R1.156 N#CCCC(=O)NCC1CCCOC1 1626a_100000720124_100011934036 [0,1,0,0,0,1|1,0,1]=4 5711 B14R1.156 N#CCCC(=O)NCC1CCCOC1 240690a_100000720124_100011934036 [0,1,0,0,0,1|1,0,1]=4 5712 B14R1.156 N#CCCC(=O)NCC1CCCOC1 527a_100000720124_100011934036 [0,1,0,0,0,1|1,0,1]=4 5713 B14R1.156 N#CCCC(=O)NC[C@H]1COCCO1 11a_100010981119_100011934036 [0,1,0,0,0,1|1,0,1]=4 5714 B14R1.156 N#CCCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100011934036 [0,1,0,0,0,1|1,0,1]=4 5715 B14R1.156 N#CCCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100011934036 [0,1,0,0,0,1|1,0,1]=4 5716 B14R1.156 N#CCCC(=O)NC[C@H]1COCCO1 527a_100010981119_100011934036 [0,1,0,0,0,1|1,0,1]=4 5717 B14R1.156 O=C(CCCF)CCC1CCCCC1 1458a_100000211375_100011934791 [0,1,0,0,0,1|2,0,0]=4 5718 B14R1.156 O=C(CCCF)CCN1CCCCO1 1458a_200015184090_100011934791 [0,1,0,0,0,1|2,0,0]=4 5719 B14R1.156 O=C(CCCO)CCC1CCCCC1 1458a_100000211375_100011215043 [0,1,0,0,0,1|2,0,0]=4 5720 B14R1.156 O=C(CCCO)CCN1CCCCO1 1458a_200015184090_100011215043 [0,1,0,0,0,1|2,0,0]=4 5721 B14R1.156 O=C(NCCF)NCC1CCCCO1 2708a_100000174945_100000724931 [0,1,0,0,0,1|2,0,0]=4 5722 B14R1.156 O=C(NCCF)NCC1CCCCO1 273464a_100000174945_100000724931 [0,1,0,0,0,1|2,0,0]=4 5723 B14R1.156 O=C(NCCF)NCC1CCCCO1 273464a_100000724931_100000174945 [0,1,0,0,0,1|2,0,0]=4 5724 B14R1.156 O=C(NCCF)NCC1CCCCO1 512a_100000174945_100000724931 [0,1,0,0,0,1|2,0,0]=4 5725 B14R1.156 O=C(NCCF)NCC1CCCOC1 2708a_100000720124_100000724931 [0,1,0,0,0,1|2,0,0]=4 5726 B14R1.156 O=C(NCCF)NCC1CCCOC1 273464a_100000720124_100000724931 [0,1,0,0,0,1|2,0,0]=4 5727 B14R1.156 O=C(NCCF)NCC1CCCOC1 273464a_100000724931_100000720124 [0,1,0,0,0,1|2,0,0]=4 5728 B14R1.156 O=C(NCCF)NCC1CCCOC1 512a_100000720124_100000724931 [0,1,0,0,0,1|2,0,0]=4 5729 B14R1.156 O=C(NCCF)NC[C@H]1COCCO1 2708a_100010981119_100000724931 [0,1,0,0,0,1|2,0,0]=4 5730 B14R1.156 O=C(NCCF)NC[C@H]1COCCO1 273464a_100000724931_100010981119 [0,1,0,0,0,1|2,0,0]=4 5731 B14R1.156 O=C(NCCF)NC[C@H]1COCCO1 273464a_100010981119_100000724931 [0,1,0,0,0,1|2,0,0]=4 5732 B14R1.156 O=C(NCCF)NC[C@H]1COCCO1 512a_100010981119_100000724931 [0,1,0,0,0,1|2,0,0]=4 5733 B14R1.156 O=C(NCCO)NCC1CCCCO1 2708a_100000174945_100000210304 [0,1,0,0,0,1|2,0,0]=4 5734 B14R1.156 O=C(NCCO)NCC1CCCCO1 273464a_100000174945_100000210304 [0,1,0,0,0,1|2,0,0]=4 5735 B14R1.156 O=C(NCCO)NCC1CCCCO1 273464a_100000210304_100000174945 [0,1,0,0,0,1|2,0,0]=4 5736 B14R1.156 O=C(NCCO)NCC1CCCCO1 512a_100000174945_100000210304 [0,1,0,0,0,1|2,0,0]=4 5737 B14R1.156 O=C(NCCO)NCC1CCCOC1 2708a_100000720124_100000210304 [0,1,0,0,0,1|2,0,0]=4 5738 B14R1.156 O=C(NCCO)NCC1CCCOC1 273464a_100000210304_100000720124 [0,1,0,0,0,1|2,0,0]=4 5739 B14R1.156 O=C(NCCO)NCC1CCCOC1 273464a_100000720124_100000210304 [0,1,0,0,0,1|2,0,0]=4 5740 B14R1.156 O=C(NCCO)NCC1CCCOC1 512a_100000720124_100000210304 [0,1,0,0,0,1|2,0,0]=4 5741 B14R1.156 O=C(NCCO)NC[C@H]1COCCO1 2708a_100010981119_100000210304 [0,1,0,0,0,1|2,0,0]=4 5742 B14R1.156 O=C(NCCO)NC[C@H]1COCCO1 273464a_100000210304_100010981119 [0,1,0,0,0,1|2,0,0]=4 5743 B14R1.156 O=C(NCCO)NC[C@H]1COCCO1 273464a_100010981119_100000210304 [0,1,0,0,0,1|2,0,0]=4 5744 B14R1.156 O=C(NCCO)NC[C@H]1COCCO1 512a_100010981119_100000210304 [0,1,0,0,0,1|2,0,0]=4 5745 B14R1.502 C=C1CCN(CC1)COC(=O)CCC 2230a_100000752442_100000034017 [0,1,0,0,0,1|2,0,0]=4 5746 B14R1.502 C=C1CCN(CC1)COC(=O)CCC 269982a_100000752442_100000034017 [0,1,0,0,0,1|2,0,0]=4 5747 B14R1.502 C=C1CCN(CC1)COC(=O)CCC 34a_100000752442_100000034017 [0,1,0,0,0,1|2,0,0]=4 5748 B14R1.502 CCCC(=O)NCC1CCC(CC1)C 11a_103436935547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5749 B14R1.502 CCCC(=O)NCC1CCC(CC1)C 1626a_103436935547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5750 B14R1.502 CCCC(=O)NCC1CCC(CC1)C 240690a_103436935547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5751 B14R1.502 CCCC(=O)NCC1CCC(CC1)C 527a_103436935547_100000211992 [0,1,0,0,0,1|2,0,0]=4 5752 B14R1.502 CCCC(=O)NCC1CCN(CC1)C 240690a_100000746316_100000211992 [0,1,0,0,0,1|2,0,0]=4 5753 B14R1.502 CCCC(=O)NCC1CCN(CC1)C 527a_100000746316_100000211992 [0,1,0,0,0,1|2,0,0]=4 5754 B14R1.502 CCCC(=O)OCN1CCC(CC1)C 2230a_100000188429_100000034017 [0,1,0,0,0,1|2,0,0]=4 5755 B14R1.502 CCCC(=O)OCN1CCC(CC1)C 269982a_100000188429_100000034017 [0,1,0,0,0,1|2,0,0]=4 5756 B14R1.502 CCCC(=O)OCN1CCC(CC1)C 34a_100000188429_100000034017 [0,1,0,0,0,1|2,0,0]=4 5757 B14R1.502 CCCC(=O)OCN1CCC(CC1)F 2230a_100015193889_100000034017 [0,1,0,0,0,1|2,0,0]=4 5758 B14R1.502 CCCC(=O)OCN1CCC(CC1)F 269982a_100015193889_100000034017 [0,1,0,0,0,1|2,0,0]=4 5759 B14R1.502 CCCC(=O)OCN1CCC(CC1)F 34a_100015193889_100000034017 [0,1,0,0,0,1|2,0,0]=4 5760 B14R1.502 CCCC(=O)OCN1CCC(CC1)O 2230a_100025773856_100000034017 [0,1,0,0,0,1|2,0,0]=4 5761 B14R1.502 CCCC(=O)OCN1CCC(CC1)O 269982a_100025773856_100000034017 [0,1,0,0,0,1|2,0,0]=4 5762 B14R1.502 CCCC(=O)OCN1CCN(CC1)C 2230a_100000188432_100000034017 [0,1,0,0,0,1|2,0,0]=4 5763 B14R1.502 CCCC(=O)OCN1CCN(CC1)C 269982a_100000188432_100000034017 [0,1,0,0,0,1|2,0,0]=4 5764 B14R1.502 CCCC(=O)OCN1CCS(=O)CC1 2230a_100000752083_100000034017 [0,1,0,0,0,1|2,0,0]=4 5765 B14R1.502 CCCC(=O)OCN1CCS(=O)CC1 269982a_100000752083_100000034017 [0,1,0,0,0,1|2,0,0]=4 5766 B14R1.598 CCCC(=O)CCC1CCCCN1C 1458a_100000211992_100000211948 [0,1,0,0,0,1|2,0,0]=4 5767 B14R1.598 CCCC(=O)CCC1CCCCN1C 1458a_100000718493_100000210303 [0,1,0,0,0,1|2,0,0]=4 5768 B14R1.598 CCCC(=O)CN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000747444 [0,1,0,0,0,1|2,0,0]=4 5769 B14R1.598 CCCC(=O)NCC1CCCCC1O 240690a_100011216029_100000211992 [0,1,0,0,0,1|2,0,0]=4 5770 B14R1.598 CCCC(=O)NCC1CCCCC1O 527a_100011216029_100000211992 [0,1,0,0,0,1|2,0,0]=4 5771 B14R1.598 CCCC(=O)NCC1CCCCN1C 240690a_100011228421_100000211992 [0,1,0,0,0,1|2,0,0]=4 5772 B14R1.598 CCCC(=O)NCC1CCCCN1C 527a_100011228421_100000211992 [0,1,0,0,0,1|2,0,0]=4 5773 B14R1.598 CCCC(=O)OCN1CCCCC1C 2230a_100000211376_100000034017 [0,1,0,0,0,1|2,0,0]=4 5774 B14R1.598 CCCC(=O)OCN1CCCCC1C 269982a_100000211376_100000034017 [0,1,0,0,0,1|2,0,0]=4 5775 B14R1.598 CCCC(=O)OCN1CCCCC1C 34a_100000211376_100000034017 [0,1,0,0,0,1|2,0,0]=4 5776 B14R1.598 CCCC(=O)OCN1CCOC[C@@H]1C 2230a_100009815349_100000034017 [0,1,0,0,0,1|2,0,0]=4 5777 B14R1.598 CCCC(=O)OCN1CCOC[C@@H]1C 269982a_100009815349_100000034017 [0,1,0,0,0,1|2,0,0]=4 5778 B14R1.598 CCCC(=O)OCN1CCOC[C@@H]1C 34a_100009815349_100000034017 [0,1,0,0,0,1|2,0,0]=4 5779 B14R1.598 CCCC(C)OCC1COCCC1N 34a_214813039666_100000766640 [0,1,0,0,0,1|1,0,1]=4 5780 B14R1.756 CCC(C)C(=O)CCC1CCCCC1 1458a_100000211375_100000758301 [0,1,0,0,0,1|2,0,0]=4 5781 B14R1.756 CCC(C)C(=O)CCC1CCCCC1 1458a_100011192722_100011273959 [0,1,0,0,0,1|2,0,0]=4 5782 B14R1.756 CCC(C)C(=O)CCC1CCOCC1 1458a_100011192722_100011934994 [0,1,0,0,0,1|2,0,0]=4 5783 B14R1.756 CCC(C)C(=O)CCC1OCCCO1 1458a_100011192722_100000764188 [0,1,0,0,0,1|1,0,0]=3 5784 B14R1.756 CCC(C)C(=O)CCN1CCCCO1 1458a_200015184090_100000758301 [0,1,0,0,0,1|2,0,0]=4 5785 B14R1.756 CCC(C)C(=O)NCC1CCCCC1 11a_100000210473_100011192722 [0,1,0,0,0,1|2,0,0]=4 5786 B14R1.756 CCC(C)C(=O)NCC1CCCCC1 1626a_100000210473_100011192722 [0,1,0,0,0,1|2,0,0]=4 5787 B14R1.756 CCC(C)C(=O)NCC1CCCCC1 240690a_100000210473_100011192722 [0,1,0,0,0,1|2,0,0]=4 5788 B14R1.756 CCC(C)C(=O)NCC1CCCCC1 527a_100000210473_100011192722 [0,1,0,0,0,1|2,0,0]=4 5789 B14R1.756 CCC(C)C(=O)NCC1CCCCO1 11a_100000174945_100011192722 [0,1,0,0,0,1|1,0,0]=3 5790 B14R1.756 CCC(C)C(=O)NCC1CCCCO1 1626a_100000174945_100011192722 [0,1,0,0,0,1|1,0,0]=3 5791 B14R1.756 CCC(C)C(=O)NCC1CCCCO1 240690a_100000174945_100011192722 [0,1,0,0,0,1|1,0,0]=3 5792 B14R1.756 CCC(C)C(=O)NCC1CCCCO1 527a_100000174945_100011192722 [0,1,0,0,0,1|1,0,0]=3 5793 B14R1.756 CCC(C)C(=O)NCC1CCCOC1 11a_100000720124_100011192722 [0,1,0,0,0,1|1,0,0]=3 5794 B14R1.756 CCC(C)C(=O)NCC1CCCOC1 1626a_100000720124_100011192722 [0,1,0,0,0,1|1,0,0]=3 5795 B14R1.756 CCC(C)C(=O)NCC1CCCOC1 240690a_100000720124_100011192722 [0,1,0,0,0,1|1,0,0]=3 5796 B14R1.756 CCC(C)C(=O)NCC1CCCOC1 527a_100000720124_100011192722 [0,1,0,0,0,1|1,0,0]=3 5797 B14R1.756 CCC(C)C(=O)NCC1CCOCC1 11a_100000746373_100011192722 [0,1,0,0,0,1|2,0,0]=4 5798 B14R1.756 CCC(C)C(=O)NCC1CCOCC1 1626a_100000746373_100011192722 [0,1,0,0,0,1|2,0,0]=4 5799 B14R1.756 CCC(C)C(=O)NCC1CCOCC1 240690a_100000746373_100011192722 [0,1,0,0,0,1|2,0,0]=4 5800 B14R1.756 CCC(C)C(=O)NCC1CCOCC1 527a_100000746373_100011192722 [0,1,0,0,0,1|2,0,0]=4 5801 B14R1.756 CCC(C)C(=O)NCC1CCSCC1 11a_100015188806_100011192722 [0,1,0,0,0,1|2,0,0]=4 5802 B14R1.756 CCC(C)C(=O)NCC1CCSCC1 240690a_100015188806_100011192722 [0,1,0,0,0,1|2,0,0]=4 5803 B14R1.756 CCC(C)C(=O)NCC1CCSCC1 527a_100015188806_100011192722 [0,1,0,0,0,1|2,0,0]=4 5804 B14R1.756 CCC(C)C(=O)NC[C@H]1COCCO1 11a_100010981119_100011192722 [0,1,0,0,0,1|1,0,0]=3 5805 B14R1.756 CCC(C)C(=O)NC[C@H]1COCCO1 1626a_100010981119_100011192722 [0,1,0,0,0,1|1,0,0]=3 5806 B14R1.756 CCC(C)C(=O)NC[C@H]1COCCO1 240690a_100010981119_100011192722 [0,1,0,0,0,1|1,0,0]=3 5807 B14R1.756 CCC(C)C(=O)NC[C@H]1COCCO1 527a_100010981119_100011192722 [0,1,0,0,0,1|1,0,0]=3 5808 B14R1.756 CCC(C)C(C)OCC1CCCCO1 7a_100011215189_100000211543 [0,1,0,0,0,1|1,0,1]=4 5809 B14R1.756 CCC(C)C(C)OCC1CCCOC1 7a_100011215189_100000741521 [0,1,0,0,0,1|1,0,1]=4 5810 B14R1.756 CCC(O)C(=O)CCC1CCCCC1 1458a_100011196387_100011273959 [0,1,0,0,0,1|2,0,0]=4 5811 B14R1.756 CCC(O)C(=O)CCC1CCOCC1 1458a_100011196387_100011934994 [0,1,0,0,0,1|2,0,0]=4 5812 B14R1.756 CCC(O)C(=O)CCC1OCCCO1 1458a_100011196387_100000764188 [0,1,0,0,0,1|1,0,0]=3 5813 B14R1.756 CCC(O)C(=O)NCC1CCCCC1 240690a_100000210473_100011196387 [0,1,0,0,0,1|2,0,0]=4 5814 B14R1.756 CCC(O)C(=O)NCC1CCCCO1 240690a_100000174945_100011196387 [0,1,0,0,0,1|1,0,0]=3 5815 B14R1.756 CCC(O)C(=O)NCC1CCCOC1 240690a_100000720124_100011196387 [0,1,0,0,0,1|1,0,0]=3 5816 B14R1.756 CCC(O)C(=O)NCC1CCOCC1 240690a_100000746373_100011196387 [0,1,0,0,0,1|2,0,0]=4 5817 B14R1.756 CCC(O)C(=O)NCC1CCSCC1 240690a_100015188806_100011196387 [0,1,0,0,0,1|2,0,0]=4 5818 B14R1.756 CCC(O)C(=O)NC[C@H]1COCCO1 240690a_100010981119_100011196387 [0,1,0,0,0,1|1,0,0]=3 5819 B14R1.756 CCN(C)C(=O)NCC1CCCCO1 2708a_100000174945_100000225621 [0,1,0,0,0,1|2,0,0]=4 5820 B14R1.756 CCN(C)C(=O)NCC1CCCCO1 273464a_100000174945_100000225621 [0,1,0,0,0,1|2,0,0]=4 5821 B14R1.756 CCN(C)C(=O)NCC1CCCOC1 2708a_100000720124_100000225621 [0,1,0,0,0,1|2,0,0]=4 5822 B14R1.756 CCN(C)C(=O)NCC1CCCOC1 273464a_100000720124_100000225621 [0,1,0,0,0,1|2,0,0]=4 5823 B14R1.756 CCN(C)C(=O)NC[C@H]1COCCO1 2708a_100010981119_100000225621 [0,1,0,0,0,1|2,0,0]=4 5824 B14R1.756 CCN(C)C(=O)NC[C@H]1COCCO1 273464a_100010981119_100000225621 [0,1,0,0,0,1|2,0,0]=4 5825 B14R1.756 COC(C)C(=O)CCC1OCCCO1 1458a_100000743197_100000764188 [0,1,0,0,0,1|2,0,0]=4 5826 B14R1.756 COC(C)C(=O)NCC1CCCCO1 11a_100000174945_100000743197 [0,1,0,0,0,1|2,0,0]=4 5827 B14R1.756 COC(C)C(=O)NCC1CCCCO1 1626a_100000174945_100000743197 [0,1,0,0,0,1|2,0,0]=4 5828 B14R1.756 COC(C)C(=O)NCC1CCCCO1 240690a_100000174945_100000743197 [0,1,0,0,0,1|2,0,0]=4 5829 B14R1.756 COC(C)C(=O)NCC1CCCCO1 527a_100000174945_100000743197 [0,1,0,0,0,1|2,0,0]=4 5830 B14R1.756 COC(C)C(=O)NCC1CCCOC1 11a_100000720124_100000743197 [0,1,0,0,0,1|2,0,0]=4 5831 B14R1.756 COC(C)C(=O)NCC1CCCOC1 1626a_100000720124_100000743197 [0,1,0,0,0,1|2,0,0]=4 5832 B14R1.756 COC(C)C(=O)NCC1CCCOC1 240690a_100000720124_100000743197 [0,1,0,0,0,1|2,0,0]=4 5833 B14R1.756 COC(C)C(=O)NCC1CCCOC1 527a_100000720124_100000743197 [0,1,0,0,0,1|2,0,0]=4 5834 B14R1.756 COC(C)C(=O)NC[C@H]1COCCO1 11a_100010981119_100000743197 [0,1,0,0,0,1|2,0,0]=4 5835 B14R1.756 COC(C)C(=O)NC[C@H]1COCCO1 1626a_100010981119_100000743197 [0,1,0,0,0,1|2,0,0]=4 5836 B14R1.756 COC(C)C(=O)NC[C@H]1COCCO1 240690a_100010981119_100000743197 [0,1,0,0,0,1|2,0,0]=4 5837 B14R1.756 COC(C)C(=O)NC[C@H]1COCCO1 527a_100010981119_100000743197 [0,1,0,0,0,1|2,0,0]=4 5838 B14R1.756 CSC(C)C(=O)CCC1OCCCO1 1458a_100000149566_100000764188 [0,1,0,0,0,1|2,0,0]=4 5839 B14R1.756 CSC(C)C(=O)NCC1CCCCO1 11a_100000174945_100000149566 [0,1,0,0,0,1|2,0,0]=4 5840 B14R1.756 CSC(C)C(=O)NCC1CCCCO1 1626a_100000174945_100000149566 [0,1,0,0,0,1|2,0,0]=4 5841 B14R1.756 CSC(C)C(=O)NCC1CCCCO1 240690a_100000174945_100000149566 [0,1,0,0,0,1|2,0,0]=4 5842 B14R1.756 CSC(C)C(=O)NCC1CCCCO1 527a_100000174945_100000149566 [0,1,0,0,0,1|2,0,0]=4 5843 B14R1.756 CSC(C)C(=O)NCC1CCCOC1 11a_100000720124_100000149566 [0,1,0,0,0,1|2,0,0]=4 5844 B14R1.756 CSC(C)C(=O)NCC1CCCOC1 1626a_100000720124_100000149566 [0,1,0,0,0,1|2,0,0]=4 5845 B14R1.756 CSC(C)C(=O)NCC1CCCOC1 240690a_100000720124_100000149566 [0,1,0,0,0,1|2,0,0]=4 5846 B14R1.756 CSC(C)C(=O)NCC1CCCOC1 527a_100000720124_100000149566 [0,1,0,0,0,1|2,0,0]=4 5847 B14R1.756 CSC(C)C(=O)NC[C@H]1COCCO1 11a_100010981119_100000149566 [0,1,0,0,0,1|2,0,0]=4 5848 B14R1.756 CSC(C)C(=O)NC[C@H]1COCCO1 1626a_100010981119_100000149566 [0,1,0,0,0,1|2,0,0]=4 5849 B14R1.756 CSC(C)C(=O)NC[C@H]1COCCO1 240690a_100010981119_100000149566 [0,1,0,0,0,1|2,0,0]=4 5850 B14R1.756 CSC(C)C(=O)NC[C@H]1COCCO1 527a_100010981119_100000149566 [0,1,0,0,0,1|2,0,0]=4 5851 B14R1.756 O=C(CCC1OCCCO1)C(O)CO 1458a_100011215603_100000764188 [0,1,0,0,0,1|2,0,0]=4 5852 B14R1.756 O=C(NCC1CCCCO1)C(O)CO 240690a_100000174945_100011215603 [0,1,0,0,0,1|2,0,0]=4 5853 B14R1.756 O=C(NCC1CCCOC1)C(O)CO 240690a_100000720124_100011215603 [0,1,0,0,0,1|2,0,0]=4 5854 B14R1.756 O=C(NC[C@H]1COCCO1)C(O)CO 240690a_100010981119_100011215603 [0,1,0,0,0,1|2,0,0]=4 5855 B14R1.818 CC(C)CC(=O)CCC1CCCCC1 1458a_100000210554_100011273959 [0,1,0,0,0,1|2,0,0]=4 5856 B14R1.818 CC(C)CC(=O)CCC1CCCCC1 1458a_100000211375_100000210624 [0,1,0,0,0,1|2,0,0]=4 5857 B14R1.818 CC(C)CC(=O)CCC1CCOCC1 1458a_100000210554_100011934994 [0,1,0,0,0,1|2,0,0]=4 5858 B14R1.818 CC(C)CC(=O)CCC1OCCCO1 1458a_100000210554_100000764188 [0,1,0,0,0,1|1,0,0]=3 5859 B14R1.818 CC(C)CC(=O)CCN1CCCCO1 1458a_200015184090_100000210624 [0,1,0,0,0,1|2,0,0]=4 5860 B14R1.818 CC(C)CC(=O)NCC1CCCCC1 11a_100000210473_100000210554 [0,1,0,0,0,1|2,0,0]=4 5861 B14R1.818 CC(C)CC(=O)NCC1CCCCC1 1626a_100000210473_100000210554 [0,1,0,0,0,1|2,0,0]=4 5862 B14R1.818 CC(C)CC(=O)NCC1CCCCC1 240690a_100000210473_100000210554 [0,1,0,0,0,1|2,0,0]=4 5863 B14R1.818 CC(C)CC(=O)NCC1CCCCC1 527a_100000210473_100000210554 [0,1,0,0,0,1|2,0,0]=4 5864 B14R1.818 CC(C)CC(=O)NCC1CCCCO1 11a_100000174945_100000210554 [0,1,0,0,0,1|1,0,0]=3 5865 B14R1.818 CC(C)CC(=O)NCC1CCCCO1 1626a_100000174945_100000210554 [0,1,0,0,0,1|1,0,0]=3 5866 B14R1.818 CC(C)CC(=O)NCC1CCCCO1 240690a_100000174945_100000210554 [0,1,0,0,0,1|1,0,0]=3 5867 B14R1.818 CC(C)CC(=O)NCC1CCCCO1 527a_100000174945_100000210554 [0,1,0,0,0,1|1,0,0]=3 5868 B14R1.818 CC(C)CC(=O)NCC1CCCOC1 11a_100000720124_100000210554 [0,1,0,0,0,1|1,0,0]=3 5869 B14R1.818 CC(C)CC(=O)NCC1CCCOC1 1626a_100000720124_100000210554 [0,1,0,0,0,1|1,0,0]=3 5870 B14R1.818 CC(C)CC(=O)NCC1CCCOC1 240690a_100000720124_100000210554 [0,1,0,0,0,1|1,0,0]=3 5871 B14R1.818 CC(C)CC(=O)NCC1CCCOC1 527a_100000720124_100000210554 [0,1,0,0,0,1|1,0,0]=3 5872 B14R1.818 CC(C)CC(=O)NCC1CCOCC1 11a_100000746373_100000210554 [0,1,0,0,0,1|2,0,0]=4 5873 B14R1.818 CC(C)CC(=O)NCC1CCOCC1 1626a_100000746373_100000210554 [0,1,0,0,0,1|2,0,0]=4 5874 B14R1.818 CC(C)CC(=O)NCC1CCOCC1 240690a_100000746373_100000210554 [0,1,0,0,0,1|2,0,0]=4 5875 B14R1.818 CC(C)CC(=O)NCC1CCOCC1 527a_100000746373_100000210554 [0,1,0,0,0,1|2,0,0]=4 5876 B14R1.818 CC(C)CC(=O)NCC1CCSCC1 11a_100015188806_100000210554 [0,1,0,0,0,1|2,0,0]=4 5877 B14R1.818 CC(C)CC(=O)NCC1CCSCC1 240690a_100015188806_100000210554 [0,1,0,0,0,1|2,0,0]=4 5878 B14R1.818 CC(C)CC(=O)NCC1CCSCC1 527a_100015188806_100000210554 [0,1,0,0,0,1|2,0,0]=4 5879 B14R1.818 CC(C)CC(=O)NC[C@H]1COCCO1 11a_100010981119_100000210554 [0,1,0,0,0,1|1,0,0]=3 5880 B14R1.818 CC(C)CC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000210554 [0,1,0,0,0,1|1,0,0]=3 5881 B14R1.818 CC(C)CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000210554 [0,1,0,0,0,1|1,0,0]=3 5882 B14R1.818 CC(C)CC(=O)NC[C@H]1COCCO1 527a_100010981119_100000210554 [0,1,0,0,0,1|1,0,0]=3 5883 B14R1.818 CC(C)CC(C)OCC1CCCCO1 34a_100000211370_100000731052 [0,1,0,0,0,1|1,0,1]=4 5884 B14R1.818 CC(C)CC(C)OCC1CCCCO1 34a_100000211805_100000211543 [0,1,0,0,0,1|1,0,1]=4 5885 B14R1.818 CC(C)CC(C)OCC1CCCCO1 7a_100000211370_100000731052 [0,1,0,0,0,1|1,0,1]=4 5886 B14R1.818 CC(C)CC(C)OCC1CCCCO1 7a_100000211805_100000211543 [0,1,0,0,0,1|1,0,1]=4 5887 B14R1.818 CC(C)CC(C)OCC1CCCOC1 34a_100000211805_100000741521 [0,1,0,0,0,1|1,0,1]=4 5888 B14R1.818 CC(C)CC(C)OCC1CCCOC1 34a_100000741520_100000731052 [0,1,0,0,0,1|1,0,1]=4 5889 B14R1.818 CC(C)CC(C)OCC1CCCOC1 7a_100000211805_100000741521 [0,1,0,0,0,1|1,0,1]=4 5890 B14R1.818 CC(C)CC(C)OC[C@@H]1CNCCO1 34a_100015189573_100000731052 [0,1,0,0,0,1|1,0,1]=4 5891 B14R1.818 CC(C)CC(C)OC[C@H]1COCCO1 34a_100009875890_100000731052 [0,1,0,0,0,1|1,0,1]=4 5892 B14R1.818 CC(C)NC(=O)NCC1CCCCO1 2708a_100000174945_100138425928 [0,1,0,0,0,1|2,0,0]=4 5893 B14R1.818 CC(C)NC(=O)NCC1CCCCO1 2708a_100138425928_100000174945 [0,1,0,0,0,1|2,0,0]=4 5894 B14R1.818 CC(C)NC(=O)NCC1CCCCO1 273464a_100138425928_100000174945 [0,1,0,0,0,1|2,0,0]=4 5895 B14R1.818 CC(C)NC(=O)NCC1CCCCO1 512a_100000174945_100138425928 [0,1,0,0,0,1|2,0,0]=4 5896 B14R1.818 CC(C)NC(=O)NCC1CCCCO1 512a_100138425928_100000174945 [0,1,0,0,0,1|2,0,0]=4 5897 B14R1.818 CC(C)NC(=O)NCC1CCCOC1 2708a_100000720124_100138425928 [0,1,0,0,0,1|2,0,0]=4 5898 B14R1.818 CC(C)NC(=O)NCC1CCCOC1 2708a_100138425928_100000720124 [0,1,0,0,0,1|2,0,0]=4 5899 B14R1.818 CC(C)NC(=O)NCC1CCCOC1 273464a_100138425928_100000720124 [0,1,0,0,0,1|2,0,0]=4 5900 B14R1.818 CC(C)NC(=O)NCC1CCCOC1 512a_100000720124_100138425928 [0,1,0,0,0,1|2,0,0]=4 5901 B14R1.818 CC(C)NC(=O)NCC1CCCOC1 512a_100138425928_100000720124 [0,1,0,0,0,1|2,0,0]=4 5902 B14R1.818 CC(C)NC(=O)NC[C@H]1COCCO1 2708a_100010981119_100138425928 [0,1,0,0,0,1|2,0,0]=4 5903 B14R1.818 CC(C)NC(=O)NC[C@H]1COCCO1 2708a_100138425928_100010981119 [0,1,0,0,0,1|2,0,0]=4 5904 B14R1.818 CC(C)NC(=O)NC[C@H]1COCCO1 273464a_100138425928_100010981119 [0,1,0,0,0,1|2,0,0]=4 5905 B14R1.818 CC(C)NC(=O)NC[C@H]1COCCO1 512a_100010981119_100138425928 [0,1,0,0,0,1|2,0,0]=4 5906 B14R1.818 CC(C)NC(=O)NC[C@H]1COCCO1 512a_100138425928_100010981119 [0,1,0,0,0,1|2,0,0]=4 5907 B14R1.818 CC(C)OC(=O)OCN1CCCOC1 269982a_100000131196_100010125566 [0,1,0,0,0,1|2,0,0]=4 5908 B14R1.818 CC(O)CC(=O)CCC1CCCCC1 1458a_100000211375_100011218427 [0,1,0,0,0,1|2,0,0]=4 5909 B14R1.818 CC(O)CC(=O)CCN1CCCCO1 1458a_200015184090_100011218427 [0,1,0,0,0,1|2,0,0]=4 5910 B14R1.818 CN(C)CC(=O)CCC1OCCCO1 1458a_100000750896_100000764188 [0,1,0,0,0,1|2,0,0]=4 5911 B14R1.818 CN(C)CC(=O)NCC1CCCCO1 11a_100000174945_100000750896 [0,1,0,0,0,1|2,0,0]=4 5912 B14R1.818 CN(C)CC(=O)NCC1CCCCO1 240690a_100000174945_100000750896 [0,1,0,0,0,1|2,0,0]=4 5913 B14R1.818 CN(C)CC(=O)NCC1CCCCO1 527a_100000174945_100000750896 [0,1,0,0,0,1|2,0,0]=4 5914 B14R1.818 CN(C)CC(=O)NCC1CCCOC1 11a_100000720124_100000750896 [0,1,0,0,0,1|2,0,0]=4 5915 B14R1.818 CN(C)CC(=O)NCC1CCCOC1 240690a_100000720124_100000750896 [0,1,0,0,0,1|2,0,0]=4 5916 B14R1.818 CN(C)CC(=O)NCC1CCCOC1 527a_100000720124_100000750896 [0,1,0,0,0,1|2,0,0]=4 5917 B14R1.818 CN(C)CC(=O)NC[C@H]1COCCO1 11a_100010981119_100000750896 [0,1,0,0,0,1|2,0,0]=4 5918 B14R1.818 CN(C)CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000750896 [0,1,0,0,0,1|2,0,0]=4 5919 B14R1.818 CN(C)CC(=O)NC[C@H]1COCCO1 527a_100010981119_100000750896 [0,1,0,0,0,1|2,0,0]=4 5920 B14R1.818 C[C@@H](O)CC(=O)CCC1CCCCC1 1458a_100011933948_100011273959 [0,1,0,0,0,1|2,0,0]=4 5921 B14R1.818 C[C@@H](O)CC(=O)CCC1CCOCC1 1458a_100011933948_100011934994 [0,1,0,0,0,1|2,0,0]=4 5922 B14R1.818 C[C@@H](O)CC(=O)CCC1OCCCO1 1458a_100011933948_100000764188 [0,1,0,0,0,1|1,0,0]=3 5923 B14R1.818 C[C@@H](O)CC(=O)NCC1CCCCC1 240690a_100000210473_100011933948 [0,1,0,0,0,1|2,0,0]=4 5924 B14R1.818 C[C@@H](O)CC(=O)NCC1CCCCO1 240690a_100000174945_100011933948 [0,1,0,0,0,1|1,0,0]=3 5925 B14R1.818 C[C@@H](O)CC(=O)NCC1CCCOC1 240690a_100000720124_100011933948 [0,1,0,0,0,1|1,0,0]=3 5926 B14R1.818 C[C@@H](O)CC(=O)NCC1CCOCC1 240690a_100000746373_100011933948 [0,1,0,0,0,1|2,0,0]=4 5927 B14R1.818 C[C@@H](O)CC(=O)NCC1CCSCC1 240690a_100015188806_100011933948 [0,1,0,0,0,1|2,0,0]=4 5928 B14R1.818 C[C@@H](O)CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100011933948 [0,1,0,0,0,1|1,0,0]=3 5929 B14R1.818 C[S+](C)CC(=O)CCC1OCCCO1 1458a_200159257847_100000764188 [0,1,0,0,0,1|2,0,0]=4 5930 B14R1.818 C[S+](C)CC(=O)NCC1CCCCO1 11a_100000174945_200159257847 [0,1,0,0,0,1|2,0,0]=4 5931 B14R1.818 C[S+](C)CC(=O)NCC1CCCCO1 1626a_100000174945_200159257847 [0,1,0,0,0,1|2,0,0]=4 5932 B14R1.818 C[S+](C)CC(=O)NCC1CCCCO1 240690a_100000174945_200159257847 [0,1,0,0,0,1|2,0,0]=4 5933 B14R1.818 C[S+](C)CC(=O)NCC1CCCCO1 527a_100000174945_200159257847 [0,1,0,0,0,1|2,0,0]=4 5934 B14R1.818 C[S+](C)CC(=O)NCC1CCCOC1 11a_100000720124_200159257847 [0,1,0,0,0,1|2,0,0]=4 5935 B14R1.818 C[S+](C)CC(=O)NCC1CCCOC1 1626a_100000720124_200159257847 [0,1,0,0,0,1|2,0,0]=4 5936 B14R1.818 C[S+](C)CC(=O)NCC1CCCOC1 240690a_100000720124_200159257847 [0,1,0,0,0,1|2,0,0]=4 5937 B14R1.818 C[S+](C)CC(=O)NCC1CCCOC1 527a_100000720124_200159257847 [0,1,0,0,0,1|2,0,0]=4 5938 B14R1.818 C[S+](C)CC(=O)NC[C@H]1COCCO1 11a_100010981119_200159257847 [0,1,0,0,0,1|2,0,0]=4 5939 B14R1.818 C[S+](C)CC(=O)NC[C@H]1COCCO1 1626a_100010981119_200159257847 [0,1,0,0,0,1|2,0,0]=4 5940 B14R1.818 C[S+](C)CC(=O)NC[C@H]1COCCO1 240690a_100010981119_200159257847 [0,1,0,0,0,1|2,0,0]=4 5941 B14R1.818 C[S+](C)CC(=O)NC[C@H]1COCCO1 527a_100010981119_200159257847 [0,1,0,0,0,1|2,0,0]=4 5942 B14R1.979 C#CC(CCC)OCC1CCCCO1 34a_200011217317_100000211543 [0,1,0,0,0,1|1,0,1]=4 5943 B14R1.979 C#CC(CCC)OCC1CCCCO1 7a_200011217317_100000211543 [0,1,0,0,0,1|1,0,1]=4 5944 B14R1.979 C#CC(CCC)OCC1CCCOC1 34a_200011217317_100000741521 [0,1,0,0,0,1|1,0,1]=4 5945 B14R1.979 C#CC(CCC)OCC1CCCOC1 7a_200011217317_100000741521 [0,1,0,0,0,1|1,0,1]=4 5946 B14R1.979 C=CC(CCC)OCC1CCCCO1 34a_100011216692_100000211543 [0,1,0,0,0,1|1,0,1]=4 5947 B14R1.979 C=CC(CCC)OCC1CCCCO1 7a_100011216692_100000211543 [0,1,0,0,0,1|1,0,1]=4 5948 B14R1.979 C=CC(CCC)OCC1CCCOC1 34a_100011216692_100000741521 [0,1,0,0,0,1|1,0,1]=4 5949 B14R1.979 C=CC(CCC)OCC1CCCOC1 7a_100011216692_100000741521 [0,1,0,0,0,1|1,0,1]=4 5950 B14R1.979 CCCC(C#N)OCC1CCCCO1 34a_100000686963_100000211543 [0,1,0,0,0,1|1,0,1]=4 5951 B14R1.979 CCCC(C#N)OCC1CCCCO1 7a_100000686963_100000211543 [0,1,0,0,0,1|1,0,1]=4 5952 B14R1.979 CCCC(C#N)OCC1CCCOC1 34a_100000686963_100000741521 [0,1,0,0,0,1|1,0,1]=4 5953 B14R1.979 CCCC(C#N)OCC1CCCOC1 7a_100000686963_100000741521 [0,1,0,0,0,1|1,0,1]=4 5954 B14R1.979 CCCC(CC)OCC1CCCCO1 34a_100000687864_100000211543 [0,1,0,0,0,1|1,0,1]=4 5955 B14R1.979 CCCC(CC)OCC1CCCCO1 7a_100000211370_100011219200 [0,1,0,0,0,1|1,0,1]=4 5956 B14R1.979 CCCC(CC)OCC1CCCCO1 7a_100000687864_100000211543 [0,1,0,0,0,1|1,0,1]=4 5957 B14R1.979 CCCC(CC)OCC1CCCOC1 34a_100000687864_100000741521 [0,1,0,0,0,1|1,0,1]=4 5958 B14R1.979 CCCC(CC)OCC1CCCOC1 7a_100000687864_100000741521 [0,1,0,0,0,1|1,0,1]=4 5959 B14R1.6829 CCCC(C)(C)OCC1CCCCO1 7a_100000748436_100000211543 [0,1,0,0,0,1|1,0,1]=4 5960 B14R1.6829 CCCC(C)(C)OCC1CCCOC1 7a_100000748436_100000741521 [0,1,0,0,0,1|1,0,1]=4 5961 B14R1.6829 CCCS(=O)(=O)NCC1CCCCO1 270084a_100000174945_100000211391 [0,1,0,0,0,1|2,0,0]=4 5962 B14R1.6829 CCCS(=O)(=O)NCC1CCCCO1 274078a_100000174945_100000211391 [0,1,0,0,0,1|2,0,0]=4 5963 B14R1.6829 CCCS(=O)(=O)NCC1CCCCO1 40a_100000174945_100000054278 [0,1,0,0,0,1|2,0,0]=4 5964 B14R1.6829 CCCS(=O)(=O)NCC1CCCOC1 270084a_100000720124_100000211391 [0,1,0,0,0,1|2,0,0]=4 5965 B14R1.6829 CCCS(=O)(=O)NCC1CCCOC1 274078a_100000720124_100000211391 [0,1,0,0,0,1|2,0,0]=4 5966 B14R1.6829 CCCS(=O)(=O)NCC1CCCOC1 40a_100000720124_100000054278 [0,1,0,0,0,1|2,0,0]=4 5967 B14R1.6829 CCCS(=O)(=O)NC[C@H]1COCCO1 270084a_100010981119_100000211391 [0,1,0,0,0,1|2,0,0]=4 5968 B14R1.6829 CCCS(=O)(=O)NC[C@H]1COCCO1 274078a_100010981119_100000211391 [0,1,0,0,0,1|2,0,0]=4 5969 B14R1.6829 CCCS(=O)(=O)NC[C@H]1COCCO1 40a_100010981119_100000054278 [0,1,0,0,0,1|2,0,0]=4 5970 B14R1.18883 CCCC(=O)NCC1(CCCCC1)C 11a_100000706052_100000211992 [0,1,0,0,0,1|2,0,0]=4 5971 B14R1.18883 CCCC(=O)NCC1(CCCCC1)C 1626a_100000706052_100000211992 [0,1,0,0,0,1|2,0,0]=4 5972 B14R1.18883 CCCC(=O)NCC1(CCCCC1)C 240690a_100000706052_100000211992 [0,1,0,0,0,1|2,0,0]=4 5973 B14R1.18883 CCCC(=O)NCC1(CCCCC1)C 527a_100000706052_100000211992 [0,1,0,0,0,1|2,0,0]=4 5974 B14R1.18883 CCCC(=O)NCC1(CCCCC1)O 11a_100000748649_100000211992 [0,1,0,0,0,1|2,0,0]=4 5975 B14R1.18883 CCCC(=O)NCC1(CCCCC1)O 1626a_100000748649_100000211992 [0,1,0,0,0,1|2,0,0]=4 5976 B14R1.18883 CCCC(=O)NCC1(CCCCC1)O 240690a_100000748649_100000211992 [0,1,0,0,0,1|2,0,0]=4 5977 B14R1.18883 CCCC(=O)NCC1(CCCCC1)O 527a_100000748649_100000211992 [0,1,0,0,0,1|2,0,0]=4 5978 B14R1.18883 CCCC(=O)NCC1(CCOCC1)C 11a_100000695556_100000211992 [0,1,0,0,0,1|2,0,0]=4 5979 B14R1.18883 CCCC(=O)NCC1(CCOCC1)C 1626a_100000695556_100000211992 [0,1,0,0,0,1|2,0,0]=4 5980 B14R1.18883 CCCC(=O)NCC1(CCOCC1)C 240690a_100000695556_100000211992 [0,1,0,0,0,1|2,0,0]=4 5981 B14R1.18883 CCCC(=O)NCC1(CCOCC1)C 527a_100000695556_100000211992 [0,1,0,0,0,1|2,0,0]=4 5982 B14R1.18883 CCCC(=O)NCC1(CCOCC1)F 11a_100016991512_100000211992 [0,1,0,0,0,1|2,0,0]=4 5983 B14R1.18883 CCCC(=O)NCC1(CCOCC1)F 1626a_100016991512_100000211992 [0,1,0,0,0,1|2,0,0]=4 5984 B14R1.18883 CCCC(=O)NCC1(CCOCC1)F 240690a_100016991512_100000211992 [0,1,0,0,0,1|2,0,0]=4 5985 B14R1.18883 CCCC(=O)NCC1(CCOCC1)F 527a_100016991512_100000211992 [0,1,0,0,0,1|2,0,0]=4 5986 B14R1.18883 CCCC(=O)NCC1(CCOCC1)O 11a_100000704115_100000211992 [0,1,0,0,0,1|2,0,0]=4 5987 B14R1.18883 CCCC(=O)NCC1(CCOCC1)O 240690a_100000704115_100000211992 [0,1,0,0,0,1|2,0,0]=4 5988 B14R1.18883 CCCC(=O)NCC1(CCOCC1)O 527a_100000704115_100000211992 [0,1,0,0,0,1|2,0,0]=4 5989 B14R1.18883 CCCC(=O)NCC1(CCSCC1)O 11a_100000758141_100000211992 [0,1,0,0,0,1|2,0,0]=4 5990 B14R1.18883 CCCC(=O)NCC1(CCSCC1)O 240690a_100000758141_100000211992 [0,1,0,0,0,1|2,0,0]=4 5991 B14R1.18883 CCCC(=O)NCC1(CCSCC1)O 527a_100000758141_100000211992 [0,1,0,0,0,1|2,0,0]=4 5992 B14R1.100 CCCC(=O)CNC(C)C1CCCC1 2230a_100015185923_100000747444 [0,1,0,0,0,1|2,0,0]=4 5993 B14R1.100 CCCC(=O)CNC(C)C1CCCO1 2230a_100025754208_100000747444 [0,1,0,0,0,1|1,0,0]=3 5994 B14R1.100 CCCC(=O)COC(C)C1CCCC1 7a_100011216366_100000747444 [0,1,0,0,0,1|1,0,0]=3 5995 B14R1.100 CCCC(=O)NNC(=O)C1CCCO1 22a_100000189947_100000211992 [0,1,0,0,0,1|1,0,1]=4 5996 B14R1.100 CCCC(=O)NNC(=O)[C@@H]1CCCO1 22a_100000189770_100000686382 [0,1,0,0,0,1|1,0,1]=4 5997 B14R1.100 CCCC(=O)OCC(=O)C1=CCCC1 1458a_100000038896_100000034017 [0,1,0,0,0,1|1,0,1]=4 5998 B14R1.100 CCCC(=O)OCC(=O)C1CCCC1 1458a_100000210718_100000034017 [0,1,0,0,0,1|1,0,0]=3 5999 B14R1.100 CCCC(=O)OCC(=O)C1CCCS1 1458a_100012002731_100000034017 [0,1,0,0,0,1|0,1,0]=3 6000 B14R1.100 CCCC(=O)OCC(=O)C1CCOC1 1458a_100011219752_100000034017 [0,1,0,0,0,1|2,0,0]=4 6001 B14R1.100 CCCC(=O)OCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000034017 [0,1,0,0,0,1|0,0,0]=2 6002 B14R1.100 CCCC(=O)OCN(C)C1CCCC1 2230a_100000207505_100000034017 [0,1,0,0,0,1|1,0,0]=3 6003 B14R1.100 CCCC(=O)OCN(C)C1CCCC1 269982a_100000207505_100000034017 [0,1,0,0,0,1|1,0,0]=3 6004 B14R1.100 CCCC(=O)OCN(C)C1CCCC1 34a_100000207505_100000034017 [0,1,0,0,0,1|1,0,0]=3 6005 B14R1.100 CCCC(=O)OCN(C)C1CCOC1 2230a_100016988252_100000034017 [0,1,0,0,0,1|2,0,0]=4 6006 B14R1.100 CCCC(=O)OCN(C)C1CCOC1 269982a_100016988252_100000034017 [0,1,0,0,0,1|2,0,0]=4 6007 B14R1.100 CCCC(=O)OCN(C)C1CCOC1 34a_100016988252_100000034017 [0,1,0,0,0,1|2,0,0]=4 6008 B14R1.100 CCNC(=O)CNC(C)C1CCCO1 2230a_100025754208_100000183381 [0,1,0,0,0,1|2,0,0]=4 6009 B14R1.100 CCNC(=O)CNC(C)C1CCCO1 34a_100025754208_100000183381 [0,1,0,0,0,1|2,0,0]=4 6010 B14R1.100 CCNC(=O)COC(C)C1CCCC1 34a_100011216366_100000183381 [0,1,0,0,0,1|2,0,0]=4 6011 B14R1.100 CCNC(=O)COC(C)C1CCCC1 7a_100011216366_100000183381 [0,1,0,0,0,1|2,0,0]=4 6012 B14R1.100 CCOC(=O)CNC(C)C1CCCO1 2230a_100025754208_100000188475 [0,1,0,0,0,1|2,0,0]=4 6013 B14R1.100 CCOC(=O)CNC(C)C1CCCO1 34a_100025754208_100000188475 [0,1,0,0,0,1|2,0,0]=4 6014 B14R1.100 CCOC(=O)COC(C)C1CCCC1 34a_100011216366_100000188475 [0,1,0,0,0,1|2,0,0]=4 6015 B14R1.100 CCOC(=O)COC(C)C1CCCC1 7a_100011216366_100000188475 [0,1,0,0,0,1|2,0,0]=4 6016 B14R1.177 C#CCCC(=O)COCC1CCCO1 1458a_100011223388_100000753159 [0,1,0,0,0,1|0,0,1]=3 6017 B14R1.177 C#CCCC(=O)CSCC1CCCO1 1458a_100000217298_100000753159 [0,1,0,0,0,1|0,1,1]=4 6018 B14R1.177 C#CCNC(=O)COCC1CCCO1 11a_100000212058_100011223388 [0,1,0,0,0,1|0,0,2]=4 6019 B14R1.177 C#CCNC(=O)COCC1CCCO1 1626a_100000212058_100011223388 [0,1,0,0,0,1|0,0,2]=4 6020 B14R1.177 C#CCNC(=O)COCC1CCCO1 240690a_100000212058_100011223388 [0,1,0,0,0,1|0,0,2]=4 6021 B14R1.177 C#CCNC(=O)COCC1CCCO1 527a_100000212058_100011223388 [0,1,0,0,0,1|0,0,2]=4 6022 B14R1.177 C/C=C/CC(=O)COCC1CCCO1 1458a_100011223388_100102629194 [0,1,0,0,0,1|0,0,1]=3 6023 B14R1.177 C/C=C/CC(=O)CSCC1CCCO1 1458a_100000217298_100102629194 [0,1,0,0,0,1|0,1,1]=4 6024 B14R1.177 C=C(COCC1CCCO1)OCOC 34a_100000210270_100000042856 [0,1,0,0,0,1|2,0,0]=4 6025 B14R1.177 C=CCCC(=O)COCC1CCCO1 1458a_100011223388_100000754431 [0,1,0,0,0,1|0,0,1]=3 6026 B14R1.177 C=CCCC(=O)CSCC1CCCO1 1458a_100000217298_100000754431 [0,1,0,0,0,1|0,1,1]=4 6027 B14R1.177 C=CCNC(=O)COCC1CCCO1 1626a_100020586998_100011223388 [0,1,0,0,0,1|0,0,2]=4 6028 B14R1.177 C=CCNC(=O)COCC1CCCO1 240690a_100020586998_100011223388 [0,1,0,0,0,1|0,0,2]=4 6029 B14R1.177 C=CCNC(=O)COCC1CCCO1 527a_100020586998_100011223388 [0,1,0,0,0,1|0,0,2]=4 6030 B14R1.177 C=CCNC(=O)COCC1CCCO1 7a_100000210270_100000183597 [0,1,0,0,0,1|0,0,2]=4 6031 B14R1.177 C=CCOC(=O)COCC1CCCO1 34a_100000210270_100000033060 [0,1,0,0,0,1|0,0,2]=4 6032 B14R1.177 C=CCOC(=O)COCC1CCCO1 7a_100000210270_100000033060 [0,1,0,0,0,1|0,0,2]=4 6033 B14R1.177 CC#CCC(=O)COCC1CCCO1 1458a_100011223388_100000748600 [0,1,0,0,0,1|0,0,1]=3 6034 B14R1.177 CC#CCC(=O)CSCC1CCCO1 1458a_100000217298_100000748600 [0,1,0,0,0,1|0,1,1]=4 6035 B14R1.177 CC=CCC(=O)COCC1CCCO1 1458a_100011223388_100000070051 [0,1,0,0,0,1|0,0,1]=3 6036 B14R1.177 CC=CCC(=O)CSCC1CCCO1 1458a_100000217298_100000070051 [0,1,0,0,0,1|0,1,1]=4 6037 B14R1.177 CCCCC(=O)CCCC1CCCC1 1458a_100000210183_100011713738 [0,1,0,0,0,1|2,0,0]=4 6038 B14R1.177 CCCCC(=O)CCCC1OCCO1 1458a_100000210183_100000042513 [0,1,0,0,0,1|2,0,0]=4 6039 B14R1.177 CCCCC(=O)COCC1CCCO1 1458a_100011223388_100000210211 [0,1,0,0,0,1|0,0,0]=2 6040 B14R1.177 CCCCC(=O)CSCC1CCCO1 1458a_100000217298_100000210211 [0,1,0,0,0,1|0,1,0]=3 6041 B14R1.177 CCCCC(=O)NCCC1CCCC1 11a_100000739158_100000210183 [0,1,0,0,0,1|2,0,0]=4 6042 B14R1.177 CCCCC(=O)NCCC1CCCC1 1626a_100000739158_100000210183 [0,1,0,0,0,1|2,0,0]=4 6043 B14R1.177 CCCCC(=O)NCCC1CCCC1 240690a_100000739158_100000210183 [0,1,0,0,0,1|2,0,0]=4 6044 B14R1.177 CCCCC(=O)NCCC1CCCC1 527a_100000739158_100000210183 [0,1,0,0,0,1|2,0,0]=4 6045 B14R1.177 CCCCC(=O)NCCC1OCCO1 11a_100000034215_100000210183 [0,1,0,0,0,1|2,0,0]=4 6046 B14R1.177 CCCCC(=O)NCCC1OCCO1 1626a_100000034215_100000210183 [0,1,0,0,0,1|2,0,0]=4 6047 B14R1.177 CCCCC(=O)NCCC1OCCO1 240690a_100000034215_100000210183 [0,1,0,0,0,1|2,0,0]=4 6048 B14R1.177 CCCCC(=O)NCCC1OCCO1 527a_100000034215_100000210183 [0,1,0,0,0,1|2,0,0]=4 6049 B14R1.177 CCCCC(C)COCC1CCCO1 7a_100011995851_100000203698 [0,1,0,0,0,1|1,0,1]=4 6050 B14R1.177 CCCNC(=O)CNCC1CCCC1 2230a_100000174927_100000740388 [0,1,0,0,0,1|2,0,0]=4 6051 B14R1.177 CCCNC(=O)CNCC1CCCC1 2230a_100000737975_100000183358 [0,1,0,0,0,1|2,0,0]=4 6052 B14R1.177 CCCNC(=O)CNCC1CCCC1 269862a_100000174927_100000746403 [0,1,0,0,0,1|2,0,0]=4 6053 B14R1.177 CCCNC(=O)CNCC1CCCC1 34a_100000737975_100000183358 [0,1,0,0,0,1|2,0,0]=4 6054 B14R1.177 CCCNC(=O)CNCC1CCCO1 2230a_100000174927_100000203698 [0,1,0,0,0,1|1,0,0]=3 6055 B14R1.177 CCCNC(=O)CNCC1OCCO1 2230a_100000036311_100000183358 [0,1,0,0,0,1|2,0,0]=4 6056 B14R1.177 CCCNC(=O)CNCC1OCCO1 2230a_100000174927_100000755774 [0,1,0,0,0,1|2,0,0]=4 6057 B14R1.177 CCCNC(=O)CNCC1OCCO1 34a_100000036311_100000183358 [0,1,0,0,0,1|2,0,0]=4 6058 B14R1.177 CCCNC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000183358 [0,1,0,0,0,1|1,0,0]=3 6059 B14R1.177 CCCNC(=O)CNC[C@@H]1CCCO1 34a_100020590478_100000183358 [0,1,0,0,0,1|1,0,0]=3 6060 B14R1.177 CCCNC(=O)COCC1CCCC1 34a_100000742336_100000183358 [0,1,0,0,0,1|1,0,0]=3 6061 B14R1.177 CCCNC(=O)COCC1CCCC1 7a_100000742336_100000183358 [0,1,0,0,0,1|1,0,0]=3 6062 B14R1.177 CCCNC(=O)COCC1CCCO1 11a_100020643023_100011223388 [0,1,0,0,0,1|0,0,0]=2 6063 B14R1.177 CCCNC(=O)COCC1CCCO1 1626a_100020643023_100011223388 [0,1,0,0,0,1|0,0,0]=2 6064 B14R1.177 CCCNC(=O)COCC1CCCO1 240690a_100020643023_100011223388 [0,1,0,0,0,1|0,0,0]=2 6065 B14R1.177 CCCNC(=O)COCC1CCCO1 34a_100000210270_100000183358 [0,1,0,0,0,1|0,0,0]=2 6066 B14R1.177 CCCNC(=O)COCC1CCCO1 527a_100020643023_100011223388 [0,1,0,0,0,1|0,0,0]=2 6067 B14R1.177 CCCNC(=O)COCC1CCCO1 7a_100000210270_100000183358 [0,1,0,0,0,1|0,0,0]=2 6068 B14R1.177 CCCNC(=O)COCC1CCNC1 34a_100000748654_100000183358 [0,1,0,0,0,1|2,0,0]=4 6069 B14R1.177 CCCNC(=O)COCC1CCOC1 34a_100000740260_100000183358 [0,1,0,0,0,1|2,0,0]=4 6070 B14R1.177 CCCNC(=O)COCC1COCO1 34a_100011216627_100000183358 [0,1,0,0,0,1|1,0,0]=3 6071 B14R1.177 CCCNC(=O)COCC1OCCO1 34a_100000087154_100000183358 [0,1,0,0,0,1|1,0,0]=3 6072 B14R1.177 CCCNC(=O)COC[C@H]1CCCN1 34a_100000745186_100000183358 [0,1,0,0,0,1|1,0,0]=3 6073 B14R1.177 CCCNC(=O)CSCC1CCCC1 62a_100000183358_100000740388 [0,1,0,0,0,1|1,1,0]=4 6074 B14R1.177 CCCNC(=O)CSCC1CCCC1 62a_100000740388_100000183358 [0,1,0,0,0,1|1,1,0]=4 6075 B14R1.177 CCCNC(=O)CSCC1CCCO1 11a_100020643023_100000217298 [0,1,0,0,0,1|0,1,0]=3 6076 B14R1.177 CCCNC(=O)CSCC1CCCO1 1626a_100020643023_100000217298 [0,1,0,0,0,1|0,1,0]=3 6077 B14R1.177 CCCNC(=O)CSCC1CCCO1 240690a_100020643023_100000217298 [0,1,0,0,0,1|0,1,0]=3 6078 B14R1.177 CCCNC(=O)CSCC1CCCO1 527a_100020643023_100000217298 [0,1,0,0,0,1|0,1,0]=3 6079 B14R1.177 CCCNC(=O)CSCC1CCCO1 62a_100000183358_100000203698 [0,1,0,0,0,1|0,1,0]=3 6080 B14R1.177 CCCNC(=O)CSCC1CCCO1 62a_100000203698_100000183358 [0,1,0,0,0,1|0,1,0]=3 6081 B14R1.177 CCCNC(=O)CSCC1OCCO1 62a_100000183358_100000755774 [0,1,0,0,0,1|1,1,0]=4 6082 B14R1.177 CCCNC(=O)CSCC1OCCO1 62a_100000755774_100000183358 [0,1,0,0,0,1|1,1,0]=4 6083 B14R1.177 CCCNC(=O)NCCC1CCCC1 2708a_100000739158_100020643023 [0,1,0,0,0,1|2,0,0]=4 6084 B14R1.177 CCCNC(=O)NCCC1CCCC1 2708a_100020643023_100000739158 [0,1,0,0,0,1|2,0,0]=4 6085 B14R1.177 CCCNC(=O)NCCC1CCCC1 273464a_100000739158_100020643023 [0,1,0,0,0,1|2,0,0]=4 6086 B14R1.177 CCCNC(=O)NCCC1CCCC1 273464a_100020643023_100000739158 [0,1,0,0,0,1|2,0,0]=4 6087 B14R1.177 CCCNC(=O)NCCC1CCCC1 512a_100000739158_100020643023 [0,1,0,0,0,1|2,0,0]=4 6088 B14R1.177 CCCNC(=O)NCCC1CCCC1 512a_100020643023_100000739158 [0,1,0,0,0,1|2,0,0]=4 6089 B14R1.177 CCCNC(=O)NCCC1OCCO1 2708a_100000034215_100020643023 [0,1,0,0,0,1|2,0,0]=4 6090 B14R1.177 CCCNC(=O)NCCC1OCCO1 2708a_100020643023_100000034215 [0,1,0,0,0,1|2,0,0]=4 6091 B14R1.177 CCCNC(=O)NCCC1OCCO1 273464a_100000034215_100020643023 [0,1,0,0,0,1|2,0,0]=4 6092 B14R1.177 CCCNC(=O)NCCC1OCCO1 273464a_100020643023_100000034215 [0,1,0,0,0,1|2,0,0]=4 6093 B14R1.177 CCCNC(=O)NCCC1OCCO1 512a_100000034215_100020643023 [0,1,0,0,0,1|2,0,0]=4 6094 B14R1.177 CCCNC(=O)NCCC1OCCO1 512a_100020643023_100000034215 [0,1,0,0,0,1|2,0,0]=4 6095 B14R1.177 CCCOC(=O)CNCC1CCCC1 2230a_100000737975_200011215008 [0,1,0,0,0,1|2,0,0]=4 6096 B14R1.177 CCCOC(=O)CNCC1CCCC1 34a_100000737975_200011215008 [0,1,0,0,0,1|2,0,0]=4 6097 B14R1.177 CCCOC(=O)CNCC1OCCO1 2230a_100000036311_200011215008 [0,1,0,0,0,1|2,0,0]=4 6098 B14R1.177 CCCOC(=O)CNCC1OCCO1 34a_100000036311_200011215008 [0,1,0,0,0,1|2,0,0]=4 6099 B14R1.177 CCCOC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_200011215008 [0,1,0,0,0,1|1,0,0]=3 6100 B14R1.177 CCCOC(=O)CNC[C@@H]1CCCO1 34a_100020590478_200011215008 [0,1,0,0,0,1|1,0,0]=3 6101 B14R1.177 CCCOC(=O)COCC1CCCC1 34a_100000742336_200011215008 [0,1,0,0,0,1|1,0,0]=3 6102 B14R1.177 CCCOC(=O)COCC1CCCC1 7a_100000742336_200011215008 [0,1,0,0,0,1|1,0,0]=3 6103 B14R1.177 CCCOC(=O)COCC1CCCO1 34a_100000210270_200011215008 [0,1,0,0,0,1|0,0,0]=2 6104 B14R1.177 CCCOC(=O)COCC1CCCO1 7a_100000210270_200011215008 [0,1,0,0,0,1|0,0,0]=2 6105 B14R1.177 CCCOC(=O)COCC1CCNC1 34a_100000748654_200011215008 [0,1,0,0,0,1|2,0,0]=4 6106 B14R1.177 CCCOC(=O)COCC1CCOC1 34a_100000740260_200011215008 [0,1,0,0,0,1|2,0,0]=4 6107 B14R1.177 CCCOC(=O)COCC1COCO1 34a_100011216627_200011215008 [0,1,0,0,0,1|1,0,0]=3 6108 B14R1.177 CCCOC(=O)COCC1OCCO1 34a_100000087154_200011215008 [0,1,0,0,0,1|1,0,0]=3 6109 B14R1.177 CCCOC(=O)COC[C@H]1CCCN1 34a_100000745186_200011215008 [0,1,0,0,0,1|1,0,0]=3 6110 B14R1.177 CCCOC(=O)CSCC1CCCC1 62a_100000740388_200011215008 [0,1,0,0,0,1|1,1,0]=4 6111 B14R1.177 CCCOC(=O)CSCC1CCCC1 62a_200011215008_100000740388 [0,1,0,0,0,1|1,1,0]=4 6112 B14R1.177 CCCOC(=O)CSCC1CCCO1 62a_100000203698_200011215008 [0,1,0,0,0,1|0,1,0]=3 6113 B14R1.177 CCCOC(=O)CSCC1CCCO1 62a_200011215008_100000203698 [0,1,0,0,0,1|0,1,0]=3 6114 B14R1.177 CCCOC(=O)CSCC1OCCO1 62a_100000755774_200011215008 [0,1,0,0,0,1|1,1,0]=4 6115 B14R1.177 CCCOC(=O)CSCC1OCCO1 62a_200011215008_100000755774 [0,1,0,0,0,1|1,1,0]=4 6116 B14R1.177 CCCOC(=O)OCNC1CCCC1 34a_100000211070_200000139673 [0,1,0,0,0,1|1,0,0]=3 6117 B14R1.177 CCCOC(=O)OCN[C@H]1CCOC1 34a_100015188467_200000139673 [0,1,0,0,0,1|2,0,0]=4 6118 B14R1.177 CCCOC(=O)OCOC1CCCC1 34a_100000210269_200000139673 [0,1,0,0,0,1|1,0,0]=3 6119 B14R1.177 CCCOC(=O)OCOC1CCCC1 7a_100000210269_200000139673 [0,1,0,0,0,1|1,0,0]=3 6120 B14R1.177 CCCOC(=O)OCOC1CCCO1 34a_100000085407_200000139673 [0,1,0,0,0,1|0,0,0]=2 6121 B14R1.177 CCCOC(=O)OCOC1CCSC1 7a_100011232664_200000139673 [0,1,0,0,0,1|2,0,0]=4 6122 B14R1.177 CCCOC(=O)OCO[C@H]1CCOC1 34a_100000717292_200000139673 [0,1,0,0,0,1|2,0,0]=4 6123 B14R1.177 CCCOC(=O)OCSC1CCCC1 62a_100011217020_200000139673 [0,1,0,0,0,1|1,0,0]=3 6124 B14R1.177 CCNNC(=O)COCC1CCCO1 22a_100000756455_100011223388 [0,1,0,0,0,1|1,0,0]=3 6125 B14R1.177 CCNNC(=O)CSCC1CCCO1 22a_100000756455_100000217298 [0,1,0,0,0,1|1,1,0]=4 6126 B14R1.177 CCOCC(=O)CCCC1CCCC1 1458a_100000211967_100011713738 [0,1,0,0,0,1|2,0,0]=4 6127 B14R1.177 CCOCC(=O)CCCC1OCCO1 1458a_100000211967_100000042513 [0,1,0,0,0,1|2,0,0]=4 6128 B14R1.177 CCOCC(=O)NCCC1CCCC1 11a_100000739158_100000211967 [0,1,0,0,0,1|2,0,0]=4 6129 B14R1.177 CCOCC(=O)NCCC1CCCC1 1626a_100000739158_100000211967 [0,1,0,0,0,1|2,0,0]=4 6130 B14R1.177 CCOCC(=O)NCCC1CCCC1 240690a_100000739158_100000211967 [0,1,0,0,0,1|2,0,0]=4 6131 B14R1.177 CCOCC(=O)NCCC1CCCC1 527a_100000739158_100000211967 [0,1,0,0,0,1|2,0,0]=4 6132 B14R1.177 CCOCC(=O)NCCC1OCCO1 11a_100000034215_100000211967 [0,1,0,0,0,1|2,0,0]=4 6133 B14R1.177 CCOCC(=O)NCCC1OCCO1 1626a_100000034215_100000211967 [0,1,0,0,0,1|2,0,0]=4 6134 B14R1.177 CCOCC(=O)NCCC1OCCO1 240690a_100000034215_100000211967 [0,1,0,0,0,1|2,0,0]=4 6135 B14R1.177 CCOCC(=O)NCCC1OCCO1 527a_100000034215_100000211967 [0,1,0,0,0,1|2,0,0]=4 6136 B14R1.177 CCSCC(=O)CCCC1CCCC1 1458a_100000230394_100011713738 [0,1,0,0,0,1|2,0,0]=4 6137 B14R1.177 CCSCC(=O)CCCC1OCCO1 1458a_100000230394_100000042513 [0,1,0,0,0,1|2,0,0]=4 6138 B14R1.177 CCSCC(=O)NCCC1CCCC1 11a_100000739158_100000230394 [0,1,0,0,0,1|2,0,0]=4 6139 B14R1.177 CCSCC(=O)NCCC1CCCC1 1626a_100000739158_100000230394 [0,1,0,0,0,1|2,0,0]=4 6140 B14R1.177 CCSCC(=O)NCCC1CCCC1 240690a_100000739158_100000230394 [0,1,0,0,0,1|2,0,0]=4 6141 B14R1.177 CCSCC(=O)NCCC1CCCC1 527a_100000739158_100000230394 [0,1,0,0,0,1|2,0,0]=4 6142 B14R1.177 CCSCC(=O)NCCC1OCCO1 11a_100000034215_100000230394 [0,1,0,0,0,1|2,0,0]=4 6143 B14R1.177 CCSCC(=O)NCCC1OCCO1 1626a_100000034215_100000230394 [0,1,0,0,0,1|2,0,0]=4 6144 B14R1.177 CCSCC(=O)NCCC1OCCO1 240690a_100000034215_100000230394 [0,1,0,0,0,1|2,0,0]=4 6145 B14R1.177 CCSCC(=O)NCCC1OCCO1 527a_100000034215_100000230394 [0,1,0,0,0,1|2,0,0]=4 6146 B14R1.177 COCCC(=O)CCCC1CCCC1 1458a_100000749529_100011713738 [0,1,0,0,0,1|2,0,0]=4 6147 B14R1.177 COCCC(=O)CCCC1OCCO1 1458a_100000749529_100000042513 [0,1,0,0,0,1|2,0,0]=4 6148 B14R1.177 COCCC(=O)COCC1CCCO1 1458a_100011223388_100000233755 [0,1,0,0,0,1|0,0,0]=2 6149 B14R1.177 COCCC(=O)CSCC1CCCO1 1458a_100000217298_100000233755 [0,1,0,0,0,1|0,1,0]=3 6150 B14R1.177 COCCC(=O)NCCC1CCCC1 11a_100000739158_100000749529 [0,1,0,0,0,1|2,0,0]=4 6151 B14R1.177 COCCC(=O)NCCC1CCCC1 1626a_100000739158_100000749529 [0,1,0,0,0,1|2,0,0]=4 6152 B14R1.177 COCCC(=O)NCCC1CCCC1 240690a_100000739158_100000749529 [0,1,0,0,0,1|2,0,0]=4 6153 B14R1.177 COCCC(=O)NCCC1CCCC1 527a_100000739158_100000749529 [0,1,0,0,0,1|2,0,0]=4 6154 B14R1.177 COCCC(=O)NCCC1OCCO1 11a_100000034215_100000749529 [0,1,0,0,0,1|2,0,0]=4 6155 B14R1.177 COCCC(=O)NCCC1OCCO1 1626a_100000034215_100000749529 [0,1,0,0,0,1|2,0,0]=4 6156 B14R1.177 COCCC(=O)NCCC1OCCO1 240690a_100000034215_100000749529 [0,1,0,0,0,1|2,0,0]=4 6157 B14R1.177 COCCC(=O)NCCC1OCCO1 527a_100000034215_100000749529 [0,1,0,0,0,1|2,0,0]=4 6158 B14R1.177 CSCCC(=O)CCCC1CCCC1 1458a_100000174002_100011713738 [0,1,0,0,0,1|2,0,0]=4 6159 B14R1.177 CSCCC(=O)CCCC1OCCO1 1458a_100000174002_100000042513 [0,1,0,0,0,1|2,0,0]=4 6160 B14R1.177 CSCCC(=O)COCC1CCCO1 1458a_100011223388_100000751147 [0,1,0,0,0,1|0,0,0]=2 6161 B14R1.177 CSCCC(=O)CSCC1CCCO1 1458a_100000217298_100000751147 [0,1,0,0,0,1|0,1,0]=3 6162 B14R1.177 CSCCC(=O)NCCC1CCCC1 11a_100000739158_100000174002 [0,1,0,0,0,1|2,0,0]=4 6163 B14R1.177 CSCCC(=O)NCCC1CCCC1 1626a_100000739158_100000174002 [0,1,0,0,0,1|2,0,0]=4 6164 B14R1.177 CSCCC(=O)NCCC1CCCC1 240690a_100000739158_100000174002 [0,1,0,0,0,1|2,0,0]=4 6165 B14R1.177 CSCCC(=O)NCCC1CCCC1 527a_100000739158_100000174002 [0,1,0,0,0,1|2,0,0]=4 6166 B14R1.177 CSCCC(=O)NCCC1OCCO1 11a_100000034215_100000174002 [0,1,0,0,0,1|2,0,0]=4 6167 B14R1.177 CSCCC(=O)NCCC1OCCO1 1626a_100000034215_100000174002 [0,1,0,0,0,1|2,0,0]=4 6168 B14R1.177 CSCCC(=O)NCCC1OCCO1 240690a_100000034215_100000174002 [0,1,0,0,0,1|2,0,0]=4 6169 B14R1.177 CSCCC(=O)NCCC1OCCO1 527a_100000034215_100000174002 [0,1,0,0,0,1|2,0,0]=4 6170 B14R1.177 N#CCCC(=O)COCC1CCCO1 1458a_100011223388_100011215226 [0,1,0,0,0,1|0,0,1]=3 6171 B14R1.177 N#CCCC(=O)CSCC1CCCO1 1458a_100000217298_100011215226 [0,1,0,0,0,1|0,1,1]=4 6172 B14R1.177 N#CCNC(=O)COCC1CCCO1 1626a_100000734998_100011223388 [0,1,0,0,0,1|1,0,1]=4 6173 B14R1.177 N#CCNC(=O)COCC1CCCO1 527a_100000734998_100011223388 [0,1,0,0,0,1|1,0,1]=4 6174 B14R1.177 N#CCNC(=O)COCC1CCCO1 7a_100000210270_100000736037 [0,1,0,0,0,1|1,0,1]=4 6175 B14R1.177 O=C(CCCF)COCC1CCCO1 1458a_100011223388_100011934791 [0,1,0,0,0,1|0,0,0]=2 6176 B14R1.177 O=C(CCCF)CSCC1CCCO1 1458a_100000217298_100011934791 [0,1,0,0,0,1|0,1,0]=3 6177 B14R1.177 O=C(CCCO)COCC1CCCO1 1458a_100011223388_100011215043 [0,1,0,0,0,1|0,0,0]=2 6178 B14R1.177 O=C(CCCO)CSCC1CCCO1 1458a_100000217298_100011215043 [0,1,0,0,0,1|0,1,0]=3 6179 B14R1.177 O=C(CNCC1CCCO1)NCCF 2230a_100000725713_100000203698 [0,1,0,0,0,1|2,0,0]=4 6180 B14R1.177 O=C(COCC1CCCO1)NCCF 11a_100000724931_100011223388 [0,1,0,0,0,1|1,0,0]=3 6181 B14R1.177 O=C(COCC1CCCO1)NCCF 1626a_100000724931_100011223388 [0,1,0,0,0,1|1,0,0]=3 6182 B14R1.177 O=C(COCC1CCCO1)NCCF 240690a_100000724931_100011223388 [0,1,0,0,0,1|1,0,0]=3 6183 B14R1.177 O=C(COCC1CCCO1)NCCF 527a_100000724931_100011223388 [0,1,0,0,0,1|1,0,0]=3 6184 B14R1.177 O=C(COCC1CCCO1)NCCO 240690a_100000210304_100011223388 [0,1,0,0,0,1|1,0,0]=3 6185 B14R1.177 O=C(COCC1CCCO1)NCCO 527a_100000210304_100011223388 [0,1,0,0,0,1|1,0,0]=3 6186 B14R1.177 O=C(CSCC1CCCO1)NCCF 11a_100000724931_100000217298 [0,1,0,0,0,1|1,1,0]=4 6187 B14R1.177 O=C(CSCC1CCCO1)NCCF 1626a_100000724931_100000217298 [0,1,0,0,0,1|1,1,0]=4 6188 B14R1.177 O=C(CSCC1CCCO1)NCCF 240690a_100000724931_100000217298 [0,1,0,0,0,1|1,1,0]=4 6189 B14R1.177 O=C(CSCC1CCCO1)NCCF 527a_100000724931_100000217298 [0,1,0,0,0,1|1,1,0]=4 6190 B14R1.177 O=C(CSCC1CCCO1)NCCO 240690a_100000210304_100000217298 [0,1,0,0,0,1|1,1,0]=4 6191 B14R1.177 O=C(CSCC1CCCO1)NCCO 527a_100000210304_100000217298 [0,1,0,0,0,1|1,1,0]=4 6192 B14R1.519 CCCC(=O)OCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000034017 [0,1,0,0,0,1|1,0,0]=3 6193 B14R1.519 CCCC(=O)OCOC1CCC(=O)C1 34a_100012614533_100000034017 [0,1,0,0,0,1|1,0,1]=4 6194 B14R1.519 CCCC(=O)OCOC1CCC(C1)C 34a_100000698185_100000034017 [0,1,0,0,0,1|1,0,0]=3 6195 B14R1.519 CCNC(=O)COC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000183381 [0,1,0,0,0,1|2,0,0]=4 6196 B14R1.519 CCOC(=O)COC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000188475 [0,1,0,0,0,1|2,0,0]=4 6197 B14R1.621 C=C(CCC)CC(=O)CC1CCCO1 1458a_100000138376_100000203698 [0,1,0,0,0,1|2,0,0]=4 6198 B14R1.621 CCCC(=CC(=O)CC1CCCO1)C 1458a_100020676950_100000203698 [0,1,0,0,0,1|2,0,0]=4 6199 B14R1.621 CCCC(=O)CC(=O)CC1CCCC1 1458a_100000210891_100000747444 [0,1,0,0,0,1|2,0,0]=4 6200 B14R1.621 CCCC(=O)CN(C)CC1CCCO1 2230a_100102946541_100000747444 [0,1,0,0,0,1|1,0,0]=3 6201 B14R1.621 CCCC(=O)CN(C)CC1CCCO1 269982a_100102946541_100000747444 [0,1,0,0,0,1|1,0,0]=3 6202 B14R1.621 CCCC(=O)CN(C)CC1OCCO1 2230a_200000032744_100000747444 [0,1,0,0,0,1|2,0,0]=4 6203 B14R1.621 CCCC(=O)CN(C)CC1OCCO1 269982a_200000032744_100000747444 [0,1,0,0,0,1|2,0,0]=4 6204 B14R1.621 CCCS(=O)CC(=O)CC1CCCO1 1458a_100011387404_100000203698 [0,1,0,0,0,1|2,0,0]=4 6205 B14R1.621 CCNC(=O)CN(C)CC1CCCO1 2230a_100000741943_100000203698 [0,1,0,0,0,1|2,0,0]=4 6206 B14R1.621 CCNC(=O)CN(C)CC1CCCO1 2230a_100102946541_100000183381 [0,1,0,0,0,1|2,0,0]=4 6207 B14R1.621 CCNC(=O)CN(C)CC1CCCO1 269982a_100000741943_100000183445 [0,1,0,0,0,1|2,0,0]=4 6208 B14R1.621 CCNC(=O)CN(C)CC1CCCO1 269982a_100102946541_100000183381 [0,1,0,0,0,1|2,0,0]=4 6209 B14R1.621 CCNC(=O)CN(C)CC1CCCO1 34a_100102946541_100000183381 [0,1,0,0,0,1|2,0,0]=4 6210 B14R1.621 CCOC(=O)CC(=O)CC1CCCO1 1458a_100000243816_100000203698 [0,1,0,0,0,1|2,0,0]=4 6211 B14R1.621 CCOC(=O)CN(C)CC1CCCO1 2230a_100000220588_100000203698 [0,1,0,0,0,1|2,0,0]=4 6212 B14R1.621 CCOC(=O)CN(C)CC1CCCO1 2230a_100102946541_100000188475 [0,1,0,0,0,1|2,0,0]=4 6213 B14R1.621 CCOC(=O)CN(C)CC1CCCO1 269982a_100102946541_100000188475 [0,1,0,0,0,1|2,0,0]=4 6214 B14R1.621 CCOC(=O)CN(C)CC1CCCO1 34a_100102946541_100000188475 [0,1,0,0,0,1|2,0,0]=4 6215 B14R1.621 CCOC(=O)OC(C)SC1CCCC1 62a_100000036008_100000179811 [0,1,0,0,0,1|2,0,0]=4 6216 B14R1.621 CCOC(=O)OC(C)SC1CCCC1 62a_100011217020_100000036008 [0,1,0,0,0,1|2,0,0]=4 6217 B14R1.633 C#CCC(=O)C(C)OCC1CCCO1 1458a_100000746140_100000184674 [0,1,0,0,0,1|0,0,2]=4 6218 B14R1.633 C=C(COC1CCCO1)C(=O)OCC 34a_100000085407_100000755967 [0,1,0,0,0,1|2,0,0]=4 6219 B14R1.633 C=CCC(=O)C(C)OCC1CCCO1 1458a_100000746140_100000210623 [0,1,0,0,0,1|0,0,2]=4 6220 B14R1.633 CC(OCC1CCCO1)C(=O)CC#N 1458a_100000746140_100011214920 [0,1,0,0,0,1|1,0,1]=4 6221 B14R1.633 CC(OCC1CCCO1)C(=O)CCF 1458a_100000746140_100011217306 [0,1,0,0,0,1|1,0,0]=3 6222 B14R1.633 CC(OCC1CCCO1)C(=O)CCO 1458a_100000746140_100000211926 [0,1,0,0,0,1|1,0,0]=3 6223 B14R1.633 CC(SCC1CCCO1)C(=O)CCF 1458a_100000217297_100011217306 [0,1,0,0,0,1|1,1,0]=4 6224 B14R1.633 CC(SCC1CCCO1)C(=O)CCO 1458a_100000217297_100000211926 [0,1,0,0,0,1|1,1,0]=4 6225 B14R1.633 CCCC(=O)C(C)OCC1CCCO1 1458a_100000746140_100000210303 [0,1,0,0,0,1|0,0,0]=2 6226 B14R1.633 CCCC(=O)C(C)SCC1CCCO1 1458a_100000217297_100000210303 [0,1,0,0,0,1|0,1,0]=3 6227 B14R1.633 CCCC(C)C(C)OCC1CCCO1 7a_100000708338_100000203698 [0,1,0,0,0,1|1,0,1]=4 6228 B14R1.633 CCNC(=O)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_200011297158 [0,1,0,0,0,1|2,0,0]=4 6229 B14R1.633 CCNC(=O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_200011297158 [0,1,0,0,0,1|2,0,0]=4 6230 B14R1.633 CCNC(=O)C(=O)NC[C@@H]1CCCO1 527a_100020590478_200011297158 [0,1,0,0,0,1|2,0,0]=4 6231 B14R1.633 CCNC(=O)C(C)NCC1CCCO1 2230a_100000736553_100000203698 [0,1,0,0,0,1|2,0,0]=4 6232 B14R1.633 CCNC(=O)C(C)NC[C@@H]1CCCO1 2230a_100020590478_100000230173 [0,1,0,0,0,1|2,0,0]=4 6233 B14R1.633 CCNC(=O)C(C)NC[C@@H]1CCCO1 34a_100020590478_100000230173 [0,1,0,0,0,1|2,0,0]=4 6234 B14R1.633 CCNC(=O)C(C)OCC1CCCC1 34a_100000742336_100000230173 [0,1,0,0,0,1|2,0,0]=4 6235 B14R1.633 CCNC(=O)C(C)OCC1CCCC1 7a_100000742336_100000230173 [0,1,0,0,0,1|2,0,0]=4 6236 B14R1.633 CCNC(=O)C(C)OCC1CCCO1 11a_100015525214_100000746140 [0,1,0,0,0,1|1,0,0]=3 6237 B14R1.633 CCNC(=O)C(C)OCC1CCCO1 240690a_100015525214_100000746140 [0,1,0,0,0,1|1,0,0]=3 6238 B14R1.633 CCNC(=O)C(C)OCC1CCCO1 34a_100000210270_100000230173 [0,1,0,0,0,1|1,0,0]=3 6239 B14R1.633 CCNC(=O)C(C)OCC1CCCO1 527a_100015525214_100000746140 [0,1,0,0,0,1|1,0,0]=3 6240 B14R1.633 CCNC(=O)C(C)OCC1CCCO1 7a_100000210270_100000230173 [0,1,0,0,0,1|1,0,0]=3 6241 B14R1.633 CCNC(=O)C(C)OCC1COCO1 34a_100011216627_100000230173 [0,1,0,0,0,1|2,0,0]=4 6242 B14R1.633 CCNC(=O)C(C)OCC1OCCO1 34a_100000087154_100000230173 [0,1,0,0,0,1|2,0,0]=4 6243 B14R1.633 CCNC(=O)C(C)OC[C@H]1CCCN1 34a_100000745186_100000230173 [0,1,0,0,0,1|2,0,0]=4 6244 B14R1.633 CCNC(=O)C(C)SCC1CCCO1 11a_100015525214_100000217297 [0,1,0,0,0,1|1,1,0]=4 6245 B14R1.633 CCNC(=O)C(C)SCC1CCCO1 240690a_100015525214_100000217297 [0,1,0,0,0,1|1,1,0]=4 6246 B14R1.633 CCNC(=O)C(C)SCC1CCCO1 527a_100015525214_100000217297 [0,1,0,0,0,1|1,1,0]=4 6247 B14R1.633 CCNC(=O)C(C)SCC1CCCO1 62a_100000203698_100000230173 [0,1,0,0,0,1|1,1,0]=4 6248 B14R1.633 CCNC(=O)C(C)SCC1CCCO1 62a_100000230173_100000203698 [0,1,0,0,0,1|1,1,0]=4 6249 B14R1.633 CCOC(=O)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100014798877 [0,1,0,0,0,1|2,0,0]=4 6250 B14R1.633 CCOC(=O)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100014798877 [0,1,0,0,0,1|2,0,0]=4 6251 B14R1.633 CCOC(=O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100014798877 [0,1,0,0,0,1|2,0,0]=4 6252 B14R1.633 CCOC(=O)C(C)NC[C@@H]1CCCO1 2230a_100020590478_100011215307 [0,1,0,0,0,1|2,0,0]=4 6253 B14R1.633 CCOC(=O)C(C)NC[C@@H]1CCCO1 34a_100020590478_100011216346 [0,1,0,0,0,1|2,0,0]=4 6254 B14R1.633 CCOC(=O)C(C)OCC1CCCC1 34a_100000742336_100011216346 [0,1,0,0,0,1|2,0,0]=4 6255 B14R1.633 CCOC(=O)C(C)OCC1CCCC1 7a_100000742336_100011216346 [0,1,0,0,0,1|2,0,0]=4 6256 B14R1.633 CCOC(=O)C(C)OCC1CCCO1 34a_100000210270_100011216346 [0,1,0,0,0,1|1,0,0]=3 6257 B14R1.633 CCOC(=O)C(C)OCC1CCCO1 7a_100000210270_100011216346 [0,1,0,0,0,1|1,0,0]=3 6258 B14R1.633 CCOC(=O)C(C)OCC1COCO1 34a_100011216627_100011216346 [0,1,0,0,0,1|2,0,0]=4 6259 B14R1.633 CCOC(=O)C(C)OCC1OCCO1 34a_100000087154_100011216346 [0,1,0,0,0,1|2,0,0]=4 6260 B14R1.633 CCOC(=O)C(C)OC[C@H]1CCCN1 34a_100000745186_100011216346 [0,1,0,0,0,1|2,0,0]=4 6261 B14R1.633 CCOC(=O)C(C)SCC1CCCO1 62a_100000203698_100011216346 [0,1,0,0,0,1|1,1,0]=4 6262 B14R1.633 CCOC(=O)C(C)SCC1CCCO1 62a_100011216346_100000203698 [0,1,0,0,0,1|1,1,0]=4 6263 B14R1.633 CCOC(=O)C(F)NC[C@@H]1CCCO1 2230a_100020590478_100000760018 [0,1,0,0,0,1|2,0,0]=4 6264 B14R1.633 CCOC(=O)C(F)NC[C@@H]1CCCO1 34a_100020590478_100000760018 [0,1,0,0,0,1|2,0,0]=4 6265 B14R1.633 CCOC(=O)C(F)OCC1CCCC1 34a_100000742336_100000760018 [0,1,0,0,0,1|2,0,0]=4 6266 B14R1.633 CCOC(=O)C(F)OCC1CCCC1 7a_100000742336_100000040065 [0,1,0,0,0,1|2,0,0]=4 6267 B14R1.633 CCOC(=O)C(F)OCC1CCCO1 34a_100000210270_100000760018 [0,1,0,0,0,1|1,0,0]=3 6268 B14R1.633 CCOC(=O)C(F)OCC1CCCO1 7a_100000210270_100000040065 [0,1,0,0,0,1|1,0,0]=3 6269 B14R1.633 CCOC(=O)C(F)OCC1COCO1 34a_100011216627_100000760018 [0,1,0,0,0,1|2,0,0]=4 6270 B14R1.633 CCOC(=O)C(F)OCC1OCCO1 34a_100000087154_100000760018 [0,1,0,0,0,1|2,0,0]=4 6271 B14R1.633 CCOC(=O)C(F)OC[C@H]1CCCN1 34a_100000745186_100000760018 [0,1,0,0,0,1|2,0,0]=4 6272 B14R1.633 CCOC(=O)C(F)SCC1CCCO1 62a_100000203698_100000760018 [0,1,0,0,0,1|1,1,0]=4 6273 B14R1.633 CCOC(=O)C(F)SCC1CCCO1 62a_100000760018_100000203698 [0,1,0,0,0,1|1,1,0]=4 6274 B14R1.633 CCOC(=O)[C@H](C)OCC1CCCC1 7a_100000751109_100000740388 [0,1,0,0,0,1|2,0,0]=4 6275 B14R1.633 CCOC(=O)[C@H](C)OCC1CCCO1 7a_100000751109_100000203698 [0,1,0,0,0,1|1,0,0]=3 6276 B14R1.633 CCOC(=O)[C@H](C)OCC1OCCO1 7a_100000751109_100000755774 [0,1,0,0,0,1|2,0,0]=4 6277 B14R1.633 CCSC(=O)[C@H](C)NCC1CCCO1 2230a_100103168634_100000203698 [0,1,0,0,0,1|2,0,0]=4 6278 B14R1.633 CNNC(=O)C(C)OCC1CCCO1 22a_100016993582_100000746140 [0,1,0,0,0,1|2,0,0]=4 6279 B14R1.948 CCCC(=O)NCCC1CCCN1C 240690a_100011219722_100000211992 [0,1,0,0,0,1|2,0,0]=4 6280 B14R1.948 CCCC(=O)NCCC1CCCN1C 527a_100011219722_100000211992 [0,1,0,0,0,1|2,0,0]=4 6281 B14R1.948 CCCC(=O)OCNC1CCNC1=O 2230a_100016995588_100000034017 [0,1,0,0,0,1|2,0,0]=4 6282 B14R1.948 CCCC(=O)OCNC1CCNC1=O 34a_100016995588_100000034017 [0,1,0,0,0,1|2,0,0]=4 6283 B14R1.948 CCCC(=O)OCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000034017 [0,1,0,0,0,1|2,0,0]=4 6284 B14R1.948 CCCC(=O)OCOC1CCCC1=O 34a_200000719330_100000034017 [0,1,0,0,0,1|1,0,0]=3 6285 B14R1.948 CCCC(=O)OCOC1CCCC1C 34a_100011216460_100000034017 [0,1,0,0,0,1|1,0,0]=3 6286 B14R1.948 CCCC(=O)OCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000034017 [0,1,0,0,0,1|1,0,0]=3 6287 B14R1.948 CCCC(=O)OCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000034017 [0,1,0,0,0,1|1,0,0]=3 6288 B14R1.948 CCCC(=O)OCO[C@H]1CCNC1=O 34a_100000688343_100000034017 [0,1,0,0,0,1|2,0,0]=4 6289 B14R1.948 CCCC(=O)OCO[C@H]1CNC[C@H]1C 34a_200015306588_100000034017 [0,1,0,0,0,1|2,0,0]=4 6290 B14R1.948 CCCC(=O)OCO[C@H]1COC[C@@H]1N 34a_100015191717_100000034017 [0,1,0,0,0,1|2,0,0]=4 6291 B14R1.948 CCCC(=O)OCSC1CCCC1=O 62a_100000211823_100000034017 [0,1,0,0,0,1|1,0,0]=3 6292 B14R1.948 CCCC(=O)OCSC1CCOC1=O 62a_100000211211_100000034017 [0,1,0,0,0,1|2,0,0]=4 6293 B14R1.948 CCCC(=O)OCSC1COCC1O 62a_200000725654_100000034017 [0,1,0,0,0,1|2,0,0]=4 6294 B14R1.948 CCCC(=O)OCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000034017 [0,1,0,0,0,1|1,0,0]=3 6295 B14R1.948 CCNC(=O)COCC1CCCN1C 34a_100000743107_100000183381 [0,1,0,0,0,1|2,0,0]=4 6296 B14R1.948 CCOC(=O)COCC1CCCN1C 34a_100000743107_100000188475 [0,1,0,0,0,1|2,0,0]=4 6297 B14R1.948 CCOC(=O)OCSC1CCCC1=O 62a_100000211823_100000075025 [0,1,0,0,0,1|2,0,0]=4 6298 B14R1.948 CCOC(=O)OCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000075025 [0,1,0,0,0,1|2,0,0]=4 6299 B14R1.986 C#CC(C)C(=O)COCC1CCCO1 1458a_100011223388_200000035995 [0,1,0,0,0,1|0,0,2]=4 6300 B14R1.986 CC(C#N)C(=O)COCC1CCCO1 1458a_100011223388_100000703298 [0,1,0,0,0,1|1,0,1]=4 6301 B14R1.986 CCC(C)C(=O)CCCC1CCCC1 1458a_100011192722_100011713738 [0,1,0,0,0,1|2,0,0]=4 6302 B14R1.986 CCC(C)C(=O)CCCC1OCCO1 1458a_100011192722_100000042513 [0,1,0,0,0,1|2,0,0]=4 6303 B14R1.986 CCC(C)C(=O)COCC1CCCO1 1458a_100011223388_100000758301 [0,1,0,0,0,1|0,0,0]=2 6304 B14R1.986 CCC(C)C(=O)CSCC1CCCO1 1458a_100000217298_100000758301 [0,1,0,0,0,1|0,1,0]=3 6305 B14R1.986 CCC(C)C(=O)NCCC1CCCC1 11a_100000739158_100011192722 [0,1,0,0,0,1|2,0,0]=4 6306 B14R1.986 CCC(C)C(=O)NCCC1CCCC1 1626a_100000739158_100011192722 [0,1,0,0,0,1|2,0,0]=4 6307 B14R1.986 CCC(C)C(=O)NCCC1CCCC1 240690a_100000739158_100011192722 [0,1,0,0,0,1|2,0,0]=4 6308 B14R1.986 CCC(C)C(=O)NCCC1CCCC1 527a_100000739158_100011192722 [0,1,0,0,0,1|2,0,0]=4 6309 B14R1.986 CCC(C)C(=O)NCCC1OCCO1 11a_100000034215_100011192722 [0,1,0,0,0,1|2,0,0]=4 6310 B14R1.986 CCC(C)C(=O)NCCC1OCCO1 1626a_100000034215_100011192722 [0,1,0,0,0,1|2,0,0]=4 6311 B14R1.986 CCC(C)C(=O)NCCC1OCCO1 240690a_100000034215_100011192722 [0,1,0,0,0,1|2,0,0]=4 6312 B14R1.986 CCC(C)C(=O)NCCC1OCCO1 527a_100000034215_100011192722 [0,1,0,0,0,1|2,0,0]=4 6313 B14R1.986 CCC(O)C(=O)CCCC1CCCC1 1458a_100011196387_100011713738 [0,1,0,0,0,1|2,0,0]=4 6314 B14R1.986 CCC(O)C(=O)CCCC1OCCO1 1458a_100011196387_100000042513 [0,1,0,0,0,1|2,0,0]=4 6315 B14R1.986 CCC(O)C(=O)NCCC1CCCC1 240690a_100000739158_100011196387 [0,1,0,0,0,1|2,0,0]=4 6316 B14R1.986 CCC(O)C(=O)NCCC1OCCO1 240690a_100000034215_100011196387 [0,1,0,0,0,1|2,0,0]=4 6317 B14R1.986 CCN(C)C(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000738999 [0,1,0,0,0,1|2,0,0]=4 6318 B14R1.986 CCN(C)C(=O)CNC[C@@H]1CCCO1 34a_100020590478_100000738999 [0,1,0,0,0,1|2,0,0]=4 6319 B14R1.986 CCN(C)C(=O)COCC1CCCC1 34a_100000742336_100000738999 [0,1,0,0,0,1|2,0,0]=4 6320 B14R1.986 CCN(C)C(=O)COCC1CCCC1 7a_100000742336_100000738999 [0,1,0,0,0,1|2,0,0]=4 6321 B14R1.986 CCN(C)C(=O)COCC1CCCO1 11a_100000225621_100011223388 [0,1,0,0,0,1|1,0,0]=3 6322 B14R1.986 CCN(C)C(=O)COCC1CCCO1 1626a_100000225621_100011223388 [0,1,0,0,0,1|1,0,0]=3 6323 B14R1.986 CCN(C)C(=O)COCC1CCCO1 240690a_100000225621_100011223388 [0,1,0,0,0,1|1,0,0]=3 6324 B14R1.986 CCN(C)C(=O)COCC1CCCO1 34a_100000210270_100000738999 [0,1,0,0,0,1|1,0,0]=3 6325 B14R1.986 CCN(C)C(=O)COCC1CCCO1 527a_100000225621_100011223388 [0,1,0,0,0,1|1,0,0]=3 6326 B14R1.986 CCN(C)C(=O)COCC1CCCO1 7a_100000210270_100000738999 [0,1,0,0,0,1|1,0,0]=3 6327 B14R1.986 CCN(C)C(=O)COCC1COCO1 34a_100011216627_100000738999 [0,1,0,0,0,1|2,0,0]=4 6328 B14R1.986 CCN(C)C(=O)COCC1OCCO1 34a_100000087154_100000738999 [0,1,0,0,0,1|2,0,0]=4 6329 B14R1.986 CCN(C)C(=O)COC[C@H]1CCCN1 34a_100000745186_100000738999 [0,1,0,0,0,1|2,0,0]=4 6330 B14R1.986 CCN(C)C(=O)CSCC1CCCO1 11a_100000225621_100000217298 [0,1,0,0,0,1|1,1,0]=4 6331 B14R1.986 CCN(C)C(=O)CSCC1CCCO1 1626a_100000225621_100000217298 [0,1,0,0,0,1|1,1,0]=4 6332 B14R1.986 CCN(C)C(=O)CSCC1CCCO1 240690a_100000225621_100000217298 [0,1,0,0,0,1|1,1,0]=4 6333 B14R1.986 CCN(C)C(=O)CSCC1CCCO1 527a_100000225621_100000217298 [0,1,0,0,0,1|1,1,0]=4 6334 B14R1.986 CCN(C)C(=O)CSCC1CCCO1 62a_100000203698_100000738999 [0,1,0,0,0,1|1,1,0]=4 6335 B14R1.986 CCN(C)C(=O)CSCC1CCCO1 62a_100000738999_100000203698 [0,1,0,0,0,1|1,1,0]=4 6336 B14R1.986 COC(=O)C(=O)COCC1CCCO1 34a_100000210270_100011610305 [0,1,0,0,0,1|1,0,1]=4 6337 B14R1.986 CON(C)C(=O)COCC1CCCO1 7a_100000210270_100000764215 [0,1,0,0,0,1|2,0,0]=4 6338 B14R1.2617 CCCC(=O)CCCC1(OCCO1)C 1458a_100000211992_100000037737 [0,1,0,0,0,1|2,0,0]=4 6339 B14R1.2617 CCCC(=O)CNCC1(CCCC1)O 2230a_100000737848_100000747444 [0,1,0,0,0,1|2,0,0]=4 6340 B14R1.2617 CCCC(=O)CNCC1(OCCO1)C 2230a_100000691740_100000747444 [0,1,0,0,0,1|2,0,0]=4 6341 B14R1.2617 CCCC(=O)CSCC1(OCCO1)C 62a_100000747444_100009818610 [0,1,0,0,0,1|1,1,0]=4 6342 B14R1.2617 CCCC(=O)CSCC1(OCCO1)C 62a_100009818610_100000747444 [0,1,0,0,0,1|1,1,0]=4 6343 B14R1.2617 CCCC(=O)NCCC1(CCCC1)O 11a_100000719956_100000211992 [0,1,0,0,0,1|2,0,0]=4 6344 B14R1.2617 CCCC(=O)NCCC1(CCCC1)O 1626a_100000719956_100000211992 [0,1,0,0,0,1|2,0,0]=4 6345 B14R1.2617 CCCC(=O)NCCC1(CCCC1)O 240690a_100000719956_100000211992 [0,1,0,0,0,1|2,0,0]=4 6346 B14R1.2617 CCCC(=O)NCCC1(CCCC1)O 527a_100000719956_100000211992 [0,1,0,0,0,1|2,0,0]=4 6347 B14R1.2617 CCCC(=O)NCCC1(OCCO1)C 1626a_100000073055_100000211992 [0,1,0,0,0,1|2,0,0]=4 6348 B14R1.2617 CCCC(=O)NCCC1(OCCO1)C 240690a_100000073055_100000211992 [0,1,0,0,0,1|2,0,0]=4 6349 B14R1.2617 CCCC(=O)NCCC1(OCCO1)C 527a_100000073055_100000211992 [0,1,0,0,0,1|2,0,0]=4 6350 B14R1.2617 CCCC(=O)OCNC1(CCOC1)C 2230a_100000693475_100000034017 [0,1,0,0,0,1|2,0,0]=4 6351 B14R1.2617 CCCC(=O)OCOC1(CCCC1)C 34a_100000751722_100000034017 [0,1,0,0,0,1|1,0,0]=3 6352 B14R1.2617 CCNC(=O)COCC1(CCCC1)N 34a_100000749328_100000183381 [0,1,0,0,0,1|2,0,0]=4 6353 B14R1.2617 CCNC(=O)COC[C@@]1(CCCN1)C 34a_100016195882_100000183381 [0,1,0,0,0,1|2,0,0]=4 6354 B14R1.2617 CCOC(=O)COCC1(CCCC1)N 34a_100000749328_100000188475 [0,1,0,0,0,1|2,0,0]=4 6355 B14R1.2617 CCOC(=O)COC[C@@]1(CCCN1)C 34a_100016195882_100000188475 [0,1,0,0,0,1|2,0,0]=4 6356 B14R1.6454 C=C(C)CC(=O)COCC1CCCO1 1458a_100011223388_100000748629 [0,1,0,0,0,1|0,0,1]=3 6357 B14R1.6454 C=C(C)CC(=O)CSCC1CCCO1 1458a_100000217298_100000748629 [0,1,0,0,0,1|0,1,1]=4 6358 B14R1.6454 C=C(F)CC(=O)COCC1CCCO1 1458a_100011223388_100009893438 [0,1,0,0,0,1|0,0,2]=4 6359 B14R1.6454 CC(=O)NC(=O)COCC1CCCO1 7a_100000210270_100000183797 [0,1,0,0,0,1|1,0,1]=4 6360 B14R1.6454 CC(C)CC(=O)CCCC1CCCC1 1458a_100000210554_100011713738 [0,1,0,0,0,1|2,0,0]=4 6361 B14R1.6454 CC(C)CC(=O)CCCC1OCCO1 1458a_100000210554_100000042513 [0,1,0,0,0,1|2,0,0]=4 6362 B14R1.6454 CC(C)CC(=O)COCC1CCCO1 1458a_100011223388_100000210624 [0,1,0,0,0,1|0,0,0]=2 6363 B14R1.6454 CC(C)CC(=O)CSCC1CCCO1 1458a_100000217298_100000210624 [0,1,0,0,0,1|0,1,0]=3 6364 B14R1.6454 CC(C)CC(=O)NCCC1CCCC1 11a_100000739158_100000210554 [0,1,0,0,0,1|2,0,0]=4 6365 B14R1.6454 CC(C)CC(=O)NCCC1CCCC1 1626a_100000739158_100000210554 [0,1,0,0,0,1|2,0,0]=4 6366 B14R1.6454 CC(C)CC(=O)NCCC1CCCC1 240690a_100000739158_100000210554 [0,1,0,0,0,1|2,0,0]=4 6367 B14R1.6454 CC(C)CC(=O)NCCC1CCCC1 527a_100000739158_100000210554 [0,1,0,0,0,1|2,0,0]=4 6368 B14R1.6454 CC(C)CC(=O)NCCC1OCCO1 11a_100000034215_100000210554 [0,1,0,0,0,1|2,0,0]=4 6369 B14R1.6454 CC(C)CC(=O)NCCC1OCCO1 1626a_100000034215_100000210554 [0,1,0,0,0,1|2,0,0]=4 6370 B14R1.6454 CC(C)CC(=O)NCCC1OCCO1 240690a_100000034215_100000210554 [0,1,0,0,0,1|2,0,0]=4 6371 B14R1.6454 CC(C)CC(=O)NCCC1OCCO1 527a_100000034215_100000210554 [0,1,0,0,0,1|2,0,0]=4 6372 B14R1.6454 CC(C)NC(=O)CNCC1CCCO1 2230a_100000168517_100000203698 [0,1,0,0,0,1|2,0,0]=4 6373 B14R1.6454 CC(C)NC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100000183996 [0,1,0,0,0,1|2,0,0]=4 6374 B14R1.6454 CC(C)NC(=O)CNC[C@@H]1CCCO1 34a_100020590478_100000183996 [0,1,0,0,0,1|2,0,0]=4 6375 B14R1.6454 CC(C)NC(=O)COCC1CCCC1 34a_100000742336_100000183996 [0,1,0,0,0,1|2,0,0]=4 6376 B14R1.6454 CC(C)NC(=O)COCC1CCCC1 7a_100000742336_100000183996 [0,1,0,0,0,1|2,0,0]=4 6377 B14R1.6454 CC(C)NC(=O)COCC1CCCO1 11a_100138425928_100011223388 [0,1,0,0,0,1|1,0,0]=3 6378 B14R1.6454 CC(C)NC(=O)COCC1CCCO1 1626a_100138425928_100011223388 [0,1,0,0,0,1|1,0,0]=3 6379 B14R1.6454 CC(C)NC(=O)COCC1CCCO1 240690a_100138425928_100011223388 [0,1,0,0,0,1|1,0,0]=3 6380 B14R1.6454 CC(C)NC(=O)COCC1CCCO1 34a_100000210270_100000183996 [0,1,0,0,0,1|1,0,0]=3 6381 B14R1.6454 CC(C)NC(=O)COCC1CCCO1 527a_100138425928_100011223388 [0,1,0,0,0,1|1,0,0]=3 6382 B14R1.6454 CC(C)NC(=O)COCC1CCCO1 7a_100000210270_100000183996 [0,1,0,0,0,1|1,0,0]=3 6383 B14R1.6454 CC(C)NC(=O)COCC1COCO1 34a_100011216627_100000183996 [0,1,0,0,0,1|2,0,0]=4 6384 B14R1.6454 CC(C)NC(=O)COCC1OCCO1 34a_100000087154_100000183996 [0,1,0,0,0,1|2,0,0]=4 6385 B14R1.6454 CC(C)NC(=O)COC[C@H]1CCCN1 34a_100000745186_100000183996 [0,1,0,0,0,1|2,0,0]=4 6386 B14R1.6454 CC(C)NC(=O)CSCC1CCCO1 11a_100138425928_100000217298 [0,1,0,0,0,1|1,1,0]=4 6387 B14R1.6454 CC(C)NC(=O)CSCC1CCCO1 1626a_100138425928_100000217298 [0,1,0,0,0,1|1,1,0]=4 6388 B14R1.6454 CC(C)NC(=O)CSCC1CCCO1 240690a_100138425928_100000217298 [0,1,0,0,0,1|1,1,0]=4 6389 B14R1.6454 CC(C)NC(=O)CSCC1CCCO1 527a_100138425928_100000217298 [0,1,0,0,0,1|1,1,0]=4 6390 B14R1.6454 CC(C)NC(=O)CSCC1CCCO1 62a_100000183996_100000203698 [0,1,0,0,0,1|1,1,0]=4 6391 B14R1.6454 CC(C)NC(=O)CSCC1CCCO1 62a_100000203698_100000183996 [0,1,0,0,0,1|1,1,0]=4 6392 B14R1.6454 CC(C)OC(=O)CNC[C@@H]1CCCO1 2230a_100020590478_100011215430 [0,1,0,0,0,1|2,0,0]=4 6393 B14R1.6454 CC(C)OC(=O)CNC[C@@H]1CCCO1 34a_100020590478_100011215430 [0,1,0,0,0,1|2,0,0]=4 6394 B14R1.6454 CC(C)OC(=O)COCC1CCCC1 34a_100000742336_100011215430 [0,1,0,0,0,1|2,0,0]=4 6395 B14R1.6454 CC(C)OC(=O)COCC1CCCC1 7a_100000742336_100011215430 [0,1,0,0,0,1|2,0,0]=4 6396 B14R1.6454 CC(C)OC(=O)COCC1CCCO1 34a_100000210270_100011215430 [0,1,0,0,0,1|1,0,0]=3 6397 B14R1.6454 CC(C)OC(=O)COCC1CCCO1 7a_100000210270_100011215430 [0,1,0,0,0,1|1,0,0]=3 6398 B14R1.6454 CC(C)OC(=O)COCC1COCO1 34a_100011216627_100011215430 [0,1,0,0,0,1|2,0,0]=4 6399 B14R1.6454 CC(C)OC(=O)COCC1OCCO1 34a_100000087154_100011215430 [0,1,0,0,0,1|2,0,0]=4 6400 B14R1.6454 CC(C)OC(=O)COC[C@H]1CCCN1 34a_100000745186_100011215430 [0,1,0,0,0,1|2,0,0]=4 6401 B14R1.6454 CC(C)OC(=O)CSCC1CCCO1 62a_100000203698_100011215430 [0,1,0,0,0,1|1,1,0]=4 6402 B14R1.6454 CC(C)OC(=O)CSCC1CCCO1 62a_100011215430_100000203698 [0,1,0,0,0,1|1,1,0]=4 6403 B14R1.6454 CC(C)OC(=O)OCSC1CCCC1 62a_100000003507_100000179811 [0,1,0,0,0,1|2,0,0]=4 6404 B14R1.6454 CC(C)OC(=O)OCSC1CCCC1 62a_100011217020_100000003507 [0,1,0,0,0,1|2,0,0]=4 6405 B14R1.6454 CC(O)CC(=O)COCC1CCCO1 1458a_100011223388_100011218427 [0,1,0,0,0,1|0,0,0]=2 6406 B14R1.6454 CC(O)CC(=O)CSCC1CCCO1 1458a_100000217298_100011218427 [0,1,0,0,0,1|0,1,0]=3 6407 B14R1.6454 C[C@@H](O)CC(=O)CCCC1CCCC1 1458a_100011933948_100011713738 [0,1,0,0,0,1|2,0,0]=4 6408 B14R1.6454 C[C@@H](O)CC(=O)CCCC1OCCO1 1458a_100011933948_100000042513 [0,1,0,0,0,1|2,0,0]=4 6409 B14R1.6454 C[C@@H](O)CC(=O)NCCC1CCCC1 240690a_100000739158_100011933948 [0,1,0,0,0,1|2,0,0]=4 6410 B14R1.6454 C[C@@H](O)CC(=O)NCCC1OCCO1 240690a_100000034215_100011933948 [0,1,0,0,0,1|2,0,0]=4 6411 B14R1.6454 NC(=O)CC(=O)COCC1CCCO1 1458a_100011223388_100000187820 [0,1,0,0,0,1|1,0,1]=4 6412 B14R1.6454 O=C(COCC1CCCO1)CC(F)F 1458a_100011223388_100011934356 [0,1,0,0,0,1|1,0,0]=3 6413 B14R1.6454 O=C(COCC1CCCO1)C[N+](=O)[O-] 1458a_100011223388_100000761209 [0,1,0,0,0,1|2,0,0]=4 6414 B14R1.6454 O=C(CSCC1CCCO1)CC(F)F 1458a_100000217298_100011934356 [0,1,0,0,0,1|1,1,0]=4 6415 B14R1.6454 O=C([O-])CC(=O)COCC1CCCO1 1458a_100011223388_100020667443 [0,1,0,0,0,1|1,0,1]=4 6416 B14R1.6715 CCCC(C)(C)COCC1CCCO1 7a_100011995695_100000203698 [0,1,0,0,0,1|1,0,1]=4 6417 B14R1.137 C#CCCC(=O)NC(C)C1CCCO1 11a_100025754208_100000692101 [0,2,0,0,0,0|1,0,1]=4 6418 B14R1.137 C#CCCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000692101 [0,2,0,0,0,0|1,0,1]=4 6419 B14R1.137 C#CCCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000692101 [0,2,0,0,0,0|1,0,1]=4 6420 B14R1.137 C#CCCC(=O)NC(C)C1CCCO1 527a_100025754208_100000692101 [0,2,0,0,0,0|1,0,1]=4 6421 B14R1.137 C=CCCC(=O)NC(C)C1CCCO1 11a_100025754208_100000749702 [0,2,0,0,0,0|1,0,1]=4 6422 B14R1.137 C=CCCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000749702 [0,2,0,0,0,0|1,0,1]=4 6423 B14R1.137 C=CCCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000749702 [0,2,0,0,0,0|1,0,1]=4 6424 B14R1.137 C=CCCC(=O)NC(C)C1CCCO1 527a_100025754208_100000749702 [0,2,0,0,0,0|1,0,1]=4 6425 B14R1.137 CC(NC(=O)CCC#N)C1CCCO1 11a_100025754208_100011934036 [0,2,0,0,0,0|1,0,1]=4 6426 B14R1.137 CC(NC(=O)CCC#N)C1CCCO1 1626a_100025754208_100011934036 [0,2,0,0,0,0|1,0,1]=4 6427 B14R1.137 CC(NC(=O)CCC#N)C1CCCO1 240690a_100025754208_100011934036 [0,2,0,0,0,0|1,0,1]=4 6428 B14R1.137 CC(NC(=O)CCC#N)C1CCCO1 527a_100025754208_100011934036 [0,2,0,0,0,0|1,0,1]=4 6429 B14R1.137 CC(NC(=O)NCCF)C1CCCO1 2708a_100025754208_100000724931 [0,2,0,0,0,0|2,0,0]=4 6430 B14R1.137 CC(NC(=O)NCCF)C1CCCO1 273464a_100000724931_100025754208 [0,2,0,0,0,0|2,0,0]=4 6431 B14R1.137 CC(NC(=O)NCCF)C1CCCO1 273464a_100025754208_100000724931 [0,2,0,0,0,0|2,0,0]=4 6432 B14R1.137 CC(NC(=O)NCCF)C1CCCO1 512a_100025754208_100000724931 [0,2,0,0,0,0|2,0,0]=4 6433 B14R1.137 CC(NC(=O)NCCO)C1CCCO1 2708a_100025754208_100000210304 [0,2,0,0,0,0|2,0,0]=4 6434 B14R1.137 CC(NC(=O)NCCO)C1CCCO1 273464a_100000210304_100025754208 [0,2,0,0,0,0|2,0,0]=4 6435 B14R1.137 CC(NC(=O)NCCO)C1CCCO1 273464a_100025754208_100000210304 [0,2,0,0,0,0|2,0,0]=4 6436 B14R1.137 CC(NC(=O)NCCO)C1CCCO1 512a_100025754208_100000210304 [0,2,0,0,0,0|2,0,0]=4 6437 B14R1.137 CC=CCC(=O)NC(C)C1CCCO1 11a_100025754208_100121576822 [0,2,0,0,0,0|1,0,1]=4 6438 B14R1.137 CC=CCC(=O)NC(C)C1CCCO1 1626a_100025754208_100121576822 [0,2,0,0,0,0|1,0,1]=4 6439 B14R1.137 CC=CCC(=O)NC(C)C1CCCO1 240690a_100025754208_100121576822 [0,2,0,0,0,0|1,0,1]=4 6440 B14R1.137 CC=CCC(=O)NC(C)C1CCCO1 527a_100025754208_100121576822 [0,2,0,0,0,0|1,0,1]=4 6441 B14R1.137 CCC=CC(=O)NC(C)C1CCCO1 11a_100025754208_100000212282 [0,2,0,0,0,0|1,0,1]=4 6442 B14R1.137 CCC=CC(=O)NC(C)C1CCCO1 1626a_100025754208_100000212282 [0,2,0,0,0,0|1,0,1]=4 6443 B14R1.137 CCC=CC(=O)NC(C)C1CCCO1 240690a_100025754208_100000212282 [0,2,0,0,0,0|1,0,1]=4 6444 B14R1.137 CCCCC(=O)NC(C)C1CCCC1 11a_100015185923_100000210183 [0,2,0,0,0,0|2,0,0]=4 6445 B14R1.137 CCCCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000210183 [0,2,0,0,0,0|2,0,0]=4 6446 B14R1.137 CCCCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000210183 [0,2,0,0,0,0|2,0,0]=4 6447 B14R1.137 CCCCC(=O)NC(C)C1CCCC1 527a_100015185923_100000210183 [0,2,0,0,0,0|2,0,0]=4 6448 B14R1.137 CCCCC(=O)NC(C)C1CCCO1 11a_100025754208_100000210183 [0,2,0,0,0,0|1,0,0]=3 6449 B14R1.137 CCCCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000210183 [0,2,0,0,0,0|1,0,0]=3 6450 B14R1.137 CCCCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000210183 [0,2,0,0,0,0|1,0,0]=3 6451 B14R1.137 CCCCC(=O)NC(C)C1CCCO1 527a_100025754208_100000210183 [0,2,0,0,0,0|1,0,0]=3 6452 B14R1.137 CCCNC(=O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100000183358 [0,2,0,0,0,0|1,0,1]=4 6453 B14R1.137 CCCNC(=O)NC(C)C1CCCC1 2708a_100015185923_100020643023 [0,2,0,0,0,0|2,0,0]=4 6454 B14R1.137 CCCNC(=O)NC(C)C1CCCC1 2708a_100020643023_100015185923 [0,2,0,0,0,0|2,0,0]=4 6455 B14R1.137 CCCNC(=O)NC(C)C1CCCC1 273464a_100015185923_100020643023 [0,2,0,0,0,0|2,0,0]=4 6456 B14R1.137 CCCNC(=O)NC(C)C1CCCC1 273464a_100020643023_100015185923 [0,2,0,0,0,0|2,0,0]=4 6457 B14R1.137 CCCNC(=O)NC(C)C1CCCC1 512a_100015185923_100020643023 [0,2,0,0,0,0|2,0,0]=4 6458 B14R1.137 CCCNC(=O)NC(C)C1CCCC1 512a_100020643023_100015185923 [0,2,0,0,0,0|2,0,0]=4 6459 B14R1.137 CCCNC(=O)NC(C)C1CCCO1 2708a_100020643023_100025754208 [0,2,0,0,0,0|1,0,0]=3 6460 B14R1.137 CCCNC(=O)NC(C)C1CCCO1 2708a_100025754208_100020643023 [0,2,0,0,0,0|1,0,0]=3 6461 B14R1.137 CCCNC(=O)NC(C)C1CCCO1 273464a_100020643023_100025754208 [0,2,0,0,0,0|1,0,0]=3 6462 B14R1.137 CCCNC(=O)NC(C)C1CCCO1 273464a_100025754208_100020643023 [0,2,0,0,0,0|1,0,0]=3 6463 B14R1.137 CCCNC(=O)NC(C)C1CCCO1 512a_100020643023_100025754208 [0,2,0,0,0,0|1,0,0]=3 6464 B14R1.137 CCCNC(=O)NC(C)C1CCCO1 512a_100025754208_100020643023 [0,2,0,0,0,0|1,0,0]=3 6465 B14R1.137 CCCOC(=O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_200011215008 [0,2,0,0,0,0|1,0,1]=4 6466 B14R1.137 CCNNC(=O)NC(C)C1CCCO1 273464a_100025754208_100000756455 [0,2,0,0,0,0|2,0,0]=4 6467 B14R1.137 CCNNC(=O)NC(C)C1CCCO1 512a_100000756455_100025754208 [0,2,0,0,0,0|2,0,0]=4 6468 B14R1.137 CCNNC(=O)NC(C)C1CCCO1 512a_100025754208_100000756455 [0,2,0,0,0,0|2,0,0]=4 6469 B14R1.137 CCOCC(=O)NC(C)C1CCCC1 11a_100015185923_100000211967 [0,2,0,0,0,0|2,0,0]=4 6470 B14R1.137 CCOCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000211967 [0,2,0,0,0,0|2,0,0]=4 6471 B14R1.137 CCOCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000211967 [0,2,0,0,0,0|2,0,0]=4 6472 B14R1.137 CCOCC(=O)NC(C)C1CCCC1 527a_100015185923_100000211967 [0,2,0,0,0,0|2,0,0]=4 6473 B14R1.137 CCOCC(=O)NC(C)C1CCCO1 11a_100025754208_100000211967 [0,2,0,0,0,0|1,0,0]=3 6474 B14R1.137 CCOCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000211967 [0,2,0,0,0,0|1,0,0]=3 6475 B14R1.137 CCOCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000211967 [0,2,0,0,0,0|1,0,0]=3 6476 B14R1.137 CCOCC(=O)NC(C)C1CCCO1 527a_100025754208_100000211967 [0,2,0,0,0,0|1,0,0]=3 6477 B14R1.137 CCSCC(=O)NC(C)C1CCCC1 11a_100015185923_100000230394 [0,2,0,0,0,0|2,0,0]=4 6478 B14R1.137 CCSCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000230394 [0,2,0,0,0,0|2,0,0]=4 6479 B14R1.137 CCSCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000230394 [0,2,0,0,0,0|2,0,0]=4 6480 B14R1.137 CCSCC(=O)NC(C)C1CCCC1 527a_100015185923_100000230394 [0,2,0,0,0,0|2,0,0]=4 6481 B14R1.137 CCSCC(=O)NC(C)C1CCCO1 11a_100025754208_100000230394 [0,2,0,0,0,0|1,0,0]=3 6482 B14R1.137 CCSCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000230394 [0,2,0,0,0,0|1,0,0]=3 6483 B14R1.137 CCSCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000230394 [0,2,0,0,0,0|1,0,0]=3 6484 B14R1.137 CCSCC(=O)NC(C)C1CCCO1 527a_100025754208_100000230394 [0,2,0,0,0,0|1,0,0]=3 6485 B14R1.137 COCCC(=O)NC(C)C1CCCC1 11a_100015185923_100000749529 [0,2,0,0,0,0|2,0,0]=4 6486 B14R1.137 COCCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000749529 [0,2,0,0,0,0|2,0,0]=4 6487 B14R1.137 COCCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000749529 [0,2,0,0,0,0|2,0,0]=4 6488 B14R1.137 COCCC(=O)NC(C)C1CCCC1 527a_100015185923_100000749529 [0,2,0,0,0,0|2,0,0]=4 6489 B14R1.137 COCCC(=O)NC(C)C1CCCO1 11a_100025754208_100000749529 [0,2,0,0,0,0|1,0,0]=3 6490 B14R1.137 COCCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000749529 [0,2,0,0,0,0|1,0,0]=3 6491 B14R1.137 COCCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000749529 [0,2,0,0,0,0|1,0,0]=3 6492 B14R1.137 COCCC(=O)NC(C)C1CCCO1 527a_100025754208_100000749529 [0,2,0,0,0,0|1,0,0]=3 6493 B14R1.137 CSCCC(=O)NC(C)C1CCCC1 11a_100015185923_100000174002 [0,2,0,0,0,0|2,0,0]=4 6494 B14R1.137 CSCCC(=O)NC(C)C1CCCC1 1626a_100015185923_100000174002 [0,2,0,0,0,0|2,0,0]=4 6495 B14R1.137 CSCCC(=O)NC(C)C1CCCC1 240690a_100015185923_100000174002 [0,2,0,0,0,0|2,0,0]=4 6496 B14R1.137 CSCCC(=O)NC(C)C1CCCC1 527a_100015185923_100000174002 [0,2,0,0,0,0|2,0,0]=4 6497 B14R1.137 CSCCC(=O)NC(C)C1CCCO1 11a_100025754208_100000174002 [0,2,0,0,0,0|1,0,0]=3 6498 B14R1.137 CSCCC(=O)NC(C)C1CCCO1 1626a_100025754208_100000174002 [0,2,0,0,0,0|1,0,0]=3 6499 B14R1.137 CSCCC(=O)NC(C)C1CCCO1 240690a_100025754208_100000174002 [0,2,0,0,0,0|1,0,0]=3 6500 B14R1.137 CSCCC(=O)NC(C)C1CCCO1 527a_100025754208_100000174002 [0,2,0,0,0,0|1,0,0]=3 6501 B14R1.475 CCCC(=O)N(C)C(C)C1CCCC1 11a_106630658171_100000211992 [0,2,0,0,0,0|2,0,0]=4 6502 B14R1.475 CCCC(=O)N(C)C(C)C1CCCC1 1626a_106630658171_100000211992 [0,2,0,0,0,0|2,0,0]=4 6503 B14R1.475 CCCC(=O)N(C)C(C)C1CCCC1 240690a_106630658171_100000211992 [0,2,0,0,0,0|2,0,0]=4 6504 B14R1.475 CCCC(=O)N(C)C(C)C1CCCC1 527a_106630658171_100000211992 [0,2,0,0,0,0|2,0,0]=4 6505 B14R1.720 CC(NC(=O)C(O)CO)C1CCCO1 240690a_100025754208_100011215603 [0,2,0,0,0,0|2,0,0]=4 6506 B14R1.720 CCC(C)C(=O)NC(C)C1CCCC1 11a_100015185923_100011192722 [0,2,0,0,0,0|2,0,0]=4 6507 B14R1.720 CCC(C)C(=O)NC(C)C1CCCC1 1626a_100015185923_100011192722 [0,2,0,0,0,0|2,0,0]=4 6508 B14R1.720 CCC(C)C(=O)NC(C)C1CCCC1 240690a_100015185923_100011192722 [0,2,0,0,0,0|2,0,0]=4 6509 B14R1.720 CCC(C)C(=O)NC(C)C1CCCC1 527a_100015185923_100011192722 [0,2,0,0,0,0|2,0,0]=4 6510 B14R1.720 CCC(C)C(=O)NC(C)C1CCCO1 11a_100025754208_100011192722 [0,2,0,0,0,0|1,0,0]=3 6511 B14R1.720 CCC(C)C(=O)NC(C)C1CCCO1 1626a_100025754208_100011192722 [0,2,0,0,0,0|1,0,0]=3 6512 B14R1.720 CCC(C)C(=O)NC(C)C1CCCO1 240690a_100025754208_100011192722 [0,2,0,0,0,0|1,0,0]=3 6513 B14R1.720 CCC(C)C(=O)NC(C)C1CCCO1 527a_100025754208_100011192722 [0,2,0,0,0,0|1,0,0]=3 6514 B14R1.720 CCC(O)C(=O)NC(C)C1CCCC1 240690a_100015185923_100011196387 [0,2,0,0,0,0|2,0,0]=4 6515 B14R1.720 CCC(O)C(=O)NC(C)C1CCCO1 240690a_100025754208_100011196387 [0,2,0,0,0,0|1,0,0]=3 6516 B14R1.720 CCN(C)C(=O)NC(C)C1CCCO1 2708a_100025754208_100000225621 [0,2,0,0,0,0|2,0,0]=4 6517 B14R1.720 CCN(C)C(=O)NC(C)C1CCCO1 273464a_100025754208_100000225621 [0,2,0,0,0,0|2,0,0]=4 6518 B14R1.720 COC(C)C(=O)NC(C)C1CCCO1 11a_100025754208_100000743197 [0,2,0,0,0,0|2,0,0]=4 6519 B14R1.720 COC(C)C(=O)NC(C)C1CCCO1 1626a_100025754208_100000743197 [0,2,0,0,0,0|2,0,0]=4 6520 B14R1.720 COC(C)C(=O)NC(C)C1CCCO1 240690a_100025754208_100000743197 [0,2,0,0,0,0|2,0,0]=4 6521 B14R1.720 COC(C)C(=O)NC(C)C1CCCO1 527a_100025754208_100000743197 [0,2,0,0,0,0|2,0,0]=4 6522 B14R1.720 CSC(C)C(=O)NC(C)C1CCCO1 11a_100025754208_100000149566 [0,2,0,0,0,0|2,0,0]=4 6523 B14R1.720 CSC(C)C(=O)NC(C)C1CCCO1 1626a_100025754208_100000149566 [0,2,0,0,0,0|2,0,0]=4 6524 B14R1.720 CSC(C)C(=O)NC(C)C1CCCO1 240690a_100025754208_100000149566 [0,2,0,0,0,0|2,0,0]=4 6525 B14R1.720 CSC(C)C(=O)NC(C)C1CCCO1 527a_100025754208_100000149566 [0,2,0,0,0,0|2,0,0]=4 6526 B14R1.807 CC(C)CC(=O)NC(C)C1CCCC1 11a_100015185923_100000210554 [0,2,0,0,0,0|2,0,0]=4 6527 B14R1.807 CC(C)CC(=O)NC(C)C1CCCC1 1626a_100015185923_100000210554 [0,2,0,0,0,0|2,0,0]=4 6528 B14R1.807 CC(C)CC(=O)NC(C)C1CCCC1 240690a_100015185923_100000210554 [0,2,0,0,0,0|2,0,0]=4 6529 B14R1.807 CC(C)CC(=O)NC(C)C1CCCC1 527a_100015185923_100000210554 [0,2,0,0,0,0|2,0,0]=4 6530 B14R1.807 CC(C)CC(=O)NC(C)C1CCCO1 11a_100025754208_100000210554 [0,2,0,0,0,0|1,0,0]=3 6531 B14R1.807 CC(C)CC(=O)NC(C)C1CCCO1 1626a_100025754208_100000210554 [0,2,0,0,0,0|1,0,0]=3 6532 B14R1.807 CC(C)CC(=O)NC(C)C1CCCO1 240690a_100025754208_100000210554 [0,2,0,0,0,0|1,0,0]=3 6533 B14R1.807 CC(C)CC(=O)NC(C)C1CCCO1 527a_100025754208_100000210554 [0,2,0,0,0,0|1,0,0]=3 6534 B14R1.807 CC(C)NC(=O)NC(C)C1CCCO1 2708a_100025754208_100138425928 [0,2,0,0,0,0|2,0,0]=4 6535 B14R1.807 CC(C)NC(=O)NC(C)C1CCCO1 2708a_100138425928_100025754208 [0,2,0,0,0,0|2,0,0]=4 6536 B14R1.807 CC(C)NC(=O)NC(C)C1CCCO1 273464a_100138425928_100025754208 [0,2,0,0,0,0|2,0,0]=4 6537 B14R1.807 CC(C)NC(=O)NC(C)C1CCCO1 512a_100025754208_100138425928 [0,2,0,0,0,0|2,0,0]=4 6538 B14R1.807 CC(C)NC(=O)NC(C)C1CCCO1 512a_100138425928_100025754208 [0,2,0,0,0,0|2,0,0]=4 6539 B14R1.807 CC(NC(=O)CN(C)C)C1CCCO1 11a_100025754208_100000750896 [0,2,0,0,0,0|2,0,0]=4 6540 B14R1.807 CC(NC(=O)CN(C)C)C1CCCO1 240690a_100025754208_100000750896 [0,2,0,0,0,0|2,0,0]=4 6541 B14R1.807 CC(NC(=O)CN(C)C)C1CCCO1 527a_100025754208_100000750896 [0,2,0,0,0,0|2,0,0]=4 6542 B14R1.807 CC(NC(=O)C[C@@H](C)O)C1CCCC1 240690a_100015185923_100011933948 [0,2,0,0,0,0|2,0,0]=4 6543 B14R1.807 CC(NC(=O)C[C@@H](C)O)C1CCCO1 240690a_100025754208_100011933948 [0,2,0,0,0,0|1,0,0]=3 6544 B14R1.807 CC(NC(=O)C[S+](C)C)C1CCCO1 11a_100025754208_200159257847 [0,2,0,0,0,0|2,0,0]=4 6545 B14R1.807 CC(NC(=O)C[S+](C)C)C1CCCO1 1626a_100025754208_200159257847 [0,2,0,0,0,0|2,0,0]=4 6546 B14R1.807 CC(NC(=O)C[S+](C)C)C1CCCO1 240690a_100025754208_200159257847 [0,2,0,0,0,0|2,0,0]=4 6547 B14R1.807 CC(NC(=O)C[S+](C)C)C1CCCO1 527a_100025754208_200159257847 [0,2,0,0,0,0|2,0,0]=4 6548 B14R1.951 CCCC(=O)NC(C#N)C1CCCC1 11a_100000767069_100000211992 [0,2,0,0,0,0|2,0,0]=4 6549 B14R1.951 CCCC(=O)NC(C#N)C1CCCC1 1626a_100000767069_100000211992 [0,2,0,0,0,0|2,0,0]=4 6550 B14R1.951 CCCC(=O)NC(C#N)C1CCCC1 240690a_100000767069_100000211992 [0,2,0,0,0,0|2,0,0]=4 6551 B14R1.951 CCCC(=O)NC(C#N)C1CCCC1 527a_100000767069_100000211992 [0,2,0,0,0,0|2,0,0]=4 6552 B14R1.6822 CCCS(=O)(=O)NC(C)C1CCCO1 270084a_100025754208_100000211391 [0,2,0,0,0,0|2,0,0]=4 6553 B14R1.6822 CCCS(=O)(=O)NC(C)C1CCCO1 274078a_100025754208_100000211391 [0,2,0,0,0,0|2,0,0]=4 6554 B14R1.6822 CCCS(=O)(=O)NC(C)C1CCCO1 40a_100025754208_100000054278 [0,2,0,0,0,0|2,0,0]=4 6555 B14R1.10078 CCCC(=O)CC(=O)C1(CCCO1)C 1458a_100000684770_100000747444 [0,2,0,0,0,0|1,0,1]=4 6556 B14R1.155 CCCOC(=O)OCN1CCC(C1)O 269982a_100011215560_200000139673 [0,2,0,0,0,0|2,0,0]=4 6557 B14R1.155 CCCOC(=O)OCN1CC[C@@H](C1)F 269982a_100015203821_200000139673 [0,2,0,0,0,0|2,0,0]=4 6558 B14R1.155 CCCOC(=O)OCN1CC[C@@H](C1)F 34a_100015203821_200000139673 [0,2,0,0,0,0|2,0,0]=4 6559 B14R1.155 CCCOC(=O)OCN1CC[C@H](C1)C 269982a_100016987628_200000139673 [0,2,0,0,0,0|2,0,0]=4 6560 B14R1.155 CCCOC(=O)OCN1CC[C@H](C1)C 34a_100016987628_200000139673 [0,2,0,0,0,0|2,0,0]=4 6561 B14R1.2612 CCCC(=O)NC[C@H]1COC(O1)(C)C 11a_100015982057_100000211992 [0,2,0,0,0,0|2,0,0]=4 6562 B14R1.2612 CCCC(=O)NC[C@H]1COC(O1)(C)C 1626a_100015982057_100000211992 [0,2,0,0,0,0|2,0,0]=4 6563 B14R1.2612 CCCC(=O)NC[C@H]1COC(O1)(C)C 240690a_100015982057_100000211992 [0,2,0,0,0,0|2,0,0]=4 6564 B14R1.2612 CCCC(=O)NC[C@H]1COC(O1)(C)C 527a_100015982057_100000211992 [0,2,0,0,0,0|2,0,0]=4 6565 B14R1.2612 CCCC(=O)OCN1CCC(C1)(C)C 2230a_100000764714_100000034017 [0,2,0,0,0,0|2,0,0]=4 6566 B14R1.2612 CCCC(=O)OCN1CCC(C1)(C)C 269982a_100000764714_100000034017 [0,2,0,0,0,0|2,0,0]=4 6567 B14R1.2612 CCCC(=O)OCN1CCC(C1)(C)O 2230a_100000718628_100000034017 [0,2,0,0,0,0|2,0,0]=4 6568 B14R1.2612 CCCC(=O)OCN1CCC(C1)(C)O 269982a_100000718628_100000034017 [0,2,0,0,0,0|2,0,0]=4 6569 B14R1.2612 CCCC(=O)OCN1CCC(C1)(F)F 2230a_100000697292_100000034017 [0,2,0,0,0,0|2,0,0]=4 6570 B14R1.2612 CCCC(=O)OCN1CCC(C1)(F)F 269982a_100000697292_100000034017 [0,2,0,0,0,0|2,0,0]=4 6571 B14R1.2612 CCCC(=O)OCN1CCC(C1)(F)F 34a_100000697292_100000034017 [0,2,0,0,0,0|2,0,0]=4 6572 B14R1.2613 CCCC(=O)CCC1CCC(C1)CC 1458a_200009887184_100000210303 [0,2,0,0,0,0|2,0,0]=4 6573 B14R1.2613 CCCC(=O)NC[C@@H]1CC[C@@H](C1)CO 240690a_206354213956_100000211992 [0,2,0,0,0,0|2,0,0]=4 6574 B14R1.2613 CCCC(=O)OCN1CCC(C1)C#N 2230a_100016989334_100000034017 [0,2,0,0,0,0|2,0,0]=4 6575 B14R1.2613 CCCC(=O)OCN1CCC(C1)CO 2230a_100000748654_100000034017 [0,2,0,0,0,0|2,0,0]=4 6576 B14R1.2613 CCCC(=O)OCN1CCC(C1)CO 269982a_100000748654_100000034017 [0,2,0,0,0,0|2,0,0]=4 6577 B14R1.2613 CCCC(=O)OCN1CCC(C1)CO 34a_100000748654_100000034017 [0,2,0,0,0,0|2,0,0]=4 6578 B14R1.2613 CCCC(=O)OCN1CC[C@H](C1)OC 2230a_100000766984_100000034017 [0,2,0,0,0,0|2,0,0]=4 6579 B14R1.2613 CCCC(=O)OCN1CC[C@H](C1)OC 269982a_100000766984_100000034017 [0,2,0,0,0,0|2,0,0]=4 6580 B14R1.3310 CCCC(=O)OCN1C[C@@H]([C@H](C1)F)O 2230a_100020590056_100000034017 [0,2,0,0,0,0|2,0,0]=4 6581 B14R1.3310 CCCC(=O)OCN1C[C@@H]([C@H](C1)F)O 269982a_100020590056_100000034017 [0,2,0,0,0,0|2,0,0]=4 6582 B14R1.3310 CCCC(=O)OCN1C[C@H]([C@H](C1)F)F 269982a_100103146936_100000034017 [0,2,0,0,0,0|2,0,0]=4 6583 B14R1.3310 CCCC(=O)OCN1C[C@H]([C@H](C1)F)F 34a_100103146936_100000034017 [0,2,0,0,0,0|2,0,0]=4 6584 B14R1.3310 CCCC(=O)OCN1C[C@H]([C@H](C1)O)C 2230a_200015306588_100000034017 [0,2,0,0,0,0|2,0,0]=4 6585 B14R1.3310 CCCC(=O)OCN1C[C@H]([C@H](C1)O)C 269982a_200015306588_100000034017 [0,2,0,0,0,0|2,0,0]=4 6586 B14R1.3310 CCCC(=O)OCN1C[C@H]([C@H](C1)O)O 2230a_100015207562_100000034017 [0,2,0,0,0,0|2,0,0]=4 6587 B14R1.3310 CCCC(=O)OCN1C[C@H]([C@H](C1)O)O 269982a_100015207562_100000034017 [0,2,0,0,0,0|2,0,0]=4 6588 B14R1.416 CC(C)CC(=O)N(C)CC1CCCO1 11a_100102946541_100000210554 [0,2,0,0,0,0|1,0,0]=3 6589 B14R1.416 CC(C)CC(=O)N(C)CC1CCCO1 1626a_100102946541_100000210554 [0,2,0,0,0,0|1,0,0]=3 6590 B14R1.416 CC(C)CC(=O)N(C)CC1CCCO1 240690a_100102946541_100000210554 [0,2,0,0,0,0|1,0,0]=3 6591 B14R1.416 CC(C)CC(=O)N(C)CC1CCCO1 527a_100102946541_100000210554 [0,2,0,0,0,0|1,0,0]=3 6592 B14R1.416 CC(C)CC(=O)N(C)CC1OCCO1 11a_200000032744_100000210554 [0,2,0,0,0,0|2,0,0]=4 6593 B14R1.416 CC(C)CC(=O)N(C)CC1OCCO1 1626a_200000032744_100000210554 [0,2,0,0,0,0|2,0,0]=4 6594 B14R1.416 CC(C)CC(=O)N(C)CC1OCCO1 527a_200000032744_100000210554 [0,2,0,0,0,0|2,0,0]=4 6595 B14R1.416 CC(C)NC(=O)C(=O)CC1CCCO1 1458a_100011220036_100000203698 [0,2,0,0,0,0|2,0,0]=4 6596 B14R1.416 CC(C)NC(=O)N(C)CC1CCCO1 2708a_100138425928_100102946541 [0,2,0,0,0,0|2,0,0]=4 6597 B14R1.416 CC(C)NC(=O)N(C)CC1CCCO1 273464a_100138425928_100102946541 [0,2,0,0,0,0|2,0,0]=4 6598 B14R1.416 CN(C)CC(=O)N(C)CC1CCCO1 11a_100102946541_100000750896 [0,2,0,0,0,0|2,0,0]=4 6599 B14R1.416 CN(C)CC(=O)N(C)CC1CCCO1 240690a_100102946541_100000750896 [0,2,0,0,0,0|2,0,0]=4 6600 B14R1.416 CN(C)CC(=O)N(C)CC1CCCO1 527a_100102946541_100000750896 [0,2,0,0,0,0|2,0,0]=4 6601 B14R1.416 CN(CC1CCCO1)C(=O)C[S+](C)C 11a_100102946541_200159257847 [0,2,0,0,0,0|2,0,0]=4 6602 B14R1.416 CN(CC1CCCO1)C(=O)C[S+](C)C 1626a_100102946541_200159257847 [0,2,0,0,0,0|2,0,0]=4 6603 B14R1.416 CN(CC1CCCO1)C(=O)C[S+](C)C 240690a_100102946541_200159257847 [0,2,0,0,0,0|2,0,0]=4 6604 B14R1.416 CN(CC1CCCO1)C(=O)C[S+](C)C 527a_100102946541_200159257847 [0,2,0,0,0,0|2,0,0]=4 6605 B14R1.416 C[C@@H](O)CC(=O)N(C)CC1CCCO1 240690a_100102946541_100011933948 [0,2,0,0,0,0|1,0,0]=3 6606 B14R1.454 C#CCCC(=O)N(C)CC1CCCO1 11a_100102946541_100000692101 [0,2,0,0,0,0|1,0,1]=4 6607 B14R1.454 C#CCCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000692101 [0,2,0,0,0,0|1,0,1]=4 6608 B14R1.454 C#CCCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000692101 [0,2,0,0,0,0|1,0,1]=4 6609 B14R1.454 C#CCCC(=O)N(C)CC1CCCO1 527a_100102946541_100000692101 [0,2,0,0,0,0|1,0,1]=4 6610 B14R1.454 C=CCCC(=O)N(C)CC1CCCO1 11a_100102946541_100000749702 [0,2,0,0,0,0|1,0,1]=4 6611 B14R1.454 C=CCCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000749702 [0,2,0,0,0,0|1,0,1]=4 6612 B14R1.454 C=CCCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000749702 [0,2,0,0,0,0|1,0,1]=4 6613 B14R1.454 C=CCCC(=O)N(C)CC1CCCO1 527a_100102946541_100000749702 [0,2,0,0,0,0|1,0,1]=4 6614 B14R1.454 CC=CCC(=O)N(C)CC1CCCO1 11a_100102946541_100121576822 [0,2,0,0,0,0|1,0,1]=4 6615 B14R1.454 CC=CCC(=O)N(C)CC1CCCO1 1626a_100102946541_100121576822 [0,2,0,0,0,0|1,0,1]=4 6616 B14R1.454 CC=CCC(=O)N(C)CC1CCCO1 240690a_100102946541_100121576822 [0,2,0,0,0,0|1,0,1]=4 6617 B14R1.454 CC=CCC(=O)N(C)CC1CCCO1 527a_100102946541_100121576822 [0,2,0,0,0,0|1,0,1]=4 6618 B14R1.454 CCC/C=C(\C)/C(=O)CC1CCCO1 1458a_200020648666_100000203698 [0,2,0,0,0,0|2,0,0]=4 6619 B14R1.454 CCC=CC(=O)N(C)CC1CCCO1 11a_100102946541_100000212282 [0,2,0,0,0,0|1,0,1]=4 6620 B14R1.454 CCC=CC(=O)N(C)CC1CCCO1 1626a_100102946541_100000212282 [0,2,0,0,0,0|1,0,1]=4 6621 B14R1.454 CCC=CC(=O)N(C)CC1CCCO1 240690a_100102946541_100000212282 [0,2,0,0,0,0|1,0,1]=4 6622 B14R1.454 CCCCC(=O)N(C)CC1CCCO1 11a_100102946541_100000210183 [0,2,0,0,0,0|1,0,0]=3 6623 B14R1.454 CCCCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000210183 [0,2,0,0,0,0|1,0,0]=3 6624 B14R1.454 CCCCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000210183 [0,2,0,0,0,0|1,0,0]=3 6625 B14R1.454 CCCCC(=O)N(C)CC1CCCO1 527a_100102946541_100000210183 [0,2,0,0,0,0|1,0,0]=3 6626 B14R1.454 CCCCC(=O)N(C)CC1OCCO1 11a_200000032744_100000210183 [0,2,0,0,0,0|2,0,0]=4 6627 B14R1.454 CCCCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000210183 [0,2,0,0,0,0|2,0,0]=4 6628 B14R1.454 CCCCC(=O)N(C)CC1OCCO1 527a_200000032744_100000210183 [0,2,0,0,0,0|2,0,0]=4 6629 B14R1.454 CCCNC(=O)C(=O)CC1CCCC1 1458a_200011297150_100000740388 [0,2,0,0,0,0|2,0,0]=4 6630 B14R1.454 CCCNC(=O)C(=O)CC1CCCO1 1458a_200011297150_100000203698 [0,2,0,0,0,0|1,0,0]=3 6631 B14R1.454 CCCNC(=O)C(=O)CC1OCCO1 1458a_200011297150_100000755774 [0,2,0,0,0,0|2,0,0]=4 6632 B14R1.454 CCCNC(=O)C(C)OC1CCCO1 34a_100000085407_100000230305 [0,2,0,0,0,0|2,0,0]=4 6633 B14R1.454 CCCNC(=O)N(C)CC1CCCO1 2708a_100020643023_100102946541 [0,2,0,0,0,0|1,0,0]=3 6634 B14R1.454 CCCNC(=O)N(C)CC1CCCO1 273464a_100020643023_100102946541 [0,2,0,0,0,0|1,0,0]=3 6635 B14R1.454 CCCNC(=O)N(C)CC1OCCO1 2708a_100020643023_200000032744 [0,2,0,0,0,0|2,0,0]=4 6636 B14R1.454 CCCNC(=O)N(C)CC1OCCO1 273464a_100020643023_200000032744 [0,2,0,0,0,0|2,0,0]=4 6637 B14R1.454 CCCOC(=O)C(C)OC1CCCO1 34a_100000085407_100000760410 [0,2,0,0,0,0|2,0,0]=4 6638 B14R1.454 CCOCC(=O)N(C)CC1CCCO1 11a_100102946541_100000211967 [0,2,0,0,0,0|1,0,0]=3 6639 B14R1.454 CCOCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000211967 [0,2,0,0,0,0|1,0,0]=3 6640 B14R1.454 CCOCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000211967 [0,2,0,0,0,0|1,0,0]=3 6641 B14R1.454 CCOCC(=O)N(C)CC1CCCO1 527a_100102946541_100000211967 [0,2,0,0,0,0|1,0,0]=3 6642 B14R1.454 CCOCC(=O)N(C)CC1OCCO1 11a_200000032744_100000211967 [0,2,0,0,0,0|2,0,0]=4 6643 B14R1.454 CCOCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000211967 [0,2,0,0,0,0|2,0,0]=4 6644 B14R1.454 CCOCC(=O)N(C)CC1OCCO1 527a_200000032744_100000211967 [0,2,0,0,0,0|2,0,0]=4 6645 B14R1.454 CCSCC(=O)N(C)CC1CCCO1 11a_100102946541_100000230394 [0,2,0,0,0,0|1,0,0]=3 6646 B14R1.454 CCSCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000230394 [0,2,0,0,0,0|1,0,0]=3 6647 B14R1.454 CCSCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000230394 [0,2,0,0,0,0|1,0,0]=3 6648 B14R1.454 CCSCC(=O)N(C)CC1CCCO1 527a_100102946541_100000230394 [0,2,0,0,0,0|1,0,0]=3 6649 B14R1.454 CCSCC(=O)N(C)CC1OCCO1 11a_200000032744_100000230394 [0,2,0,0,0,0|2,0,0]=4 6650 B14R1.454 CCSCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000230394 [0,2,0,0,0,0|2,0,0]=4 6651 B14R1.454 CCSCC(=O)N(C)CC1OCCO1 527a_200000032744_100000230394 [0,2,0,0,0,0|2,0,0]=4 6652 B14R1.454 CN(CC1CCCO1)C(=O)CCC#N 11a_100102946541_100011934036 [0,2,0,0,0,0|1,0,1]=4 6653 B14R1.454 CN(CC1CCCO1)C(=O)CCC#N 1626a_100102946541_100011934036 [0,2,0,0,0,0|1,0,1]=4 6654 B14R1.454 CN(CC1CCCO1)C(=O)CCC#N 240690a_100102946541_100011934036 [0,2,0,0,0,0|1,0,1]=4 6655 B14R1.454 CN(CC1CCCO1)C(=O)CCC#N 527a_100102946541_100011934036 [0,2,0,0,0,0|1,0,1]=4 6656 B14R1.454 CN(CC1CCCO1)C(=O)NCCF 273464a_100000724931_100102946541 [0,2,0,0,0,0|2,0,0]=4 6657 B14R1.454 CN(CC1CCCO1)C(=O)NCCO 273464a_100000210304_100102946541 [0,2,0,0,0,0|2,0,0]=4 6658 B14R1.454 COCCC(=O)N(C)CC1CCCO1 11a_100102946541_100000749529 [0,2,0,0,0,0|1,0,0]=3 6659 B14R1.454 COCCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000749529 [0,2,0,0,0,0|1,0,0]=3 6660 B14R1.454 COCCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000749529 [0,2,0,0,0,0|1,0,0]=3 6661 B14R1.454 COCCC(=O)N(C)CC1CCCO1 527a_100102946541_100000749529 [0,2,0,0,0,0|1,0,0]=3 6662 B14R1.454 COCCC(=O)N(C)CC1OCCO1 11a_200000032744_100000749529 [0,2,0,0,0,0|2,0,0]=4 6663 B14R1.454 COCCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000749529 [0,2,0,0,0,0|2,0,0]=4 6664 B14R1.454 COCCC(=O)N(C)CC1OCCO1 527a_200000032744_100000749529 [0,2,0,0,0,0|2,0,0]=4 6665 B14R1.454 CSCCC(=O)N(C)CC1CCCO1 11a_100102946541_100000174002 [0,2,0,0,0,0|1,0,0]=3 6666 B14R1.454 CSCCC(=O)N(C)CC1CCCO1 1626a_100102946541_100000174002 [0,2,0,0,0,0|1,0,0]=3 6667 B14R1.454 CSCCC(=O)N(C)CC1CCCO1 240690a_100102946541_100000174002 [0,2,0,0,0,0|1,0,0]=3 6668 B14R1.454 CSCCC(=O)N(C)CC1CCCO1 527a_100102946541_100000174002 [0,2,0,0,0,0|1,0,0]=3 6669 B14R1.454 CSCCC(=O)N(C)CC1OCCO1 11a_200000032744_100000174002 [0,2,0,0,0,0|2,0,0]=4 6670 B14R1.454 CSCCC(=O)N(C)CC1OCCO1 1626a_200000032744_100000174002 [0,2,0,0,0,0|2,0,0]=4 6671 B14R1.454 CSCCC(=O)N(C)CC1OCCO1 527a_200000032744_100000174002 [0,2,0,0,0,0|2,0,0]=4 6672 B14R1.524 CCCC(=O)N(CC)CC1CCCO1 11a_100000186375_100000211992 [0,2,0,0,0,0|1,0,0]=3 6673 B14R1.524 CCCC(=O)N(CC)CC1CCCO1 1626a_100000186375_100000211992 [0,2,0,0,0,0|1,0,0]=3 6674 B14R1.524 CCCC(=O)N(CC)CC1CCCO1 240690a_100000186375_100000211992 [0,2,0,0,0,0|1,0,0]=3 6675 B14R1.524 CCCC(=O)N(CC)CC1CCCO1 527a_100000186375_100000211992 [0,2,0,0,0,0|1,0,0]=3 6676 B14R1.524 CCN(CC1CCCO1)C(=O)CCO 240690a_100000186375_100011216618 [0,2,0,0,0,0|2,0,0]=4 6677 B14R1.524 CCN(CC1CCCO1)C(=O)COC 11a_100000186375_100000210968 [0,2,0,0,0,0|2,0,0]=4 6678 B14R1.524 CCN(CC1CCCO1)C(=O)COC 1626a_100000186375_100000210968 [0,2,0,0,0,0|2,0,0]=4 6679 B14R1.524 CCN(CC1CCCO1)C(=O)COC 240690a_100000186375_100000210968 [0,2,0,0,0,0|2,0,0]=4 6680 B14R1.524 CCN(CC1CCCO1)C(=O)COC 527a_100000186375_100000210968 [0,2,0,0,0,0|2,0,0]=4 6681 B14R1.524 CCN(CC1CCCO1)C(=O)CSC 11a_100000186375_100000184570 [0,2,0,0,0,0|2,0,0]=4 6682 B14R1.524 CCN(CC1CCCO1)C(=O)CSC 1626a_100000186375_100000184570 [0,2,0,0,0,0|2,0,0]=4 6683 B14R1.524 CCN(CC1CCCO1)C(=O)CSC 240690a_100000186375_100000184570 [0,2,0,0,0,0|2,0,0]=4 6684 B14R1.524 CCN(CC1CCCO1)C(=O)CSC 527a_100000186375_100000184570 [0,2,0,0,0,0|2,0,0]=4 6685 B14R1.524 CCNC(=O)N(CC)CC1CCCO1 2708a_100015525214_100000186375 [0,2,0,0,0,0|2,0,0]=4 6686 B14R1.524 CCNC(=O)N(CC)CC1CCCO1 273464a_100015525214_100000186375 [0,2,0,0,0,0|2,0,0]=4 6687 B14R1.737 CCC(C)C(=O)N(C)CC1CCCO1 11a_100102946541_100011192722 [0,2,0,0,0,0|1,0,0]=3 6688 B14R1.737 CCC(C)C(=O)N(C)CC1CCCO1 1626a_100102946541_100011192722 [0,2,0,0,0,0|1,0,0]=3 6689 B14R1.737 CCC(C)C(=O)N(C)CC1CCCO1 240690a_100102946541_100011192722 [0,2,0,0,0,0|1,0,0]=3 6690 B14R1.737 CCC(C)C(=O)N(C)CC1CCCO1 527a_100102946541_100011192722 [0,2,0,0,0,0|1,0,0]=3 6691 B14R1.737 CCC(C)C(=O)N(C)CC1OCCO1 11a_200000032744_100011192722 [0,2,0,0,0,0|2,0,0]=4 6692 B14R1.737 CCC(C)C(=O)N(C)CC1OCCO1 1626a_200000032744_100011192722 [0,2,0,0,0,0|2,0,0]=4 6693 B14R1.737 CCC(C)C(=O)N(C)CC1OCCO1 527a_200000032744_100011192722 [0,2,0,0,0,0|2,0,0]=4 6694 B14R1.737 CCC(O)C(=O)N(C)CC1CCCO1 240690a_100102946541_100011196387 [0,2,0,0,0,0|1,0,0]=3 6695 B14R1.737 CN(CC1CCCO1)C(=O)C(O)CO 240690a_100102946541_100011215603 [0,2,0,0,0,0|2,0,0]=4 6696 B14R1.737 COC(C)C(=O)N(C)CC1CCCO1 11a_100102946541_100000743197 [0,2,0,0,0,0|2,0,0]=4 6697 B14R1.737 COC(C)C(=O)N(C)CC1CCCO1 1626a_100102946541_100000743197 [0,2,0,0,0,0|2,0,0]=4 6698 B14R1.737 COC(C)C(=O)N(C)CC1CCCO1 240690a_100102946541_100000743197 [0,2,0,0,0,0|2,0,0]=4 6699 B14R1.737 COC(C)C(=O)N(C)CC1CCCO1 527a_100102946541_100000743197 [0,2,0,0,0,0|2,0,0]=4 6700 B14R1.737 CSC(C)C(=O)N(C)CC1CCCO1 11a_100102946541_100000149566 [0,2,0,0,0,0|2,0,0]=4 6701 B14R1.737 CSC(C)C(=O)N(C)CC1CCCO1 1626a_100102946541_100000149566 [0,2,0,0,0,0|2,0,0]=4 6702 B14R1.737 CSC(C)C(=O)N(C)CC1CCCO1 240690a_100102946541_100000149566 [0,2,0,0,0,0|2,0,0]=4 6703 B14R1.737 CSC(C)C(=O)N(C)CC1CCCO1 527a_100102946541_100000149566 [0,2,0,0,0,0|2,0,0]=4 6704 B14R1.6825 CCCS(=O)(=O)N(C)CC1CCCO1 270084a_100102946541_100000211391 [0,2,0,0,0,0|2,0,0]=4 6705 B14R1.6825 CCCS(=O)(=O)N(C)CC1CCCO1 274078a_100102946541_100000211391 [0,2,0,0,0,0|2,0,0]=4 6706 B14R1.6825 CCCS(=O)(=O)N(C)CC1CCCO1 40a_100102946541_100000054278 [0,2,0,0,0,0|2,0,0]=4 6707 B14R1.86 C#CCCCC(=O)CCC1CCCC1 1458a_100000211120_100000731252 [0,2,0,0,0,0|2,0,0]=4 6708 B14R1.86 C#CCCCC(=O)CCC1CCCC1 1458a_100000690238_100000760354 [0,2,0,0,0,0|2,0,0]=4 6709 B14R1.86 C#CCCCC(=O)CCC1CCCO1 1458a_100011247709_100000731252 [0,2,0,0,0,0|1,0,0]=3 6710 B14R1.86 C#CCCCC(=O)CCC1OCCO1 1458a_100000082924_100000731252 [0,2,0,0,0,0|2,0,0]=4 6711 B14R1.86 C#CCCCC(=O)CCC1OCCO1 1458a_100000690238_100000740749 [0,2,0,0,0,0|2,0,0]=4 6712 B14R1.86 C#CCCCC(=O)CCN1CCCO1 1458a_200015187630_100000731252 [0,2,0,0,0,0|2,0,0]=4 6713 B14R1.86 C#CCCCC(=O)NCC1CCCC1 11a_100000737975_100000690238 [0,2,0,0,0,0|2,0,0]=4 6714 B14R1.86 C#CCCCC(=O)NCC1CCCC1 1626a_100000737975_100000690238 [0,2,0,0,0,0|2,0,0]=4 6715 B14R1.86 C#CCCCC(=O)NCC1CCCC1 240690a_100000737975_100000690238 [0,2,0,0,0,0|2,0,0]=4 6716 B14R1.86 C#CCCCC(=O)NCC1CCCC1 527a_100000737975_100000690238 [0,2,0,0,0,0|2,0,0]=4 6717 B14R1.86 C#CCCCC(=O)NCC1OCCO1 11a_100000036311_100000690238 [0,2,0,0,0,0|2,0,0]=4 6718 B14R1.86 C#CCCCC(=O)NCC1OCCO1 1626a_100000036311_100000690238 [0,2,0,0,0,0|2,0,0]=4 6719 B14R1.86 C#CCCCC(=O)NCC1OCCO1 527a_100000036311_100000690238 [0,2,0,0,0,0|2,0,0]=4 6720 B14R1.86 C#CCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000690238 [0,2,0,0,0,0|1,0,0]=3 6721 B14R1.86 C#CCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000690238 [0,2,0,0,0,0|1,0,0]=3 6722 B14R1.86 C#CCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000690238 [0,2,0,0,0,0|1,0,0]=3 6723 B14R1.86 C#CCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000690238 [0,2,0,0,0,0|1,0,0]=3 6724 B14R1.86 C#CCCNC(=O)CCC1CCCO1 11a_100000755551_100011247709 [0,2,0,0,0,0|1,0,1]=4 6725 B14R1.86 C#CCCNC(=O)CCC1CCCO1 1626a_100000755551_100011247709 [0,2,0,0,0,0|1,0,1]=4 6726 B14R1.86 C#CCCNC(=O)CCC1CCCO1 240690a_100000755551_100011247709 [0,2,0,0,0,0|1,0,1]=4 6727 B14R1.86 C#CCCNC(=O)CCC1CCCO1 527a_100000755551_100011247709 [0,2,0,0,0,0|1,0,1]=4 6728 B14R1.86 C#CCCNC(=O)NC[C@@H]1CCCO1 2708a_100000755551_100020590478 [0,2,0,0,0,0|1,0,1]=4 6729 B14R1.86 C#CCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000755551 [0,2,0,0,0,0|1,0,1]=4 6730 B14R1.86 C#CCCNC(=O)NC[C@@H]1CCCO1 273464a_100000755551_100020590478 [0,2,0,0,0,0|1,0,1]=4 6731 B14R1.86 C#CCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000755551 [0,2,0,0,0,0|1,0,1]=4 6732 B14R1.86 C#CCCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000755551 [0,2,0,0,0,0|1,0,1]=4 6733 B14R1.86 C#CCOCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100011251226 [0,2,0,0,0,0|1,0,1]=4 6734 B14R1.86 C#CCOCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011251226 [0,2,0,0,0,0|1,0,1]=4 6735 B14R1.86 C#CCOCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100011251226 [0,2,0,0,0,0|1,0,1]=4 6736 B14R1.86 C#CCSCC(=O)NCC1CCCO1 62a_100000038162_100000182893 [0,2,0,0,0,0|1,0,1]=4 6737 B14R1.86 C=CCCCC(=O)CCC1CCCC1 1458a_100000211120_100000757094 [0,2,0,0,0,0|2,0,0]=4 6738 B14R1.86 C=CCCCC(=O)CCC1CCCC1 1458a_100000766728_100000760354 [0,2,0,0,0,0|2,0,0]=4 6739 B14R1.86 C=CCCCC(=O)CCC1CCCO1 1458a_100011247709_100000757094 [0,2,0,0,0,0|1,0,0]=3 6740 B14R1.86 C=CCCCC(=O)CCC1OCCO1 1458a_100000082924_100000757094 [0,2,0,0,0,0|2,0,0]=4 6741 B14R1.86 C=CCCCC(=O)CCC1OCCO1 1458a_100000766728_100000740749 [0,2,0,0,0,0|2,0,0]=4 6742 B14R1.86 C=CCCCC(=O)CCN1CCCO1 1458a_200015187630_100000757094 [0,2,0,0,0,0|2,0,0]=4 6743 B14R1.86 C=CCCCC(=O)NCC1CCCC1 11a_100000737975_100000766728 [0,2,0,0,0,0|2,0,0]=4 6744 B14R1.86 C=CCCCC(=O)NCC1CCCC1 1626a_100000737975_100000766728 [0,2,0,0,0,0|2,0,0]=4 6745 B14R1.86 C=CCCCC(=O)NCC1CCCC1 240690a_100000737975_100000766728 [0,2,0,0,0,0|2,0,0]=4 6746 B14R1.86 C=CCCCC(=O)NCC1CCCC1 527a_100000737975_100000766728 [0,2,0,0,0,0|2,0,0]=4 6747 B14R1.86 C=CCCCC(=O)NCC1OCCO1 11a_100000036311_100000766728 [0,2,0,0,0,0|2,0,0]=4 6748 B14R1.86 C=CCCCC(=O)NCC1OCCO1 1626a_100000036311_100000766728 [0,2,0,0,0,0|2,0,0]=4 6749 B14R1.86 C=CCCCC(=O)NCC1OCCO1 527a_100000036311_100000766728 [0,2,0,0,0,0|2,0,0]=4 6750 B14R1.86 C=CCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000766728 [0,2,0,0,0,0|1,0,0]=3 6751 B14R1.86 C=CCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000766728 [0,2,0,0,0,0|1,0,0]=3 6752 B14R1.86 C=CCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000766728 [0,2,0,0,0,0|1,0,0]=3 6753 B14R1.86 C=CCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000766728 [0,2,0,0,0,0|1,0,0]=3 6754 B14R1.86 C=CCCNC(=O)CCC1CCCO1 11a_100015191253_100011247709 [0,2,0,0,0,0|1,0,1]=4 6755 B14R1.86 C=CCCNC(=O)CCC1CCCO1 1626a_100015191253_100011247709 [0,2,0,0,0,0|1,0,1]=4 6756 B14R1.86 C=CCCNC(=O)CCC1CCCO1 240690a_100015191253_100011247709 [0,2,0,0,0,0|1,0,1]=4 6757 B14R1.86 C=CCCNC(=O)CCC1CCCO1 527a_100015191253_100011247709 [0,2,0,0,0,0|1,0,1]=4 6758 B14R1.86 C=CCCNC(=O)NC[C@@H]1CCCO1 2708a_100015191253_100020590478 [0,2,0,0,0,0|1,0,1]=4 6759 B14R1.86 C=CCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100015191253 [0,2,0,0,0,0|1,0,1]=4 6760 B14R1.86 C=CCCNC(=O)NC[C@@H]1CCCO1 273464a_100015191253_100020590478 [0,2,0,0,0,0|1,0,1]=4 6761 B14R1.86 C=CCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100015191253 [0,2,0,0,0,0|1,0,1]=4 6762 B14R1.86 C=CCCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100015191253 [0,2,0,0,0,0|1,0,1]=4 6763 B14R1.86 C=CCNCC(=O)NCC1CCCO1 2230a_100020586998_100000182893 [0,2,0,0,0,0|1,0,1]=4 6764 B14R1.86 C=CCSCC(=O)NCC1CCCO1 62a_100000182893_100000210623 [0,2,0,0,0,0|1,0,1]=4 6765 B14R1.86 C=CCSCC(=O)NCC1CCCO1 62a_100000210623_100000182893 [0,2,0,0,0,0|1,0,1]=4 6766 B14R1.86 C=CCSCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000230395 [0,2,0,0,0,0|1,0,1]=4 6767 B14R1.86 C=CCSCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000230395 [0,2,0,0,0,0|1,0,1]=4 6768 B14R1.86 C=CCSCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000230395 [0,2,0,0,0,0|1,0,1]=4 6769 B14R1.86 C=CCSCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000230395 [0,2,0,0,0,0|1,0,1]=4 6770 B14R1.86 C=COCCC(=O)CCC1CCCO1 1458a_100011247709_100000039644 [0,2,0,0,0,0|1,0,1]=4 6771 B14R1.86 CC#CCNC(=O)CCC1CCCO1 11a_100000685387_100011247709 [0,2,0,0,0,0|1,0,1]=4 6772 B14R1.86 CC#CCNC(=O)CCC1CCCO1 1626a_100000685387_100011247709 [0,2,0,0,0,0|1,0,1]=4 6773 B14R1.86 CC#CCNC(=O)CCC1CCCO1 527a_100000685387_100011247709 [0,2,0,0,0,0|1,0,1]=4 6774 B14R1.86 CC#CCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000685387 [0,2,0,0,0,0|1,0,1]=4 6775 B14R1.86 CC#CCNC(=O)NC[C@@H]1CCCO1 273464a_100000685387_100020590478 [0,2,0,0,0,0|1,0,1]=4 6776 B14R1.86 CC#CCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000685387 [0,2,0,0,0,0|1,0,1]=4 6777 B14R1.86 CC#CCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000685387 [0,2,0,0,0,0|1,0,1]=4 6778 B14R1.86 CC/C=C/CC(=O)CCC1CCCC1 1458a_100016274230_100000760354 [0,2,0,0,0,0|2,0,0]=4 6779 B14R1.86 CC/C=C/CC(=O)CCC1OCCO1 1458a_100016274230_100000740749 [0,2,0,0,0,0|2,0,0]=4 6780 B14R1.86 CC/C=C/CC(=O)NCC1CCCC1 11a_100000737975_100016274230 [0,2,0,0,0,0|2,0,0]=4 6781 B14R1.86 CC/C=C/CC(=O)NCC1CCCC1 1626a_100000737975_100016274230 [0,2,0,0,0,0|2,0,0]=4 6782 B14R1.86 CC/C=C/CC(=O)NCC1CCCC1 240690a_100000737975_100016274230 [0,2,0,0,0,0|2,0,0]=4 6783 B14R1.86 CC/C=C/CC(=O)NCC1CCCC1 527a_100000737975_100016274230 [0,2,0,0,0,0|2,0,0]=4 6784 B14R1.86 CC/C=C/CC(=O)NCC1OCCO1 11a_100000036311_100016274230 [0,2,0,0,0,0|2,0,0]=4 6785 B14R1.86 CC/C=C/CC(=O)NCC1OCCO1 1626a_100000036311_100016274230 [0,2,0,0,0,0|2,0,0]=4 6786 B14R1.86 CC/C=C/CC(=O)NCC1OCCO1 527a_100000036311_100016274230 [0,2,0,0,0,0|2,0,0]=4 6787 B14R1.86 CC/C=C/CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100016274230 [0,2,0,0,0,0|1,0,0]=3 6788 B14R1.86 CC/C=C/CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100016274230 [0,2,0,0,0,0|1,0,0]=3 6789 B14R1.86 CC/C=C/CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100016274230 [0,2,0,0,0,0|1,0,0]=3 6790 B14R1.86 CC/C=C/CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100016274230 [0,2,0,0,0,0|1,0,0]=3 6791 B14R1.86 CC/C=C\CC(=O)CCC1CCCC1 1458a_100000211120_100103147603 [0,2,0,0,0,0|2,0,0]=4 6792 B14R1.86 CC/C=C\CC(=O)CCC1CCCO1 1458a_100011247709_100103147603 [0,2,0,0,0,0|1,0,0]=3 6793 B14R1.86 CC/C=C\CC(=O)CCC1OCCO1 1458a_100000082924_100103147603 [0,2,0,0,0,0|2,0,0]=4 6794 B14R1.86 CC/C=C\CC(=O)CCN1CCCO1 1458a_200015187630_100103147603 [0,2,0,0,0,0|2,0,0]=4 6795 B14R1.86 CCC#CCC(=O)CCC1CCCC1 1458a_100000211120_100009813939 [0,2,0,0,0,0|2,0,0]=4 6796 B14R1.86 CCC#CCC(=O)CCC1CCCO1 1458a_100011247709_100009813939 [0,2,0,0,0,0|1,0,0]=3 6797 B14R1.86 CCC#CCC(=O)CCC1OCCO1 1458a_100000082924_100009813939 [0,2,0,0,0,0|2,0,0]=4 6798 B14R1.86 CCC#CCC(=O)CCN1CCCO1 1458a_200015187630_100009813939 [0,2,0,0,0,0|2,0,0]=4 6799 B14R1.86 CCC#CCC(C)OCC1CCCO1 7a_200000035118_100000203698 [0,2,0,0,0,0|1,0,1]=4 6800 B14R1.86 CCCC#CC(=O)CCC1CCCC1 1458a_200011218047_100000760354 [0,2,0,0,0,0|2,0,0]=4 6801 B14R1.86 CCCC#CC(=O)CCC1OCCO1 1458a_200011218047_100000740749 [0,2,0,0,0,0|2,0,0]=4 6802 B14R1.86 CCCC#CC(=O)NCC1CCCC1 240690a_100000737975_200011218047 [0,2,0,0,0,0|2,0,0]=4 6803 B14R1.86 CCCC#CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_200011218047 [0,2,0,0,0,0|1,0,0]=3 6804 B14R1.86 CCCC=CC(=O)CCC1CCCC1 1458a_100000212230_100000760354 [0,2,0,0,0,0|2,0,0]=4 6805 B14R1.86 CCCC=CC(=O)CCC1OCCO1 1458a_100000212230_100000740749 [0,2,0,0,0,0|2,0,0]=4 6806 B14R1.86 CCCC=CC(=O)NCC1CCCC1 11a_100000737975_100000212230 [0,2,0,0,0,0|2,0,0]=4 6807 B14R1.86 CCCC=CC(=O)NCC1CCCC1 1626a_100000737975_100000212230 [0,2,0,0,0,0|2,0,0]=4 6808 B14R1.86 CCCC=CC(=O)NCC1CCCC1 240690a_100000737975_100000212230 [0,2,0,0,0,0|2,0,0]=4 6809 B14R1.86 CCCC=CC(=O)NCC1OCCO1 11a_100000036311_100000212230 [0,2,0,0,0,0|2,0,0]=4 6810 B14R1.86 CCCC=CC(=O)NCC1OCCO1 1626a_100000036311_100000212230 [0,2,0,0,0,0|2,0,0]=4 6811 B14R1.86 CCCC=CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000212230 [0,2,0,0,0,0|1,0,0]=3 6812 B14R1.86 CCCC=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000212230 [0,2,0,0,0,0|1,0,0]=3 6813 B14R1.86 CCCC=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000212230 [0,2,0,0,0,0|1,0,0]=3 6814 B14R1.86 CCCCCC(=O)CCC1CCCC1 1458a_100000211120_100000210326 [0,2,0,0,0,0|2,0,0]=4 6815 B14R1.86 CCCCCC(=O)CCC1CCCC1 1458a_100000212188_100000760354 [0,2,0,0,0,0|2,0,0]=4 6816 B14R1.86 CCCCCC(=O)CCC1CCCO1 1458a_100011247709_100000210326 [0,2,0,0,0,0|1,0,0]=3 6817 B14R1.86 CCCCCC(=O)CCC1OCCO1 1458a_100000082924_100000210326 [0,2,0,0,0,0|2,0,0]=4 6818 B14R1.86 CCCCCC(=O)CCC1OCCO1 1458a_100000212188_100000740749 [0,2,0,0,0,0|2,0,0]=4 6819 B14R1.86 CCCCCC(=O)CCN1CCCO1 1458a_200015187630_100000210326 [0,2,0,0,0,0|2,0,0]=4 6820 B14R1.86 CCCCCC(=O)COC1CCCO1 34a_100000085407_200012276598 [0,2,0,0,0,0|2,0,0]=4 6821 B14R1.86 CCCCCC(=O)NCC1CCCC1 11a_100000737975_100000212188 [0,2,0,0,0,0|2,0,0]=4 6822 B14R1.86 CCCCCC(=O)NCC1CCCC1 1626a_100000737975_100000212188 [0,2,0,0,0,0|2,0,0]=4 6823 B14R1.86 CCCCCC(=O)NCC1CCCC1 240690a_100000737975_100000212188 [0,2,0,0,0,0|2,0,0]=4 6824 B14R1.86 CCCCCC(=O)NCC1CCCC1 527a_100000737975_100000212188 [0,2,0,0,0,0|2,0,0]=4 6825 B14R1.86 CCCCCC(=O)NCC1OCCO1 11a_100000036311_100000212188 [0,2,0,0,0,0|2,0,0]=4 6826 B14R1.86 CCCCCC(=O)NCC1OCCO1 1626a_100000036311_100000212188 [0,2,0,0,0,0|2,0,0]=4 6827 B14R1.86 CCCCCC(=O)NCC1OCCO1 527a_100000036311_100000212188 [0,2,0,0,0,0|2,0,0]=4 6828 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000212188 [0,2,0,0,0,0|1,0,0]=3 6829 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000212188 [0,2,0,0,0,0|1,0,0]=3 6830 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000212188 [0,2,0,0,0,0|1,0,0]=3 6831 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000212188 [0,2,0,0,0,0|1,0,0]=3 6832 B14R1.86 CCCCCC(C)OCC1CCCO1 34a_100000210270_200011218191 [0,2,0,0,0,0|1,0,1]=4 6833 B14R1.86 CCCCCC(C)OCC1CCCO1 7a_100000210270_200011218191 [0,2,0,0,0,0|1,0,1]=4 6834 B14R1.86 CCCCCC(C)OCC1CCCO1 7a_100011215632_100000203698 [0,2,0,0,0,0|1,0,1]=4 6835 B14R1.86 CCCCNC(=O)CCC1CCCC1 11a_100000102301_100000211120 [0,2,0,0,0,0|2,0,0]=4 6836 B14R1.86 CCCCNC(=O)CCC1CCCC1 1626a_100000102301_100000211120 [0,2,0,0,0,0|2,0,0]=4 6837 B14R1.86 CCCCNC(=O)CCC1CCCC1 240690a_100000102301_100000211120 [0,2,0,0,0,0|2,0,0]=4 6838 B14R1.86 CCCCNC(=O)CCC1CCCC1 527a_100000102301_100000211120 [0,2,0,0,0,0|2,0,0]=4 6839 B14R1.86 CCCCNC(=O)CCC1CCCO1 11a_100000102301_100011247709 [0,2,0,0,0,0|1,0,0]=3 6840 B14R1.86 CCCCNC(=O)CCC1CCCO1 1626a_100000102301_100011247709 [0,2,0,0,0,0|1,0,0]=3 6841 B14R1.86 CCCCNC(=O)CCC1CCCO1 240690a_100000102301_100011247709 [0,2,0,0,0,0|1,0,0]=3 6842 B14R1.86 CCCCNC(=O)CCC1CCCO1 527a_100000102301_100011247709 [0,2,0,0,0,0|1,0,0]=3 6843 B14R1.86 CCCCNC(=O)CCN1CCCO1 240690a_100000102301_200015187630 [0,2,0,0,0,0|2,0,0]=4 6844 B14R1.86 CCCCNC(=O)COC1CCCO1 34a_100000085407_100000182744 [0,2,0,0,0,0|2,0,0]=4 6845 B14R1.86 CCCCNC(=O)NCC1CCCC1 2708a_100000102301_100000737975 [0,2,0,0,0,0|2,0,0]=4 6846 B14R1.86 CCCCNC(=O)NCC1CCCC1 2708a_100000737975_100000102301 [0,2,0,0,0,0|2,0,0]=4 6847 B14R1.86 CCCCNC(=O)NCC1CCCC1 273464a_100000102301_100000737975 [0,2,0,0,0,0|2,0,0]=4 6848 B14R1.86 CCCCNC(=O)NCC1CCCC1 273464a_100000737975_100000102301 [0,2,0,0,0,0|2,0,0]=4 6849 B14R1.86 CCCCNC(=O)NCC1CCCC1 512a_100000102301_100000737975 [0,2,0,0,0,0|2,0,0]=4 6850 B14R1.86 CCCCNC(=O)NCC1CCCC1 512a_100000737975_100000102301 [0,2,0,0,0,0|2,0,0]=4 6851 B14R1.86 CCCCNC(=O)NCC1OCCO1 2708a_100000036311_100000102301 [0,2,0,0,0,0|2,0,0]=4 6852 B14R1.86 CCCCNC(=O)NCC1OCCO1 2708a_100000102301_100000036311 [0,2,0,0,0,0|2,0,0]=4 6853 B14R1.86 CCCCNC(=O)NCC1OCCO1 273464a_100000036311_100000102301 [0,2,0,0,0,0|2,0,0]=4 6854 B14R1.86 CCCCNC(=O)NCC1OCCO1 273464a_100000102301_100000036311 [0,2,0,0,0,0|2,0,0]=4 6855 B14R1.86 CCCCNC(=O)NCC1OCCO1 512a_100000036311_100000102301 [0,2,0,0,0,0|2,0,0]=4 6856 B14R1.86 CCCCNC(=O)NC[C@@H]1CCCO1 2708a_100000102301_100020590478 [0,2,0,0,0,0|1,0,0]=3 6857 B14R1.86 CCCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000102301 [0,2,0,0,0,0|1,0,0]=3 6858 B14R1.86 CCCCNC(=O)NC[C@@H]1CCCO1 273464a_100000102301_100020590478 [0,2,0,0,0,0|1,0,0]=3 6859 B14R1.86 CCCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000102301 [0,2,0,0,0,0|1,0,0]=3 6860 B14R1.86 CCCCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000102301 [0,2,0,0,0,0|1,0,0]=3 6861 B14R1.86 CCCCOC(=O)COC1CCCO1 34a_100000085407_100000211628 [0,2,0,0,0,0|2,0,0]=4 6862 B14R1.86 CCCNNC(=O)CCC1CCCC1 22a_100000740057_100000211120 [0,2,0,0,0,0|2,0,0]=4 6863 B14R1.86 CCCNNC(=O)CCC1CCCO1 22a_100000740057_100011247709 [0,2,0,0,0,0|1,0,0]=3 6864 B14R1.86 CCCNNC(=O)CCC1OCCO1 22a_100000740057_100000082924 [0,2,0,0,0,0|2,0,0]=4 6865 B14R1.86 CCCNNC(=O)NCC1CCCC1 273464a_100000737975_100000740057 [0,2,0,0,0,0|2,0,0]=4 6866 B14R1.86 CCCNNC(=O)NCC1CCCC1 512a_100000737975_100000740057 [0,2,0,0,0,0|2,0,0]=4 6867 B14R1.86 CCCNNC(=O)NCC1CCCC1 512a_100000740057_100000737975 [0,2,0,0,0,0|2,0,0]=4 6868 B14R1.86 CCCNNC(=O)NCC1OCCO1 273464a_100000036311_100000740057 [0,2,0,0,0,0|2,0,0]=4 6869 B14R1.86 CCCNNC(=O)NCC1OCCO1 512a_100000036311_100000740057 [0,2,0,0,0,0|2,0,0]=4 6870 B14R1.86 CCCNNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000740057 [0,2,0,0,0,0|1,0,0]=3 6871 B14R1.86 CCCNNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000740057 [0,2,0,0,0,0|1,0,0]=3 6872 B14R1.86 CCCOCC(=O)CCC1CCCC1 1458a_100000745993_100000760354 [0,2,0,0,0,0|2,0,0]=4 6873 B14R1.86 CCCOCC(=O)CCC1OCCO1 1458a_100000745993_100000740749 [0,2,0,0,0,0|2,0,0]=4 6874 B14R1.86 CCCOCC(=O)NCC1CCCC1 11a_100000737975_100000745993 [0,2,0,0,0,0|2,0,0]=4 6875 B14R1.86 CCCOCC(=O)NCC1CCCC1 1626a_100000737975_100000745993 [0,2,0,0,0,0|2,0,0]=4 6876 B14R1.86 CCCOCC(=O)NCC1CCCC1 240690a_100000737975_100000745993 [0,2,0,0,0,0|2,0,0]=4 6877 B14R1.86 CCCOCC(=O)NCC1CCCC1 527a_100000737975_100000745993 [0,2,0,0,0,0|2,0,0]=4 6878 B14R1.86 CCCOCC(=O)NCC1OCCO1 11a_100000036311_100000745993 [0,2,0,0,0,0|2,0,0]=4 6879 B14R1.86 CCCOCC(=O)NCC1OCCO1 1626a_100000036311_100000745993 [0,2,0,0,0,0|2,0,0]=4 6880 B14R1.86 CCCOCC(=O)NCC1OCCO1 527a_100000036311_100000745993 [0,2,0,0,0,0|2,0,0]=4 6881 B14R1.86 CCCOCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000745993 [0,2,0,0,0,0|1,0,0]=3 6882 B14R1.86 CCCOCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000745993 [0,2,0,0,0,0|1,0,0]=3 6883 B14R1.86 CCCOCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000745993 [0,2,0,0,0,0|1,0,0]=3 6884 B14R1.86 CCCOCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000745993 [0,2,0,0,0,0|1,0,0]=3 6885 B14R1.86 CCCSCC(=O)CCC1CCCC1 1458a_100000217233_100000760354 [0,2,0,0,0,0|2,0,0]=4 6886 B14R1.86 CCCSCC(=O)CCC1OCCO1 1458a_100000217233_100000740749 [0,2,0,0,0,0|2,0,0]=4 6887 B14R1.86 CCCSCC(=O)NCC1CCCC1 11a_100000737975_100000217233 [0,2,0,0,0,0|2,0,0]=4 6888 B14R1.86 CCCSCC(=O)NCC1CCCC1 1626a_100000737975_100000217233 [0,2,0,0,0,0|2,0,0]=4 6889 B14R1.86 CCCSCC(=O)NCC1CCCC1 240690a_100000737975_100000217233 [0,2,0,0,0,0|2,0,0]=4 6890 B14R1.86 CCCSCC(=O)NCC1CCCC1 527a_100000737975_100000217233 [0,2,0,0,0,0|2,0,0]=4 6891 B14R1.86 CCCSCC(=O)NCC1CCCO1 62a_100000182893_100000210303 [0,2,0,0,0,0|1,0,0]=3 6892 B14R1.86 CCCSCC(=O)NCC1CCCO1 62a_100000210303_100000182893 [0,2,0,0,0,0|1,0,0]=3 6893 B14R1.86 CCCSCC(=O)NCC1OCCO1 11a_100000036311_100000217233 [0,2,0,0,0,0|2,0,0]=4 6894 B14R1.86 CCCSCC(=O)NCC1OCCO1 1626a_100000036311_100000217233 [0,2,0,0,0,0|2,0,0]=4 6895 B14R1.86 CCCSCC(=O)NCC1OCCO1 527a_100000036311_100000217233 [0,2,0,0,0,0|2,0,0]=4 6896 B14R1.86 CCCSCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000217233 [0,2,0,0,0,0|1,0,0]=3 6897 B14R1.86 CCCSCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000217233 [0,2,0,0,0,0|1,0,0]=3 6898 B14R1.86 CCCSCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000217233 [0,2,0,0,0,0|1,0,0]=3 6899 B14R1.86 CCCSCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000217233 [0,2,0,0,0,0|1,0,0]=3 6900 B14R1.86 CCOC=CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100016266692 [0,2,0,0,0,0|1,0,1]=4 6901 B14R1.86 CCOC=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100016266692 [0,2,0,0,0,0|1,0,1]=4 6902 B14R1.86 CCOC=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100016266692 [0,2,0,0,0,0|1,0,1]=4 6903 B14R1.86 CCOCCC(=O)CCC1CCCC1 1458a_100000211120_100011215890 [0,2,0,0,0,0|2,0,0]=4 6904 B14R1.86 CCOCCC(=O)CCC1CCCC1 1458a_100000749530_100000760354 [0,2,0,0,0,0|2,0,0]=4 6905 B14R1.86 CCOCCC(=O)CCC1CCCO1 1458a_100011247709_100011215890 [0,2,0,0,0,0|1,0,0]=3 6906 B14R1.86 CCOCCC(=O)CCC1OCCO1 1458a_100000082924_100011215890 [0,2,0,0,0,0|2,0,0]=4 6907 B14R1.86 CCOCCC(=O)CCC1OCCO1 1458a_100000749530_100000740749 [0,2,0,0,0,0|2,0,0]=4 6908 B14R1.86 CCOCCC(=O)CCN1CCCO1 1458a_200015187630_100011215890 [0,2,0,0,0,0|2,0,0]=4 6909 B14R1.86 CCOCCC(=O)NCC1CCCC1 11a_100000737975_100000749530 [0,2,0,0,0,0|2,0,0]=4 6910 B14R1.86 CCOCCC(=O)NCC1CCCC1 1626a_100000737975_100000749530 [0,2,0,0,0,0|2,0,0]=4 6911 B14R1.86 CCOCCC(=O)NCC1CCCC1 240690a_100000737975_100000749530 [0,2,0,0,0,0|2,0,0]=4 6912 B14R1.86 CCOCCC(=O)NCC1CCCC1 527a_100000737975_100000749530 [0,2,0,0,0,0|2,0,0]=4 6913 B14R1.86 CCOCCC(=O)NCC1OCCO1 11a_100000036311_100000749530 [0,2,0,0,0,0|2,0,0]=4 6914 B14R1.86 CCOCCC(=O)NCC1OCCO1 1626a_100000036311_100000749530 [0,2,0,0,0,0|2,0,0]=4 6915 B14R1.86 CCOCCC(=O)NCC1OCCO1 527a_100000036311_100000749530 [0,2,0,0,0,0|2,0,0]=4 6916 B14R1.86 CCOCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000749530 [0,2,0,0,0,0|1,0,0]=3 6917 B14R1.86 CCOCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000749530 [0,2,0,0,0,0|1,0,0]=3 6918 B14R1.86 CCOCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000749530 [0,2,0,0,0,0|1,0,0]=3 6919 B14R1.86 CCOCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000749530 [0,2,0,0,0,0|1,0,0]=3 6920 B14R1.86 CCSCCC(=O)CCC1CCCC1 1458a_100000211120_100000757381 [0,2,0,0,0,0|2,0,0]=4 6921 B14R1.86 CCSCCC(=O)CCC1CCCC1 1458a_100000230768_100000760354 [0,2,0,0,0,0|2,0,0]=4 6922 B14R1.86 CCSCCC(=O)CCC1CCCO1 1458a_100011247709_100000757381 [0,2,0,0,0,0|1,0,0]=3 6923 B14R1.86 CCSCCC(=O)CCC1OCCO1 1458a_100000082924_100000757381 [0,2,0,0,0,0|2,0,0]=4 6924 B14R1.86 CCSCCC(=O)CCC1OCCO1 1458a_100000230768_100000740749 [0,2,0,0,0,0|2,0,0]=4 6925 B14R1.86 CCSCCC(=O)CCN1CCCO1 1458a_200015187630_100000757381 [0,2,0,0,0,0|2,0,0]=4 6926 B14R1.86 CCSCCC(=O)NCC1CCCC1 11a_100000737975_100000230768 [0,2,0,0,0,0|2,0,0]=4 6927 B14R1.86 CCSCCC(=O)NCC1CCCC1 1626a_100000737975_100000230768 [0,2,0,0,0,0|2,0,0]=4 6928 B14R1.86 CCSCCC(=O)NCC1CCCC1 240690a_100000737975_100000230768 [0,2,0,0,0,0|2,0,0]=4 6929 B14R1.86 CCSCCC(=O)NCC1CCCC1 527a_100000737975_100000230768 [0,2,0,0,0,0|2,0,0]=4 6930 B14R1.86 CCSCCC(=O)NCC1OCCO1 11a_100000036311_100000230768 [0,2,0,0,0,0|2,0,0]=4 6931 B14R1.86 CCSCCC(=O)NCC1OCCO1 1626a_100000036311_100000230768 [0,2,0,0,0,0|2,0,0]=4 6932 B14R1.86 CCSCCC(=O)NCC1OCCO1 527a_100000036311_100000230768 [0,2,0,0,0,0|2,0,0]=4 6933 B14R1.86 CCSCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000230768 [0,2,0,0,0,0|1,0,0]=3 6934 B14R1.86 CCSCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000230768 [0,2,0,0,0,0|1,0,0]=3 6935 B14R1.86 CCSCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000230768 [0,2,0,0,0,0|1,0,0]=3 6936 B14R1.86 CCSCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000230768 [0,2,0,0,0,0|1,0,0]=3 6937 B14R1.86 COCC=CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100016285016 [0,2,0,0,0,0|1,0,1]=4 6938 B14R1.86 COCC=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100016285016 [0,2,0,0,0,0|1,0,1]=4 6939 B14R1.86 COCC=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100016285016 [0,2,0,0,0,0|1,0,1]=4 6940 B14R1.86 COCCCC(=O)CCC1CCCC1 1458a_100000211120_100000740836 [0,2,0,0,0,0|2,0,0]=4 6941 B14R1.86 COCCCC(=O)CCC1CCCC1 1458a_100000741012_100000760354 [0,2,0,0,0,0|2,0,0]=4 6942 B14R1.86 COCCCC(=O)CCC1CCCO1 1458a_100011247709_100000740836 [0,2,0,0,0,0|1,0,0]=3 6943 B14R1.86 COCCCC(=O)CCC1OCCO1 1458a_100000082924_100000740836 [0,2,0,0,0,0|2,0,0]=4 6944 B14R1.86 COCCCC(=O)CCC1OCCO1 1458a_100000741012_100000740749 [0,2,0,0,0,0|2,0,0]=4 6945 B14R1.86 COCCCC(=O)CCN1CCCO1 1458a_200015187630_100000740836 [0,2,0,0,0,0|2,0,0]=4 6946 B14R1.86 COCCCC(=O)NCC1CCCC1 11a_100000737975_100000741012 [0,2,0,0,0,0|2,0,0]=4 6947 B14R1.86 COCCCC(=O)NCC1CCCC1 1626a_100000737975_100000741012 [0,2,0,0,0,0|2,0,0]=4 6948 B14R1.86 COCCCC(=O)NCC1CCCC1 240690a_100000737975_100000741012 [0,2,0,0,0,0|2,0,0]=4 6949 B14R1.86 COCCCC(=O)NCC1CCCC1 527a_100000737975_100000741012 [0,2,0,0,0,0|2,0,0]=4 6950 B14R1.86 COCCCC(=O)NCC1OCCO1 11a_100000036311_100000741012 [0,2,0,0,0,0|2,0,0]=4 6951 B14R1.86 COCCCC(=O)NCC1OCCO1 1626a_100000036311_100000741012 [0,2,0,0,0,0|2,0,0]=4 6952 B14R1.86 COCCCC(=O)NCC1OCCO1 527a_100000036311_100000741012 [0,2,0,0,0,0|2,0,0]=4 6953 B14R1.86 COCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000741012 [0,2,0,0,0,0|1,0,0]=3 6954 B14R1.86 COCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000741012 [0,2,0,0,0,0|1,0,0]=3 6955 B14R1.86 COCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000741012 [0,2,0,0,0,0|1,0,0]=3 6956 B14R1.86 COCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000741012 [0,2,0,0,0,0|1,0,0]=3 6957 B14R1.86 COCCCC(C)OCC1CCCO1 7a_200011539412_100000203698 [0,2,0,0,0,0|1,0,1]=4 6958 B14R1.86 COCCNC(=O)CCC1CCCC1 1626a_100000209980_100000211120 [0,2,0,0,0,0|2,0,0]=4 6959 B14R1.86 COCCNC(=O)CCC1CCCC1 240690a_100000209980_100000211120 [0,2,0,0,0,0|2,0,0]=4 6960 B14R1.86 COCCNC(=O)CCC1CCCC1 527a_100000209980_100000211120 [0,2,0,0,0,0|2,0,0]=4 6961 B14R1.86 COCCNC(=O)CCC1CCCO1 1626a_100000209980_100011247709 [0,2,0,0,0,0|1,0,0]=3 6962 B14R1.86 COCCNC(=O)CCC1CCCO1 240690a_100000209980_100011247709 [0,2,0,0,0,0|1,0,0]=3 6963 B14R1.86 COCCNC(=O)CCC1CCCO1 527a_100000209980_100011247709 [0,2,0,0,0,0|1,0,0]=3 6964 B14R1.86 COCCNC(=O)CCN1CCCO1 240690a_100000209980_200015187630 [0,2,0,0,0,0|2,0,0]=4 6965 B14R1.86 COCCNC(=O)COC1CCCO1 34a_100000085407_100000183275 [0,2,0,0,0,0|2,0,0]=4 6966 B14R1.86 COCCNC(=O)NCC1CCCC1 2708a_100000737975_100000209980 [0,2,0,0,0,0|2,0,0]=4 6967 B14R1.86 COCCNC(=O)NCC1CCCC1 273464a_100000209980_100000737975 [0,2,0,0,0,0|2,0,0]=4 6968 B14R1.86 COCCNC(=O)NCC1CCCC1 273464a_100000737975_100000209980 [0,2,0,0,0,0|2,0,0]=4 6969 B14R1.86 COCCNC(=O)NCC1OCCO1 2708a_100000036311_100000209980 [0,2,0,0,0,0|2,0,0]=4 6970 B14R1.86 COCCNC(=O)NCC1OCCO1 273464a_100000036311_100000209980 [0,2,0,0,0,0|2,0,0]=4 6971 B14R1.86 COCCNC(=O)NCC1OCCO1 273464a_100000209980_100000036311 [0,2,0,0,0,0|2,0,0]=4 6972 B14R1.86 COCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000209980 [0,2,0,0,0,0|1,0,0]=3 6973 B14R1.86 COCCNC(=O)NC[C@@H]1CCCO1 273464a_100000209980_100020590478 [0,2,0,0,0,0|1,0,0]=3 6974 B14R1.86 COCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000209980 [0,2,0,0,0,0|1,0,0]=3 6975 B14R1.86 COCCOC(=O)COC1CCCO1 34a_100000085407_200000040189 [0,2,0,0,0,0|2,0,0]=4 6976 B14R1.86 COCSCC(=O)NCC1CCCO1 62a_100000182893_100000766300 [0,2,0,0,0,0|1,0,0]=3 6977 B14R1.86 COCSCC(=O)NCC1CCCO1 62a_100000766300_100000182893 [0,2,0,0,0,0|1,0,0]=3 6978 B14R1.86 CSCCCC(=O)CCC1CCCC1 1458a_100000173376_100000760354 [0,2,0,0,0,0|2,0,0]=4 6979 B14R1.86 CSCCCC(=O)CCC1OCCO1 1458a_100000173376_100000740749 [0,2,0,0,0,0|2,0,0]=4 6980 B14R1.86 CSCCCC(=O)NCC1CCCC1 11a_100000737975_100000173376 [0,2,0,0,0,0|2,0,0]=4 6981 B14R1.86 CSCCCC(=O)NCC1CCCC1 1626a_100000737975_100000173376 [0,2,0,0,0,0|2,0,0]=4 6982 B14R1.86 CSCCCC(=O)NCC1CCCC1 240690a_100000737975_100000173376 [0,2,0,0,0,0|2,0,0]=4 6983 B14R1.86 CSCCCC(=O)NCC1CCCC1 527a_100000737975_100000173376 [0,2,0,0,0,0|2,0,0]=4 6984 B14R1.86 CSCCCC(=O)NCC1OCCO1 11a_100000036311_100000173376 [0,2,0,0,0,0|2,0,0]=4 6985 B14R1.86 CSCCCC(=O)NCC1OCCO1 1626a_100000036311_100000173376 [0,2,0,0,0,0|2,0,0]=4 6986 B14R1.86 CSCCCC(=O)NCC1OCCO1 527a_100000036311_100000173376 [0,2,0,0,0,0|2,0,0]=4 6987 B14R1.86 CSCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000173376 [0,2,0,0,0,0|1,0,0]=3 6988 B14R1.86 CSCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000173376 [0,2,0,0,0,0|1,0,0]=3 6989 B14R1.86 CSCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000173376 [0,2,0,0,0,0|1,0,0]=3 6990 B14R1.86 CSCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000173376 [0,2,0,0,0,0|1,0,0]=3 6991 B14R1.86 CSCCNC(=O)CCC1CCCC1 11a_100020590264_100000211120 [0,2,0,0,0,0|2,0,0]=4 6992 B14R1.86 CSCCNC(=O)CCC1CCCC1 1626a_100020590264_100000211120 [0,2,0,0,0,0|2,0,0]=4 6993 B14R1.86 CSCCNC(=O)CCC1CCCC1 240690a_100020590264_100000211120 [0,2,0,0,0,0|2,0,0]=4 6994 B14R1.86 CSCCNC(=O)CCC1CCCC1 527a_100020590264_100000211120 [0,2,0,0,0,0|2,0,0]=4 6995 B14R1.86 CSCCNC(=O)CCC1CCCO1 11a_100020590264_100011247709 [0,2,0,0,0,0|1,0,0]=3 6996 B14R1.86 CSCCNC(=O)CCC1CCCO1 1626a_100020590264_100011247709 [0,2,0,0,0,0|1,0,0]=3 6997 B14R1.86 CSCCNC(=O)CCC1CCCO1 240690a_100020590264_100011247709 [0,2,0,0,0,0|1,0,0]=3 6998 B14R1.86 CSCCNC(=O)CCC1CCCO1 527a_100020590264_100011247709 [0,2,0,0,0,0|1,0,0]=3 6999 B14R1.86 CSCCNC(=O)CCN1CCCO1 240690a_100020590264_200015187630 [0,2,0,0,0,0|2,0,0]=4 7000 B14R1.86 CSCCNC(=O)NCC1CCCC1 2708a_100000737975_100020590264 [0,2,0,0,0,0|2,0,0]=4 7001 B14R1.86 CSCCNC(=O)NCC1CCCC1 2708a_100020590264_100000737975 [0,2,0,0,0,0|2,0,0]=4 7002 B14R1.86 CSCCNC(=O)NCC1CCCC1 273464a_100000737975_100020590264 [0,2,0,0,0,0|2,0,0]=4 7003 B14R1.86 CSCCNC(=O)NCC1CCCC1 273464a_100020590264_100000737975 [0,2,0,0,0,0|2,0,0]=4 7004 B14R1.86 CSCCNC(=O)NCC1CCCC1 512a_100000737975_100020590264 [0,2,0,0,0,0|2,0,0]=4 7005 B14R1.86 CSCCNC(=O)NCC1CCCC1 512a_100020590264_100000737975 [0,2,0,0,0,0|2,0,0]=4 7006 B14R1.86 CSCCNC(=O)NCC1OCCO1 2708a_100000036311_100020590264 [0,2,0,0,0,0|2,0,0]=4 7007 B14R1.86 CSCCNC(=O)NCC1OCCO1 2708a_100020590264_100000036311 [0,2,0,0,0,0|2,0,0]=4 7008 B14R1.86 CSCCNC(=O)NCC1OCCO1 273464a_100000036311_100020590264 [0,2,0,0,0,0|2,0,0]=4 7009 B14R1.86 CSCCNC(=O)NCC1OCCO1 273464a_100020590264_100000036311 [0,2,0,0,0,0|2,0,0]=4 7010 B14R1.86 CSCCNC(=O)NCC1OCCO1 512a_100000036311_100020590264 [0,2,0,0,0,0|2,0,0]=4 7011 B14R1.86 CSCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590264_100020590478 [0,2,0,0,0,0|1,0,0]=3 7012 B14R1.86 CSCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100020590264 [0,2,0,0,0,0|1,0,0]=3 7013 B14R1.86 CSCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590264_100020590478 [0,2,0,0,0,0|1,0,0]=3 7014 B14R1.86 CSCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100020590264 [0,2,0,0,0,0|1,0,0]=3 7015 B14R1.86 CSCCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100020590264 [0,2,0,0,0,0|1,0,0]=3 7016 B14R1.86 CSCSCC(=O)NCC1CCCO1 62a_100000182893_100011218213 [0,2,0,0,0,0|1,0,0]=3 7017 B14R1.86 CSCSCC(=O)NCC1CCCO1 62a_100011218213_100000182893 [0,2,0,0,0,0|1,0,0]=3 7018 B14R1.86 N#CCCCC(=O)CCC1CCCC1 1458a_100000075515_100000760354 [0,2,0,0,0,0|2,0,0]=4 7019 B14R1.86 N#CCCCC(=O)CCC1CCCC1 1458a_100000211120_100000211468 [0,2,0,0,0,0|2,0,0]=4 7020 B14R1.86 N#CCCCC(=O)CCC1CCCO1 1458a_100011247709_100000211468 [0,2,0,0,0,0|1,0,0]=3 7021 B14R1.86 N#CCCCC(=O)CCC1OCCO1 1458a_100000075515_100000740749 [0,2,0,0,0,0|2,0,0]=4 7022 B14R1.86 N#CCCCC(=O)CCC1OCCO1 1458a_100000082924_100000211468 [0,2,0,0,0,0|2,0,0]=4 7023 B14R1.86 N#CCCCC(=O)CCN1CCCO1 1458a_200015187630_100000211468 [0,2,0,0,0,0|2,0,0]=4 7024 B14R1.86 N#CCCCC(=O)NCC1CCCC1 11a_100000737975_100000075515 [0,2,0,0,0,0|2,0,0]=4 7025 B14R1.86 N#CCCCC(=O)NCC1CCCC1 1626a_100000737975_100000075515 [0,2,0,0,0,0|2,0,0]=4 7026 B14R1.86 N#CCCCC(=O)NCC1CCCC1 240690a_100000737975_100000075515 [0,2,0,0,0,0|2,0,0]=4 7027 B14R1.86 N#CCCCC(=O)NCC1CCCC1 527a_100000737975_100000075515 [0,2,0,0,0,0|2,0,0]=4 7028 B14R1.86 N#CCCCC(=O)NCC1OCCO1 11a_100000036311_100000075515 [0,2,0,0,0,0|2,0,0]=4 7029 B14R1.86 N#CCCCC(=O)NCC1OCCO1 1626a_100000036311_100000075515 [0,2,0,0,0,0|2,0,0]=4 7030 B14R1.86 N#CCCCC(=O)NCC1OCCO1 527a_100000036311_100000075515 [0,2,0,0,0,0|2,0,0]=4 7031 B14R1.86 N#CCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000075515 [0,2,0,0,0,0|1,0,0]=3 7032 B14R1.86 N#CCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000075515 [0,2,0,0,0,0|1,0,0]=3 7033 B14R1.86 N#CCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000075515 [0,2,0,0,0,0|1,0,0]=3 7034 B14R1.86 N#CCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000075515 [0,2,0,0,0,0|1,0,0]=3 7035 B14R1.86 N#CCCNC(=O)CCC1CCCO1 11a_100000720768_100011247709 [0,2,0,0,0,0|1,0,1]=4 7036 B14R1.86 N#CCCNC(=O)CCC1CCCO1 1626a_100000720768_100011247709 [0,2,0,0,0,0|1,0,1]=4 7037 B14R1.86 N#CCCNC(=O)CCC1CCCO1 240690a_100000720768_100011247709 [0,2,0,0,0,0|1,0,1]=4 7038 B14R1.86 N#CCCNC(=O)CCC1CCCO1 527a_100000720768_100011247709 [0,2,0,0,0,0|1,0,1]=4 7039 B14R1.86 N#CCCNC(=O)NC[C@@H]1CCCO1 2708a_100000720768_100020590478 [0,2,0,0,0,0|1,0,1]=4 7040 B14R1.86 N#CCCNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000720768 [0,2,0,0,0,0|1,0,1]=4 7041 B14R1.86 N#CCCNC(=O)NC[C@@H]1CCCO1 273464a_100000720768_100020590478 [0,2,0,0,0,0|1,0,1]=4 7042 B14R1.86 N#CCCNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000720768 [0,2,0,0,0,0|1,0,1]=4 7043 B14R1.86 N#CCCNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000720768 [0,2,0,0,0,0|1,0,1]=4 7044 B14R1.86 N#CCSCC(=O)NCC1CCCO1 62a_100000182893_100011215382 [0,2,0,0,0,0|1,0,1]=4 7045 B14R1.86 N#CCSCC(=O)NCC1CCCO1 62a_100011215382_100000182893 [0,2,0,0,0,0|1,0,1]=4 7046 B14R1.86 N#CCSCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000150266 [0,2,0,0,0,0|1,0,1]=4 7047 B14R1.86 N#CCSCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000150266 [0,2,0,0,0,0|1,0,1]=4 7048 B14R1.86 N#CCSCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000150266 [0,2,0,0,0,0|1,0,1]=4 7049 B14R1.86 O=C(CC#CCO)CCC1CCCO1 1458a_100011247709_200000047223 [0,2,0,0,0,0|1,0,1]=4 7050 B14R1.86 O=C(CCC1CCCC1)COCCO 1458a_100000708028_100000760354 [0,2,0,0,0,0|2,0,0]=4 7051 B14R1.86 O=C(CCC1CCCC1)NCCCF 11a_100015189416_100000211120 [0,2,0,0,0,0|2,0,0]=4 7052 B14R1.86 O=C(CCC1CCCC1)NCCCF 1626a_100015189416_100000211120 [0,2,0,0,0,0|2,0,0]=4 7053 B14R1.86 O=C(CCC1CCCC1)NCCCF 240690a_100015189416_100000211120 [0,2,0,0,0,0|2,0,0]=4 7054 B14R1.86 O=C(CCC1CCCC1)NCCCF 527a_100015189416_100000211120 [0,2,0,0,0,0|2,0,0]=4 7055 B14R1.86 O=C(CCC1CCCC1)NCCCO 240690a_100000182051_100000211120 [0,2,0,0,0,0|2,0,0]=4 7056 B14R1.86 O=C(CCC1CCCC1)NCCCO 527a_100000182051_100000211120 [0,2,0,0,0,0|2,0,0]=4 7057 B14R1.86 O=C(CCC1CCCO1)NCCCF 11a_100015189416_100011247709 [0,2,0,0,0,0|1,0,0]=3 7058 B14R1.86 O=C(CCC1CCCO1)NCCCF 1626a_100015189416_100011247709 [0,2,0,0,0,0|1,0,0]=3 7059 B14R1.86 O=C(CCC1CCCO1)NCCCF 240690a_100015189416_100011247709 [0,2,0,0,0,0|1,0,0]=3 7060 B14R1.86 O=C(CCC1CCCO1)NCCCF 527a_100015189416_100011247709 [0,2,0,0,0,0|1,0,0]=3 7061 B14R1.86 O=C(CCC1CCCO1)NCCCO 240690a_100000182051_100011247709 [0,2,0,0,0,0|1,0,0]=3 7062 B14R1.86 O=C(CCC1CCCO1)NCCCO 527a_100000182051_100011247709 [0,2,0,0,0,0|1,0,0]=3 7063 B14R1.86 O=C(CCC1CCCO1)NNCCO 22a_100000210001_100011247709 [0,2,0,0,0,0|2,0,0]=4 7064 B14R1.86 O=C(CCC1OCCO1)COCCO 1458a_100000708028_100000740749 [0,2,0,0,0,0|2,0,0]=4 7065 B14R1.86 O=C(CCCCF)CCC1CCCC1 1458a_100000211120_100000729493 [0,2,0,0,0,0|2,0,0]=4 7066 B14R1.86 O=C(CCCCF)CCC1CCCO1 1458a_100011247709_100000729493 [0,2,0,0,0,0|1,0,0]=3 7067 B14R1.86 O=C(CCCCF)CCC1OCCO1 1458a_100000082924_100000729493 [0,2,0,0,0,0|2,0,0]=4 7068 B14R1.86 O=C(CCCCF)CCN1CCCO1 1458a_200015187630_100000729493 [0,2,0,0,0,0|2,0,0]=4 7069 B14R1.86 O=C(CCCCO)CCC1CCCC1 1458a_100000211120_100000210776 [0,2,0,0,0,0|2,0,0]=4 7070 B14R1.86 O=C(CCCCO)CCC1CCCC1 1458a_100000695505_100000760354 [0,2,0,0,0,0|2,0,0]=4 7071 B14R1.86 O=C(CCCCO)CCC1CCCO1 1458a_100011247709_100000210776 [0,2,0,0,0,0|1,0,0]=3 7072 B14R1.86 O=C(CCCCO)CCC1OCCO1 1458a_100000082924_100000210776 [0,2,0,0,0,0|2,0,0]=4 7073 B14R1.86 O=C(CCCCO)CCC1OCCO1 1458a_100000695505_100000740749 [0,2,0,0,0,0|2,0,0]=4 7074 B14R1.86 O=C(CCCCO)CCN1CCCO1 1458a_200015187630_100000210776 [0,2,0,0,0,0|2,0,0]=4 7075 B14R1.86 O=C(CCCCO)NCC1CCCC1 1626a_100000737975_100000695505 [0,2,0,0,0,0|2,0,0]=4 7076 B14R1.86 O=C(CCCCO)NCC1OCCO1 1626a_100000036311_100000695505 [0,2,0,0,0,0|2,0,0]=4 7077 B14R1.86 O=C(CCCCO)NC[C@@H]1CCCO1 1626a_100020590478_100000695505 [0,2,0,0,0,0|1,0,0]=3 7078 B14R1.86 O=C(CCN1CCCO1)NCCCF 240690a_100015189416_200015187630 [0,2,0,0,0,0|2,0,0]=4 7079 B14R1.86 O=C(CCN1CCCO1)NCCCO 240690a_100000182051_200015187630 [0,2,0,0,0,0|2,0,0]=4 7080 B14R1.86 O=C(CNCCO)NCC1CCCO1 2230a_100016997473_100000182893 [0,2,0,0,0,0|1,0,0]=3 7081 B14R1.86 O=C(COCCO)NCC1CCCC1 1626a_100000737975_100000708028 [0,2,0,0,0,0|2,0,0]=4 7082 B14R1.86 O=C(COCCO)NCC1CCCC1 240690a_100000737975_100000708028 [0,2,0,0,0,0|2,0,0]=4 7083 B14R1.86 O=C(COCCO)NCC1OCCO1 1626a_100000036311_100000708028 [0,2,0,0,0,0|2,0,0]=4 7084 B14R1.86 O=C(COCCO)NC[C@@H]1CCCO1 1626a_100020590478_100000708028 [0,2,0,0,0,0|1,0,0]=3 7085 B14R1.86 O=C(COCCO)NC[C@@H]1CCCO1 240690a_100020590478_100000708028 [0,2,0,0,0,0|1,0,0]=3 7086 B14R1.86 O=C(CSCCF)NCC1CCCO1 62a_100000182893_100011217306 [0,2,0,0,0,0|1,0,0]=3 7087 B14R1.86 O=C(CSCCF)NCC1CCCO1 62a_100011217306_100000182893 [0,2,0,0,0,0|1,0,0]=3 7088 B14R1.86 O=C(CSCCO)NCC1CCCO1 62a_100000182893_100000211926 [0,2,0,0,0,0|1,0,0]=3 7089 B14R1.86 O=C(CSCCO)NCC1CCCO1 62a_100000211926_100000182893 [0,2,0,0,0,0|1,0,0]=3 7090 B14R1.86 O=C(NCCCF)NCC1CCCC1 2708a_100000737975_100015189416 [0,2,0,0,0,0|2,0,0]=4 7091 B14R1.86 O=C(NCCCF)NCC1CCCC1 2708a_100015189416_100000737975 [0,2,0,0,0,0|2,0,0]=4 7092 B14R1.86 O=C(NCCCF)NCC1CCCC1 273464a_100000737975_100015189416 [0,2,0,0,0,0|2,0,0]=4 7093 B14R1.86 O=C(NCCCF)NCC1CCCC1 273464a_100015189416_100000737975 [0,2,0,0,0,0|2,0,0]=4 7094 B14R1.86 O=C(NCCCF)NCC1CCCC1 512a_100000737975_100015189416 [0,2,0,0,0,0|2,0,0]=4 7095 B14R1.86 O=C(NCCCF)NCC1CCCC1 512a_100015189416_100000737975 [0,2,0,0,0,0|2,0,0]=4 7096 B14R1.86 O=C(NCCCF)NCC1OCCO1 2708a_100000036311_100015189416 [0,2,0,0,0,0|2,0,0]=4 7097 B14R1.86 O=C(NCCCF)NCC1OCCO1 2708a_100015189416_100000036311 [0,2,0,0,0,0|2,0,0]=4 7098 B14R1.86 O=C(NCCCF)NCC1OCCO1 273464a_100000036311_100015189416 [0,2,0,0,0,0|2,0,0]=4 7099 B14R1.86 O=C(NCCCF)NCC1OCCO1 273464a_100015189416_100000036311 [0,2,0,0,0,0|2,0,0]=4 7100 B14R1.86 O=C(NCCCF)NCC1OCCO1 512a_100000036311_100015189416 [0,2,0,0,0,0|2,0,0]=4 7101 B14R1.86 O=C(NCCCF)NC[C@@H]1CCCO1 2708a_100015189416_100020590478 [0,2,0,0,0,0|1,0,0]=3 7102 B14R1.86 O=C(NCCCF)NC[C@@H]1CCCO1 2708a_100020590478_100015189416 [0,2,0,0,0,0|1,0,0]=3 7103 B14R1.86 O=C(NCCCF)NC[C@@H]1CCCO1 273464a_100015189416_100020590478 [0,2,0,0,0,0|1,0,0]=3 7104 B14R1.86 O=C(NCCCF)NC[C@@H]1CCCO1 273464a_100020590478_100015189416 [0,2,0,0,0,0|1,0,0]=3 7105 B14R1.86 O=C(NCCCF)NC[C@@H]1CCCO1 512a_100020590478_100015189416 [0,2,0,0,0,0|1,0,0]=3 7106 B14R1.86 O=C(NCCCO)NCC1CCCC1 2708a_100000737975_100000182051 [0,2,0,0,0,0|2,0,0]=4 7107 B14R1.86 O=C(NCCCO)NCC1CCCC1 273464a_100000182051_100000737975 [0,2,0,0,0,0|2,0,0]=4 7108 B14R1.86 O=C(NCCCO)NCC1CCCC1 273464a_100000737975_100000182051 [0,2,0,0,0,0|2,0,0]=4 7109 B14R1.86 O=C(NCCCO)NCC1CCCC1 512a_100000737975_100000182051 [0,2,0,0,0,0|2,0,0]=4 7110 B14R1.86 O=C(NCCCO)NCC1OCCO1 2708a_100000036311_100000182051 [0,2,0,0,0,0|2,0,0]=4 7111 B14R1.86 O=C(NCCCO)NCC1OCCO1 273464a_100000036311_100000182051 [0,2,0,0,0,0|2,0,0]=4 7112 B14R1.86 O=C(NCCCO)NCC1OCCO1 273464a_100000182051_100000036311 [0,2,0,0,0,0|2,0,0]=4 7113 B14R1.86 O=C(NCCCO)NCC1OCCO1 512a_100000036311_100000182051 [0,2,0,0,0,0|2,0,0]=4 7114 B14R1.86 O=C(NCCCO)NC[C@@H]1CCCO1 2708a_100020590478_100000182051 [0,2,0,0,0,0|1,0,0]=3 7115 B14R1.86 O=C(NCCCO)NC[C@@H]1CCCO1 273464a_100000182051_100020590478 [0,2,0,0,0,0|1,0,0]=3 7116 B14R1.86 O=C(NCCCO)NC[C@@H]1CCCO1 273464a_100020590478_100000182051 [0,2,0,0,0,0|1,0,0]=3 7117 B14R1.86 O=C(NCCCO)NC[C@@H]1CCCO1 512a_100020590478_100000182051 [0,2,0,0,0,0|1,0,0]=3 7118 B14R1.86 O=C(NC[C@@H]1CCCO1)NNCCO 273464a_100020590478_100000210001 [0,2,0,0,0,0|2,0,0]=4 7119 B14R1.86 O=C(NC[C@@H]1CCCO1)NNCCO 512a_100020590478_100000210001 [0,2,0,0,0,0|2,0,0]=4 7120 B14R1.86 O=CCSCC(=O)NCC1CCCO1 62a_100000182893_200015260668 [0,2,0,0,0,0|1,0,1]=4 7121 B14R1.86 O=CCSCC(=O)NCC1CCCO1 62a_200015260668_100000182893 [0,2,0,0,0,0|1,0,1]=4 7122 B14R1.86 [N-]=[N+]=NCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000688302 [0,2,0,0,0,0|2,0,0]=4 7123 B14R1.86 [N-]=[N+]=NCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000688302 [0,2,0,0,0,0|2,0,0]=4 7124 B14R1.588 C#CC(C)NC(=O)CCC1CCCO1 11a_100000707721_100011247709 [0,2,0,0,0,0|2,0,0]=4 7125 B14R1.588 C#CC(C)NC(=O)CCC1CCCO1 1626a_100000707721_100011247709 [0,2,0,0,0,0|2,0,0]=4 7126 B14R1.588 C#CC(C)NC(=O)CCC1CCCO1 240690a_100000707721_100011247709 [0,2,0,0,0,0|2,0,0]=4 7127 B14R1.588 C#CC(C)NC(=O)CCC1CCCO1 527a_100000707721_100011247709 [0,2,0,0,0,0|2,0,0]=4 7128 B14R1.588 C#CC(C)NC(=O)NC[C@@H]1CCCO1 2708a_100000707721_100020590478 [0,2,0,0,0,0|2,0,0]=4 7129 B14R1.588 C#CC(C)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000707721 [0,2,0,0,0,0|2,0,0]=4 7130 B14R1.588 C#CC(C)NC(=O)NC[C@@H]1CCCO1 273464a_100000707721_100020590478 [0,2,0,0,0,0|2,0,0]=4 7131 B14R1.588 C#CC(C)NC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000707721 [0,2,0,0,0,0|2,0,0]=4 7132 B14R1.588 C#CC(C)NC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000707721 [0,2,0,0,0,0|2,0,0]=4 7133 B14R1.588 C=CC(C)CC(=O)CCC1CCCC1 1458a_100011934298_100000760354 [0,2,0,0,0,0|2,0,0]=4 7134 B14R1.588 C=CC(C)CC(=O)CCC1OCCO1 1458a_100011934298_100000740749 [0,2,0,0,0,0|2,0,0]=4 7135 B14R1.588 C=CC(C)CC(=O)NCC1CCCC1 11a_100000737975_100011934298 [0,2,0,0,0,0|2,0,0]=4 7136 B14R1.588 C=CC(C)CC(=O)NCC1CCCC1 1626a_100000737975_100011934298 [0,2,0,0,0,0|2,0,0]=4 7137 B14R1.588 C=CC(C)CC(=O)NCC1CCCC1 240690a_100000737975_100011934298 [0,2,0,0,0,0|2,0,0]=4 7138 B14R1.588 C=CC(C)CC(=O)NCC1CCCC1 527a_100000737975_100011934298 [0,2,0,0,0,0|2,0,0]=4 7139 B14R1.588 C=CC(C)CC(=O)NCC1OCCO1 11a_100000036311_100011934298 [0,2,0,0,0,0|2,0,0]=4 7140 B14R1.588 C=CC(C)CC(=O)NCC1OCCO1 1626a_100000036311_100011934298 [0,2,0,0,0,0|2,0,0]=4 7141 B14R1.588 C=CC(C)CC(=O)NCC1OCCO1 527a_100000036311_100011934298 [0,2,0,0,0,0|2,0,0]=4 7142 B14R1.588 C=CC(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100011934298 [0,2,0,0,0,0|1,0,0]=3 7143 B14R1.588 C=CC(C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011934298 [0,2,0,0,0,0|1,0,0]=3 7144 B14R1.588 C=CC(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011934298 [0,2,0,0,0,0|1,0,0]=3 7145 B14R1.588 C=CC(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100011934298 [0,2,0,0,0,0|1,0,0]=3 7146 B14R1.588 CC(C#N)NC(=O)CCC1CCCO1 11a_100000737613_100011247709 [0,2,0,0,0,0|2,0,0]=4 7147 B14R1.588 CC(C#N)NC(=O)CCC1CCCO1 1626a_100000737613_100011247709 [0,2,0,0,0,0|2,0,0]=4 7148 B14R1.588 CC(C#N)NC(=O)CCC1CCCO1 527a_100000737613_100011247709 [0,2,0,0,0,0|2,0,0]=4 7149 B14R1.588 CC(C#N)NC(=O)NC[C@@H]1CCCO1 2708a_100000737613_100020590478 [0,2,0,0,0,0|2,0,0]=4 7150 B14R1.588 CC(C#N)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000737613 [0,2,0,0,0,0|2,0,0]=4 7151 B14R1.588 CC(C#N)NC(=O)NC[C@@H]1CCCO1 273464a_100000737613_100020590478 [0,2,0,0,0,0|2,0,0]=4 7152 B14R1.588 CC(C#N)NC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000737613 [0,2,0,0,0,0|2,0,0]=4 7153 B14R1.588 CC(C#N)NC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000737613 [0,2,0,0,0,0|2,0,0]=4 7154 B14R1.588 CCC(=CC(=O)NC[C@@H]1CCCO1)C 11a_100020590478_100020758463 [0,2,0,0,0,0|1,0,1]=4 7155 B14R1.588 CCC(=CC(=O)NC[C@@H]1CCCO1)C 1626a_100020590478_100020758463 [0,2,0,0,0,0|1,0,1]=4 7156 B14R1.588 CCC(=CC(=O)NC[C@@H]1CCCO1)C 240690a_100020590478_100020758463 [0,2,0,0,0,0|1,0,1]=4 7157 B14R1.588 CCC(=O)CC(=O)CCC1CCCC1 1458a_100000211120_100000747405 [0,2,0,0,0,0|2,0,0]=4 7158 B14R1.588 CCC(=O)CC(=O)CCC1CCCO1 1458a_100011247709_100000747405 [0,2,0,0,0,0|1,0,0]=3 7159 B14R1.588 CCC(=O)CC(=O)CCC1OCCO1 1458a_100000082924_100000747405 [0,2,0,0,0,0|2,0,0]=4 7160 B14R1.588 CCC(=O)CC(=O)CCN1CCCO1 1458a_200015187630_100000747405 [0,2,0,0,0,0|2,0,0]=4 7161 B14R1.588 CCC(=O)CC(=O)NCC1CCCO1 1458a_100000210414_100000182893 [0,2,0,0,0,0|1,0,0]=3 7162 B14R1.588 CCC(C)CC(=O)CCC1CCCC1 1458a_100000211120_100000748023 [0,2,0,0,0,0|2,0,0]=4 7163 B14R1.588 CCC(C)CC(=O)CCC1CCCC1 1458a_100000708755_100000760354 [0,2,0,0,0,0|2,0,0]=4 7164 B14R1.588 CCC(C)CC(=O)CCC1CCCO1 1458a_100011247709_100000748023 [0,2,0,0,0,0|1,0,0]=3 7165 B14R1.588 CCC(C)CC(=O)CCC1OCCO1 1458a_100000082924_100000748023 [0,2,0,0,0,0|2,0,0]=4 7166 B14R1.588 CCC(C)CC(=O)CCC1OCCO1 1458a_100000708755_100000740749 [0,2,0,0,0,0|2,0,0]=4 7167 B14R1.588 CCC(C)CC(=O)CCN1CCCO1 1458a_200015187630_100000748023 [0,2,0,0,0,0|2,0,0]=4 7168 B14R1.588 CCC(C)CC(=O)NCC1CCCC1 11a_100000737975_100000708755 [0,2,0,0,0,0|2,0,0]=4 7169 B14R1.588 CCC(C)CC(=O)NCC1CCCC1 1626a_100000737975_100000708755 [0,2,0,0,0,0|2,0,0]=4 7170 B14R1.588 CCC(C)CC(=O)NCC1CCCC1 240690a_100000737975_100000708755 [0,2,0,0,0,0|2,0,0]=4 7171 B14R1.588 CCC(C)CC(=O)NCC1CCCC1 527a_100000737975_100000708755 [0,2,0,0,0,0|2,0,0]=4 7172 B14R1.588 CCC(C)CC(=O)NCC1OCCO1 11a_100000036311_100000708755 [0,2,0,0,0,0|2,0,0]=4 7173 B14R1.588 CCC(C)CC(=O)NCC1OCCO1 1626a_100000036311_100000708755 [0,2,0,0,0,0|2,0,0]=4 7174 B14R1.588 CCC(C)CC(=O)NCC1OCCO1 527a_100000036311_100000708755 [0,2,0,0,0,0|2,0,0]=4 7175 B14R1.588 CCC(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000708755 [0,2,0,0,0,0|1,0,0]=3 7176 B14R1.588 CCC(C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000708755 [0,2,0,0,0,0|1,0,0]=3 7177 B14R1.588 CCC(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000708755 [0,2,0,0,0,0|1,0,0]=3 7178 B14R1.588 CCC(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000708755 [0,2,0,0,0,0|1,0,0]=3 7179 B14R1.588 CCC(C)NC(=O)CCC1CCCC1 11a_100000209981_100000211120 [0,2,0,0,0,0|2,0,0]=4 7180 B14R1.588 CCC(C)NC(=O)CCC1CCCC1 1626a_100000209981_100000211120 [0,2,0,0,0,0|2,0,0]=4 7181 B14R1.588 CCC(C)NC(=O)CCC1CCCC1 240690a_100000209981_100000211120 [0,2,0,0,0,0|2,0,0]=4 7182 B14R1.588 CCC(C)NC(=O)CCC1CCCC1 527a_100000209981_100000211120 [0,2,0,0,0,0|2,0,0]=4 7183 B14R1.588 CCC(C)NC(=O)CCC1CCCO1 11a_100000209981_100011247709 [0,2,0,0,0,0|1,0,0]=3 7184 B14R1.588 CCC(C)NC(=O)CCC1CCCO1 1626a_100000209981_100011247709 [0,2,0,0,0,0|1,0,0]=3 7185 B14R1.588 CCC(C)NC(=O)CCC1CCCO1 240690a_100000209981_100011247709 [0,2,0,0,0,0|1,0,0]=3 7186 B14R1.588 CCC(C)NC(=O)CCC1CCCO1 527a_100000209981_100011247709 [0,2,0,0,0,0|1,0,0]=3 7187 B14R1.588 CCC(C)NC(=O)CCN1CCCO1 240690a_100000209981_200015187630 [0,2,0,0,0,0|2,0,0]=4 7188 B14R1.588 CCC(C)NC(=O)COC1CCCO1 34a_100000085407_100000182745 [0,2,0,0,0,0|2,0,0]=4 7189 B14R1.588 CCC(C)NC(=O)NCC1CCCC1 2708a_100000209981_100000737975 [0,2,0,0,0,0|2,0,0]=4 7190 B14R1.588 CCC(C)NC(=O)NCC1CCCC1 2708a_100000737975_100000209981 [0,2,0,0,0,0|2,0,0]=4 7191 B14R1.588 CCC(C)NC(=O)NCC1CCCC1 273464a_100000209981_100000737975 [0,2,0,0,0,0|2,0,0]=4 7192 B14R1.588 CCC(C)NC(=O)NCC1CCCC1 273464a_100000737975_100000209981 [0,2,0,0,0,0|2,0,0]=4 7193 B14R1.588 CCC(C)NC(=O)NCC1CCCC1 512a_100000209981_100000737975 [0,2,0,0,0,0|2,0,0]=4 7194 B14R1.588 CCC(C)NC(=O)NCC1CCCC1 512a_100000737975_100000209981 [0,2,0,0,0,0|2,0,0]=4 7195 B14R1.588 CCC(C)NC(=O)NCC1OCCO1 2708a_100000036311_100000209981 [0,2,0,0,0,0|2,0,0]=4 7196 B14R1.588 CCC(C)NC(=O)NCC1OCCO1 2708a_100000209981_100000036311 [0,2,0,0,0,0|2,0,0]=4 7197 B14R1.588 CCC(C)NC(=O)NCC1OCCO1 273464a_100000036311_100000209981 [0,2,0,0,0,0|2,0,0]=4 7198 B14R1.588 CCC(C)NC(=O)NCC1OCCO1 273464a_100000209981_100000036311 [0,2,0,0,0,0|2,0,0]=4 7199 B14R1.588 CCC(C)NC(=O)NCC1OCCO1 512a_100000036311_100000209981 [0,2,0,0,0,0|2,0,0]=4 7200 B14R1.588 CCC(C)NC(=O)NC[C@@H]1CCCO1 2708a_100000209981_100020590478 [0,2,0,0,0,0|1,0,0]=3 7201 B14R1.588 CCC(C)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000209981 [0,2,0,0,0,0|1,0,0]=3 7202 B14R1.588 CCC(C)NC(=O)NC[C@@H]1CCCO1 273464a_100000209981_100020590478 [0,2,0,0,0,0|1,0,0]=3 7203 B14R1.588 CCC(C)NC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000209981 [0,2,0,0,0,0|1,0,0]=3 7204 B14R1.588 CCC(C)NC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000209981 [0,2,0,0,0,0|1,0,0]=3 7205 B14R1.588 CCC(O)CC(=O)CCC1CCCC1 1458a_100000211120_100011218378 [0,2,0,0,0,0|2,0,0]=4 7206 B14R1.588 CCC(O)CC(=O)CCC1CCCC1 1458a_100011667805_100000760354 [0,2,0,0,0,0|2,0,0]=4 7207 B14R1.588 CCC(O)CC(=O)CCC1CCCO1 1458a_100011247709_100011218378 [0,2,0,0,0,0|1,0,0]=3 7208 B14R1.588 CCC(O)CC(=O)CCC1OCCO1 1458a_100000082924_100011218378 [0,2,0,0,0,0|2,0,0]=4 7209 B14R1.588 CCC(O)CC(=O)CCC1OCCO1 1458a_100011667805_100000740749 [0,2,0,0,0,0|2,0,0]=4 7210 B14R1.588 CCC(O)CC(=O)CCN1CCCO1 1458a_200015187630_100011218378 [0,2,0,0,0,0|2,0,0]=4 7211 B14R1.588 CCC(O)CC(=O)NCC1CCCC1 1626a_100000737975_100011667805 [0,2,0,0,0,0|2,0,0]=4 7212 B14R1.588 CCC(O)CC(=O)NCC1CCCC1 240690a_100000737975_100011667805 [0,2,0,0,0,0|2,0,0]=4 7213 B14R1.588 CCC(O)CC(=O)NCC1OCCO1 1626a_100000036311_100011667805 [0,2,0,0,0,0|2,0,0]=4 7214 B14R1.588 CCC(O)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011667805 [0,2,0,0,0,0|1,0,0]=3 7215 B14R1.588 CCC(O)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011667805 [0,2,0,0,0,0|1,0,0]=3 7216 B14R1.588 CCN(C)CC(=O)CCC1CCCC1 1458a_100116209913_100000760354 [0,2,0,0,0,0|2,0,0]=4 7217 B14R1.588 CCN(C)CC(=O)CCC1OCCO1 1458a_100116209913_100000740749 [0,2,0,0,0,0|2,0,0]=4 7218 B14R1.588 CCN(C)CC(=O)NCC1CCCC1 240690a_100000737975_100116209913 [0,2,0,0,0,0|2,0,0]=4 7219 B14R1.588 CCN(C)CC(=O)NCC1CCCC1 527a_100000737975_100116209913 [0,2,0,0,0,0|2,0,0]=4 7220 B14R1.588 CCN(C)CC(=O)NCC1CCCO1 2230a_100000225621_100000182893 [0,2,0,0,0,0|1,0,0]=3 7221 B14R1.588 CCN(C)CC(=O)NCC1CCCO1 269982a_100000225621_100000182893 [0,2,0,0,0,0|1,0,0]=3 7222 B14R1.588 CCN(C)CC(=O)NCC1OCCO1 527a_100000036311_100116209913 [0,2,0,0,0,0|2,0,0]=4 7223 B14R1.588 CCN(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100116209913 [0,2,0,0,0,0|1,0,0]=3 7224 B14R1.588 CCN(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100116209913 [0,2,0,0,0,0|1,0,0]=3 7225 B14R1.588 CC[C@H](C)CC(=O)CCC1CCCC1 1458a_100000211120_100009816398 [0,2,0,0,0,0|2,0,0]=4 7226 B14R1.588 CC[C@H](C)CC(=O)CCC1CCCO1 1458a_100011247709_100009816398 [0,2,0,0,0,0|1,0,0]=3 7227 B14R1.588 CC[C@H](C)CC(=O)CCC1OCCO1 1458a_100000082924_100009816398 [0,2,0,0,0,0|2,0,0]=4 7228 B14R1.588 CC[C@H](C)CC(=O)CCN1CCCO1 1458a_200015187630_100009816398 [0,2,0,0,0,0|2,0,0]=4 7229 B14R1.588 CNC(=O)CC(=O)CCC1CCCO1 1458a_100011247709_100000183359 [0,2,0,0,0,0|1,0,1]=4 7230 B14R1.588 COC(=O)CC(=O)CCC1CCCO1 1458a_100011247709_100000747449 [0,2,0,0,0,0|1,0,1]=4 7231 B14R1.588 COC(=O)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000211351 [0,2,0,0,0,0|1,0,1]=4 7232 B14R1.588 C[C@@H](CO)CC(=O)CCC1CCCC1 1458a_100000211120_100000059175 [0,2,0,0,0,0|2,0,0]=4 7233 B14R1.588 C[C@@H](CO)CC(=O)CCC1CCCO1 1458a_100011247709_100000059175 [0,2,0,0,0,0|1,0,0]=3 7234 B14R1.588 C[C@@H](CO)CC(=O)CCC1OCCO1 1458a_100000082924_100000059175 [0,2,0,0,0,0|2,0,0]=4 7235 B14R1.588 C[C@@H](CO)CC(=O)CCN1CCCO1 1458a_200015187630_100000059175 [0,2,0,0,0,0|2,0,0]=4 7236 B14R1.588 C[C@H](CF)NC(=O)CCC1CCCO1 11a_100102880703_100011247709 [0,2,0,0,0,0|2,0,0]=4 7237 B14R1.588 C[C@H](CF)NC(=O)CCC1CCCO1 1626a_100102880703_100011247709 [0,2,0,0,0,0|2,0,0]=4 7238 B14R1.588 C[C@H](CF)NC(=O)CCC1CCCO1 240690a_100102880703_100011247709 [0,2,0,0,0,0|2,0,0]=4 7239 B14R1.588 C[C@H](CF)NC(=O)CCC1CCCO1 527a_100102880703_100011247709 [0,2,0,0,0,0|2,0,0]=4 7240 B14R1.588 C[C@H](CF)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100102880703 [0,2,0,0,0,0|2,0,0]=4 7241 B14R1.588 C[C@H](CF)NC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100102880703 [0,2,0,0,0,0|2,0,0]=4 7242 B14R1.588 C[C@H](CF)NC(=O)NC[C@@H]1CCCO1 273464a_100102880703_100020590478 [0,2,0,0,0,0|2,0,0]=4 7243 B14R1.588 C[C@H](CF)NC(=O)NC[C@@H]1CCCO1 512a_100020590478_100102880703 [0,2,0,0,0,0|2,0,0]=4 7244 B14R1.588 C[C@H](CO)NC(=O)CCC1CCCO1 240690a_100000737577_100011247709 [0,2,0,0,0,0|2,0,0]=4 7245 B14R1.588 C[C@H](CO)NC(=O)CCC1CCCO1 527a_100000737577_100011247709 [0,2,0,0,0,0|2,0,0]=4 7246 B14R1.588 C[C@H](CO)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000737577 [0,2,0,0,0,0|2,0,0]=4 7247 B14R1.588 C[C@H](CO)NC(=O)NC[C@@H]1CCCO1 273464a_100000737577_100020590478 [0,2,0,0,0,0|2,0,0]=4 7248 B14R1.588 C[C@H](CO)NC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000737577 [0,2,0,0,0,0|2,0,0]=4 7249 B14R1.588 O=C(CO)CC(=O)NCC1CCCO1 1458a_100000210174_100000182893 [0,2,0,0,0,0|1,0,1]=4 7250 B14R1.916 CCCCC(=O)CCC1CCCN1C 1458a_100000210183_100000005710 [0,2,0,0,0,0|2,0,0]=4 7251 B14R1.916 CCCCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000210183 [0,2,0,0,0,0|2,0,0]=4 7252 B14R1.916 CCCCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000210183 [0,2,0,0,0,0|2,0,0]=4 7253 B14R1.916 CCCNC(=O)NC[C@@H]1CCCN1C 2708a_100009821018_100020643023 [0,2,0,0,0,0|2,0,0]=4 7254 B14R1.916 CCCNC(=O)NC[C@@H]1CCCN1C 2708a_100020643023_100009821018 [0,2,0,0,0,0|2,0,0]=4 7255 B14R1.916 CCCNC(=O)NC[C@@H]1CCCN1C 273464a_100009821018_100020643023 [0,2,0,0,0,0|2,0,0]=4 7256 B14R1.916 CCCNC(=O)NC[C@@H]1CCCN1C 273464a_100020643023_100009821018 [0,2,0,0,0,0|2,0,0]=4 7257 B14R1.916 CCCNC(=O)NC[C@@H]1CCCN1C 512a_100009821018_100020643023 [0,2,0,0,0,0|2,0,0]=4 7258 B14R1.916 CCCNC(=O)NC[C@@H]1CCCN1C 512a_100020643023_100009821018 [0,2,0,0,0,0|2,0,0]=4 7259 B14R1.916 CCCOC(=O)OCN1CCC[C@@H]1C 269982a_100020605311_200000139673 [0,2,0,0,0,0|2,0,0]=4 7260 B14R1.916 CCCOC(=O)OCN1CCC[C@H]1C 269982a_100015189458_200000139673 [0,2,0,0,0,0|2,0,0]=4 7261 B14R1.916 CCCOC(=O)OCN1CCC[C@H]1C 34a_100015189458_200000139673 [0,2,0,0,0,0|2,0,0]=4 7262 B14R1.916 CCOCC(=O)CCC1CCCN1C 1458a_100000211967_100000005710 [0,2,0,0,0,0|2,0,0]=4 7263 B14R1.916 CCOCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000211967 [0,2,0,0,0,0|2,0,0]=4 7264 B14R1.916 CCOCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000211967 [0,2,0,0,0,0|2,0,0]=4 7265 B14R1.916 CCSCC(=O)CCC1CCCN1C 1458a_100000230394_100000005710 [0,2,0,0,0,0|2,0,0]=4 7266 B14R1.916 CCSCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000230394 [0,2,0,0,0,0|2,0,0]=4 7267 B14R1.916 CCSCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000230394 [0,2,0,0,0,0|2,0,0]=4 7268 B14R1.916 COCCC(=O)CCC1CCCN1C 1458a_100000749529_100000005710 [0,2,0,0,0,0|2,0,0]=4 7269 B14R1.916 COCCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000749529 [0,2,0,0,0,0|2,0,0]=4 7270 B14R1.916 COCCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000749529 [0,2,0,0,0,0|2,0,0]=4 7271 B14R1.916 CSCCC(=O)CCC1CCCN1C 1458a_100000174002_100000005710 [0,2,0,0,0,0|2,0,0]=4 7272 B14R1.916 CSCCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000174002 [0,2,0,0,0,0|2,0,0]=4 7273 B14R1.916 CSCCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000174002 [0,2,0,0,0,0|2,0,0]=4 7274 B14R1.2492 CCCCC(=O)CCC1(OCCO1)C 1458a_100000210183_100000758764 [0,2,0,0,0,0|2,0,0]=4 7275 B14R1.2492 CCCCC(=O)NCC1(CCCC1)O 11a_100000737848_100000210183 [0,2,0,0,0,0|2,0,0]=4 7276 B14R1.2492 CCCCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000210183 [0,2,0,0,0,0|2,0,0]=4 7277 B14R1.2492 CCCCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000210183 [0,2,0,0,0,0|2,0,0]=4 7278 B14R1.2492 CCCCC(=O)NCC1(CCCC1)O 527a_100000737848_100000210183 [0,2,0,0,0,0|2,0,0]=4 7279 B14R1.2492 CCCCC(=O)NCC1(OCCO1)C 11a_100000691740_100000210183 [0,2,0,0,0,0|2,0,0]=4 7280 B14R1.2492 CCCCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000210183 [0,2,0,0,0,0|2,0,0]=4 7281 B14R1.2492 CCCCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000210183 [0,2,0,0,0,0|2,0,0]=4 7282 B14R1.2492 CCCCC(=O)NCC1(OCCO1)C 527a_100000691740_100000210183 [0,2,0,0,0,0|2,0,0]=4 7283 B14R1.2492 CCCNC(=O)NCC1(CCCC1)O 2708a_100000737848_100020643023 [0,2,0,0,0,0|2,0,0]=4 7284 B14R1.2492 CCCNC(=O)NCC1(CCCC1)O 2708a_100020643023_100000737848 [0,2,0,0,0,0|2,0,0]=4 7285 B14R1.2492 CCCNC(=O)NCC1(CCCC1)O 273464a_100020643023_100000737848 [0,2,0,0,0,0|2,0,0]=4 7286 B14R1.2492 CCCNC(=O)NCC1(CCCC1)O 512a_100000737848_100020643023 [0,2,0,0,0,0|2,0,0]=4 7287 B14R1.2492 CCCNC(=O)NCC1(CCCC1)O 512a_100020643023_100000737848 [0,2,0,0,0,0|2,0,0]=4 7288 B14R1.2492 CCCNC(=O)NCC1(OCCO1)C 2708a_100000691740_100020643023 [0,2,0,0,0,0|2,0,0]=4 7289 B14R1.2492 CCCNC(=O)NCC1(OCCO1)C 2708a_100020643023_100000691740 [0,2,0,0,0,0|2,0,0]=4 7290 B14R1.2492 CCCNC(=O)NCC1(OCCO1)C 273464a_100000691740_100020643023 [0,2,0,0,0,0|2,0,0]=4 7291 B14R1.2492 CCCNC(=O)NCC1(OCCO1)C 273464a_100020643023_100000691740 [0,2,0,0,0,0|2,0,0]=4 7292 B14R1.2492 CCCNC(=O)NCC1(OCCO1)C 512a_100000691740_100020643023 [0,2,0,0,0,0|2,0,0]=4 7293 B14R1.2492 CCCNC(=O)NCC1(OCCO1)C 512a_100020643023_100000691740 [0,2,0,0,0,0|2,0,0]=4 7294 B14R1.2492 CCOCC(=O)CCC1(OCCO1)C 1458a_100000211967_100000758764 [0,2,0,0,0,0|2,0,0]=4 7295 B14R1.2492 CCOCC(=O)NCC1(CCCC1)O 11a_100000737848_100000211967 [0,2,0,0,0,0|2,0,0]=4 7296 B14R1.2492 CCOCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000211967 [0,2,0,0,0,0|2,0,0]=4 7297 B14R1.2492 CCOCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000211967 [0,2,0,0,0,0|2,0,0]=4 7298 B14R1.2492 CCOCC(=O)NCC1(CCCC1)O 527a_100000737848_100000211967 [0,2,0,0,0,0|2,0,0]=4 7299 B14R1.2492 CCOCC(=O)NCC1(OCCO1)C 11a_100000691740_100000211967 [0,2,0,0,0,0|2,0,0]=4 7300 B14R1.2492 CCOCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000211967 [0,2,0,0,0,0|2,0,0]=4 7301 B14R1.2492 CCOCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000211967 [0,2,0,0,0,0|2,0,0]=4 7302 B14R1.2492 CCOCC(=O)NCC1(OCCO1)C 527a_100000691740_100000211967 [0,2,0,0,0,0|2,0,0]=4 7303 B14R1.2492 CCSCC(=O)CCC1(OCCO1)C 1458a_100000230394_100000758764 [0,2,0,0,0,0|2,0,0]=4 7304 B14R1.2492 CCSCC(=O)NCC1(CCCC1)O 11a_100000737848_100000230394 [0,2,0,0,0,0|2,0,0]=4 7305 B14R1.2492 CCSCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000230394 [0,2,0,0,0,0|2,0,0]=4 7306 B14R1.2492 CCSCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000230394 [0,2,0,0,0,0|2,0,0]=4 7307 B14R1.2492 CCSCC(=O)NCC1(CCCC1)O 527a_100000737848_100000230394 [0,2,0,0,0,0|2,0,0]=4 7308 B14R1.2492 CCSCC(=O)NCC1(OCCO1)C 11a_100000691740_100000230394 [0,2,0,0,0,0|2,0,0]=4 7309 B14R1.2492 CCSCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000230394 [0,2,0,0,0,0|2,0,0]=4 7310 B14R1.2492 CCSCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000230394 [0,2,0,0,0,0|2,0,0]=4 7311 B14R1.2492 CCSCC(=O)NCC1(OCCO1)C 527a_100000691740_100000230394 [0,2,0,0,0,0|2,0,0]=4 7312 B14R1.2492 COCCC(=O)CCC1(OCCO1)C 1458a_100000749529_100000758764 [0,2,0,0,0,0|2,0,0]=4 7313 B14R1.2492 COCCC(=O)NCC1(CCCC1)O 11a_100000737848_100000749529 [0,2,0,0,0,0|2,0,0]=4 7314 B14R1.2492 COCCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000749529 [0,2,0,0,0,0|2,0,0]=4 7315 B14R1.2492 COCCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000749529 [0,2,0,0,0,0|2,0,0]=4 7316 B14R1.2492 COCCC(=O)NCC1(CCCC1)O 527a_100000737848_100000749529 [0,2,0,0,0,0|2,0,0]=4 7317 B14R1.2492 COCCC(=O)NCC1(OCCO1)C 11a_100000691740_100000749529 [0,2,0,0,0,0|2,0,0]=4 7318 B14R1.2492 COCCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000749529 [0,2,0,0,0,0|2,0,0]=4 7319 B14R1.2492 COCCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000749529 [0,2,0,0,0,0|2,0,0]=4 7320 B14R1.2492 COCCC(=O)NCC1(OCCO1)C 527a_100000691740_100000749529 [0,2,0,0,0,0|2,0,0]=4 7321 B14R1.2492 CSCCC(=O)CCC1(OCCO1)C 1458a_100000174002_100000758764 [0,2,0,0,0,0|2,0,0]=4 7322 B14R1.2492 CSCCC(=O)NCC1(CCCC1)O 11a_100000737848_100000174002 [0,2,0,0,0,0|2,0,0]=4 7323 B14R1.2492 CSCCC(=O)NCC1(CCCC1)O 1626a_100000737848_100000174002 [0,2,0,0,0,0|2,0,0]=4 7324 B14R1.2492 CSCCC(=O)NCC1(CCCC1)O 240690a_100000737848_100000174002 [0,2,0,0,0,0|2,0,0]=4 7325 B14R1.2492 CSCCC(=O)NCC1(CCCC1)O 527a_100000737848_100000174002 [0,2,0,0,0,0|2,0,0]=4 7326 B14R1.2492 CSCCC(=O)NCC1(OCCO1)C 11a_100000691740_100000174002 [0,2,0,0,0,0|2,0,0]=4 7327 B14R1.2492 CSCCC(=O)NCC1(OCCO1)C 1626a_100000691740_100000174002 [0,2,0,0,0,0|2,0,0]=4 7328 B14R1.2492 CSCCC(=O)NCC1(OCCO1)C 240690a_100000691740_100000174002 [0,2,0,0,0,0|2,0,0]=4 7329 B14R1.2492 CSCCC(=O)NCC1(OCCO1)C 527a_100000691740_100000174002 [0,2,0,0,0,0|2,0,0]=4 7330 B14R1.3343 C#CC(CCCC)OCC1CCCO1 7a_200011217967_100000203698 [0,2,0,0,0,0|1,0,1]=4 7331 B14R1.3343 C=CC(CCCC)OCC1CCCO1 7a_200011215037_100000203698 [0,2,0,0,0,0|1,0,1]=4 7332 B14R1.3343 CCCCC(CC)OCC1CCCO1 34a_100000210270_200011216223 [0,2,0,0,0,0|1,0,1]=4 7333 B14R1.3343 CCCCC(CC)OCC1CCCO1 7a_100000210270_200011216223 [0,2,0,0,0,0|1,0,1]=4 7334 B14R1.3343 CCCCC(CC)OCC1CCCO1 7a_100011215227_100000203698 [0,2,0,0,0,0|1,0,1]=4 7335 B14R1.4526 C=C(C)CCC(=O)CCC1CCCC1 1458a_100000211120_100000730704 [0,2,0,0,0,0|2,0,0]=4 7336 B14R1.4526 C=C(C)CCC(=O)CCC1CCCC1 1458a_200000688413_100000760354 [0,2,0,0,0,0|2,0,0]=4 7337 B14R1.4526 C=C(C)CCC(=O)CCC1CCCO1 1458a_100011247709_100000730704 [0,2,0,0,0,0|1,0,0]=3 7338 B14R1.4526 C=C(C)CCC(=O)CCC1OCCO1 1458a_100000082924_100000730704 [0,2,0,0,0,0|2,0,0]=4 7339 B14R1.4526 C=C(C)CCC(=O)CCC1OCCO1 1458a_200000688413_100000740749 [0,2,0,0,0,0|2,0,0]=4 7340 B14R1.4526 C=C(C)CCC(=O)CCN1CCCO1 1458a_200015187630_100000730704 [0,2,0,0,0,0|2,0,0]=4 7341 B14R1.4526 C=C(C)CCC(=O)NCC1CCCC1 11a_100000737975_200000688413 [0,2,0,0,0,0|2,0,0]=4 7342 B14R1.4526 C=C(C)CCC(=O)NCC1CCCC1 1626a_100000737975_200000688413 [0,2,0,0,0,0|2,0,0]=4 7343 B14R1.4526 C=C(C)CCC(=O)NCC1CCCC1 240690a_100000737975_200000688413 [0,2,0,0,0,0|2,0,0]=4 7344 B14R1.4526 C=C(C)CCC(=O)NCC1CCCC1 527a_100000737975_200000688413 [0,2,0,0,0,0|2,0,0]=4 7345 B14R1.4526 C=C(C)CCC(=O)NCC1OCCO1 11a_100000036311_200000688413 [0,2,0,0,0,0|2,0,0]=4 7346 B14R1.4526 C=C(C)CCC(=O)NCC1OCCO1 1626a_100000036311_200000688413 [0,2,0,0,0,0|2,0,0]=4 7347 B14R1.4526 C=C(C)CCC(=O)NCC1OCCO1 527a_100000036311_200000688413 [0,2,0,0,0,0|2,0,0]=4 7348 B14R1.4526 C=C(C)CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_200000688413 [0,2,0,0,0,0|1,0,0]=3 7349 B14R1.4526 C=C(C)CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_200000688413 [0,2,0,0,0,0|1,0,0]=3 7350 B14R1.4526 C=C(C)CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_200000688413 [0,2,0,0,0,0|1,0,0]=3 7351 B14R1.4526 C=C(C)CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_200000688413 [0,2,0,0,0,0|1,0,0]=3 7352 B14R1.4526 C=C(C)CNC(=O)CCC1CCCO1 11a_100000765925_100011247709 [0,2,0,0,0,0|1,0,1]=4 7353 B14R1.4526 C=C(C)CNC(=O)CCC1CCCO1 1626a_100000765925_100011247709 [0,2,0,0,0,0|1,0,1]=4 7354 B14R1.4526 C=C(C)CNC(=O)CCC1CCCO1 240690a_100000765925_100011247709 [0,2,0,0,0,0|1,0,1]=4 7355 B14R1.4526 C=C(C)CNC(=O)CCC1CCCO1 527a_100000765925_100011247709 [0,2,0,0,0,0|1,0,1]=4 7356 B14R1.4526 C=C(C)CNC(=O)NC[C@@H]1CCCO1 2708a_100000765925_100020590478 [0,2,0,0,0,0|1,0,1]=4 7357 B14R1.4526 C=C(C)CNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000765925 [0,2,0,0,0,0|1,0,1]=4 7358 B14R1.4526 C=C(C)CNC(=O)NC[C@@H]1CCCO1 273464a_100000765925_100020590478 [0,2,0,0,0,0|1,0,1]=4 7359 B14R1.4526 C=C(C)CNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000765925 [0,2,0,0,0,0|1,0,1]=4 7360 B14R1.4526 C=C(C)CNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000765925 [0,2,0,0,0,0|1,0,1]=4 7361 B14R1.4526 CC(=CCC(=O)CCC1CCCO1)C 1458a_100011247709_100000761012 [0,2,0,0,0,0|1,0,1]=4 7362 B14R1.4526 CC(=CCC(=O)NC[C@@H]1CCCO1)C 11a_100020590478_100011220947 [0,2,0,0,0,0|1,0,1]=4 7363 B14R1.4526 CC(=CCC(=O)NC[C@@H]1CCCO1)C 1626a_100020590478_100011220947 [0,2,0,0,0,0|1,0,1]=4 7364 B14R1.4526 CC(=CCC(=O)NC[C@@H]1CCCO1)C 240690a_100020590478_100011220947 [0,2,0,0,0,0|1,0,1]=4 7365 B14R1.4526 CC(=CCC(=O)NC[C@@H]1CCCO1)C 527a_100020590478_100011220947 [0,2,0,0,0,0|1,0,1]=4 7366 B14R1.4526 CC(=O)NCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000194580 [0,2,0,0,0,0|1,0,1]=4 7367 B14R1.4526 CC(=O)NCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000194580 [0,2,0,0,0,0|1,0,1]=4 7368 B14R1.4526 CC(=O)NCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000194580 [0,2,0,0,0,0|1,0,1]=4 7369 B14R1.4526 CC(=O)NCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000194580 [0,2,0,0,0,0|1,0,1]=4 7370 B14R1.4526 CC(=O)OCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000183556 [0,2,0,0,0,0|1,0,1]=4 7371 B14R1.4526 CC(=O)OCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000183556 [0,2,0,0,0,0|1,0,1]=4 7372 B14R1.4526 CC(=O)OCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000183556 [0,2,0,0,0,0|1,0,1]=4 7373 B14R1.4526 CC(=O)SCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000049016 [0,2,0,0,0,0|1,0,1]=4 7374 B14R1.4526 CC(=O)SCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000049016 [0,2,0,0,0,0|1,0,1]=4 7375 B14R1.4526 CC(=O)SCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000049016 [0,2,0,0,0,0|1,0,1]=4 7376 B14R1.4526 CC(C)C=CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100016268746 [0,2,0,0,0,0|1,0,1]=4 7377 B14R1.4526 CC(C)C=CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100016268746 [0,2,0,0,0,0|1,0,1]=4 7378 B14R1.4526 CC(C)C=CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100016268746 [0,2,0,0,0,0|1,0,1]=4 7379 B14R1.4526 CC(C)CCC(=O)CCC1CCCC1 1458a_100000181311_100000760354 [0,2,0,0,0,0|2,0,0]=4 7380 B14R1.4526 CC(C)CCC(=O)CCC1CCCC1 1458a_100000211120_100000210312 [0,2,0,0,0,0|2,0,0]=4 7381 B14R1.4526 CC(C)CCC(=O)CCC1CCCO1 1458a_100011247709_100000210312 [0,2,0,0,0,0|1,0,0]=3 7382 B14R1.4526 CC(C)CCC(=O)CCC1OCCO1 1458a_100000082924_100000210312 [0,2,0,0,0,0|2,0,0]=4 7383 B14R1.4526 CC(C)CCC(=O)CCC1OCCO1 1458a_100000181311_100000740749 [0,2,0,0,0,0|2,0,0]=4 7384 B14R1.4526 CC(C)CCC(=O)CCN1CCCO1 1458a_200015187630_100000210312 [0,2,0,0,0,0|2,0,0]=4 7385 B14R1.4526 CC(C)CCC(=O)NCC1CCCC1 11a_100000737975_100000181311 [0,2,0,0,0,0|2,0,0]=4 7386 B14R1.4526 CC(C)CCC(=O)NCC1CCCC1 1626a_100000737975_100000181311 [0,2,0,0,0,0|2,0,0]=4 7387 B14R1.4526 CC(C)CCC(=O)NCC1CCCC1 240690a_100000737975_100000181311 [0,2,0,0,0,0|2,0,0]=4 7388 B14R1.4526 CC(C)CCC(=O)NCC1CCCC1 527a_100000737975_100000181311 [0,2,0,0,0,0|2,0,0]=4 7389 B14R1.4526 CC(C)CCC(=O)NCC1OCCO1 11a_100000036311_100000181311 [0,2,0,0,0,0|2,0,0]=4 7390 B14R1.4526 CC(C)CCC(=O)NCC1OCCO1 1626a_100000036311_100000181311 [0,2,0,0,0,0|2,0,0]=4 7391 B14R1.4526 CC(C)CCC(=O)NCC1OCCO1 527a_100000036311_100000181311 [0,2,0,0,0,0|2,0,0]=4 7392 B14R1.4526 CC(C)CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000181311 [0,2,0,0,0,0|1,0,0]=3 7393 B14R1.4526 CC(C)CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000181311 [0,2,0,0,0,0|1,0,0]=3 7394 B14R1.4526 CC(C)CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000181311 [0,2,0,0,0,0|1,0,0]=3 7395 B14R1.4526 CC(C)CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000181311 [0,2,0,0,0,0|1,0,0]=3 7396 B14R1.4526 CC(C)CCC(C)OCC1CCCO1 34a_100000210270_100011261404 [0,2,0,0,0,0|1,0,1]=4 7397 B14R1.4526 CC(C)CCC(C)OCC1CCCO1 7a_100011215350_100000203698 [0,2,0,0,0,0|1,0,1]=4 7398 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 11a_100000210953_100000211120 [0,2,0,0,0,0|2,0,0]=4 7399 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 1626a_100000210953_100000211120 [0,2,0,0,0,0|2,0,0]=4 7400 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 240690a_100000210953_100000211120 [0,2,0,0,0,0|2,0,0]=4 7401 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 527a_100000210953_100000211120 [0,2,0,0,0,0|2,0,0]=4 7402 B14R1.4526 CC(C)CNC(=O)CCC1CCCO1 11a_100000210953_100011247709 [0,2,0,0,0,0|1,0,0]=3 7403 B14R1.4526 CC(C)CNC(=O)CCC1CCCO1 1626a_100000210953_100011247709 [0,2,0,0,0,0|1,0,0]=3 7404 B14R1.4526 CC(C)CNC(=O)CCC1CCCO1 240690a_100000210953_100011247709 [0,2,0,0,0,0|1,0,0]=3 7405 B14R1.4526 CC(C)CNC(=O)CCC1CCCO1 527a_100000210953_100011247709 [0,2,0,0,0,0|1,0,0]=3 7406 B14R1.4526 CC(C)CNC(=O)CCN1CCCO1 240690a_100000210953_200015187630 [0,2,0,0,0,0|2,0,0]=4 7407 B14R1.4526 CC(C)CNC(=O)COC1CCCO1 34a_100000085407_100000183291 [0,2,0,0,0,0|2,0,0]=4 7408 B14R1.4526 CC(C)CNC(=O)NCC1CCCC1 2708a_100000210953_100000737975 [0,2,0,0,0,0|2,0,0]=4 7409 B14R1.4526 CC(C)CNC(=O)NCC1CCCC1 2708a_100000737975_100000210953 [0,2,0,0,0,0|2,0,0]=4 7410 B14R1.4526 CC(C)CNC(=O)NCC1CCCC1 273464a_100000210953_100000737975 [0,2,0,0,0,0|2,0,0]=4 7411 B14R1.4526 CC(C)CNC(=O)NCC1CCCC1 273464a_100000737975_100000210953 [0,2,0,0,0,0|2,0,0]=4 7412 B14R1.4526 CC(C)CNC(=O)NCC1CCCC1 512a_100000210953_100000737975 [0,2,0,0,0,0|2,0,0]=4 7413 B14R1.4526 CC(C)CNC(=O)NCC1CCCC1 512a_100000737975_100000210953 [0,2,0,0,0,0|2,0,0]=4 7414 B14R1.4526 CC(C)CNC(=O)NCC1OCCO1 2708a_100000036311_100000210953 [0,2,0,0,0,0|2,0,0]=4 7415 B14R1.4526 CC(C)CNC(=O)NCC1OCCO1 2708a_100000210953_100000036311 [0,2,0,0,0,0|2,0,0]=4 7416 B14R1.4526 CC(C)CNC(=O)NCC1OCCO1 273464a_100000036311_100000210953 [0,2,0,0,0,0|2,0,0]=4 7417 B14R1.4526 CC(C)CNC(=O)NCC1OCCO1 273464a_100000210953_100000036311 [0,2,0,0,0,0|2,0,0]=4 7418 B14R1.4526 CC(C)CNC(=O)NCC1OCCO1 512a_100000036311_100000210953 [0,2,0,0,0,0|2,0,0]=4 7419 B14R1.4526 CC(C)CNC(=O)NC[C@@H]1CCCO1 2708a_100000210953_100020590478 [0,2,0,0,0,0|1,0,0]=3 7420 B14R1.4526 CC(C)CNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000210953 [0,2,0,0,0,0|1,0,0]=3 7421 B14R1.4526 CC(C)CNC(=O)NC[C@@H]1CCCO1 273464a_100000210953_100020590478 [0,2,0,0,0,0|1,0,0]=3 7422 B14R1.4526 CC(C)CNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000210953 [0,2,0,0,0,0|1,0,0]=3 7423 B14R1.4526 CC(C)CNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000210953 [0,2,0,0,0,0|1,0,0]=3 7424 B14R1.4526 CC(C)NCC(=O)NCC1CCCO1 2230a_100138425928_100000182893 [0,2,0,0,0,0|1,0,0]=3 7425 B14R1.4526 CC(C)NNC(=O)CCC1CCCO1 22a_100000741168_100011247709 [0,2,0,0,0,0|2,0,0]=4 7426 B14R1.4526 CC(C)NNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000741168 [0,2,0,0,0,0|2,0,0]=4 7427 B14R1.4526 CC(C)NNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000741168 [0,2,0,0,0,0|2,0,0]=4 7428 B14R1.4526 CC(C)OCC(=O)CCC1CCCC1 1458a_100000745533_100000760354 [0,2,0,0,0,0|2,0,0]=4 7429 B14R1.4526 CC(C)OCC(=O)CCC1OCCO1 1458a_100000745533_100000740749 [0,2,0,0,0,0|2,0,0]=4 7430 B14R1.4526 CC(C)OCC(=O)NCC1CCCC1 11a_100000737975_100000745533 [0,2,0,0,0,0|2,0,0]=4 7431 B14R1.4526 CC(C)OCC(=O)NCC1CCCC1 1626a_100000737975_100000745533 [0,2,0,0,0,0|2,0,0]=4 7432 B14R1.4526 CC(C)OCC(=O)NCC1CCCC1 240690a_100000737975_100000745533 [0,2,0,0,0,0|2,0,0]=4 7433 B14R1.4526 CC(C)OCC(=O)NCC1CCCC1 527a_100000737975_100000745533 [0,2,0,0,0,0|2,0,0]=4 7434 B14R1.4526 CC(C)OCC(=O)NCC1OCCO1 11a_100000036311_100000745533 [0,2,0,0,0,0|2,0,0]=4 7435 B14R1.4526 CC(C)OCC(=O)NCC1OCCO1 1626a_100000036311_100000745533 [0,2,0,0,0,0|2,0,0]=4 7436 B14R1.4526 CC(C)OCC(=O)NCC1OCCO1 527a_100000036311_100000745533 [0,2,0,0,0,0|2,0,0]=4 7437 B14R1.4526 CC(C)OCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000745533 [0,2,0,0,0,0|1,0,0]=3 7438 B14R1.4526 CC(C)OCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000745533 [0,2,0,0,0,0|1,0,0]=3 7439 B14R1.4526 CC(C)OCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000745533 [0,2,0,0,0,0|1,0,0]=3 7440 B14R1.4526 CC(C)OCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000745533 [0,2,0,0,0,0|1,0,0]=3 7441 B14R1.4526 CC(C)SCC(=O)CCC1CCCC1 1458a_100000241585_100000760354 [0,2,0,0,0,0|2,0,0]=4 7442 B14R1.4526 CC(C)SCC(=O)CCC1OCCO1 1458a_100000241585_100000740749 [0,2,0,0,0,0|2,0,0]=4 7443 B14R1.4526 CC(C)SCC(=O)NCC1CCCC1 11a_100000737975_100000241585 [0,2,0,0,0,0|2,0,0]=4 7444 B14R1.4526 CC(C)SCC(=O)NCC1CCCC1 1626a_100000737975_100000241585 [0,2,0,0,0,0|2,0,0]=4 7445 B14R1.4526 CC(C)SCC(=O)NCC1CCCC1 240690a_100000737975_100000241585 [0,2,0,0,0,0|2,0,0]=4 7446 B14R1.4526 CC(C)SCC(=O)NCC1CCCC1 527a_100000737975_100000241585 [0,2,0,0,0,0|2,0,0]=4 7447 B14R1.4526 CC(C)SCC(=O)NCC1CCCO1 62a_100000182893_100000210206 [0,2,0,0,0,0|1,0,0]=3 7448 B14R1.4526 CC(C)SCC(=O)NCC1CCCO1 62a_100000210206_100000182893 [0,2,0,0,0,0|1,0,0]=3 7449 B14R1.4526 CC(C)SCC(=O)NCC1OCCO1 11a_100000036311_100000241585 [0,2,0,0,0,0|2,0,0]=4 7450 B14R1.4526 CC(C)SCC(=O)NCC1OCCO1 1626a_100000036311_100000241585 [0,2,0,0,0,0|2,0,0]=4 7451 B14R1.4526 CC(C)SCC(=O)NCC1OCCO1 527a_100000036311_100000241585 [0,2,0,0,0,0|2,0,0]=4 7452 B14R1.4526 CC(C)SCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000241585 [0,2,0,0,0,0|1,0,0]=3 7453 B14R1.4526 CC(C)SCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000241585 [0,2,0,0,0,0|1,0,0]=3 7454 B14R1.4526 CC(C)SCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000241585 [0,2,0,0,0,0|1,0,0]=3 7455 B14R1.4526 CC(C)SCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000241585 [0,2,0,0,0,0|1,0,0]=3 7456 B14R1.4526 CC(O)CCC(=O)CCC1CCCC1 1458a_100000211120_100012276601 [0,2,0,0,0,0|2,0,0]=4 7457 B14R1.4526 CC(O)CCC(=O)CCC1CCCO1 1458a_100011247709_100012276601 [0,2,0,0,0,0|1,0,0]=3 7458 B14R1.4526 CC(O)CCC(=O)CCC1OCCO1 1458a_100000082924_100012276601 [0,2,0,0,0,0|2,0,0]=4 7459 B14R1.4526 CC(O)CCC(=O)CCN1CCCO1 1458a_200015187630_100012276601 [0,2,0,0,0,0|2,0,0]=4 7460 B14R1.4526 CC(O)CCC(=O)NCC1CCCC1 1626a_100000737975_100000718519 [0,2,0,0,0,0|2,0,0]=4 7461 B14R1.4526 CC(O)CCC(=O)NCC1OCCO1 1626a_100000036311_100000718519 [0,2,0,0,0,0|2,0,0]=4 7462 B14R1.4526 CC(O)CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000718519 [0,2,0,0,0,0|1,0,0]=3 7463 B14R1.4526 CC(O)CNC(=O)CCC1CCCC1 11a_100000210904_100000211120 [0,2,0,0,0,0|2,0,0]=4 7464 B14R1.4526 CC(O)CNC(=O)CCC1CCCC1 240690a_100000210904_100000211120 [0,2,0,0,0,0|2,0,0]=4 7465 B14R1.4526 CC(O)CNC(=O)CCC1CCCC1 527a_100000210904_100000211120 [0,2,0,0,0,0|2,0,0]=4 7466 B14R1.4526 CC(O)CNC(=O)CCC1CCCO1 11a_100000210904_100011247709 [0,2,0,0,0,0|1,0,0]=3 7467 B14R1.4526 CC(O)CNC(=O)CCC1CCCO1 240690a_100000210904_100011247709 [0,2,0,0,0,0|1,0,0]=3 7468 B14R1.4526 CC(O)CNC(=O)CCC1CCCO1 527a_100000210904_100011247709 [0,2,0,0,0,0|1,0,0]=3 7469 B14R1.4526 CC(O)CNC(=O)CCN1CCCO1 240690a_100000210904_200015187630 [0,2,0,0,0,0|2,0,0]=4 7470 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 2708a_100000737975_100000210904 [0,2,0,0,0,0|2,0,0]=4 7471 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 273464a_100000210904_100000737975 [0,2,0,0,0,0|2,0,0]=4 7472 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 273464a_100000737975_100000210904 [0,2,0,0,0,0|2,0,0]=4 7473 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 512a_100000210904_100000737975 [0,2,0,0,0,0|2,0,0]=4 7474 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 512a_100000737975_100000210904 [0,2,0,0,0,0|2,0,0]=4 7475 B14R1.4526 CC(O)CNC(=O)NCC1OCCO1 2708a_100000036311_100000210904 [0,2,0,0,0,0|2,0,0]=4 7476 B14R1.4526 CC(O)CNC(=O)NCC1OCCO1 273464a_100000036311_100000210904 [0,2,0,0,0,0|2,0,0]=4 7477 B14R1.4526 CC(O)CNC(=O)NCC1OCCO1 273464a_100000210904_100000036311 [0,2,0,0,0,0|2,0,0]=4 7478 B14R1.4526 CC(O)CNC(=O)NCC1OCCO1 512a_100000036311_100000210904 [0,2,0,0,0,0|2,0,0]=4 7479 B14R1.4526 CC(O)CNC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000210904 [0,2,0,0,0,0|1,0,0]=3 7480 B14R1.4526 CC(O)CNC(=O)NC[C@@H]1CCCO1 273464a_100000210904_100020590478 [0,2,0,0,0,0|1,0,0]=3 7481 B14R1.4526 CC(O)CNC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000210904 [0,2,0,0,0,0|1,0,0]=3 7482 B14R1.4526 CC(O)CNC(=O)NC[C@@H]1CCCO1 512a_100020590478_100000210904 [0,2,0,0,0,0|1,0,0]=3 7483 B14R1.4526 CN(C)CCC(=O)NCC1CCCC1 11a_100000737975_100000689311 [0,2,0,0,0,0|2,0,0]=4 7484 B14R1.4526 CN(C)CCC(=O)NCC1CCCC1 240690a_100000737975_100000689311 [0,2,0,0,0,0|2,0,0]=4 7485 B14R1.4526 CN(C)CCC(=O)NCC1CCCC1 527a_100000737975_100000689311 [0,2,0,0,0,0|2,0,0]=4 7486 B14R1.4526 CN(C)CCC(=O)NCC1OCCO1 11a_100000036311_100000689311 [0,2,0,0,0,0|2,0,0]=4 7487 B14R1.4526 CN(C)CCC(=O)NCC1OCCO1 527a_100000036311_100000689311 [0,2,0,0,0,0|2,0,0]=4 7488 B14R1.4526 CN(C)CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000689311 [0,2,0,0,0,0|1,0,0]=3 7489 B14R1.4526 CN(C)CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000689311 [0,2,0,0,0,0|1,0,0]=3 7490 B14R1.4526 CN(C)CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000689311 [0,2,0,0,0,0|1,0,0]=3 7491 B14R1.4526 C[S+](C)CCC(=O)CCC1CCCC1 1458a_100009452791_100000760354 [0,2,0,0,0,0|2,0,0]=4 7492 B14R1.4526 C[S+](C)CCC(=O)CCC1OCCO1 1458a_100009452791_100000740749 [0,2,0,0,0,0|2,0,0]=4 7493 B14R1.4526 C[S+](C)CCC(=O)NCC1CCCC1 11a_100000737975_100009452791 [0,2,0,0,0,0|2,0,0]=4 7494 B14R1.4526 C[S+](C)CCC(=O)NCC1CCCC1 1626a_100000737975_100009452791 [0,2,0,0,0,0|2,0,0]=4 7495 B14R1.4526 C[S+](C)CCC(=O)NCC1CCCC1 240690a_100000737975_100009452791 [0,2,0,0,0,0|2,0,0]=4 7496 B14R1.4526 C[S+](C)CCC(=O)NCC1OCCO1 11a_100000036311_100009452791 [0,2,0,0,0,0|2,0,0]=4 7497 B14R1.4526 C[S+](C)CCC(=O)NCC1OCCO1 1626a_100000036311_100009452791 [0,2,0,0,0,0|2,0,0]=4 7498 B14R1.4526 C[S+](C)CCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100009452791 [0,2,0,0,0,0|1,0,0]=3 7499 B14R1.4526 C[S+](C)CCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100009452791 [0,2,0,0,0,0|1,0,0]=3 7500 B14R1.4526 C[S+](C)CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100009452791 [0,2,0,0,0,0|1,0,0]=3 7501 B14R1.4526 NC(=O)CCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011215257 [0,2,0,0,0,0|1,0,1]=4 7502 B14R1.4526 NC(=O)CCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100011215257 [0,2,0,0,0,0|1,0,1]=4 7503 B14R1.4526 O=C(CCC1CCCO1)NCC(F)F 11a_100000765723_100011247709 [0,2,0,0,0,0|2,0,0]=4 7504 B14R1.4526 O=C(CCC1CCCO1)NCC(F)F 1626a_100000765723_100011247709 [0,2,0,0,0,0|2,0,0]=4 7505 B14R1.4526 O=C(CCC1CCCO1)NCC(F)F 240690a_100000765723_100011247709 [0,2,0,0,0,0|2,0,0]=4 7506 B14R1.4526 O=C(CCC1CCCO1)NCC(F)F 527a_100000765723_100011247709 [0,2,0,0,0,0|2,0,0]=4 7507 B14R1.4526 O=C(CC[N+](=O)[O-])NC[C@@H]1CCCO1 11a_100020590478_200000064761 [0,2,0,0,0,0|2,0,0]=4 7508 B14R1.4526 O=C(CC[N+](=O)[O-])NC[C@@H]1CCCO1 1626a_100020590478_200000064761 [0,2,0,0,0,0|2,0,0]=4 7509 B14R1.4526 O=C(CC[N+](=O)[O-])NC[C@@H]1CCCO1 240690a_100020590478_200000064761 [0,2,0,0,0,0|2,0,0]=4 7510 B14R1.4526 O=C(COC(F)F)NC[C@@H]1CCCO1 11a_100020590478_200000719455 [0,2,0,0,0,0|2,0,0]=4 7511 B14R1.4526 O=C(COC(F)F)NC[C@@H]1CCCO1 1626a_100020590478_200000719455 [0,2,0,0,0,0|2,0,0]=4 7512 B14R1.4526 O=C(COC(F)F)NC[C@@H]1CCCO1 240690a_100020590478_200000719455 [0,2,0,0,0,0|2,0,0]=4 7513 B14R1.4526 O=C(COC(F)F)NC[C@@H]1CCCO1 527a_100020590478_200000719455 [0,2,0,0,0,0|2,0,0]=4 7514 B14R1.4526 O=C(CSC(F)F)NC[C@@H]1CCCO1 11a_100020590478_114828291038 [0,2,0,0,0,0|2,0,0]=4 7515 B14R1.4526 O=C(CSC(F)F)NC[C@@H]1CCCO1 1626a_100020590478_114828291038 [0,2,0,0,0,0|2,0,0]=4 7516 B14R1.4526 O=C(CSC(F)F)NC[C@@H]1CCCO1 240690a_100020590478_114828291038 [0,2,0,0,0,0|2,0,0]=4 7517 B14R1.4526 O=C(CSC(F)F)NC[C@@H]1CCCO1 527a_100020590478_114828291038 [0,2,0,0,0,0|2,0,0]=4 7518 B14R1.4526 O=C(NCC(F)F)NC[C@@H]1CCCO1 2708a_100020590478_100000765723 [0,2,0,0,0,0|2,0,0]=4 7519 B14R1.4526 O=C(NCC(F)F)NC[C@@H]1CCCO1 273464a_100000765723_100020590478 [0,2,0,0,0,0|2,0,0]=4 7520 B14R1.4526 O=C(NCC(F)F)NC[C@@H]1CCCO1 273464a_100020590478_100000765723 [0,2,0,0,0,0|2,0,0]=4 7521 B14R1.4526 O=C(NCC(F)F)NC[C@@H]1CCCO1 512a_100020590478_100000765723 [0,2,0,0,0,0|2,0,0]=4 7522 B14R1.4531 CC(C)(CCCBr)OCC1CCCO1 7a_100009888830_100000203698 [0,2,0,0,0,0|1,0,1]=4 7523 B14R1.4531 CCCCC(C)(C)OCC1CCCO1 7a_100011219641_100000203698 [0,2,0,0,0,0|1,0,1]=4 7524 B14R1.4531 CCCCS(=O)(=O)NC[C@@H]1CCCO1 270084a_100020590478_100000212082 [0,2,0,0,0,0|2,0,0]=4 7525 B14R1.4531 CCCCS(=O)(=O)NC[C@@H]1CCCO1 274078a_100020590478_100000212082 [0,2,0,0,0,0|2,0,0]=4 7526 B14R1.4531 CCCCS(=O)(=O)NC[C@@H]1CCCO1 40a_100020590478_100000054263 [0,2,0,0,0,0|2,0,0]=4 7527 B14R1.4531 COCCS(=O)(=O)NC[C@@H]1CCCO1 270084a_100020590478_100000745348 [0,2,0,0,0,0|2,0,0]=4 7528 B14R1.4531 COCCS(=O)(=O)NC[C@@H]1CCCO1 274078a_100020590478_100000745348 [0,2,0,0,0,0|2,0,0]=4 7529 B14R1.4531 O=S(=O)(CCCCl)NC[C@@H]1CCCO1 270084a_100020590478_100000211827 [0,2,0,0,0,0|2,0,0]=4 7530 B14R1.4531 O=S(=O)(CCCF)NC[C@@H]1CCCO1 270084a_100020590478_200000759752 [0,2,0,0,0,0|2,0,0]=4 7531 B14R1.4531 O=S(=O)(CCCF)NC[C@@H]1CCCO1 274078a_100020590478_200000759752 [0,2,0,0,0,0|2,0,0]=4 7532 B14R1.167 CC(C)CC(=O)CCC1CCCN1C 1458a_100000210554_100000005710 [0,2,0,0,0,0|2,0,0]=4 7533 B14R1.167 CC(C)CC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000210554 [0,2,0,0,0,0|2,0,0]=4 7534 B14R1.167 CC(C)CC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000210554 [0,2,0,0,0,0|2,0,0]=4 7535 B14R1.167 C[C@@H](O)CC(=O)CCC1CCCN1C 1458a_100011933948_100000005710 [0,2,0,0,0,0|2,0,0]=4 7536 B14R1.167 C[C@@H](O)CC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100011933948 [0,2,0,0,0,0|2,0,0]=4 7537 B14R1.947 CCCC(=O)NCC1CCCN1CC 11a_100000211693_100000211992 [0,2,0,0,0,0|2,0,0]=4 7538 B14R1.947 CCCC(=O)NCC1CCCN1CC 1626a_100000211693_100000211992 [0,2,0,0,0,0|2,0,0]=4 7539 B14R1.947 CCCC(=O)NCC1CCCN1CC 240690a_100000211693_100000211992 [0,2,0,0,0,0|2,0,0]=4 7540 B14R1.947 CCCC(=O)NCC1CCCN1CC 527a_100000211693_100000211992 [0,2,0,0,0,0|2,0,0]=4 7541 B14R1.947 CCCC(=O)OCN1CCCC1C#N 2230a_100000701862_100000034017 [0,2,0,0,0,0|2,0,0]=4 7542 B14R1.947 CCCC(=O)OCN1CCCC1CC 2230a_100000754278_100000034017 [0,2,0,0,0,0|2,0,0]=4 7543 B14R1.947 CCCC(=O)OCN1CCCC1CC 269982a_100000754278_100000034017 [0,2,0,0,0,0|2,0,0]=4 7544 B14R1.947 CCCC(=O)OCN1CCCC1CC 34a_100000754278_100000034017 [0,2,0,0,0,0|2,0,0]=4 7545 B14R1.947 CCCC(=O)OCN1CCC[C@@H]1C#N 2230a_106645074975_100000034017 [0,2,0,0,0,0|2,0,0]=4 7546 B14R1.947 CCCC(=O)OCN1CCC[C@@H]1C#N 269982a_106645074975_100000034017 [0,2,0,0,0,0|2,0,0]=4 7547 B14R1.947 CCCC(=O)OCN1CCC[C@@H]1CO 2230a_100000745186_100000034017 [0,2,0,0,0,0|2,0,0]=4 7548 B14R1.947 CCCC(=O)OCN1CCC[C@@H]1CO 269982a_100000745186_100000034017 [0,2,0,0,0,0|2,0,0]=4 7549 B14R1.947 CCCC(=O)OCN1CCC[C@@H]1CO 34a_100000745186_100000034017 [0,2,0,0,0,0|2,0,0]=4 7550 B14R1.987 CCC(C)C(=O)CCC1CCCN1C 1458a_100011192722_100000005710 [0,2,0,0,0,0|2,0,0]=4 7551 B14R1.987 CCC(C)C(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100011192722 [0,2,0,0,0,0|2,0,0]=4 7552 B14R1.987 CCC(C)C(=O)NC[C@@H]1CCCN1C 527a_100009821018_100011192722 [0,2,0,0,0,0|2,0,0]=4 7553 B14R1.987 CCC(O)C(=O)CCC1CCCN1C 1458a_100011196387_100000005710 [0,2,0,0,0,0|2,0,0]=4 7554 B14R1.987 CCC(O)C(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100011196387 [0,2,0,0,0,0|2,0,0]=4 7555 B14R1.3311 CCCC(=O)OCN1CCCC1(C)C 2230a_100000761399_100000034017 [0,2,0,0,0,0|2,0,0]=4 7556 B14R1.3311 CCCC(=O)OCN1CCCC1(C)C 269982a_100000761399_100000034017 [0,2,0,0,0,0|2,0,0]=4 7557 B14R1.3311 CCCC(=O)OCN1CCCC1(C)C 34a_100000761399_100000034017 [0,2,0,0,0,0|2,0,0]=4 7558 B14R1.18023 CCCC(=O)OCN1C(CCC1C)C 2230a_100000687148_100000034017 [0,2,0,0,0,0|2,0,0]=4 7559 B14R1.18023 CCCC(=O)OCN1C(CCC1C)C 269982a_100000687148_100000034017 [0,2,0,0,0,0|2,0,0]=4 7560 B14R1.18023 CCCC(=O)OCN1C(CCC1C)C 34a_100000687148_100000034017 [0,2,0,0,0,0|2,0,0]=4 7561 B14R1.322 CC(C)(CF)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000138116 [0,2,0,0,0,0|2,0,0]=4 7562 B14R1.322 CC(C)(CF)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000138116 [0,2,0,0,0,0|2,0,0]=4 7563 B14R1.322 CC(C)(CF)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000138116 [0,2,0,0,0,0|2,0,0]=4 7564 B14R1.322 CC(C)(CF)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000138116 [0,2,0,0,0,0|2,0,0]=4 7565 B14R1.322 CC(C)(CO)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000749806 [0,2,0,0,0,0|2,0,0]=4 7566 B14R1.322 CC(C)(CO)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000749806 [0,2,0,0,0,0|2,0,0]=4 7567 B14R1.322 CC(C)(CO)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000749806 [0,2,0,0,0,0|2,0,0]=4 7568 B14R1.322 CCC(C)(C)C(=O)CCC1CCCC1 1458a_100000749717_100000760354 [0,2,0,0,0,0|2,0,0]=4 7569 B14R1.322 CCC(C)(C)C(=O)CCC1OCCO1 1458a_100000749717_100000740749 [0,2,0,0,0,0|2,0,0]=4 7570 B14R1.322 CCC(C)(C)C(=O)NCC1CCCC1 11a_100000737975_100000749717 [0,2,0,0,0,0|2,0,0]=4 7571 B14R1.322 CCC(C)(C)C(=O)NCC1CCCC1 1626a_100000737975_100000749717 [0,2,0,0,0,0|2,0,0]=4 7572 B14R1.322 CCC(C)(C)C(=O)NCC1CCCC1 240690a_100000737975_100000749717 [0,2,0,0,0,0|2,0,0]=4 7573 B14R1.322 CCC(C)(C)C(=O)NCC1CCCC1 527a_100000737975_100000749717 [0,2,0,0,0,0|2,0,0]=4 7574 B14R1.322 CCC(C)(C)C(=O)NCC1OCCO1 11a_100000036311_100000749717 [0,2,0,0,0,0|2,0,0]=4 7575 B14R1.322 CCC(C)(C)C(=O)NCC1OCCO1 1626a_100000036311_100000749717 [0,2,0,0,0,0|2,0,0]=4 7576 B14R1.322 CCC(C)(C)C(=O)NCC1OCCO1 527a_100000036311_100000749717 [0,2,0,0,0,0|2,0,0]=4 7577 B14R1.322 CCC(C)(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000749717 [0,2,0,0,0,0|1,0,0]=3 7578 B14R1.322 CCC(C)(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000749717 [0,2,0,0,0,0|1,0,0]=3 7579 B14R1.322 CCC(C)(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000749717 [0,2,0,0,0,0|1,0,0]=3 7580 B14R1.322 CCC(C)(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000749717 [0,2,0,0,0,0|1,0,0]=3 7581 B14R1.322 CCC(C)(O)C(=O)CCC1CCCC1 1458a_100011219770_100000760354 [0,2,0,0,0,0|2,0,0]=4 7582 B14R1.322 CCC(C)(O)C(=O)CCC1OCCO1 1458a_100011219770_100000740749 [0,2,0,0,0,0|2,0,0]=4 7583 B14R1.322 CCC(C)(O)C(=O)NCC1CCCC1 240690a_100000737975_100011219770 [0,2,0,0,0,0|2,0,0]=4 7584 B14R1.322 CCC(C)(O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100011219770 [0,2,0,0,0,0|1,0,0]=3 7585 B14R1.322 CCC(F)(F)C(=O)CCC1CCCC1 1458a_100000061896_100000760354 [0,2,0,0,0,0|2,0,0]=4 7586 B14R1.322 CCC(F)(F)C(=O)CCC1OCCO1 1458a_100000061896_100000740749 [0,2,0,0,0,0|2,0,0]=4 7587 B14R1.322 CCC(F)(F)C(=O)NCC1CCCC1 11a_100000737975_100000061896 [0,2,0,0,0,0|2,0,0]=4 7588 B14R1.322 CCC(F)(F)C(=O)NCC1CCCC1 1626a_100000737975_100000061896 [0,2,0,0,0,0|2,0,0]=4 7589 B14R1.322 CCC(F)(F)C(=O)NCC1CCCC1 240690a_100000737975_100000061896 [0,2,0,0,0,0|2,0,0]=4 7590 B14R1.322 CCC(F)(F)C(=O)NCC1CCCC1 527a_100000737975_100000061896 [0,2,0,0,0,0|2,0,0]=4 7591 B14R1.322 CCC(F)(F)C(=O)NCC1OCCO1 11a_100000036311_100000061896 [0,2,0,0,0,0|2,0,0]=4 7592 B14R1.322 CCC(F)(F)C(=O)NCC1OCCO1 1626a_100000036311_100000061896 [0,2,0,0,0,0|2,0,0]=4 7593 B14R1.322 CCC(F)(F)C(=O)NCC1OCCO1 527a_100000036311_100000061896 [0,2,0,0,0,0|2,0,0]=4 7594 B14R1.322 CCC(F)(F)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000061896 [0,2,0,0,0,0|1,0,0]=3 7595 B14R1.322 CCC(F)(F)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000061896 [0,2,0,0,0,0|1,0,0]=3 7596 B14R1.322 CCC(F)(F)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000061896 [0,2,0,0,0,0|1,0,0]=3 7597 B14R1.322 CCC(F)(F)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000061896 [0,2,0,0,0,0|1,0,0]=3 7598 B14R1.322 COC(C)(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000753492 [0,2,0,0,0,0|2,0,0]=4 7599 B14R1.322 COC(C)(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000753492 [0,2,0,0,0,0|2,0,0]=4 7600 B14R1.322 COC(C)(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000753492 [0,2,0,0,0,0|2,0,0]=4 7601 B14R1.322 COC(C)(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000753492 [0,2,0,0,0,0|2,0,0]=4 7602 B14R1.411 CCC(CC)C(=O)CCC1CCCC1 1458a_100000211120_100000210505 [0,2,0,0,0,0|2,0,0]=4 7603 B14R1.411 CCC(CC)C(=O)CCC1CCCC1 1458a_100000211163_100000760354 [0,2,0,0,0,0|2,0,0]=4 7604 B14R1.411 CCC(CC)C(=O)CCC1CCCO1 1458a_100011247709_100000210505 [0,2,0,0,0,0|1,0,0]=3 7605 B14R1.411 CCC(CC)C(=O)CCC1OCCO1 1458a_100000082924_100000210505 [0,2,0,0,0,0|2,0,0]=4 7606 B14R1.411 CCC(CC)C(=O)CCC1OCCO1 1458a_100000211163_100000740749 [0,2,0,0,0,0|2,0,0]=4 7607 B14R1.411 CCC(CC)C(=O)CCN1CCCO1 1458a_200015187630_100000210505 [0,2,0,0,0,0|2,0,0]=4 7608 B14R1.411 CCC(CC)C(=O)NCC1CCCC1 11a_100000737975_100000211163 [0,2,0,0,0,0|2,0,0]=4 7609 B14R1.411 CCC(CC)C(=O)NCC1CCCC1 1626a_100000737975_100000211163 [0,2,0,0,0,0|2,0,0]=4 7610 B14R1.411 CCC(CC)C(=O)NCC1CCCC1 240690a_100000737975_100000211163 [0,2,0,0,0,0|2,0,0]=4 7611 B14R1.411 CCC(CC)C(=O)NCC1CCCC1 527a_100000737975_100000211163 [0,2,0,0,0,0|2,0,0]=4 7612 B14R1.411 CCC(CC)C(=O)NCC1OCCO1 11a_100000036311_100000211163 [0,2,0,0,0,0|2,0,0]=4 7613 B14R1.411 CCC(CC)C(=O)NCC1OCCO1 1626a_100000036311_100000211163 [0,2,0,0,0,0|2,0,0]=4 7614 B14R1.411 CCC(CC)C(=O)NCC1OCCO1 527a_100000036311_100000211163 [0,2,0,0,0,0|2,0,0]=4 7615 B14R1.411 CCC(CC)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000211163 [0,2,0,0,0,0|1,0,0]=3 7616 B14R1.411 CCC(CC)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000211163 [0,2,0,0,0,0|1,0,0]=3 7617 B14R1.411 CCC(CC)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000211163 [0,2,0,0,0,0|1,0,0]=3 7618 B14R1.411 CCC(CC)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000211163 [0,2,0,0,0,0|1,0,0]=3 7619 B14R1.411 CCC(CC)C(=O)OCN1CCCC1 2230a_100000188435_100000140015 [0,2,0,0,0,0|2,0,0]=4 7620 B14R1.411 CCC(CC)C(=O)OCN1CCCC1 269982a_100000188435_100000140015 [0,2,0,0,0,0|2,0,0]=4 7621 B14R1.411 CCC(OC)C(=O)CCC1CCCC1 1458a_100000747056_100000760354 [0,2,0,0,0,0|2,0,0]=4 7622 B14R1.411 CCC(OC)C(=O)CCC1OCCO1 1458a_100000747056_100000740749 [0,2,0,0,0,0|2,0,0]=4 7623 B14R1.411 CCC(OC)C(=O)NCC1CCCC1 11a_100000737975_100000747056 [0,2,0,0,0,0|2,0,0]=4 7624 B14R1.411 CCC(OC)C(=O)NCC1CCCC1 1626a_100000737975_100000747056 [0,2,0,0,0,0|2,0,0]=4 7625 B14R1.411 CCC(OC)C(=O)NCC1CCCC1 240690a_100000737975_100000747056 [0,2,0,0,0,0|2,0,0]=4 7626 B14R1.411 CCC(OC)C(=O)NCC1CCCC1 527a_100000737975_100000747056 [0,2,0,0,0,0|2,0,0]=4 7627 B14R1.411 CCC(OC)C(=O)NCC1OCCO1 11a_100000036311_100000747056 [0,2,0,0,0,0|2,0,0]=4 7628 B14R1.411 CCC(OC)C(=O)NCC1OCCO1 1626a_100000036311_100000747056 [0,2,0,0,0,0|2,0,0]=4 7629 B14R1.411 CCC(OC)C(=O)NCC1OCCO1 527a_100000036311_100000747056 [0,2,0,0,0,0|2,0,0]=4 7630 B14R1.411 CCC(OC)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000747056 [0,2,0,0,0,0|1,0,0]=3 7631 B14R1.411 CCC(OC)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000747056 [0,2,0,0,0,0|1,0,0]=3 7632 B14R1.411 CCC(OC)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000747056 [0,2,0,0,0,0|1,0,0]=3 7633 B14R1.411 CCC(OC)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000747056 [0,2,0,0,0,0|1,0,0]=3 7634 B14R1.411 CCN(CC)C(=O)CCC1CCCO1 11a_100000724800_100011247709 [0,2,0,0,0,0|2,0,0]=4 7635 B14R1.411 CCN(CC)C(=O)CCC1CCCO1 1626a_100000724800_100011247709 [0,2,0,0,0,0|2,0,0]=4 7636 B14R1.411 CCN(CC)C(=O)CCC1CCCO1 240690a_100000724800_100011247709 [0,2,0,0,0,0|2,0,0]=4 7637 B14R1.411 CCN(CC)C(=O)CCC1CCCO1 527a_100000724800_100011247709 [0,2,0,0,0,0|2,0,0]=4 7638 B14R1.411 CCN(CC)C(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000724800 [0,2,0,0,0,0|2,0,0]=4 7639 B14R1.411 CCN(CC)C(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000724800 [0,2,0,0,0,0|2,0,0]=4 7640 B14R1.411 COC(OC)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000046285 [0,2,0,0,0,0|2,0,0]=4 7641 B14R1.411 COC(OC)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000046285 [0,2,0,0,0,0|2,0,0]=4 7642 B14R1.411 COC(OC)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000046285 [0,2,0,0,0,0|2,0,0]=4 7643 B14R1.1108 CCC(C)S(=O)(=O)NC[C@@H]1CCCO1 270084a_100020590478_100000685195 [0,2,0,0,0,0|2,0,0]=4 7644 B14R1.1108 CCC(C)S(=O)(=O)NC[C@@H]1CCCO1 274078a_100020590478_100000685195 [0,2,0,0,0,0|2,0,0]=4 7645 B14R1.2787 CCC(C)C(=O)CCC1(OCCO1)C 1458a_100011192722_100000758764 [0,2,0,0,0,0|2,0,0]=4 7646 B14R1.2787 CCC(C)C(=O)NCC1(CCCC1)O 11a_100000737848_100011192722 [0,2,0,0,0,0|2,0,0]=4 7647 B14R1.2787 CCC(C)C(=O)NCC1(CCCC1)O 1626a_100000737848_100011192722 [0,2,0,0,0,0|2,0,0]=4 7648 B14R1.2787 CCC(C)C(=O)NCC1(CCCC1)O 240690a_100000737848_100011192722 [0,2,0,0,0,0|2,0,0]=4 7649 B14R1.2787 CCC(C)C(=O)NCC1(CCCC1)O 527a_100000737848_100011192722 [0,2,0,0,0,0|2,0,0]=4 7650 B14R1.2787 CCC(C)C(=O)NCC1(OCCO1)C 11a_100000691740_100011192722 [0,2,0,0,0,0|2,0,0]=4 7651 B14R1.2787 CCC(C)C(=O)NCC1(OCCO1)C 1626a_100000691740_100011192722 [0,2,0,0,0,0|2,0,0]=4 7652 B14R1.2787 CCC(C)C(=O)NCC1(OCCO1)C 240690a_100000691740_100011192722 [0,2,0,0,0,0|2,0,0]=4 7653 B14R1.2787 CCC(C)C(=O)NCC1(OCCO1)C 527a_100000691740_100011192722 [0,2,0,0,0,0|2,0,0]=4 7654 B14R1.2787 CCC(O)C(=O)CCC1(OCCO1)C 1458a_100011196387_100000758764 [0,2,0,0,0,0|2,0,0]=4 7655 B14R1.2787 CCC(O)C(=O)NCC1(CCCC1)O 240690a_100000737848_100011196387 [0,2,0,0,0,0|2,0,0]=4 7656 B14R1.2787 CCC(O)C(=O)NCC1(OCCO1)C 240690a_100000691740_100011196387 [0,2,0,0,0,0|2,0,0]=4 7657 B14R1.3224 CC(=O)C(C)C(=O)CCC1CCCO1 1458a_100011247709_100000179758 [0,2,0,0,0,0|1,0,1]=4 7658 B14R1.3224 CC(C)C(C)C(=O)CCC1CCCC1 1458a_100000755409_100000760354 [0,2,0,0,0,0|2,0,0]=4 7659 B14R1.3224 CC(C)C(C)C(=O)CCC1OCCO1 1458a_100000755409_100000740749 [0,2,0,0,0,0|2,0,0]=4 7660 B14R1.3224 CC(C)C(C)C(=O)NCC1CCCC1 11a_100000737975_100000755409 [0,2,0,0,0,0|2,0,0]=4 7661 B14R1.3224 CC(C)C(C)C(=O)NCC1CCCC1 1626a_100000737975_100000755409 [0,2,0,0,0,0|2,0,0]=4 7662 B14R1.3224 CC(C)C(C)C(=O)NCC1CCCC1 240690a_100000737975_100000755409 [0,2,0,0,0,0|2,0,0]=4 7663 B14R1.3224 CC(C)C(C)C(=O)NCC1CCCC1 527a_100000737975_100000755409 [0,2,0,0,0,0|2,0,0]=4 7664 B14R1.3224 CC(C)C(C)C(=O)NCC1OCCO1 11a_100000036311_100000755409 [0,2,0,0,0,0|2,0,0]=4 7665 B14R1.3224 CC(C)C(C)C(=O)NCC1OCCO1 1626a_100000036311_100000755409 [0,2,0,0,0,0|2,0,0]=4 7666 B14R1.3224 CC(C)C(C)C(=O)NCC1OCCO1 527a_100000036311_100000755409 [0,2,0,0,0,0|2,0,0]=4 7667 B14R1.3224 CC(C)C(C)C(=O)NC[C@@H]1CCCO1 11a_100020590478_100000755409 [0,2,0,0,0,0|1,0,0]=3 7668 B14R1.3224 CC(C)C(C)C(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000755409 [0,2,0,0,0,0|1,0,0]=3 7669 B14R1.3224 CC(C)C(C)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000755409 [0,2,0,0,0,0|1,0,0]=3 7670 B14R1.3224 CC(C)C(C)C(=O)NC[C@@H]1CCCO1 527a_100020590478_100000755409 [0,2,0,0,0,0|1,0,0]=3 7671 B14R1.3224 CC(C)N(C)C(=O)CCC1CCCO1 11a_200000211004_100011247709 [0,2,0,0,0,0|2,0,0]=4 7672 B14R1.3224 CC(C)N(C)C(=O)CCC1CCCO1 1626a_200000211004_100011247709 [0,2,0,0,0,0|2,0,0]=4 7673 B14R1.3224 CC(C)N(C)C(=O)CCC1CCCO1 240690a_200000211004_100011247709 [0,2,0,0,0,0|2,0,0]=4 7674 B14R1.3224 CC(C)N(C)C(=O)CCC1CCCO1 527a_200000211004_100011247709 [0,2,0,0,0,0|2,0,0]=4 7675 B14R1.3224 CC(C)N(C)C(=O)NC[C@@H]1CCCO1 2708a_100020590478_200000211004 [0,2,0,0,0,0|2,0,0]=4 7676 B14R1.3224 CC(C)N(C)C(=O)NC[C@@H]1CCCO1 273464a_100020590478_200000211004 [0,2,0,0,0,0|2,0,0]=4 7677 B14R1.3224 CC(C)[C@@H](O)C(=O)CCC1CCCC1 1458a_100000691806_100000760354 [0,2,0,0,0,0|2,0,0]=4 7678 B14R1.3224 CC(C)[C@@H](O)C(=O)CCC1OCCO1 1458a_100000691806_100000740749 [0,2,0,0,0,0|2,0,0]=4 7679 B14R1.3224 CC(C)[C@@H](O)C(=O)NCC1CCCC1 240690a_100000737975_100000691806 [0,2,0,0,0,0|2,0,0]=4 7680 B14R1.3224 CC(C)[C@@H](O)C(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000691806 [0,2,0,0,0,0|1,0,0]=3 7681 B14R1.3224 C[C@@H](C(=O)NC[C@@H]1CCCO1)N(C)C 240690a_100020590478_100009822176 [0,2,0,0,0,0|2,0,0]=4 7682 B14R1.3224 C[C@@H](C(=O)NC[C@@H]1CCCO1)N(C)C 527a_100020590478_100009822176 [0,2,0,0,0,0|2,0,0]=4 7683 B14R1.1486 CC(C)CS(=O)(=O)NC[C@@H]1CCCO1 270084a_100020590478_100000748289 [0,2,0,0,0,0|2,0,0]=4 7684 B14R1.1486 CC(C)CS(=O)(=O)NC[C@@H]1CCCO1 274078a_100020590478_100000748289 [0,2,0,0,0,0|2,0,0]=4 7685 B14R1.4196 C#CC(CC(C)C)OCC1CCCO1 7a_100011215986_100000203698 [0,2,0,0,0,0|1,0,1]=4 7686 B14R1.4196 C=CC(CC(C)C)OCC1CCCO1 7a_100012186643_100000203698 [0,2,0,0,0,0|1,0,1]=4 7687 B14R1.4196 CC(C)CC(C#N)OCC1CCCO1 7a_200011294978_100000203698 [0,2,0,0,0,0|1,0,1]=4 7688 B14R1.9400 CC(C)(C)CC(=O)CCC1CCCC1 1458a_100000211214_100000760354 [0,2,0,0,0,0|2,0,0]=4 7689 B14R1.9400 CC(C)(C)CC(=O)CCC1OCCO1 1458a_100000211214_100000740749 [0,2,0,0,0,0|2,0,0]=4 7690 B14R1.9400 CC(C)(C)CC(=O)NCC1CCCC1 11a_100000737975_100000211214 [0,2,0,0,0,0|2,0,0]=4 7691 B14R1.9400 CC(C)(C)CC(=O)NCC1CCCC1 1626a_100000737975_100000211214 [0,2,0,0,0,0|2,0,0]=4 7692 B14R1.9400 CC(C)(C)CC(=O)NCC1CCCC1 240690a_100000737975_100000211214 [0,2,0,0,0,0|2,0,0]=4 7693 B14R1.9400 CC(C)(C)CC(=O)NCC1CCCC1 527a_100000737975_100000211214 [0,2,0,0,0,0|2,0,0]=4 7694 B14R1.9400 CC(C)(C)CC(=O)NCC1OCCO1 11a_100000036311_100000211214 [0,2,0,0,0,0|2,0,0]=4 7695 B14R1.9400 CC(C)(C)CC(=O)NCC1OCCO1 1626a_100000036311_100000211214 [0,2,0,0,0,0|2,0,0]=4 7696 B14R1.9400 CC(C)(C)CC(=O)NCC1OCCO1 527a_100000036311_100000211214 [0,2,0,0,0,0|2,0,0]=4 7697 B14R1.9400 CC(C)(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000211214 [0,2,0,0,0,0|1,0,0]=3 7698 B14R1.9400 CC(C)(C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000211214 [0,2,0,0,0,0|1,0,0]=3 7699 B14R1.9400 CC(C)(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000211214 [0,2,0,0,0,0|1,0,0]=3 7700 B14R1.9400 CC(C)(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000211214 [0,2,0,0,0,0|1,0,0]=3 7701 B14R1.9400 CC(C)(C)CC(=O)OCN1CCCC1 2230a_100000188435_200010999194 [0,2,0,0,0,0|2,0,0]=4 7702 B14R1.9400 CC(C)(C)CC(=O)OCN1CCCC1 269982a_100000188435_200010999194 [0,2,0,0,0,0|2,0,0]=4 7703 B14R1.9400 CC(C)(C)NC(=O)CCC1CCCO1 11a_100000715429_100011247709 [0,2,0,0,0,0|2,0,0]=4 7704 B14R1.9400 CC(C)(C)NC(=O)CCC1CCCO1 1626a_100000715429_100011247709 [0,2,0,0,0,0|2,0,0]=4 7705 B14R1.9400 CC(C)(C)NC(=O)CCC1CCCO1 240690a_100000715429_100011247709 [0,2,0,0,0,0|2,0,0]=4 7706 B14R1.9400 CC(C)(C)NC(=O)CCC1CCCO1 527a_100000715429_100011247709 [0,2,0,0,0,0|2,0,0]=4 7707 B14R1.9400 CC(C)(C)NC(=O)NC[C@@H]1CCCO1 2708a_100020590478_100000715429 [0,2,0,0,0,0|2,0,0]=4 7708 B14R1.9400 CC(C)(C)NC(=O)NC[C@@H]1CCCO1 273464a_100000715429_100020590478 [0,2,0,0,0,0|2,0,0]=4 7709 B14R1.9400 CC(C)(C)NC(=O)NC[C@@H]1CCCO1 273464a_100020590478_100000715429 [0,2,0,0,0,0|2,0,0]=4 7710 B14R1.9400 CC(C)(O)CC(=O)CCC1CCCC1 1458a_100000693243_100000760354 [0,2,0,0,0,0|2,0,0]=4 7711 B14R1.9400 CC(C)(O)CC(=O)CCC1OCCO1 1458a_100000693243_100000740749 [0,2,0,0,0,0|2,0,0]=4 7712 B14R1.9400 CC(C)(O)CC(=O)NCC1CCCC1 527a_100000737975_100000693243 [0,2,0,0,0,0|2,0,0]=4 7713 B14R1.9400 CC(C)(O)CC(=O)NCC1OCCO1 527a_100000036311_100000693243 [0,2,0,0,0,0|2,0,0]=4 7714 B14R1.9400 CC(C)(O)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000693243 [0,2,0,0,0,0|1,0,0]=3 7715 B14R1.9400 CC(CC(C)(C)C)OCC1CCCO1 7a_200011218616_100000203698 [0,2,0,0,0,0|1,0,1]=4 7716 B14R1.9400 CS(=O)(=O)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000744497 [0,2,0,0,0,0|2,0,0]=4 7717 B14R1.9400 CS(=O)(=O)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000744497 [0,2,0,0,0,0|2,0,0]=4 7718 B14R1.9400 CS(=O)(=O)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000744497 [0,2,0,0,0,0|2,0,0]=4 7719 B14R1.9400 C[N+](C)(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000033712 [0,2,0,0,0,0|2,0,0]=4 7720 B14R1.9400 C[N+](C)(C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000033712 [0,2,0,0,0,0|2,0,0]=4 7721 B14R1.9400 C[N+](C)(C)CC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000033712 [0,2,0,0,0,0|2,0,0]=4 7722 B14R1.9400 C[N+](C)(C)CC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000033712 [0,2,0,0,0,0|2,0,0]=4 7723 B14R1.9400 C[Si](C)(C)CC(=O)CCC1CCCO1 1458a_100011247709_100000233785 [0,2,0,0,0,0|1,1,0]=4 7724 B14R1.9400 C[Si](C)(C)CC(=O)NC[C@@H]1CCCO1 11a_100020590478_100011218504 [0,2,0,0,0,0|1,1,0]=4 7725 B14R1.9400 C[Si](C)(C)CC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100011218504 [0,2,0,0,0,0|1,1,0]=4 7726 B14R1.9400 O=C(CC(F)(F)F)NC[C@@H]1CCCO1 11a_100020590478_100000245130 [0,2,0,0,0,0|2,0,0]=4 7727 B14R1.9400 O=C(CC(F)(F)F)NC[C@@H]1CCCO1 1626a_100020590478_100000245130 [0,2,0,0,0,0|2,0,0]=4 7728 B14R1.9400 O=C(CC(F)(F)F)NC[C@@H]1CCCO1 527a_100020590478_100000245130 [0,2,0,0,0,0|2,0,0]=4 7729 B14R1.13051 CC(C)CC(=O)CCC1(OCCO1)C 1458a_100000210554_100000758764 [0,2,0,0,0,0|2,0,0]=4 7730 B14R1.13051 CC(C)CC(=O)NCC1(CCCC1)O 11a_100000737848_100000210554 [0,2,0,0,0,0|2,0,0]=4 7731 B14R1.13051 CC(C)CC(=O)NCC1(CCCC1)O 1626a_100000737848_100000210554 [0,2,0,0,0,0|2,0,0]=4 7732 B14R1.13051 CC(C)CC(=O)NCC1(CCCC1)O 240690a_100000737848_100000210554 [0,2,0,0,0,0|2,0,0]=4 7733 B14R1.13051 CC(C)CC(=O)NCC1(CCCC1)O 527a_100000737848_100000210554 [0,2,0,0,0,0|2,0,0]=4 7734 B14R1.13051 CC(C)CC(=O)NCC1(OCCO1)C 11a_100000691740_100000210554 [0,2,0,0,0,0|2,0,0]=4 7735 B14R1.13051 CC(C)CC(=O)NCC1(OCCO1)C 1626a_100000691740_100000210554 [0,2,0,0,0,0|2,0,0]=4 7736 B14R1.13051 CC(C)CC(=O)NCC1(OCCO1)C 240690a_100000691740_100000210554 [0,2,0,0,0,0|2,0,0]=4 7737 B14R1.13051 CC(C)CC(=O)NCC1(OCCO1)C 527a_100000691740_100000210554 [0,2,0,0,0,0|2,0,0]=4 7738 B14R1.13051 C[C@@H](O)CC(=O)CCC1(OCCO1)C 1458a_100011933948_100000758764 [0,2,0,0,0,0|2,0,0]=4 7739 B14R1.13051 C[C@@H](O)CC(=O)NCC1(CCCC1)O 240690a_100000737848_100011933948 [0,2,0,0,0,0|2,0,0]=4 7740 B14R1.13051 C[C@@H](O)CC(=O)NCC1(OCCO1)C 240690a_100000691740_100011933948 [0,2,0,0,0,0|2,0,0]=4 7741 B14R1.3366 C/C=C/C(CCC)OCC1CCCO1 7a_200016264281_100000203698 [0,2,0,0,0,0|1,0,1]=4 7742 B14R1.3366 C=CCC(CCC)OCC1CCCO1 7a_100011215139_100000203698 [0,2,0,0,0,0|1,0,1]=4 7743 B14R1.3366 CCCC(CCC)OCC1CCCO1 34a_100000210270_200011218217 [0,2,0,0,0,0|1,0,1]=4 7744 B14R1.3366 CCCC(CCC)OCC1CCCO1 7a_100000210270_200011218217 [0,2,0,0,0,0|1,0,1]=4 7745 B14R1.3366 CCCC(CCC)OCC1CCCO1 7a_200011218534_100000203698 [0,2,0,0,0,0|1,0,1]=4 7746 B14R1.3367 CCCC(OCC1CCCC1)C(=O)N 34a_100011626294_100000740388 [0,2,0,0,0,0|1,0,1]=4 7747 B14R1.3367 CCCC(OCC1CCCC1)C(=O)N 7a_100011626294_100000740388 [0,2,0,0,0,0|1,0,1]=4 7748 B14R1.3367 CCCC(OCC1CCCO1)C(=O)N 7a_100011626294_100000203698 [0,2,0,0,0,0|0,0,1]=3 7749 B14R1.3367 CCCC(OCC1CCCO1)C(C)C 7a_200011215069_100000203698 [0,2,0,0,0,0|1,0,1]=4 7750 B14R1.3367 CCCC(OCC1OCCO1)C(=O)N 34a_100011626294_100000755774 [0,2,0,0,0,0|1,0,1]=4 7751 B14R1.3367 CCCC(OCC1OCCO1)C(=O)N 7a_100011626294_100000755774 [0,2,0,0,0,0|1,0,1]=4 7752 B14R1.3367 CCC[C@H](NCC1CCCO1)C(=O)N 2230a_100000729256_100000203698 [0,2,0,0,0,0|1,0,1]=4 7753 B14R1.3367 CCC[C@H](NCC1CCCO1)C(=O)O 269956a_100000750406_100000183445 [0,2,0,0,0,0|1,0,1]=4 7754 B14R1.6887 CCCC(C)(CC)OCC1CCCO1 7a_100000210270_200000040151 [0,2,0,0,0,0|1,0,1]=4 7755 B14R1.6887 CCCC(C)(CC)OCC1CCCO1 7a_200011215934_100000203698 [0,2,0,0,0,0|1,0,1]=4 7756 B14R1.18891 CCCC(=O)NCC1(CCCC1)CO 240690a_100000699429_100000211992 [0,2,0,0,0,0|2,0,0]=4 7757 B14R1.18891 CCCC(=O)NCC1(CCCC1)CO 527a_100000699429_100000211992 [0,2,0,0,0,0|2,0,0]=4 7758 B12R1.28 CCCOCC1CCCC(=O)N1 34a_200000102386_100000210303 [0,0,1,1,0,0|1,0,0]=3 7759 B12R1.28 CCCOCC1CCNC(=O)C1 34a_100009886756_100000210303 [0,0,1,1,0,0|2,0,0]=4 7760 B12R1.28 CCCOCC1COCC(=O)N1 34a_200000101122_100000210303 [0,0,1,1,0,0|2,0,0]=4 7761 B12R1.28 CSCOCC1CCCC(=O)N1 34a_200000102386_100011218213 [0,0,1,1,0,0|2,0,0]=4 7762 B12R1.28 O=C1CCCC(C1)OCCCO 34a_100012613340_100000230001 [0,0,1,1,0,0|2,0,0]=4 7763 B12R1.28 O=C1CCCC(N1)COCCF 34a_200000102386_100011217306 [0,0,1,1,0,0|2,0,0]=4 7764 B12R1.28 O=C1CCCC(N1)COCCO 34a_200000102386_100000211926 [0,0,1,1,0,0|2,0,0]=4 7765 B12R1.32 CCCC(=O)CC1CCCCC1 1458a_100000211666_100000210303 [0,0,1,1,0,0|2,0,0]=4 7766 B12R1.32 CCCC(=O)CC1CCCCC1 1458a_100000211992_100000211423 [0,0,1,1,0,0|2,0,0]=4 7767 B12R1.32 CCCC(=O)CC1CCCCO1 1458a_100000211992_100000211543 [0,0,1,1,0,0|1,0,0]=3 7768 B12R1.32 CCCC(=O)CC1CCCCO1 1458a_100000238585_100000210303 [0,0,1,1,0,0|1,0,0]=3 7769 B12R1.32 CCCC(=O)CC1CCCOC1 1458a_100000211992_100000741521 [0,0,1,1,0,0|1,0,0]=3 7770 B12R1.32 CCCC(=O)CC1CCCOC1 1458a_100000741523_100000210303 [0,0,1,1,0,0|1,0,0]=3 7771 B12R1.32 CCCC(=O)CN1CCCOC1 2230a_100000131196_100000747444 [0,0,1,1,0,0|2,0,0]=4 7772 B12R1.32 CCCC(=O)CN1CCCOC1 269982a_100000131196_100000747444 [0,0,1,1,0,0|2,0,0]=4 7773 B12R1.32 CCCC(=O)NC1CCCCC1 11a_100000182618_100000211992 [0,0,1,1,0,0|2,0,0]=4 7774 B12R1.32 CCCC(=O)NC1CCCCC1 1626a_100000182618_100000211992 [0,0,1,1,0,0|2,0,0]=4 7775 B12R1.32 CCCC(=O)NC1CCCCC1 240690a_100000182618_100000211992 [0,0,1,1,0,0|2,0,0]=4 7776 B12R1.32 CCCC(=O)NC1CCCCC1 527a_100000182618_100000211992 [0,0,1,1,0,0|2,0,0]=4 7777 B12R1.32 CCCC(=O)NC1CCCOC1 11a_100000719290_100000211992 [0,0,1,1,0,0|1,0,0]=3 7778 B12R1.32 CCCC(=O)NC1CCCOC1 1626a_100000719290_100000211992 [0,0,1,1,0,0|1,0,0]=3 7779 B12R1.32 CCCC(=O)NC1CCCOC1 240690a_100000719290_100000211992 [0,0,1,1,0,0|1,0,0]=3 7780 B12R1.32 CCCC(=O)NC1CCCOC1 527a_100000719290_100000211992 [0,0,1,1,0,0|1,0,0]=3 7781 B12R1.32 CCCC(C)OC1CCCCO1 34a_100000033831_100000766640 [0,0,1,1,0,0|1,0,1]=4 7782 B12R1.32 CCCC(C)OC1CCCOC1 34a_100000754041_100000766640 [0,0,1,1,0,0|1,0,1]=4 7783 B12R1.32 CCCC(C)OC1CCCOC1 34a_100000764384_100000693364 [0,0,1,1,0,0|1,0,1]=4 7784 B12R1.32 CCCC(C)OC1CCCOC1 7a_100000764384_100000693364 [0,0,1,1,0,0|1,0,1]=4 7785 B12R1.32 CCNC(=O)CC1CCCCO1 11a_100015525214_100000238585 [0,0,1,1,0,0|2,0,0]=4 7786 B12R1.32 CCNC(=O)CC1CCCCO1 240690a_100015525214_100000238585 [0,0,1,1,0,0|2,0,0]=4 7787 B12R1.32 CCNC(=O)CC1CCCCO1 527a_100015525214_100000238585 [0,0,1,1,0,0|2,0,0]=4 7788 B12R1.32 CCNC(=O)CC1CCCOC1 11a_100015525214_100000741523 [0,0,1,1,0,0|2,0,0]=4 7789 B12R1.32 CCNC(=O)CC1CCCOC1 240690a_100015525214_100000741523 [0,0,1,1,0,0|2,0,0]=4 7790 B12R1.32 CCNC(=O)CC1CCCOC1 527a_100015525214_100000741523 [0,0,1,1,0,0|2,0,0]=4 7791 B12R1.32 CCNC(=O)NC1CCCOC1 2708a_100000719290_100015525214 [0,0,1,1,0,0|2,0,0]=4 7792 B12R1.32 CCNC(=O)NC1CCCOC1 2708a_100015525214_100000719290 [0,0,1,1,0,0|2,0,0]=4 7793 B12R1.32 CCNC(=O)NC1CCCOC1 273464a_100000719290_100015525214 [0,0,1,1,0,0|2,0,0]=4 7794 B12R1.32 CCNC(=O)NC1CCCOC1 273464a_100015525214_100000719290 [0,0,1,1,0,0|2,0,0]=4 7795 B12R1.32 CCNC(=O)NC1CCCOC1 512a_100000719290_100015525214 [0,0,1,1,0,0|2,0,0]=4 7796 B12R1.32 CCNC(=O)NC1CCCOC1 512a_100015525214_100000719290 [0,0,1,1,0,0|2,0,0]=4 7797 B12R1.32 CNCC(=O)OC1CCCCC1 2230a_106832991635_100000041653 [0,0,1,1,0,0|2,0,0]=4 7798 B12R1.32 CNCC(=O)OC1CCCCC1 34a_100102657272_100000041653 [0,0,1,1,0,0|2,0,0]=4 7799 B12R1.32 CNCC(=O)OC1CCCCC1 7a_106832991635_100000041653 [0,0,1,1,0,0|2,0,0]=4 7800 B12R1.32 COCC(=O)CC1CCCCO1 1458a_100000210968_100000211543 [0,0,1,1,0,0|2,0,0]=4 7801 B12R1.32 COCC(=O)CC1CCCOC1 1458a_100000210968_100000741521 [0,0,1,1,0,0|2,0,0]=4 7802 B12R1.32 COCC(=O)NC1CCCOC1 11a_100000719290_100000210968 [0,0,1,1,0,0|2,0,0]=4 7803 B12R1.32 COCC(=O)NC1CCCOC1 1626a_100000719290_100000210968 [0,0,1,1,0,0|2,0,0]=4 7804 B12R1.32 COCC(=O)NC1CCCOC1 240690a_100000719290_100000210968 [0,0,1,1,0,0|2,0,0]=4 7805 B12R1.32 COCC(=O)NC1CCCOC1 527a_100000719290_100000210968 [0,0,1,1,0,0|2,0,0]=4 7806 B12R1.32 COCC(=O)OC1CCCCC1 34a_100138415774_100000041653 [0,0,1,1,0,0|2,0,0]=4 7807 B12R1.32 CSCC(=O)CC1CCCCO1 1458a_100000184570_100000211543 [0,0,1,1,0,0|2,0,0]=4 7808 B12R1.32 CSCC(=O)CC1CCCOC1 1458a_100000184570_100000741521 [0,0,1,1,0,0|2,0,0]=4 7809 B12R1.32 CSCC(=O)NC1CCCOC1 11a_100000719290_100000184570 [0,0,1,1,0,0|2,0,0]=4 7810 B12R1.32 CSCC(=O)NC1CCCOC1 1626a_100000719290_100000184570 [0,0,1,1,0,0|2,0,0]=4 7811 B12R1.32 CSCC(=O)NC1CCCOC1 240690a_100000719290_100000184570 [0,0,1,1,0,0|2,0,0]=4 7812 B12R1.32 CSCC(=O)NC1CCCOC1 527a_100000719290_100000184570 [0,0,1,1,0,0|2,0,0]=4 7813 B12R1.32 CSCC(=O)OC1CCCCC1 62a_100000041653_200000210301 [0,0,1,1,0,0|2,0,0]=4 7814 B12R1.32 CSCC(=O)OC1CCCCC1 62a_200000210301_100000041653 [0,0,1,1,0,0|2,0,0]=4 7815 B12R1.32 O=C(CCF)CC1CCCCO1 1458a_100000238585_100011217306 [0,0,1,1,0,0|2,0,0]=4 7816 B12R1.32 O=C(CCF)CC1CCCOC1 1458a_100000741523_100011217306 [0,0,1,1,0,0|2,0,0]=4 7817 B12R1.32 O=C(CCO)CC1CCCCO1 1458a_100000238585_100000211926 [0,0,1,1,0,0|2,0,0]=4 7818 B12R1.32 O=C(CCO)CC1CCCCO1 1458a_100011216618_100000211543 [0,0,1,1,0,0|2,0,0]=4 7819 B12R1.32 O=C(CCO)CC1CCCOC1 1458a_100000741523_100000211926 [0,0,1,1,0,0|2,0,0]=4 7820 B12R1.32 O=C(CCO)CC1CCCOC1 1458a_100011216618_100000741521 [0,0,1,1,0,0|2,0,0]=4 7821 B12R1.32 O=C(CCO)NC1CCCOC1 240690a_100000719290_100011216618 [0,0,1,1,0,0|2,0,0]=4 7822 B12R1.32 [13CH3]SCC(=O)OC1CCCCC1 62a_100000041653_200025704644 [0,0,1,1,0,0|2,0,0]=4 7823 B12R1.32 [13CH3]SCC(=O)OC1CCCCC1 62a_200025704644_100000041653 [0,0,1,1,0,0|2,0,0]=4 7824 B12R1.308 CCCC(=O)C1CCCCC1C 1458a_100011215568_100000210303 [0,0,1,1,0,0|2,0,0]=4 7825 B12R1.308 CCCC(=O)C1CCCCC1O 1458a_100011803323_100000210303 [0,0,1,1,0,0|1,0,0]=3 7826 B12R1.308 CCCC(=O)N1CCCCC1C 11a_100000211376_100000211992 [0,0,1,1,0,0|2,0,0]=4 7827 B12R1.308 CCCC(=O)N1CCCCC1C 1626a_100000211376_100000211992 [0,0,1,1,0,0|2,0,0]=4 7828 B12R1.308 CCCC(=O)N1CCCCC1C 240690a_100000211376_100000211992 [0,0,1,1,0,0|2,0,0]=4 7829 B12R1.308 CCCC(=O)N1CCCCC1C 527a_100000211376_100000211992 [0,0,1,1,0,0|2,0,0]=4 7830 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000211992 [0,0,1,1,0,0|1,0,0]=3 7831 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000211992 [0,0,1,1,0,0|1,0,0]=3 7832 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000211992 [0,0,1,1,0,0|1,0,0]=3 7833 B12R1.308 CCNC(=O)N1CCOC[C@@H]1C 2708a_100015525214_100009815349 [0,0,1,1,0,0|2,0,0]=4 7834 B12R1.308 CCNC(=O)N1CCOC[C@@H]1C 273464a_100015525214_100009815349 [0,0,1,1,0,0|2,0,0]=4 7835 B12R1.308 COCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000210968 [0,0,1,1,0,0|2,0,0]=4 7836 B12R1.308 COCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000210968 [0,0,1,1,0,0|2,0,0]=4 7837 B12R1.308 COCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000210968 [0,0,1,1,0,0|2,0,0]=4 7838 B12R1.308 CSCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000184570 [0,0,1,1,0,0|2,0,0]=4 7839 B12R1.308 CSCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000184570 [0,0,1,1,0,0|2,0,0]=4 7840 B12R1.308 CSCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000184570 [0,0,1,1,0,0|2,0,0]=4 7841 B12R1.308 C[C@H]1COCCN1C(=O)CCO 240690a_100009815349_100011216618 [0,0,1,1,0,0|2,0,0]=4 7842 B12R1.308 O=C(CCF)C1CCCCC1O 1458a_100011803323_100011217306 [0,0,1,1,0,0|2,0,0]=4 7843 B12R1.308 O=C(CCO)C1CCCCC1O 1458a_100011803323_100000211926 [0,0,1,1,0,0|2,0,0]=4 7844 B12R1.310 CCCC(=O)CSCCC1CO1 62a_100000732470_100000747444 [0,0,1,1,0,0|2,0,0]=4 7845 B12R1.310 CCCC(=O)CSCCC1CO1 62a_100000747444_100000732470 [0,0,1,1,0,0|2,0,0]=4 7846 B12R1.310 CCCC(=O)OCNCC1CC1 2230a_100000735609_100000034017 [0,0,1,1,0,0|2,0,0]=4 7847 B12R1.310 CCCC(=O)OCNCC1CC1 34a_100000735609_100000034017 [0,0,1,1,0,0|2,0,0]=4 7848 B12R1.310 CCCC(=O)OCOCC1CC1 34a_100000211283_100000034017 [0,0,1,1,0,0|2,0,0]=4 7849 B12R1.310 CCCC(=O)OCOC[C@@H]1CO1 34a_100000757423_100000034017 [0,0,1,1,0,0|1,0,0]=3 7850 B12R1.310 CCCC(=O)OCSCC1CC1 62a_100000756562_100000034017 [0,0,1,1,0,0|2,0,0]=4 7851 B12R1.310 CCCC(=O)OCSCC1CO1 62a_102125554688_100000034017 [0,0,1,1,0,0|1,0,0]=3 7852 B12R1.310 CCCC(=O)OCSCC1CS1 62a_100000031435_100000034017 [0,0,1,1,0,0|1,1,0]=4 7853 B12R1.310 CCCC(=O)OCSC[C@@H]1CO1 62a_100000745022_100000034017 [0,0,1,1,0,0|1,0,0]=3 7854 B12R1.310 CCCC(C)OCCCC1CO1 34a_100000764384_100000733510 [0,0,1,1,0,0|1,0,1]=4 7855 B12R1.310 CCCC(C)OCCCC1CO1 7a_100000764384_100000733510 [0,0,1,1,0,0|1,0,1]=4 7856 B12R1.310 CCOC(=O)NCCOC1CC1 34a_100000158857_100000211595 [0,0,1,1,0,0|2,0,0]=4 7857 B12R1.310 CCOC(=O)OCSCC1CO1 62a_102125554688_100000075025 [0,0,1,1,0,0|2,0,0]=4 7858 B12R1.310 CCOC(=O)OCSC[C@@H]1CO1 62a_100000745022_100000075025 [0,0,1,1,0,0|2,0,0]=4 7859 B12R1.315 CCCC(=O)CNC[C@@H]1CCO1 2230a_100020831831_100000747444 [0,0,1,1,0,0|2,0,0]=4 7860 B12R1.315 CCCC(=O)CSCC1CCO1 62a_100000103362_100000747444 [0,0,1,1,0,0|2,0,0]=4 7861 B12R1.315 CCCC(=O)CSCC1CCO1 62a_100000747444_100000103362 [0,0,1,1,0,0|2,0,0]=4 7862 B12R1.315 CCCC(=O)NCCN1CCC1 240690a_100000691440_100000211992 [0,0,1,1,0,0|2,0,0]=4 7863 B12R1.315 CCCC(=O)OCNC1CCC1 2230a_100000749019_100000034017 [0,0,1,1,0,0|2,0,0]=4 7864 B12R1.315 CCCC(=O)OCNC1CCC1 34a_100000749019_100000034017 [0,0,1,1,0,0|2,0,0]=4 7865 B12R1.315 CCCC(=O)OCOC1CCC1 34a_100000748187_100000034017 [0,0,1,1,0,0|2,0,0]=4 7866 B12R1.316 CCCC(=O)N1CCCC1CC 11a_100000754278_100000211992 [0,0,1,1,0,0|2,0,0]=4 7867 B12R1.316 CCCC(=O)N1CCCC1CC 1626a_100000754278_100000211992 [0,0,1,1,0,0|2,0,0]=4 7868 B12R1.316 CCCC(=O)N1CCCC1CC 240690a_100000754278_100000211992 [0,0,1,1,0,0|2,0,0]=4 7869 B12R1.316 CCCC(=O)N1CCCC1CC 527a_100000754278_100000211992 [0,0,1,1,0,0|2,0,0]=4 7870 B12R1.316 CCCC(=O)N1CCC[C@@H]1CO 240690a_100000745186_100000211992 [0,0,1,1,0,0|1,0,0]=3 7871 B12R1.316 CCCC(=O)N1CCC[C@@H]1CO 527a_100000745186_100000211992 [0,0,1,1,0,0|1,0,0]=3 7872 B12R1.316 CCNC(=O)N1CCC[C@@H]1CO 2708a_100015525214_100000745186 [0,0,1,1,0,0|2,0,0]=4 7873 B12R1.316 CCNC(=O)N1CCC[C@@H]1CO 273464a_100015525214_100000745186 [0,0,1,1,0,0|2,0,0]=4 7874 B12R1.316 COCC(=O)N1CCC[C@@H]1CO 240690a_100000745186_100000210968 [0,0,1,1,0,0|2,0,0]=4 7875 B12R1.316 COCC(=O)N1CCC[C@@H]1CO 527a_100000745186_100000210968 [0,0,1,1,0,0|2,0,0]=4 7876 B12R1.316 CSCC(=O)N1CCC[C@@H]1CO 240690a_100000745186_100000184570 [0,0,1,1,0,0|2,0,0]=4 7877 B12R1.316 CSCC(=O)N1CCC[C@@H]1CO 527a_100000745186_100000184570 [0,0,1,1,0,0|2,0,0]=4 7878 B12R1.316 O=C(CCO)N1CCC[C@@H]1CO 240690a_100000745186_100011216618 [0,0,1,1,0,0|2,0,0]=4 7879 B12R1.542 CCC1C(=O)NCCN1CCO 2230a_100000187962_100000211926 [0,0,1,1,0,0|2,0,0]=4 7880 B12R1.542 CCC1C(=O)NCCN1CCO 269982a_100000187962_100000211926 [0,0,1,1,0,0|2,0,0]=4 7881 B12R1.542 CCC1C(=O)NCCN1CCO 34a_100000187962_100000211926 [0,0,1,1,0,0|2,0,0]=4 7882 B12R1.542 CCCN1CCNC(=O)C1CC 2230a_100000187962_100000210303 [0,0,1,1,0,0|2,0,0]=4 7883 B12R1.542 CCCN1CCNC(=O)C1CC 269982a_100000187962_100000210303 [0,0,1,1,0,0|2,0,0]=4 7884 B12R1.542 CCCN1CCNC(=O)C1CC 34a_100000187962_100000210303 [0,0,1,1,0,0|2,0,0]=4 7885 B12R1.923 CC(OCCCCCO)C1CC1 34a_100000744524_100000746330 [0,0,1,1,0,0|1,0,1]=4 7886 B12R1.923 CC(OCCCCCO)C1CC1 7a_100000744524_100000746330 [0,0,1,1,0,0|1,0,1]=4 7887 B12R1.923 CCCCCCCC(=O)C1CC1 1458a_100000210395_100000210614 [0,0,1,1,0,0|2,0,0]=4 7888 B12R1.923 CCCCCCNC(=O)C1CC1 11a_100000210581_100000210395 [0,0,1,1,0,0|2,0,0]=4 7889 B12R1.923 CCCCCCNC(=O)C1CC1 1626a_100000210581_100000210395 [0,0,1,1,0,0|2,0,0]=4 7890 B12R1.923 CCCCCCNC(=O)C1CC1 240690a_100000210581_100000210395 [0,0,1,1,0,0|2,0,0]=4 7891 B12R1.923 CCCCCCNC(=O)C1CC1 527a_100000210581_100000210395 [0,0,1,1,0,0|2,0,0]=4 7892 B12R1.923 CCCCNCOC(=O)C1CC1 2230a_100000102301_100000140896 [0,0,1,1,0,0|2,0,0]=4 7893 B12R1.923 CCCCOCOC(=O)C1CC1 34a_100000210227_100000140896 [0,0,1,1,0,0|2,0,0]=4 7894 B12R1.923 CCCCSCOC(=O)C1CC1 62a_100000140896_100000210210 [0,0,1,1,0,0|2,0,0]=4 7895 B12R1.923 CCCCSCOC(=O)C1CC1 62a_100000210211_100000140896 [0,0,1,1,0,0|2,0,0]=4 7896 B12R1.923 CCCOCCNC(=O)C1CC1 1626a_100161115042_100000210395 [0,0,1,1,0,0|1,0,0]=3 7897 B12R1.923 CCCOCCNC(=O)C1CC1 240690a_100161115042_100000210395 [0,0,1,1,0,0|1,0,0]=3 7898 B12R1.923 CCCOCCNC(=O)C1CC1 527a_100161115042_100000210395 [0,0,1,1,0,0|1,0,0]=3 7899 B12R1.923 CCCOCCNC(=O)C1CO1 1626a_100161115042_100000701028 [0,0,1,1,0,0|2,0,0]=4 7900 B12R1.923 CCCOCCNC(=O)C1CO1 240690a_100161115042_100000701028 [0,0,1,1,0,0|2,0,0]=4 7901 B12R1.923 CCCOCCNC(=O)C1CO1 527a_100161115042_100000701028 [0,0,1,1,0,0|2,0,0]=4 7902 B12R1.923 CCCOCCOC(C)C1CC1 34a_100000744524_100011215938 [0,0,1,1,0,0|1,0,1]=4 7903 B12R1.923 CCCOCCOC(C)C1CC1 7a_100000744524_100011215938 [0,0,1,1,0,0|1,0,1]=4 7904 B12R1.923 CCCSCCNC(=O)C1CC1 11a_100020603323_100000210395 [0,0,1,1,0,0|1,1,0]=4 7905 B12R1.923 CCCSCCNC(=O)C1CC1 240690a_100020603323_100000210395 [0,0,1,1,0,0|1,1,0]=4 7906 B12R1.923 CCCSCCNC(=O)C1CC1 527a_100020603323_100000210395 [0,0,1,1,0,0|1,1,0]=4 7907 B12R1.923 NCCCOCOC(=O)C1CC1 34a_100000182051_100000140896 [0,0,1,1,0,0|2,0,0]=4 7908 B12R1.923 O=C(CCCCCCF)C1CC1 1458a_100000210395_100015922095 [0,0,1,1,0,0|2,0,0]=4 7909 B12R1.923 O=C(CCCCCCO)C1CC1 1458a_100000210395_100000766143 [0,0,1,1,0,0|1,0,0]=3 7910 B12R1.923 O=C(CCCCCCO)C1CO1 1458a_100000701028_100000766143 [0,0,1,1,0,0|2,0,0]=4 7911 B12R1.923 O=C(CNCCCCO)C1CC1 2230a_100000750430_100000746382 [0,0,1,1,0,0|2,0,0]=4 7912 B12R1.923 O=C(CNCCCCO)C1CC1 34a_100000750430_100000746382 [0,0,1,1,0,0|2,0,0]=4 7913 B12R1.923 O=C(COCCCCO)C1CC1 34a_100000686663_100011216708 [0,0,1,1,0,0|2,0,0]=4 7914 B12R1.923 O=C(CSCCCCO)C1CC1 62a_100000210776_100000746382 [0,0,1,1,0,0|2,0,0]=4 7915 B12R1.923 O=C(CSCCCCO)C1CC1 62a_100000746382_100000210776 [0,0,1,1,0,0|2,0,0]=4 7916 B12R1.923 O=C(NCCCCCO)C1CC1 240690a_100000762737_100000210395 [0,0,1,1,0,0|1,0,0]=3 7917 B12R1.923 O=C(NCCCCCO)C1CO1 240690a_100000762737_100000701028 [0,0,1,1,0,0|2,0,0]=4 7918 B12R1.923 O=C(NCCOCCO)C1CC1 240690a_100000211614_100000210395 [0,0,1,1,0,0|2,0,0]=4 7919 B12R1.923 O=C(NCCSCCO)C1CC1 240690a_100011219999_100000210395 [0,0,1,1,0,0|2,0,0]=4 7920 B12R1.923 O=C(NCCSCCO)C1CC1 527a_100011219999_100000210395 [0,0,1,1,0,0|2,0,0]=4 7921 B12R1.923 O=C(OCNCCCF)C1CC1 2230a_100015189416_100000140896 [0,0,1,1,0,0|2,0,0]=4 7922 B12R1.923 O=C(OCNCCCF)C1CC1 34a_100015189416_100000140896 [0,0,1,1,0,0|2,0,0]=4 7923 B12R1.923 O=C(OCOCCCBr)C1CC1 34a_100011217188_100000140896 [0,0,1,1,0,0|2,0,0]=4 7924 B12R1.923 O=C(OCOCCCCl)C1CC1 34a_100000230001_100000140896 [0,0,1,1,0,0|2,0,0]=4 7925 B12R1.923 O=C(OCOCCCF)C1CC1 34a_100000759539_100000140896 [0,0,1,1,0,0|2,0,0]=4 7926 B12R1.923 O=C(OCSCCCF)C1CC1 62a_100000140896_100011934791 [0,0,1,1,0,0|2,0,0]=4 7927 B12R1.923 O=C(OCSCCCF)C1CC1 62a_100011934791_100000140896 [0,0,1,1,0,0|2,0,0]=4 7928 B12R1.923 O=C(OCSCCCO)C1CC1 62a_100000140896_100011215043 [0,0,1,1,0,0|1,0,0]=3 7929 B12R1.923 O=C(OCSCCCO)C1CC1 62a_100011215043_100000140896 [0,0,1,1,0,0|1,0,0]=3 7930 B12R1.1505 CCCC(=O)OCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000034017 [0,0,1,1,0,0|2,0,0]=4 7931 B12R1.1505 CCCC(=O)OCN[C@@H]1C[C@H]1F 2230a_100025746932_100000034017 [0,0,1,1,0,0|2,0,0]=4 7932 B12R1.1505 CCCC(=O)OCN[C@@H]1C[C@H]1F 34a_100025746932_100000034017 [0,0,1,1,0,0|2,0,0]=4 7933 B12R1.1564 CCCC(=O)C1CCCCCC1 1458a_100000211992_100011217769 [0,0,1,1,0,0|2,0,0]=4 7934 B12R1.1564 CCCC(=O)C1CCCCCC1 1458a_100000749507_100000210303 [0,0,1,1,0,0|2,0,0]=4 7935 B12R1.1564 CCCC(=O)N1CCCCCC1 11a_100000185865_100000211992 [0,0,1,1,0,0|2,0,0]=4 7936 B12R1.1564 CCCC(=O)N1CCCCCC1 1626a_100000185865_100000211992 [0,0,1,1,0,0|2,0,0]=4 7937 B12R1.1564 CCCC(=O)N1CCCCCC1 240690a_100000185865_100000211992 [0,0,1,1,0,0|2,0,0]=4 7938 B12R1.1564 CCCC(=O)N1CCCCCC1 527a_100000185865_100000211992 [0,0,1,1,0,0|2,0,0]=4 7939 B12R1.1564 CCCC(=O)N1CCCOCC1 11a_100000685342_100000211992 [0,0,1,1,0,0|1,0,0]=3 7940 B12R1.1564 CCCC(=O)N1CCCOCC1 1626a_100000685342_100000211992 [0,0,1,1,0,0|1,0,0]=3 7941 B12R1.1564 CCCC(=O)N1CCCOCC1 240690a_100000685342_100000211992 [0,0,1,1,0,0|1,0,0]=3 7942 B12R1.1564 CCCC(=O)N1CCCOCC1 527a_100000685342_100000211992 [0,0,1,1,0,0|1,0,0]=3 7943 B12R1.1564 CCNC(=O)N1CCCOCC1 2708a_100015525214_100000685342 [0,0,1,1,0,0|2,0,0]=4 7944 B12R1.1564 CCNC(=O)N1CCCOCC1 273464a_100015525214_100000685342 [0,0,1,1,0,0|2,0,0]=4 7945 B12R1.1564 COCC(=O)N1CCCOCC1 11a_100000685342_100000210968 [0,0,1,1,0,0|2,0,0]=4 7946 B12R1.1564 COCC(=O)N1CCCOCC1 1626a_100000685342_100000210968 [0,0,1,1,0,0|2,0,0]=4 7947 B12R1.1564 COCC(=O)N1CCCOCC1 240690a_100000685342_100000210968 [0,0,1,1,0,0|2,0,0]=4 7948 B12R1.1564 COCC(=O)N1CCCOCC1 527a_100000685342_100000210968 [0,0,1,1,0,0|2,0,0]=4 7949 B12R1.1564 CSCC(=O)N1CCCOCC1 11a_100000685342_100000184570 [0,0,1,1,0,0|2,0,0]=4 7950 B12R1.1564 CSCC(=O)N1CCCOCC1 1626a_100000685342_100000184570 [0,0,1,1,0,0|2,0,0]=4 7951 B12R1.1564 CSCC(=O)N1CCCOCC1 240690a_100000685342_100000184570 [0,0,1,1,0,0|2,0,0]=4 7952 B12R1.1564 CSCC(=O)N1CCCOCC1 527a_100000685342_100000184570 [0,0,1,1,0,0|2,0,0]=4 7953 B12R1.1564 O=C(CCO)N1CCCOCC1 240690a_100000685342_100011216618 [0,0,1,1,0,0|2,0,0]=4 7954 B12R1.1996 CC1(CCC1)OCCCCCO 34a_100000759064_100000746330 [0,0,1,1,0,0|1,0,1]=4 7955 B12R1.1996 CC1(CCC1)OCCCCCO 7a_100000759064_100000746330 [0,0,1,1,0,0|1,0,1]=4 7956 B12R1.1996 CCCOCCOC1(CCC1)C 34a_100000759064_100011215938 [0,0,1,1,0,0|1,0,1]=4 7957 B12R1.1996 CCCOCCOC1(CCC1)C 7a_100000759064_100011215938 [0,0,1,1,0,0|1,0,1]=4 7958 B12R1.312 CCCC(=O)N1CC[C@H](C1)OC 11a_100000766984_100000211992 [0,0,1,1,0,0|1,0,0]=3 7959 B12R1.312 CCCC(=O)N1CC[C@H](C1)OC 1626a_100000766984_100000211992 [0,0,1,1,0,0|1,0,0]=3 7960 B12R1.312 CCCC(=O)N1CC[C@H](C1)OC 240690a_100000766984_100000211992 [0,0,1,1,0,0|1,0,0]=3 7961 B12R1.312 CCCC(=O)N1CC[C@H](C1)OC 527a_100000766984_100000211992 [0,0,1,1,0,0|1,0,0]=3 7962 B12R1.312 CCNC(=O)N1CC[C@H](C1)OC 2708a_100015525214_100000766984 [0,0,1,1,0,0|2,0,0]=4 7963 B12R1.312 CCNC(=O)N1CC[C@H](C1)OC 273464a_100015525214_100000766984 [0,0,1,1,0,0|2,0,0]=4 7964 B12R1.312 COCC(=O)N1CC[C@H](C1)OC 11a_100000766984_100000210968 [0,0,1,1,0,0|2,0,0]=4 7965 B12R1.312 COCC(=O)N1CC[C@H](C1)OC 1626a_100000766984_100000210968 [0,0,1,1,0,0|2,0,0]=4 7966 B12R1.312 COCC(=O)N1CC[C@H](C1)OC 240690a_100000766984_100000210968 [0,0,1,1,0,0|2,0,0]=4 7967 B12R1.312 COCC(=O)N1CC[C@H](C1)OC 527a_100000766984_100000210968 [0,0,1,1,0,0|2,0,0]=4 7968 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CCO 240690a_100000766984_100011216618 [0,0,1,1,0,0|2,0,0]=4 7969 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CSC 11a_100000766984_100000184570 [0,0,1,1,0,0|2,0,0]=4 7970 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CSC 1626a_100000766984_100000184570 [0,0,1,1,0,0|2,0,0]=4 7971 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CSC 240690a_100000766984_100000184570 [0,0,1,1,0,0|2,0,0]=4 7972 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CSC 527a_100000766984_100000184570 [0,0,1,1,0,0|2,0,0]=4 7973 B12R1.1538 CCC(CC)CNC(=O)C1CC1 11a_100102946423_100000210395 [0,0,1,1,0,0|2,0,0]=4 7974 B12R1.1538 CCC(CC)CNC(=O)C1CC1 1626a_100102946423_100000210395 [0,0,1,1,0,0|2,0,0]=4 7975 B12R1.1538 CCC(CC)CNC(=O)C1CC1 240690a_100102946423_100000210395 [0,0,1,1,0,0|2,0,0]=4 7976 B12R1.1538 CCC(CC)CNC(=O)C1CC1 527a_100102946423_100000210395 [0,0,1,1,0,0|2,0,0]=4 7977 B12R1.1538 CCC(CNC(=O)C1CC1)OC 11a_100000731041_100000210395 [0,0,1,1,0,0|1,0,0]=3 7978 B12R1.1538 CCC(CNC(=O)C1CC1)OC 1626a_100000731041_100000210395 [0,0,1,1,0,0|1,0,0]=3 7979 B12R1.1538 CCC(CNC(=O)C1CC1)OC 240690a_100000731041_100000210395 [0,0,1,1,0,0|1,0,0]=3 7980 B12R1.1538 CCC(CNC(=O)C1CC1)OC 527a_100000731041_100000210395 [0,0,1,1,0,0|1,0,0]=3 7981 B12R1.1538 CCC(CNC(=O)C1CO1)OC 11a_100000731041_100000701028 [0,0,1,1,0,0|2,0,0]=4 7982 B12R1.1538 CCC(CNC(=O)C1CO1)OC 1626a_100000731041_100000701028 [0,0,1,1,0,0|2,0,0]=4 7983 B12R1.1538 CCC(CNC(=O)C1CO1)OC 240690a_100000731041_100000701028 [0,0,1,1,0,0|2,0,0]=4 7984 B12R1.1538 CCC(CNC(=O)C1CO1)OC 527a_100000731041_100000701028 [0,0,1,1,0,0|2,0,0]=4 7985 B12R1.1538 CCN(CC)COC(=O)C1CC1 2230a_100000724800_100000140896 [0,0,1,1,0,0|2,0,0]=4 7986 B12R1.1538 CCN(CC)COC(=O)C1CC1 269956a_100000042499_100000140896 [0,0,1,1,0,0|2,0,0]=4 7987 B12R1.1538 CCN(CC)COC(=O)C1CC1 269982a_100000724800_100000140896 [0,0,1,1,0,0|2,0,0]=4 7988 B12R1.1538 COC(CCC(=O)C1CC1)OC 1458a_100000210395_100000139399 [0,0,1,1,0,0|2,0,0]=4 7989 B12R1.1538 COC(CNC(=O)C1CC1)OC 11a_100000210479_100000210395 [0,0,1,1,0,0|2,0,0]=4 7990 B12R1.1538 COC(CNC(=O)C1CC1)OC 1626a_100000210479_100000210395 [0,0,1,1,0,0|2,0,0]=4 7991 B12R1.1538 COC(CNC(=O)C1CC1)OC 240690a_100000210479_100000210395 [0,0,1,1,0,0|2,0,0]=4 7992 B12R1.1538 COC(CNC(=O)C1CC1)OC 527a_100000210479_100000210395 [0,0,1,1,0,0|2,0,0]=4 7993 B12R1.3402 CCCC(C)OCC1(CO1)CC 34a_100000764384_200000139556 [0,0,1,1,0,0|1,0,1]=4 7994 B12R1.3402 CCCC(C)OCC1(CO1)CC 7a_100000764384_200000139556 [0,0,1,1,0,0|1,0,1]=4 7995 B12R1.17 CC1CN(CCO1)C(=O)CCO 240690a_100000729577_100011216618 [0,0,1,1,0,0|2,0,0]=4 7996 B12R1.17 CCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000210303 [0,0,1,1,0,0|2,0,0]=4 7997 B12R1.17 CCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000210303 [0,0,1,1,0,0|1,0,0]=3 7998 B12R1.17 CCCC(=O)N1CCCC(C1)F 11a_100000697950_100000211992 [0,0,1,1,0,0|2,0,0]=4 7999 B12R1.17 CCCC(=O)N1CCCC(C1)F 1626a_100000697950_100000211992 [0,0,1,1,0,0|2,0,0]=4 8000 B12R1.17 CCCC(=O)N1CCCC(C1)F 240690a_100000697950_100000211992 [0,0,1,1,0,0|2,0,0]=4 8001 B12R1.17 CCCC(=O)N1CCCC(C1)F 527a_100000697950_100000211992 [0,0,1,1,0,0|2,0,0]=4 8002 B12R1.17 CCCC(=O)N1CCCC(C1)O 240690a_100000211013_100000211992 [0,0,1,1,0,0|1,0,0]=3 8003 B12R1.17 CCCC(=O)N1CCCC(C1)O 527a_100000211013_100000211992 [0,0,1,1,0,0|1,0,0]=3 8004 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000211992 [0,0,1,1,0,0|2,0,0]=4 8005 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000211992 [0,0,1,1,0,0|2,0,0]=4 8006 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000211992 [0,0,1,1,0,0|2,0,0]=4 8007 B12R1.17 CCCC(=O)N1CCOC(C1)C 11a_100000729577_100000211992 [0,0,1,1,0,0|1,0,0]=3 8008 B12R1.17 CCCC(=O)N1CCOC(C1)C 1626a_100000729577_100000211992 [0,0,1,1,0,0|1,0,0]=3 8009 B12R1.17 CCCC(=O)N1CCOC(C1)C 240690a_100000729577_100000211992 [0,0,1,1,0,0|1,0,0]=3 8010 B12R1.17 CCCC(=O)N1CCOC(C1)C 527a_100000729577_100000211992 [0,0,1,1,0,0|1,0,0]=3 8011 B12R1.17 CCCC(=O)N1CCOC(C1)O 11a_100000688207_100000211992 [0,0,1,1,0,0|2,0,0]=4 8012 B12R1.17 CCCC(=O)N1CCOC(C1)O 240690a_100000688207_100000211992 [0,0,1,1,0,0|2,0,0]=4 8013 B12R1.17 CCCC(=O)N1CCOC(C1)O 527a_100000688207_100000211992 [0,0,1,1,0,0|2,0,0]=4 8014 B12R1.17 CCNC(=O)C1CCCC(C1)O 240690a_100015525214_100000707227 [0,0,1,1,0,0|2,0,0]=4 8015 B12R1.17 CCNC(=O)N1CCCC(C1)O 2708a_100015525214_100000211013 [0,0,1,1,0,0|2,0,0]=4 8016 B12R1.17 CCNC(=O)N1CCCC(C1)O 273464a_100015525214_100000211013 [0,0,1,1,0,0|2,0,0]=4 8017 B12R1.17 CCNC(=O)N1CCOC(C1)C 2708a_100015525214_100000729577 [0,0,1,1,0,0|2,0,0]=4 8018 B12R1.17 CCNC(=O)N1CCOC(C1)C 273464a_100015525214_100000729577 [0,0,1,1,0,0|2,0,0]=4 8019 B12R1.17 COCC(=O)N1CCCC(C1)O 240690a_100000211013_100000210968 [0,0,1,1,0,0|2,0,0]=4 8020 B12R1.17 COCC(=O)N1CCCC(C1)O 527a_100000211013_100000210968 [0,0,1,1,0,0|2,0,0]=4 8021 B12R1.17 COCC(=O)N1CCOC(C1)C 11a_100000729577_100000210968 [0,0,1,1,0,0|2,0,0]=4 8022 B12R1.17 COCC(=O)N1CCOC(C1)C 1626a_100000729577_100000210968 [0,0,1,1,0,0|2,0,0]=4 8023 B12R1.17 COCC(=O)N1CCOC(C1)C 240690a_100000729577_100000210968 [0,0,1,1,0,0|2,0,0]=4 8024 B12R1.17 COCC(=O)N1CCOC(C1)C 527a_100000729577_100000210968 [0,0,1,1,0,0|2,0,0]=4 8025 B12R1.17 CSCC(=O)N1CCCC(C1)O 240690a_100000211013_100000184570 [0,0,1,1,0,0|2,0,0]=4 8026 B12R1.17 CSCC(=O)N1CCCC(C1)O 527a_100000211013_100000184570 [0,0,1,1,0,0|2,0,0]=4 8027 B12R1.17 CSCC(=O)N1CCOC(C1)C 11a_100000729577_100000184570 [0,0,1,1,0,0|2,0,0]=4 8028 B12R1.17 CSCC(=O)N1CCOC(C1)C 1626a_100000729577_100000184570 [0,0,1,1,0,0|2,0,0]=4 8029 B12R1.17 CSCC(=O)N1CCOC(C1)C 240690a_100000729577_100000184570 [0,0,1,1,0,0|2,0,0]=4 8030 B12R1.17 CSCC(=O)N1CCOC(C1)C 527a_100000729577_100000184570 [0,0,1,1,0,0|2,0,0]=4 8031 B12R1.17 O=C(CCF)C1CCCC(C1)O 1458a_100000707227_100011217306 [0,0,1,1,0,0|2,0,0]=4 8032 B12R1.17 O=C(CCO)C1CCCC(C1)O 1458a_100000707227_100000211926 [0,0,1,1,0,0|2,0,0]=4 8033 B12R1.17 O=C(CCO)N1CCCC(C1)O 240690a_100000211013_100011216618 [0,0,1,1,0,0|2,0,0]=4 8034 B12R1.178 CCCC(=O)N1CC(C1)OCC 11a_100000732654_100000211992 [0,0,1,1,0,0|1,0,0]=3 8035 B12R1.178 CCCC(=O)N1CC(C1)OCC 1626a_100000732654_100000211992 [0,0,1,1,0,0|1,0,0]=3 8036 B12R1.178 CCCC(=O)N1CC(C1)OCC 240690a_100000732654_100000211992 [0,0,1,1,0,0|1,0,0]=3 8037 B12R1.178 CCCC(=O)N1CC(C1)OCC 527a_100000732654_100000211992 [0,0,1,1,0,0|1,0,0]=3 8038 B12R1.178 CCNC(=O)N1CC(C1)OCC 2708a_100015525214_100000732654 [0,0,1,1,0,0|2,0,0]=4 8039 B12R1.178 CCNC(=O)N1CC(C1)OCC 273464a_100015525214_100000732654 [0,0,1,1,0,0|2,0,0]=4 8040 B12R1.178 CCOC(=O)C1CC(C1)OCC 7a_100000093532_100000210202 [0,0,1,1,0,0|2,0,0]=4 8041 B12R1.178 CCOC1CN(C1)C(=O)CCO 240690a_100000732654_100011216618 [0,0,1,1,0,0|2,0,0]=4 8042 B12R1.178 CCOC1CN(C1)C(=O)COC 11a_100000732654_100000210968 [0,0,1,1,0,0|2,0,0]=4 8043 B12R1.178 CCOC1CN(C1)C(=O)COC 1626a_100000732654_100000210968 [0,0,1,1,0,0|2,0,0]=4 8044 B12R1.178 CCOC1CN(C1)C(=O)COC 240690a_100000732654_100000210968 [0,0,1,1,0,0|2,0,0]=4 8045 B12R1.178 CCOC1CN(C1)C(=O)COC 527a_100000732654_100000210968 [0,0,1,1,0,0|2,0,0]=4 8046 B12R1.178 CCOC1CN(C1)C(=O)CSC 11a_100000732654_100000184570 [0,0,1,1,0,0|2,0,0]=4 8047 B12R1.178 CCOC1CN(C1)C(=O)CSC 1626a_100000732654_100000184570 [0,0,1,1,0,0|2,0,0]=4 8048 B12R1.178 CCOC1CN(C1)C(=O)CSC 240690a_100000732654_100000184570 [0,0,1,1,0,0|2,0,0]=4 8049 B12R1.178 CCOC1CN(C1)C(=O)CSC 527a_100000732654_100000184570 [0,0,1,1,0,0|2,0,0]=4 8050 B12R1.313 CCCC(=O)[C@@H]1C[C@H](CN1C)O 1458a_100015191551_100000210303 [0,0,1,1,0,0|2,0,0]=4 8051 B12R1.686 CCCC(=O)COC(=O)C1CC1 1458a_100000211992_100000140896 [0,0,1,1,0,0|0,0,2]=4 8052 B12R1.686 CCCC(=O)NCC(O)C1CC1 11a_100000751198_100000211992 [0,0,1,1,0,0|1,0,0]=3 8053 B12R1.686 CCCC(=O)NCC(O)C1CC1 240690a_100000751198_100000211992 [0,0,1,1,0,0|1,0,0]=3 8054 B12R1.686 CCCC(=O)NCC(O)C1CC1 527a_100000751198_100000211992 [0,0,1,1,0,0|1,0,0]=3 8055 B12R1.686 CCCC(=O)OCC(=O)C1CC1 1458a_100000210395_100000034017 [0,0,1,1,0,0|0,0,2]=4 8056 B12R1.686 CCCC(=O)OCN(C)C1CC1 2230a_100000226674_100000034017 [0,0,1,1,0,0|2,0,0]=4 8057 B12R1.686 CCCC(=O)OCN(C)C1CC1 269982a_100000226674_100000034017 [0,0,1,1,0,0|2,0,0]=4 8058 B12R1.686 CCCN(C)COC(=O)C1CC1 2230a_100000747261_100000140896 [0,0,1,1,0,0|2,0,0]=4 8059 B12R1.686 CCCN(C)COC(=O)C1CC1 269982a_100000747261_100000140896 [0,0,1,1,0,0|2,0,0]=4 8060 B12R1.686 CCNC(=O)NCC(O)C1CC1 2708a_100015525214_100000751198 [0,0,1,1,0,0|2,0,0]=4 8061 B12R1.686 CCNC(=O)NCC(O)C1CC1 273464a_100000751198_100015525214 [0,0,1,1,0,0|2,0,0]=4 8062 B12R1.686 CCNC(=O)NCC(O)C1CC1 273464a_100015525214_100000751198 [0,0,1,1,0,0|2,0,0]=4 8063 B12R1.686 CCNC(=O)NCC(O)C1CC1 512a_100015525214_100000751198 [0,0,1,1,0,0|2,0,0]=4 8064 B12R1.686 COCC(=O)NCC(O)C1CC1 11a_100000751198_100000210968 [0,0,1,1,0,0|2,0,0]=4 8065 B12R1.686 COCC(=O)NCC(O)C1CC1 240690a_100000751198_100000210968 [0,0,1,1,0,0|2,0,0]=4 8066 B12R1.686 COCC(=O)NCC(O)C1CC1 527a_100000751198_100000210968 [0,0,1,1,0,0|2,0,0]=4 8067 B12R1.686 COCC(O)CNC(=O)C1CC1 240690a_100000756049_100000210395 [0,0,1,1,0,0|2,0,0]=4 8068 B12R1.686 COCC(O)CNC(=O)C1CC1 527a_100000756049_100000210395 [0,0,1,1,0,0|2,0,0]=4 8069 B12R1.686 CSCC(=O)NCC(O)C1CC1 11a_100000751198_100000184570 [0,0,1,1,0,0|2,0,0]=4 8070 B12R1.686 CSCC(=O)NCC(O)C1CC1 240690a_100000751198_100000184570 [0,0,1,1,0,0|2,0,0]=4 8071 B12R1.686 CSCC(=O)NCC(O)C1CC1 527a_100000751198_100000184570 [0,0,1,1,0,0|2,0,0]=4 8072 B12R1.686 O=C(CCO)NCC(O)C1CC1 240690a_100000751198_100011216618 [0,0,1,1,0,0|2,0,0]=4 8073 B12R2.12 CC1CCN1CC2CCCO2 269982a_100000755817_100000183445 [1,0,0,1,0,0|1,0,1]=4 8074 B12R2.98 C1COC(C1)CN2CCCC2 2230a_100000188435_100000203698 [1,0,0,1,0,0|1,0,1]=4 8075 B12R2.98 C1COC(C1)CN2CCCC2 269982a_100000188435_100000183445 [1,0,0,1,0,0|1,0,1]=4 8076 B12R2.2056 C1CC(C1)NCC2CCCO2 2230a_100000749019_100000203698 [1,0,0,1,0,0|1,0,1]=4 8077 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000241760 [1,0,0,1,0,0|1,0,1]=4 8078 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 34a_100020590478_100000749161 [1,0,0,1,0,0|1,0,1]=4 8079 B12R2.2056 C1CC(C1)OCC2CCCO2 34a_100000210270_100000749161 [1,0,0,1,0,0|0,0,1]=3 8080 B12R2.2056 C1CC(C1)OCC2COCO2 34a_100011216627_100000749161 [1,0,0,1,0,0|1,0,1]=4 8081 B12R2.2056 C1CC(C1)OCC2OCCO2 34a_100000087154_100000749161 [1,0,0,1,0,0|1,0,1]=4 8082 B12R2.2056 C1CC(C1)OCC2OCCO2 34a_100000748187_100000755774 [1,0,0,1,0,0|1,0,1]=4 8083 B12R2.2056 C1CC(C1)OC[C@H]2CCCN2 34a_100000745186_100000749161 [1,0,0,1,0,0|1,0,1]=4 8084 B12R2.2056 C1CCC(C1)COC2CCC2 34a_100000742336_100000749161 [1,0,0,1,0,0|1,0,1]=4 8085 B12R2.2056 C1CCC(C1)COC2CCC2 34a_100000748187_100000740388 [1,0,0,1,0,0|1,0,1]=4 8086 B12R2.2056 C1COC(C1)COC2COC2 34a_100000210270_100009818527 [1,0,0,1,0,0|1,0,1]=4 8087 B12R2.2056 C1COC(C1)COC2COC2 7a_100000210270_100009818527 [1,0,0,1,0,0|1,0,1]=4 8088 B12R2.2056 C1COC(C1)COC2CSC2 7a_100000072292_100000203698 [1,0,0,1,0,0|1,0,1]=4 8089 B12R2.2056 C1COC(C1)CSC2CCC2 62a_100000203698_100000749161 [1,0,0,1,0,0|0,1,1]=4 8090 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000210211 [1,0,0,1,0,0|1,0,1]=4 8091 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000210211 [1,0,0,1,0,0|1,0,1]=4 8092 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000210210 [1,0,0,1,0,0|1,0,1]=4 8093 B12R2.2383 C1CCC(C1)COCC2CC2 34a_100000211283_100000740388 [1,0,0,1,0,0|1,0,1]=4 8094 B12R2.2383 C1CCC(C1)COCC2CC2 34a_100000742336_100000742324 [1,0,0,1,0,0|1,0,1]=4 8095 B12R2.2383 C1CCC(C1)COCC2CC2 7a_100000742336_100000742324 [1,0,0,1,0,0|1,0,1]=4 8096 B12R2.2383 C1CN[C@H](C1)COCC2CC2 34a_100000745186_100000742324 [1,0,0,1,0,0|1,0,1]=4 8097 B12R2.2383 C1COC(C1)CNCC2CC2 2230a_100000735609_100000203698 [1,0,0,1,0,0|1,0,1]=4 8098 B12R2.2383 C1COC(C1)COCC2CC2 34a_100000210270_100000742324 [1,0,0,1,0,0|0,0,1]=3 8099 B12R2.2383 C1COC(C1)COCC2CC2 7a_100000210270_100000742324 [1,0,0,1,0,0|0,0,1]=3 8100 B12R2.2383 C1COC(C1)COCC2CO2 34a_100000210270_102125554688 [1,0,0,1,0,0|1,0,1]=4 8101 B12R2.2383 C1COC(C1)COCC2CO2 7a_100000210270_102125554688 [1,0,0,1,0,0|1,0,1]=4 8102 B12R2.2383 C1COC(C1)COCC2CS2 7a_100000210270_100000031435 [1,0,0,1,0,0|1,0,1]=4 8103 B12R2.2383 C1COC(C1)COC[C@@H]2CO2 7a_100000210270_100000745022 [1,0,0,1,0,0|1,0,1]=4 8104 B12R2.2383 C1COC(C1)CSCC2CC2 62a_100000203698_100000742324 [1,0,0,1,0,0|0,1,1]=4 8105 B12R2.2383 C1COC(C1)CSCC2CC2 62a_100000756562_100000203698 [1,0,0,1,0,0|0,1,1]=4 8106 B12R2.2383 C1COC(O1)COCC2CC2 34a_100000087154_100000742324 [1,0,0,1,0,0|1,0,1]=4 8107 B12R2.2383 C1COC(O1)COCC2CC2 34a_100000211283_100000755774 [1,0,0,1,0,0|1,0,1]=4 8108 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 2230a_100020590478_100000742324 [1,0,0,1,0,0|1,0,1]=4 8109 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 269862a_100020590478_100000741477 [1,0,0,1,0,0|1,0,1]=4 8110 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 34a_100020590478_100000742324 [1,0,0,1,0,0|1,0,1]=4 8111 B12R2.2383 C1OCC(O1)COCC2CC2 34a_100011216627_100000742324 [1,0,0,1,0,0|1,0,1]=4 8112 B12R2.1596 CCC(=O)C1CC2CCC1C2 1458a_100000181847_100000210202 [1,0,0,1,0,0|2,0,0]=4 8113 B12R2.1596 CCC(=O)C1CC2CCC1C2 1458a_100000210414_100000727232 [1,0,0,1,0,0|2,0,0]=4 8114 B12R2.1596 CCC(=O)N1CC2CCC1C2 11a_100000743476_100000210414 [1,0,0,1,0,0|2,0,0]=4 8115 B12R2.1596 CCC(=O)N1CC2CCC1C2 1626a_100000743476_100000210414 [1,0,0,1,0,0|2,0,0]=4 8116 B12R2.1596 CCC(=O)N1CC2CCC1C2 240690a_100000743476_100000210414 [1,0,0,1,0,0|2,0,0]=4 8117 B12R2.1596 CCC(=O)N1CC2CCC1C2 527a_100000743476_100000210414 [1,0,0,1,0,0|2,0,0]=4 8118 B12R2.1596 CCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000210414 [1,0,0,1,0,0|1,0,0]=3 8119 B12R2.1596 CCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000210414 [1,0,0,1,0,0|1,0,0]=3 8120 B12R2.1596 CCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210414 [1,0,0,1,0,0|1,0,0]=3 8121 B12R2.1596 CCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000210414 [1,0,0,1,0,0|1,0,0]=3 8122 B12R2.1596 CNC(=O)N1C[C@H]2C[C@@H]1CO2 2708a_100102657272_100016995552 [1,0,0,1,0,0|2,0,0]=4 8123 B12R2.1596 CNC(=O)N1C[C@H]2C[C@@H]1CO2 273464a_100102657272_100016995552 [1,0,0,1,0,0|2,0,0]=4 8124 B12R2.1596 O=C(CO)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210174 [1,0,0,1,0,0|2,0,0]=4 8125 B12R2.1596 O=C(CO)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000210174 [1,0,0,1,0,0|2,0,0]=4 8126 B12R2.2399 CC1(CC1)OCC2CCCO2 7a_100011725673_100000203698 [1,0,0,1,0,0|1,0,1]=4 8127 B12R2.40 CCCN1CC2CCC(C1)O2 2230a_100015188616_100000210303 [0,0,0,1,1,0|2,0,0]=4 8128 B12R2.40 CCCN1CC2CCC(C1)O2 269982a_100015188616_100000210303 [0,0,0,1,1,0|2,0,0]=4 8129 B12R2.40 CCCN1CC2CCC(C1)O2 34a_100015188616_100000210303 [0,0,0,1,1,0|2,0,0]=4 8130 B12R2.136 CC1CN(C1)CC2CCCO2 2230a_100000702820_100000203698 [0,0,0,1,1,0|2,0,0]=4 8131 B12R2.136 CC1CN(C1)CC2CCCO2 269982a_100000702820_100000183445 [0,0,0,1,1,0|2,0,0]=4 8132 B12R2.1423 CN(CC1CCCO1)C2CC2 2230a_100000226674_100000203698 [0,0,0,1,1,0|2,0,0]=4 8133 B12R2.1423 CN(CC1CCCO1)C2CC2 269982a_100000226674_100000183445 [0,0,0,1,1,0|2,0,0]=4 8134 B12R2.1423 CN(CC1CCCO1)C2CC2 269982a_100102946541_100000211595 [0,0,0,1,1,0|2,0,0]=4 8135 B12R2.1423 CN(CC1CCCO1)C2CC2 34a_100102946541_100000211595 [0,0,0,1,1,0|2,0,0]=4 8136 B12R2.1423 O=C(CC1CCCC1)C2CC2 1458a_100000210395_100000740388 [0,0,0,1,1,0|1,0,0]=3 8137 B12R2.1423 O=C(CC1CCCC1)C2CO2 1458a_100000701028_100000740388 [0,0,0,1,1,0|2,0,0]=4 8138 B12R2.1423 O=C(CC1CCCO1)C2CC2 1458a_100000210395_100000203698 [0,0,0,1,1,0|0,0,0]=2 8139 B12R2.1423 O=C(CC1CCCO1)C2CO2 1458a_100000701028_100000203698 [0,0,0,1,1,0|1,0,0]=3 8140 B12R2.1423 O=C(CC1CCOC1)C2CC2 1458a_100000210395_100000702531 [0,0,0,1,1,0|2,0,0]=4 8141 B12R2.1423 O=C(CC1OCCO1)C2CC2 1458a_100000210395_100000755774 [0,0,0,1,1,0|1,0,0]=3 8142 B12R2.1423 O=C(CC1OCCO1)C2CO2 1458a_100000701028_100000755774 [0,0,0,1,1,0|2,0,0]=4 8143 B12R2.1423 O=C(CN1CCCC1)C2CC2 2230a_100000188435_100000746382 [0,0,0,1,1,0|2,0,0]=4 8144 B12R2.1423 O=C(CN1CCCC1)C2CC2 269982a_100000188435_100000746382 [0,0,0,1,1,0|2,0,0]=4 8145 B12R2.1423 O=C(NC1CCCC1)C2CC2 11a_100000211070_100000210395 [0,0,0,1,1,0|2,0,0]=4 8146 B12R2.1423 O=C(NC1CCCC1)C2CC2 1626a_100000211070_100000210395 [0,0,0,1,1,0|2,0,0]=4 8147 B12R2.1423 O=C(NC1CCCC1)C2CC2 240690a_100000211070_100000210395 [0,0,0,1,1,0|2,0,0]=4 8148 B12R2.1423 O=C(NC1CCCC1)C2CC2 527a_100000211070_100000210395 [0,0,0,1,1,0|2,0,0]=4 8149 B12R2.1479 CCCC(=O)C1C2C1COC2 1458a_100000138910_100000210303 [0,0,0,1,1,0|2,0,0]=4 8150 B12R2.1114 O=C1CCCC1NC2CCC2 2230a_100000749019_100000211823 [0,0,0,1,1,0|2,0,0]=4 8151 B12R2.1114 O=C1CCCC1NC2CCC2 34a_100000749019_100000709159 [0,0,0,1,1,0|2,0,0]=4 8152 B12R2.1114 O=C1CCCC1OC2CCC2 34a_100000748187_100000709159 [0,0,0,1,1,0|2,0,0]=4 8153 B12R2.1114 O=C1CCCC1OC2CCC2 34a_200000719330_100000749161 [0,0,0,1,1,0|2,0,0]=4 8154 B12R2.1114 O=C1CCCC1SC2CCC2 62a_100000211823_100000749161 [0,0,0,1,1,0|2,0,0]=4 8155 B12R2.1114 O=C1CCCN1CN2CCC2 269982a_100000754969_100000026320 [0,0,0,1,1,0|2,0,0]=4 8156 B12R2.3429 CCCC(=O)C1CC12CCC2 1458a_100000687150_100000210303 [0,0,0,1,1,0|1,0,0]=3 8157 B12R2.3429 CCNC(=O)C1CC12CCC2 11a_100015525214_100000687150 [0,0,0,1,1,0|2,0,0]=4 8158 B12R2.3429 CCNC(=O)C1CC12CCC2 240690a_100015525214_100000687150 [0,0,0,1,1,0|2,0,0]=4 8159 B12R2.3429 CCNC(=O)C1CC12CCC2 527a_100015525214_100000687150 [0,0,0,1,1,0|2,0,0]=4 8160 B12R2.3429 O=C(CCF)C1CC12CCC2 1458a_100000687150_100011217306 [0,0,0,1,1,0|2,0,0]=4 8161 B12R2.3429 O=C(CCO)C1CC12CCC2 1458a_100000687150_100000211926 [0,0,0,1,1,0|2,0,0]=4 8162 B12R2.4795 CC(OCC1CCC1)C2CC2 34a_100000744524_100000763275 [0,0,0,1,1,0|1,0,1]=4 8163 B12R2.4795 CC(OCC1CCC1)C2CC2 7a_100000744524_100000763275 [0,0,0,1,1,0|1,0,1]=4 8164 B12R2.4795 CC(OCC1CCO1)C2CC2 34a_100000744524_100000103362 [0,0,0,1,1,0|1,0,1]=4 8165 B12R2.4795 CC(OCC1CCO1)C2CC2 7a_100000744524_100000103362 [0,0,0,1,1,0|1,0,1]=4 8166 B12R2.4795 O=C(CNC1CCC1)C2CC2 2230a_100000749019_100000746382 [0,0,0,1,1,0|2,0,0]=4 8167 B12R2.4795 O=C(CNC1CCC1)C2CC2 34a_100000749019_100000746382 [0,0,0,1,1,0|2,0,0]=4 8168 B12R2.4795 O=C(COC1CCC1)C2CC2 34a_100000686663_100000749161 [0,0,0,1,1,0|2,0,0]=4 8169 B12R2.4795 O=C(COC1CCC1)C2CC2 34a_100000748187_100000746382 [0,0,0,1,1,0|2,0,0]=4 8170 B12R2.4795 O=C(CSC1CCC1)C2CC2 62a_100000746382_100000749161 [0,0,0,1,1,0|2,0,0]=4 8171 B12R2.4795 O=C(NCC1CCC1)C2CC2 11a_100000738700_100000210395 [0,0,0,1,1,0|1,0,0]=3 8172 B12R2.4795 O=C(NCC1CCC1)C2CC2 1626a_100000738700_100000210395 [0,0,0,1,1,0|1,0,0]=3 8173 B12R2.4795 O=C(NCC1CCC1)C2CC2 240690a_100000738700_100000210395 [0,0,0,1,1,0|1,0,0]=3 8174 B12R2.4795 O=C(NCC1CCC1)C2CC2 527a_100000738700_100000210395 [0,0,0,1,1,0|1,0,0]=3 8175 B12R2.4795 O=C(NCC1CCC1)C2CO2 11a_100000738700_100000701028 [0,0,0,1,1,0|2,0,0]=4 8176 B12R2.4795 O=C(NCC1CCC1)C2CO2 1626a_100000738700_100000701028 [0,0,0,1,1,0|2,0,0]=4 8177 B12R2.4795 O=C(NCC1CCC1)C2CO2 240690a_100000738700_100000701028 [0,0,0,1,1,0|2,0,0]=4 8178 B12R2.4795 O=C(NCC1CCC1)C2CO2 527a_100000738700_100000701028 [0,0,0,1,1,0|2,0,0]=4 8179 B12R2.4795 O=C(NCC1COC1)C2CC2 11a_100015281925_100000210395 [0,0,0,1,1,0|2,0,0]=4 8180 B12R2.4795 O=C(NCC1COC1)C2CC2 1626a_100015281925_100000210395 [0,0,0,1,1,0|2,0,0]=4 8181 B12R2.4795 O=C(NCC1COC1)C2CC2 240690a_100015281925_100000210395 [0,0,0,1,1,0|2,0,0]=4 8182 B12R2.4795 O=C(NCC1COC1)C2CC2 527a_100015281925_100000210395 [0,0,0,1,1,0|2,0,0]=4 8183 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CC2 11a_100020831831_100000210395 [0,0,0,1,1,0|1,0,0]=3 8184 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CC2 1626a_100020831831_100000210395 [0,0,0,1,1,0|1,0,0]=3 8185 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CC2 240690a_100020831831_100000210395 [0,0,0,1,1,0|1,0,0]=3 8186 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CC2 527a_100020831831_100000210395 [0,0,0,1,1,0|1,0,0]=3 8187 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CO2 11a_100020831831_100000701028 [0,0,0,1,1,0|2,0,0]=4 8188 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CO2 1626a_100020831831_100000701028 [0,0,0,1,1,0|2,0,0]=4 8189 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CO2 240690a_100020831831_100000701028 [0,0,0,1,1,0|2,0,0]=4 8190 B12R2.4795 O=C(NC[C@@H]1CCO1)C2CO2 527a_100020831831_100000701028 [0,0,0,1,1,0|2,0,0]=4 8191 B12R2.4795 O=C(NNC1CCC1)C2CC2 22a_100000736358_100000210395 [0,0,0,1,1,0|2,0,0]=4 8192 B12R2.4795 O=C(OCN1CCC1)C2CC2 269982a_100000754969_100000140896 [0,0,0,1,1,0|1,0,0]=3 8193 B12R2.5582 CC1(CCC1)OCC2CCC2 34a_100000759064_100000763275 [0,0,0,1,1,0|1,0,1]=4 8194 B12R2.5582 CC1(CCC1)OCC2CCC2 7a_100000759064_100000763275 [0,0,0,1,1,0|1,0,1]=4 8195 B12R2.5582 CC1(CCC1)OCC2CCO2 34a_100000759064_100000103362 [0,0,0,1,1,0|1,0,1]=4 8196 B12R2.5582 CC1(CCC1)OCC2CCO2 7a_100000759064_100000103362 [0,0,0,1,1,0|1,0,1]=4 8197 B14R2.30 O=C1CCCC1NC2CCCOC2 2230a_100000719290_100000211823 [0,0,0,1,0,1|2,0,0]=4 8198 B14R2.30 O=C1CCCC1NC2CCCOC2 34a_100000719290_100000709159 [0,0,0,1,0,1|2,0,0]=4 8199 B14R2.30 O=C1CCCC1OC2CCCCO2 34a_100000033831_100000709159 [0,0,0,1,0,1|2,0,0]=4 8200 B14R2.30 O=C1CCCC1OC2CCCOC2 34a_100000754041_100000709159 [0,0,0,1,0,1|2,0,0]=4 8201 B14R2.30 O=C1CCCC1OC2CCCOC2 34a_200000719330_100000693364 [0,0,0,1,0,1|2,0,0]=4 8202 B14R2.30 O=C1CCCC1SC2CCCOC2 62a_100000211823_100000693364 [0,0,0,1,0,1|2,0,0]=4 8203 B14R2.30 O=C1CCCN1CN2CCCOC2 269982a_100000131196_100000026320 [0,0,0,1,0,1|2,0,0]=4 8204 B14R2.101 C1CCC(C1)OC[C@@H]2CNCCO2 34a_100015189573_100000179811 [0,0,0,1,0,1|1,0,1]=4 8205 B14R2.101 C1CCC(C1)OC[C@H]2COCCO2 34a_100009875890_100000179811 [0,0,0,1,0,1|1,0,1]=4 8206 B14R2.101 C1CCC(OC1)COC2CCCC2 34a_100000210269_100000211543 [0,0,0,1,0,1|1,0,1]=4 8207 B14R2.101 C1CCC(OC1)COC2CCCC2 34a_100000211370_100000179811 [0,0,0,1,0,1|1,0,1]=4 8208 B14R2.101 C1CCC(OC1)COC2CCCC2 7a_100000210269_100000211543 [0,0,0,1,0,1|1,0,1]=4 8209 B14R2.101 C1CCC(OC1)COC2CCCC2 7a_100000211370_100000179811 [0,0,0,1,0,1|1,0,1]=4 8210 B14R2.101 C1CCC(OC1)COC2CCCO2 34a_100000085407_100000211543 [0,0,0,1,0,1|0,0,2]=4 8211 B14R2.101 C1COCC(C1)COC2CCCC2 34a_100000210269_100000741521 [0,0,0,1,0,1|1,0,1]=4 8212 B14R2.101 C1COCC(C1)COC2CCCC2 34a_100000741520_100000179811 [0,0,0,1,0,1|1,0,1]=4 8213 B14R2.101 C1COCC(C1)COC2CCCC2 7a_100000210269_100000741521 [0,0,0,1,0,1|1,0,1]=4 8214 B14R2.101 C1COCC(C1)COC2CCCO2 34a_100000085407_100000741521 [0,0,0,1,0,1|0,0,2]=4 8215 B14R2.836 CCCC(=O)C1CC12CCOCC2 1458a_100000766831_100000210303 [0,0,0,1,0,1|2,0,0]=4 8216 B14R2.2899 CC(OCC1CCCCO1)C2CC2 34a_100000744524_100000211543 [0,0,0,1,0,1|1,0,1]=4 8217 B14R2.2899 CC(OCC1CCCCO1)C2CC2 7a_100000744524_100000211543 [0,0,0,1,0,1|1,0,1]=4 8218 B14R2.2899 CC(OCC1CCCOC1)C2CC2 34a_100000744524_100000741521 [0,0,0,1,0,1|1,0,1]=4 8219 B14R2.2899 CC(OCC1CCCOC1)C2CC2 7a_100000744524_100000741521 [0,0,0,1,0,1|1,0,1]=4 8220 B14R2.2899 O=C(CCC1CCCCC1)C2CC2 1458a_100000210395_100011273959 [0,0,0,1,0,1|2,0,0]=4 8221 B14R2.2899 O=C(CCC1CCOCC1)C2CC2 1458a_100000210395_100011934994 [0,0,0,1,0,1|2,0,0]=4 8222 B14R2.2899 O=C(CCC1OCCCO1)C2CC2 1458a_100000210395_100000764188 [0,0,0,1,0,1|1,0,0]=3 8223 B14R2.2899 O=C(CCC1OCCCO1)C2CO2 1458a_100000701028_100000764188 [0,0,0,1,0,1|2,0,0]=4 8224 B14R2.2899 O=C(CNC1CCCOC1)C2CC2 2230a_100000719290_100000746382 [0,0,0,1,0,1|2,0,0]=4 8225 B14R2.2899 O=C(CNC1CCCOC1)C2CC2 34a_100000719290_100000746382 [0,0,0,1,0,1|2,0,0]=4 8226 B14R2.2899 O=C(COC1CCCCO1)C2CC2 34a_100000033831_100000746382 [0,0,0,1,0,1|2,0,0]=4 8227 B14R2.2899 O=C(COC1CCCOC1)C2CC2 34a_100000686663_100000693364 [0,0,0,1,0,1|2,0,0]=4 8228 B14R2.2899 O=C(COC1CCCOC1)C2CC2 34a_100000754041_100000746382 [0,0,0,1,0,1|2,0,0]=4 8229 B14R2.2899 O=C(CSC1CCCOC1)C2CC2 62a_100000746382_100000693364 [0,0,0,1,0,1|2,0,0]=4 8230 B14R2.2899 O=C(NCC1CCCCC1)C2CC2 11a_100000210473_100000210395 [0,0,0,1,0,1|2,0,0]=4 8231 B14R2.2899 O=C(NCC1CCCCC1)C2CC2 1626a_100000210473_100000210395 [0,0,0,1,0,1|2,0,0]=4 8232 B14R2.2899 O=C(NCC1CCCCC1)C2CC2 240690a_100000210473_100000210395 [0,0,0,1,0,1|2,0,0]=4 8233 B14R2.2899 O=C(NCC1CCCCC1)C2CC2 527a_100000210473_100000210395 [0,0,0,1,0,1|2,0,0]=4 8234 B14R2.2899 O=C(NCC1CCCCO1)C2CC2 11a_100000174945_100000210395 [0,0,0,1,0,1|1,0,0]=3 8235 B14R2.2899 O=C(NCC1CCCCO1)C2CC2 1626a_100000174945_100000210395 [0,0,0,1,0,1|1,0,0]=3 8236 B14R2.2899 O=C(NCC1CCCCO1)C2CC2 240690a_100000174945_100000210395 [0,0,0,1,0,1|1,0,0]=3 8237 B14R2.2899 O=C(NCC1CCCCO1)C2CC2 527a_100000174945_100000210395 [0,0,0,1,0,1|1,0,0]=3 8238 B14R2.2899 O=C(NCC1CCCCO1)C2CO2 11a_100000174945_100000701028 [0,0,0,1,0,1|2,0,0]=4 8239 B14R2.2899 O=C(NCC1CCCCO1)C2CO2 1626a_100000174945_100000701028 [0,0,0,1,0,1|2,0,0]=4 8240 B14R2.2899 O=C(NCC1CCCCO1)C2CO2 240690a_100000174945_100000701028 [0,0,0,1,0,1|2,0,0]=4 8241 B14R2.2899 O=C(NCC1CCCCO1)C2CO2 527a_100000174945_100000701028 [0,0,0,1,0,1|2,0,0]=4 8242 B14R2.2899 O=C(NCC1CCCOC1)C2CC2 11a_100000720124_100000210395 [0,0,0,1,0,1|1,0,0]=3 8243 B14R2.2899 O=C(NCC1CCCOC1)C2CC2 1626a_100000720124_100000210395 [0,0,0,1,0,1|1,0,0]=3 8244 B14R2.2899 O=C(NCC1CCCOC1)C2CC2 240690a_100000720124_100000210395 [0,0,0,1,0,1|1,0,0]=3 8245 B14R2.2899 O=C(NCC1CCCOC1)C2CC2 527a_100000720124_100000210395 [0,0,0,1,0,1|1,0,0]=3 8246 B14R2.2899 O=C(NCC1CCCOC1)C2CO2 11a_100000720124_100000701028 [0,0,0,1,0,1|2,0,0]=4 8247 B14R2.2899 O=C(NCC1CCCOC1)C2CO2 1626a_100000720124_100000701028 [0,0,0,1,0,1|2,0,0]=4 8248 B14R2.2899 O=C(NCC1CCCOC1)C2CO2 240690a_100000720124_100000701028 [0,0,0,1,0,1|2,0,0]=4 8249 B14R2.2899 O=C(NCC1CCCOC1)C2CO2 527a_100000720124_100000701028 [0,0,0,1,0,1|2,0,0]=4 8250 B14R2.2899 O=C(NCC1CCOCC1)C2CC2 11a_100000746373_100000210395 [0,0,0,1,0,1|2,0,0]=4 8251 B14R2.2899 O=C(NCC1CCOCC1)C2CC2 1626a_100000746373_100000210395 [0,0,0,1,0,1|2,0,0]=4 8252 B14R2.2899 O=C(NCC1CCOCC1)C2CC2 240690a_100000746373_100000210395 [0,0,0,1,0,1|2,0,0]=4 8253 B14R2.2899 O=C(NCC1CCOCC1)C2CC2 527a_100000746373_100000210395 [0,0,0,1,0,1|2,0,0]=4 8254 B14R2.2899 O=C(NCC1CCSCC1)C2CC2 11a_100015188806_100000210395 [0,0,0,1,0,1|2,0,0]=4 8255 B14R2.2899 O=C(NCC1CCSCC1)C2CC2 240690a_100015188806_100000210395 [0,0,0,1,0,1|2,0,0]=4 8256 B14R2.2899 O=C(NCC1CCSCC1)C2CC2 527a_100015188806_100000210395 [0,0,0,1,0,1|2,0,0]=4 8257 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CC2 11a_100010981119_100000210395 [0,0,0,1,0,1|1,0,0]=3 8258 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CC2 1626a_100010981119_100000210395 [0,0,0,1,0,1|1,0,0]=3 8259 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CC2 240690a_100010981119_100000210395 [0,0,0,1,0,1|1,0,0]=3 8260 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CC2 527a_100010981119_100000210395 [0,0,0,1,0,1|1,0,0]=3 8261 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CO2 11a_100010981119_100000701028 [0,0,0,1,0,1|2,0,0]=4 8262 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CO2 1626a_100010981119_100000701028 [0,0,0,1,0,1|2,0,0]=4 8263 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CO2 240690a_100010981119_100000701028 [0,0,0,1,0,1|2,0,0]=4 8264 B14R2.2899 O=C(NC[C@H]1COCCO1)C2CO2 527a_100010981119_100000701028 [0,0,0,1,0,1|2,0,0]=4 8265 B14R2.2899 O=C(OCN1CCCOC1)C2CC2 2230a_100000131196_100000140896 [0,0,0,1,0,1|1,0,0]=3 8266 B14R2.2899 O=C(OCN1CCCOC1)C2CC2 269982a_100000131196_100000140896 [0,0,0,1,0,1|1,0,0]=3 8267 B14R2.2899 O=C(OCN1CCCOC1)C2CC2 34a_100000131196_100000140896 [0,0,0,1,0,1|1,0,0]=3 8268 B14R2.2899 O=C(OCN1CCOCC1)C2CC2 2230a_100015191051_100000140896 [0,0,0,1,0,1|2,0,0]=4 8269 B14R2.2899 O=C(OCN1CCOCC1)C2CC2 269982a_100015191051_100000140896 [0,0,0,1,0,1|2,0,0]=4 8270 B14R2.2899 O=C(OCN1CCOCC1)C2CC2 34a_100015191051_100000140896 [0,0,0,1,0,1|2,0,0]=4 8271 B14R2.2899 O=C(OCN1CCSCC1)C2CC2 2230a_100000737611_100000140896 [0,0,0,1,0,1|2,0,0]=4 8272 B14R2.2899 O=C(OCN1CCSCC1)C2CC2 269982a_100000737611_100000140896 [0,0,0,1,0,1|2,0,0]=4 8273 B14R2.4656 CC1(CCC1)OCC2CCCCO2 34a_100000759064_100000211543 [0,0,0,1,0,1|1,0,1]=4 8274 B14R2.4656 CC1(CCC1)OCC2CCCCO2 7a_100000759064_100000211543 [0,0,0,1,0,1|1,0,1]=4 8275 B14R2.4656 CC1(CCC1)OCC2CCCOC2 34a_100000759064_100000741521 [0,0,0,1,0,1|1,0,1]=4 8276 B14R2.4656 CC1(CCC1)OCC2CCCOC2 7a_100000759064_100000741521 [0,0,0,1,0,1|1,0,1]=4 8277 B14R2.9942 CCCC(=O)OCN1CC2CC2C1 2230a_100000741873_100000034017 [0,0,0,1,0,1|2,0,0]=4 8278 B14R2.9942 CCCC(=O)OCN1CC2CC2C1 269982a_100000741873_100000034017 [0,0,0,1,0,1|2,0,0]=4 8279 B14R2.9942 CCCC(=O)OCN1CC2CC2C1 34a_100000741873_100000034017 [0,0,0,1,0,1|2,0,0]=4 8280 B14R2.9964 CCCC(=O)C1CC2CCN1CC2 1458a_100102578056_100000210303 [0,0,0,1,0,1|2,0,0]=4 8281 B14R2.9964 CCCC(=O)N1CC2CCC1CC2 11a_100000750499_100000211992 [0,0,0,1,0,1|2,0,0]=4 8282 B14R2.9964 CCCC(=O)N1CC2CCC1CC2 1626a_100000750499_100000211992 [0,0,0,1,0,1|2,0,0]=4 8283 B14R2.9964 CCCC(=O)N1CC2CCC1CC2 240690a_100000750499_100000211992 [0,0,0,1,0,1|2,0,0]=4 8284 B14R2.9964 CCCC(=O)N1CC2CCC1CC2 527a_100000750499_100000211992 [0,0,0,1,0,1|2,0,0]=4 8285 B14R2.56 CCCc1nc(no1)C2CCCO2 270196a_100011794354_100000211992 [0,0,0,1,0,1|1,0,1]=4 8286 B14R2.56 CCCc1noc(n1)[C@@H]2CCCO2 270196a_100011193412_100000686382 [0,0,0,1,0,1|1,0,1]=4 8287 B14R2.322 C1CCC(C1)COCC2CCCO2 34a_100000210270_100000740388 [0,0,0,1,0,1|1,0,1]=4 8288 B14R2.322 C1CCC(C1)COCC2CCCO2 7a_100000210270_100000740388 [0,0,0,1,0,1|1,0,1]=4 8289 B14R2.322 C1CCC(C1)COCC2CCCO2 7a_100000742336_100000203698 [0,0,0,1,0,1|1,0,1]=4 8290 B14R2.322 C1COC(C1)COCC2=NCCN2 34a_100000210270_100000737910 [0,0,0,1,0,1|2,0,0]=4 8291 B14R2.322 C1COC(C1)COCC2=NCCN2 7a_100000210270_100000737910 [0,0,0,1,0,1|2,0,0]=4 8292 B14R2.322 C1COC(C1)COCC2CCCO2 7a_100000210270_100000203698 [0,0,0,1,0,1|0,0,2]=4 8293 B14R2.384 CC1CCCC1OCC2CCCO2 7a_100011216460_100000203698 [0,0,0,1,0,1|1,0,1]=4 8294 B14R2.384 O=C1CCCC1NCC2CCCC2 2230a_100000737975_100000211823 [0,0,0,1,0,1|2,0,0]=4 8295 B14R2.384 O=C1CCCC1NCC2CCCC2 34a_100000737975_100000709159 [0,0,0,1,0,1|2,0,0]=4 8296 B14R2.384 O=C1CCCC1NCC2OCCO2 2230a_100000036311_100000211823 [0,0,0,1,0,1|2,0,0]=4 8297 B14R2.384 O=C1CCCC1NCC2OCCO2 34a_100000036311_100000709159 [0,0,0,1,0,1|2,0,0]=4 8298 B14R2.384 O=C1CCCC1NC[C@@H]2CCCO2 2230a_100020590478_100000211823 [0,0,0,1,0,1|1,0,0]=3 8299 B14R2.384 O=C1CCCC1NC[C@@H]2CCCO2 34a_100020590478_100000709159 [0,0,0,1,0,1|1,0,0]=3 8300 B14R2.384 O=C1CCCC1OCC2CCCC2 34a_100000742336_100000709159 [0,0,0,1,0,1|1,0,0]=3 8301 B14R2.384 O=C1CCCC1OCC2CCCC2 34a_200000719330_100000740388 [0,0,0,1,0,1|1,0,0]=3 8302 B14R2.384 O=C1CCCC1OCC2CCCC2 7a_100000742336_100000211823 [0,0,0,1,0,1|1,0,0]=3 8303 B14R2.384 O=C1CCCC1OCC2CCCO2 34a_100000210270_100000709159 [0,0,0,1,0,1|0,0,0]=2 8304 B14R2.384 O=C1CCCC1OCC2CCCO2 7a_100000210270_100000211823 [0,0,0,1,0,1|0,0,0]=2 8305 B14R2.384 O=C1CCCC1OCC2CCNC2 34a_100000748654_100000709159 [0,0,0,1,0,1|2,0,0]=4 8306 B14R2.384 O=C1CCCC1OCC2CCOC2 34a_100000740260_100000709159 [0,0,0,1,0,1|2,0,0]=4 8307 B14R2.384 O=C1CCCC1OCC2CCOC2 34a_200000719330_100011261433 [0,0,0,1,0,1|2,0,0]=4 8308 B14R2.384 O=C1CCCC1OCC2COCO2 34a_100011216627_100000709159 [0,0,0,1,0,1|1,0,0]=3 8309 B14R2.384 O=C1CCCC1OCC2OCCO2 34a_100000087154_100000709159 [0,0,0,1,0,1|1,0,0]=3 8310 B14R2.384 O=C1CCCC1OCC2OCCO2 34a_200000719330_100000755774 [0,0,0,1,0,1|1,0,0]=3 8311 B14R2.384 O=C1CCCC1OC[C@H]2CCCN2 34a_100000745186_100000709159 [0,0,0,1,0,1|1,0,0]=3 8312 B14R2.384 O=C1CCCC1SCC2CCCC2 62a_100000211823_100000740388 [0,0,0,1,0,1|1,1,0]=4 8313 B14R2.384 O=C1CCCC1SCC2CCCC2 62a_100000740388_100000211823 [0,0,0,1,0,1|1,1,0]=4 8314 B14R2.384 O=C1CCCC1SCC2CCCO2 62a_100000203698_100000211823 [0,0,0,1,0,1|0,1,0]=3 8315 B14R2.384 O=C1CCCC1SCC2CCCO2 62a_100000211823_100000203698 [0,0,0,1,0,1|0,1,0]=3 8316 B14R2.384 O=C1CCCC1SCC2OCCO2 62a_100000211823_100000755774 [0,0,0,1,0,1|1,1,0]=4 8317 B14R2.384 O=C1CCCC1SCC2OCCO2 62a_100000755774_100000211823 [0,0,0,1,0,1|1,1,0]=4 8318 B14R2.384 O=C1CCCN1CSC2CCCC2 62a_100000026320_100000179811 [0,0,0,1,0,1|2,0,0]=4 8319 B14R2.384 O=C1CCCN1CSC2CCCC2 62a_100011217020_100000026320 [0,0,0,1,0,1|2,0,0]=4 8320 B14R2.384 O=C1NCCC1NCC2CCCO2 2230a_100016995588_100000203698 [0,0,0,1,0,1|2,0,0]=4 8321 B14R2.384 O=C1NCC[C@@H]1OCC2CCCC2 34a_100000688343_100000740388 [0,0,0,1,0,1|2,0,0]=4 8322 B14R2.384 O=C1NCC[C@@H]1OCC2OCCO2 34a_100000688343_100000755774 [0,0,0,1,0,1|2,0,0]=4 8323 B14R2.384 O=C1OCCC1NC[C@@H]2CCCO2 2230a_100020590478_100000211211 [0,0,0,1,0,1|2,0,0]=4 8324 B14R2.384 O=C1OCCC1NC[C@@H]2CCCO2 34a_100020590478_100000211211 [0,0,0,1,0,1|2,0,0]=4 8325 B14R2.384 O=C1OCCC1OCC2CCCC2 34a_100000742336_100000211211 [0,0,0,1,0,1|2,0,0]=4 8326 B14R2.384 O=C1OCCC1OCC2CCCC2 7a_100000742336_100000211211 [0,0,0,1,0,1|2,0,0]=4 8327 B14R2.384 O=C1OCCC1OCC2CCCO2 34a_100000210270_100000211211 [0,0,0,1,0,1|1,0,0]=3 8328 B14R2.384 O=C1OCCC1OCC2CCCO2 7a_100000210270_100000211211 [0,0,0,1,0,1|1,0,0]=3 8329 B14R2.384 O=C1OCCC1OCC2COCO2 34a_100011216627_100000211211 [0,0,0,1,0,1|2,0,0]=4 8330 B14R2.384 O=C1OCCC1OCC2OCCO2 34a_100000087154_100000211211 [0,0,0,1,0,1|2,0,0]=4 8331 B14R2.384 O=C1OCCC1OC[C@H]2CCCN2 34a_100000745186_100000211211 [0,0,0,1,0,1|2,0,0]=4 8332 B14R2.384 O=C1OCCC1SCC2CCCO2 62a_100000203698_100000211211 [0,0,0,1,0,1|1,1,0]=4 8333 B14R2.384 O=C1OCCC1SCC2CCCO2 62a_100000211211_100000203698 [0,0,0,1,0,1|1,1,0]=4 8334 B14R2.716 O=C1CCCC(C1)OC2CCCC2 34a_100012613340_100000179811 [0,0,0,1,0,1|2,0,0]=4 8335 B14R2.716 O=C1CN(CCN1)CC2CCCO2 2230a_100000184651_100000203698 [0,0,0,1,0,1|2,0,0]=4 8336 B14R2.716 O=C1CN(CCO1)CC2CCCO2 2230a_100000131268_100000203698 [0,0,0,1,0,1|2,0,0]=4 8337 B14R2.2711 CCCC(=O)CC1CC2CCC1C2 1458a_100000211222_100000210303 [0,0,0,1,0,1|2,0,0]=4 8338 B14R2.2711 CCCC(=O)CN1CC2CCC1C2 2230a_100000743476_100000747444 [0,0,0,1,0,1|2,0,0]=4 8339 B14R2.2711 CCCC(=O)CN1CC2CCC1C2 269982a_100000743476_100000747444 [0,0,0,1,0,1|2,0,0]=4 8340 B14R2.2711 CCCC(=O)CN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000747444 [0,0,0,1,0,1|1,0,0]=3 8341 B14R2.2711 CCCC(=O)CN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000747444 [0,0,0,1,0,1|1,0,0]=3 8342 B14R2.2711 CCCC(=O)NC1CC2CCC1C2 11a_100000758229_100000211992 [0,0,0,1,0,1|2,0,0]=4 8343 B14R2.2711 CCCC(=O)NC1CC2CCC1C2 1626a_100000758229_100000211992 [0,0,0,1,0,1|2,0,0]=4 8344 B14R2.2711 CCCC(=O)NC1CC2CCC1C2 240690a_100000758229_100000211992 [0,0,0,1,0,1|2,0,0]=4 8345 B14R2.2711 CCCC(=O)NC1CC2CCC1C2 527a_100000758229_100000211992 [0,0,0,1,0,1|2,0,0]=4 8346 B14R2.2711 CCNC(=O)CN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000183381 [0,0,0,1,0,1|2,0,0]=4 8347 B14R2.2711 CCNC(=O)CN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000183381 [0,0,0,1,0,1|2,0,0]=4 8348 B14R2.2711 CCNC(=O)CN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000183381 [0,0,0,1,0,1|2,0,0]=4 8349 B14R2.2711 CCOC(=O)CN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000188475 [0,0,0,1,0,1|2,0,0]=4 8350 B14R2.2711 CCOC(=O)CN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000188475 [0,0,0,1,0,1|2,0,0]=4 8351 B14R2.2711 CCOC(=O)CN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000188475 [0,0,0,1,0,1|2,0,0]=4 8352 B14R2.4658 CC1(CCC1)COCC2CCCO2 34a_100000210270_100000726658 [0,0,0,1,0,1|1,0,1]=4 8353 B14R2.4658 CC1(CCC1)COCC2CCCO2 7a_100000210270_100000726658 [0,0,0,1,0,1|1,0,1]=4 8354 B14R2.31850 O=C(CCCC1CCCC1)C2CC2 1458a_100000210395_100011713738 [0,0,0,1,0,1|2,0,0]=4 8355 B14R2.31850 O=C(CCCC1OCCO1)C2CC2 1458a_100000210395_100000042513 [0,0,0,1,0,1|2,0,0]=4 8356 B14R2.31850 O=C(CNCC1CCCC1)C2CC2 2230a_100000737975_100000746382 [0,0,0,1,0,1|2,0,0]=4 8357 B14R2.31850 O=C(CNCC1CCCC1)C2CC2 34a_100000737975_100000746382 [0,0,0,1,0,1|2,0,0]=4 8358 B14R2.31850 O=C(CNCC1OCCO1)C2CC2 2230a_100000036311_100000746382 [0,0,0,1,0,1|2,0,0]=4 8359 B14R2.31850 O=C(CNCC1OCCO1)C2CC2 34a_100000036311_100000746382 [0,0,0,1,0,1|2,0,0]=4 8360 B14R2.31850 O=C(CNC[C@@H]1CCCO1)C2CC2 2230a_100020590478_100000746382 [0,0,0,1,0,1|1,0,0]=3 8361 B14R2.31850 O=C(CNC[C@@H]1CCCO1)C2CC2 34a_100020590478_100000746382 [0,0,0,1,0,1|1,0,0]=3 8362 B14R2.31850 O=C(COCC1CCCC1)C2CC2 34a_100000686663_100000740388 [0,0,0,1,0,1|1,0,0]=3 8363 B14R2.31850 O=C(COCC1CCCC1)C2CC2 34a_100000742336_100000746382 [0,0,0,1,0,1|1,0,0]=3 8364 B14R2.31850 O=C(COCC1CCCC1)C2CC2 7a_100000742336_100000746382 [0,0,0,1,0,1|1,0,0]=3 8365 B14R2.31850 O=C(COCC1CCCO1)C2CC2 34a_100000210270_100000746382 [0,0,0,1,0,1|0,0,0]=2 8366 B14R2.31850 O=C(COCC1CCCO1)C2CC2 7a_100000210270_100000746382 [0,0,0,1,0,1|0,0,0]=2 8367 B14R2.31850 O=C(COCC1CCNC1)C2CC2 34a_100000748654_100000746382 [0,0,0,1,0,1|2,0,0]=4 8368 B14R2.31850 O=C(COCC1CCOC1)C2CC2 34a_100000686663_100011261433 [0,0,0,1,0,1|2,0,0]=4 8369 B14R2.31850 O=C(COCC1CCOC1)C2CC2 34a_100000740260_100000746382 [0,0,0,1,0,1|2,0,0]=4 8370 B14R2.31850 O=C(COCC1COCO1)C2CC2 34a_100011216627_100000746382 [0,0,0,1,0,1|1,0,0]=3 8371 B14R2.31850 O=C(COCC1OCCO1)C2CC2 34a_100000087154_100000746382 [0,0,0,1,0,1|1,0,0]=3 8372 B14R2.31850 O=C(COCC1OCCO1)C2CC2 34a_100000686663_100000755774 [0,0,0,1,0,1|1,0,0]=3 8373 B14R2.31850 O=C(COC[C@H]1CCCN1)C2CC2 34a_100000745186_100000746382 [0,0,0,1,0,1|1,0,0]=3 8374 B14R2.31850 O=C(CSCC1CCCC1)C2CC2 62a_100000740388_100000746382 [0,0,0,1,0,1|1,1,0]=4 8375 B14R2.31850 O=C(CSCC1CCCC1)C2CC2 62a_100000746382_100000740388 [0,0,0,1,0,1|1,1,0]=4 8376 B14R2.31850 O=C(CSCC1CCCO1)C2CC2 62a_100000203698_100000746382 [0,0,0,1,0,1|0,1,0]=3 8377 B14R2.31850 O=C(CSCC1CCCO1)C2CC2 62a_100000746382_100000203698 [0,0,0,1,0,1|0,1,0]=3 8378 B14R2.31850 O=C(CSCC1OCCO1)C2CC2 62a_100000746382_100000755774 [0,0,0,1,0,1|1,1,0]=4 8379 B14R2.31850 O=C(CSCC1OCCO1)C2CC2 62a_100000755774_100000746382 [0,0,0,1,0,1|1,1,0]=4 8380 B14R2.31850 O=C(NCCC1CCCC1)C2CC2 11a_100000739158_100000210395 [0,0,0,1,0,1|2,0,0]=4 8381 B14R2.31850 O=C(NCCC1CCCC1)C2CC2 1626a_100000739158_100000210395 [0,0,0,1,0,1|2,0,0]=4 8382 B14R2.31850 O=C(NCCC1CCCC1)C2CC2 240690a_100000739158_100000210395 [0,0,0,1,0,1|2,0,0]=4 8383 B14R2.31850 O=C(NCCC1CCCC1)C2CC2 527a_100000739158_100000210395 [0,0,0,1,0,1|2,0,0]=4 8384 B14R2.31850 O=C(NCCC1OCCO1)C2CC2 11a_100000034215_100000210395 [0,0,0,1,0,1|2,0,0]=4 8385 B14R2.31850 O=C(NCCC1OCCO1)C2CC2 1626a_100000034215_100000210395 [0,0,0,1,0,1|2,0,0]=4 8386 B14R2.31850 O=C(NCCC1OCCO1)C2CC2 240690a_100000034215_100000210395 [0,0,0,1,0,1|2,0,0]=4 8387 B14R2.31850 O=C(NCCC1OCCO1)C2CC2 527a_100000034215_100000210395 [0,0,0,1,0,1|2,0,0]=4 8388 B14R2.31850 O=C(OCNC1CCCC1)C2CC2 2230a_100000211070_100000140896 [0,0,0,1,0,1|1,0,0]=3 8389 B14R2.31850 O=C(OCNC1CCCC1)C2CC2 34a_100000211070_100000140896 [0,0,0,1,0,1|1,0,0]=3 8390 B14R2.31850 O=C(OCN[C@@H]1CCOC1)C2CC2 2230a_200015188469_100000140896 [0,0,0,1,0,1|2,0,0]=4 8391 B14R2.31850 O=C(OCN[C@H]1CCOC1)C2CC2 2230a_100015188467_100000140896 [0,0,0,1,0,1|2,0,0]=4 8392 B14R2.31850 O=C(OCN[C@H]1CCOC1)C2CC2 34a_100015188467_100000140896 [0,0,0,1,0,1|2,0,0]=4 8393 B14R2.31850 O=C(OCOC1CCCC1)C2CC2 34a_100000210269_100000140896 [0,0,0,1,0,1|1,0,0]=3 8394 B14R2.31850 O=C(OCOC1CCCO1)C2CC2 34a_100000085407_100000140896 [0,0,0,1,0,1|0,0,0]=2 8395 B14R2.31850 O=C(OCO[C@H]1CCOC1)C2CC2 34a_100000717292_100000140896 [0,0,0,1,0,1|2,0,0]=4 8396 B14R2.31850 O=C(OCSC1CCCC1)C2CC2 62a_100000140896_100000179811 [0,0,0,1,0,1|1,0,0]=3 8397 B14R2.31850 O=C(OCSC1CCCC1)C2CC2 62a_100011217020_100000140896 [0,0,0,1,0,1|1,0,0]=3 8398 B14R2.31850 O=C(OCSC1CCOC1)C2CC2 62a_100000140896_100000690089 [0,0,0,1,0,1|2,0,0]=4 8399 B14R2.308 O=C1CCCC1C(=O)[C@@H]2CCCO2 1458a_100000686382_100000211823 [0,1,0,1,0,0|1,0,1]=4 8400 B14R2.793 O=C(CC1CCCO1)C2=CCCC2 1458a_100000038896_100000203698 [0,1,0,1,0,0|2,0,0]=4 8401 B14R2.15286 CC(NC(=O)C1CC1)C2CCCC2 11a_100015185923_100000210395 [0,1,0,1,0,0|2,0,0]=4 8402 B14R2.15286 CC(NC(=O)C1CC1)C2CCCC2 1626a_100015185923_100000210395 [0,1,0,1,0,0|2,0,0]=4 8403 B14R2.15286 CC(NC(=O)C1CC1)C2CCCC2 240690a_100015185923_100000210395 [0,1,0,1,0,0|2,0,0]=4 8404 B14R2.15286 CC(NC(=O)C1CC1)C2CCCC2 527a_100015185923_100000210395 [0,1,0,1,0,0|2,0,0]=4 8405 B14R2.15286 CC(NC(=O)C1CC1)C2CCCO2 11a_100025754208_100000210395 [0,1,0,1,0,0|1,0,0]=3 8406 B14R2.15286 CC(NC(=O)C1CC1)C2CCCO2 1626a_100025754208_100000210395 [0,1,0,1,0,0|1,0,0]=3 8407 B14R2.15286 CC(NC(=O)C1CC1)C2CCCO2 240690a_100025754208_100000210395 [0,1,0,1,0,0|1,0,0]=3 8408 B14R2.15286 CC(NC(=O)C1CC1)C2CCCO2 527a_100025754208_100000210395 [0,1,0,1,0,0|1,0,0]=3 8409 B14R2.15286 CC(NC(=O)C1CO1)C2CCCO2 11a_100025754208_100000701028 [0,1,0,1,0,0|2,0,0]=4 8410 B14R2.15286 CC(NC(=O)C1CO1)C2CCCO2 1626a_100025754208_100000701028 [0,1,0,1,0,0|2,0,0]=4 8411 B14R2.15286 CC(NC(=O)C1CO1)C2CCCO2 240690a_100025754208_100000701028 [0,1,0,1,0,0|2,0,0]=4 8412 B14R2.15286 CC(NC(=O)C1CO1)C2CCCO2 527a_100025754208_100000701028 [0,1,0,1,0,0|2,0,0]=4 8413 B14R2.15286 O=C(CC(=O)[C@@H]1CCCO1)C2CC2 1458a_100000686382_100000746382 [0,1,0,1,0,0|1,0,1]=4 8414 B14R2.252 CN1CCC(C1)OCC2CCCO2 7a_100000210270_200012183744 [0,1,0,1,0,0|1,0,1]=4 8415 B14R2.840 CCCC(=O)N1CC2CCC(C1)O2 11a_100015188616_100000211992 [0,1,0,1,0,0|1,0,0]=3 8416 B14R2.840 CCCC(=O)N1CC2CCC(C1)O2 1626a_100015188616_100000211992 [0,1,0,1,0,0|1,0,0]=3 8417 B14R2.840 CCCC(=O)N1CC2CCC(C1)O2 240690a_100015188616_100000211992 [0,1,0,1,0,0|1,0,0]=3 8418 B14R2.840 CCCC(=O)N1CC2CCC(C1)O2 527a_100015188616_100000211992 [0,1,0,1,0,0|1,0,0]=3 8419 B14R2.840 CCNC(=O)N1CC2CCC(C1)O2 2708a_100015525214_100015188616 [0,1,0,1,0,0|2,0,0]=4 8420 B14R2.840 CCNC(=O)N1CC2CCC(C1)O2 273464a_100015525214_100015188616 [0,1,0,1,0,0|2,0,0]=4 8421 B14R2.840 COCC(=O)N1CC2CCC(C1)O2 11a_100015188616_100000210968 [0,1,0,1,0,0|2,0,0]=4 8422 B14R2.840 COCC(=O)N1CC2CCC(C1)O2 1626a_100015188616_100000210968 [0,1,0,1,0,0|2,0,0]=4 8423 B14R2.840 COCC(=O)N1CC2CCC(C1)O2 240690a_100015188616_100000210968 [0,1,0,1,0,0|2,0,0]=4 8424 B14R2.840 COCC(=O)N1CC2CCC(C1)O2 527a_100015188616_100000210968 [0,1,0,1,0,0|2,0,0]=4 8425 B14R2.840 CSCC(=O)N1CC2CCC(C1)O2 11a_100015188616_100000184570 [0,1,0,1,0,0|2,0,0]=4 8426 B14R2.840 CSCC(=O)N1CC2CCC(C1)O2 1626a_100015188616_100000184570 [0,1,0,1,0,0|2,0,0]=4 8427 B14R2.840 CSCC(=O)N1CC2CCC(C1)O2 240690a_100015188616_100000184570 [0,1,0,1,0,0|2,0,0]=4 8428 B14R2.840 CSCC(=O)N1CC2CCC(C1)O2 527a_100015188616_100000184570 [0,1,0,1,0,0|2,0,0]=4 8429 B14R2.840 O=C(CCO)N1CC2CCC(C1)O2 240690a_100015188616_100011216618 [0,1,0,1,0,0|2,0,0]=4 8430 B14R2.4373 C[C@@H]1CCN(C1)COC(=O)C2CC2 2230a_100016987628_100000140896 [0,1,0,1,0,0|2,0,0]=4 8431 B14R2.4373 C[C@@H]1CCN(C1)COC(=O)C2CC2 269982a_100016987628_100000140896 [0,1,0,1,0,0|2,0,0]=4 8432 B14R2.4373 C[C@@H]1CCN(C1)COC(=O)C2CC2 34a_100016987628_100000140896 [0,1,0,1,0,0|2,0,0]=4 8433 B14R2.4373 O=C(OCN1CCC(C1)O)C2CC2 2230a_100011215560_100000140896 [0,1,0,1,0,0|2,0,0]=4 8434 B14R2.4373 O=C(OCN1CCC(C1)O)C2CC2 269982a_100011215560_100000140896 [0,1,0,1,0,0|2,0,0]=4 8435 B14R2.4373 O=C(OCN1CC[C@@H](C1)F)C2CC2 2230a_100015203821_100000140896 [0,1,0,1,0,0|2,0,0]=4 8436 B14R2.4373 O=C(OCN1CC[C@@H](C1)F)C2CC2 269982a_100015203821_100000140896 [0,1,0,1,0,0|2,0,0]=4 8437 B14R2.4373 O=C(OCN1CC[C@@H](C1)F)C2CC2 34a_100015203821_100000140896 [0,1,0,1,0,0|2,0,0]=4 8438 B14R2.9967 CCCC(=O)[C@@H]1C[C@@H]2CC1C(=O)O2 1458a_200045396503_100000210303 [0,1,0,1,0,0|1,0,1]=4 8439 B14R2.9967 CCCC(=O)[C@@H]1C[C@@H]2C[C@H]1C(=O)O2 1458a_200121570381_100000210303 [0,1,0,1,0,0|1,0,1]=4 8440 B14R2.50 O=C1CCCCC1OC2CCCO2 34a_100000085407_100000754470 [0,1,0,1,0,0|2,0,0]=4 8441 B14R2.50 O=C1CCOCC1OC2CCCO2 34a_100000085407_100012180262 [0,1,0,1,0,0|2,0,0]=4 8442 B14R2.50 O=C1NCCCC1OC2CCCO2 34a_100000085407_100000687798 [0,1,0,1,0,0|2,0,0]=4 8443 B14R2.839 CCCC(=O)N1C[C@H]2CCC[C@H]2C1 1626a_100102946302_100000211992 [0,1,0,1,0,0|2,0,0]=4 8444 B14R2.839 CCCC(=O)N1C[C@H]2CCC[C@H]2C1 240690a_100102946302_100000211992 [0,1,0,1,0,0|2,0,0]=4 8445 B14R2.9597 CN(CC1CCCO1)C(=O)C2CC2 11a_100102946541_100000210395 [0,1,0,1,0,0|1,0,0]=3 8446 B14R2.9597 CN(CC1CCCO1)C(=O)C2CC2 1626a_100102946541_100000210395 [0,1,0,1,0,0|1,0,0]=3 8447 B14R2.9597 CN(CC1CCCO1)C(=O)C2CC2 240690a_100102946541_100000210395 [0,1,0,1,0,0|1,0,0]=3 8448 B14R2.9597 CN(CC1CCCO1)C(=O)C2CC2 527a_100102946541_100000210395 [0,1,0,1,0,0|1,0,0]=3 8449 B14R2.9597 CN(CC1CCCO1)C(=O)C2CO2 11a_100102946541_100000701028 [0,1,0,1,0,0|2,0,0]=4 8450 B14R2.9597 CN(CC1CCCO1)C(=O)C2CO2 1626a_100102946541_100000701028 [0,1,0,1,0,0|2,0,0]=4 8451 B14R2.9597 CN(CC1CCCO1)C(=O)C2CO2 240690a_100102946541_100000701028 [0,1,0,1,0,0|2,0,0]=4 8452 B14R2.9597 CN(CC1CCCO1)C(=O)C2CO2 527a_100102946541_100000701028 [0,1,0,1,0,0|2,0,0]=4 8453 B14R2.9597 CN(CC1OCCO1)C(=O)C2CC2 11a_200000032744_100000210395 [0,1,0,1,0,0|2,0,0]=4 8454 B14R2.9597 CN(CC1OCCO1)C(=O)C2CC2 1626a_200000032744_100000210395 [0,1,0,1,0,0|2,0,0]=4 8455 B14R2.9597 CN(CC1OCCO1)C(=O)C2CC2 527a_200000032744_100000210395 [0,1,0,1,0,0|2,0,0]=4 8456 B14R2.33855 CCCC(=O)C1CC2(C1)OCCO2 1458a_100000100527_100000210303 [0,1,0,1,0,0|2,0,0]=4 8457 B14R2.33855 CCCC(=O)C1CC2(C1)OCCO2 1458a_100000211992_100009907966 [0,1,0,1,0,0|2,0,0]=4 8458 B14R2.674 CC1CC1C(=O)CCC2CCCC2 1458a_100000211227_100000760354 [0,1,0,1,0,0|2,0,0]=4 8459 B14R2.674 CC1CC1C(=O)CCC2OCCO2 1458a_100000211227_100000740749 [0,1,0,1,0,0|2,0,0]=4 8460 B14R2.674 CC1CC1C(=O)NCC2CCCC2 11a_100000737975_100000211227 [0,1,0,1,0,0|2,0,0]=4 8461 B14R2.674 CC1CC1C(=O)NCC2CCCC2 1626a_100000737975_100000211227 [0,1,0,1,0,0|2,0,0]=4 8462 B14R2.674 CC1CC1C(=O)NCC2CCCC2 527a_100000737975_100000211227 [0,1,0,1,0,0|2,0,0]=4 8463 B14R2.674 CC1CC1C(=O)NCC2OCCO2 11a_100000036311_100000211227 [0,1,0,1,0,0|2,0,0]=4 8464 B14R2.674 CC1CC1C(=O)NCC2OCCO2 1626a_100000036311_100000211227 [0,1,0,1,0,0|2,0,0]=4 8465 B14R2.674 CC1CC1C(=O)NCC2OCCO2 527a_100000036311_100000211227 [0,1,0,1,0,0|2,0,0]=4 8466 B14R2.674 CC1CC1C(=O)NC[C@@H]2CCCO2 11a_100020590478_100000211227 [0,1,0,1,0,0|1,0,0]=3 8467 B14R2.674 CC1CC1C(=O)NC[C@@H]2CCCO2 1626a_100020590478_100000211227 [0,1,0,1,0,0|1,0,0]=3 8468 B14R2.674 CC1CC1C(=O)NC[C@@H]2CCCO2 527a_100020590478_100000211227 [0,1,0,1,0,0|1,0,0]=3 8469 B14R2.674 O=C(CCC1CCCC1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000760354 [0,1,0,1,0,0|2,0,0]=4 8470 B14R2.674 O=C(CCC1OCCO1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000740749 [0,1,0,1,0,0|2,0,0]=4 8471 B14R2.674 O=C(NCC1CCCC1)[C@@H]2C[C@@H]2F 11a_100000737975_100015396687 [0,1,0,1,0,0|2,0,0]=4 8472 B14R2.674 O=C(NCC1CCCC1)[C@@H]2C[C@@H]2F 240690a_100000737975_100015396687 [0,1,0,1,0,0|2,0,0]=4 8473 B14R2.674 O=C(NCC1CCCC1)[C@@H]2C[C@@H]2F 527a_100000737975_100015396687 [0,1,0,1,0,0|2,0,0]=4 8474 B14R2.674 O=C(NCC1OCCO1)[C@@H]2C[C@@H]2F 11a_100000036311_100015396687 [0,1,0,1,0,0|2,0,0]=4 8475 B14R2.674 O=C(NCC1OCCO1)[C@@H]2C[C@@H]2F 527a_100000036311_100015396687 [0,1,0,1,0,0|2,0,0]=4 8476 B14R2.674 O=C(NC[C@@H]1CCCO1)[C@@H]2C[C@@H]2F 11a_100020590478_100015396687 [0,1,0,1,0,0|1,0,0]=3 8477 B14R2.674 O=C(NC[C@@H]1CCCO1)[C@@H]2C[C@@H]2F 240690a_100020590478_100015396687 [0,1,0,1,0,0|1,0,0]=3 8478 B14R2.674 O=C(NC[C@@H]1CCCO1)[C@@H]2C[C@@H]2F 527a_100020590478_100015396687 [0,1,0,1,0,0|1,0,0]=3 8479 B14R2.2647 C#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000692101 [0,1,0,1,0,0|1,0,1]=4 8480 B14R2.2647 C#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000692101 [0,1,0,1,0,0|1,0,1]=4 8481 B14R2.2647 C#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000692101 [0,1,0,1,0,0|1,0,1]=4 8482 B14R2.2647 C#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000692101 [0,1,0,1,0,0|1,0,1]=4 8483 B14R2.2647 C=CCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000749702 [0,1,0,1,0,0|1,0,1]=4 8484 B14R2.2647 C=CCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000749702 [0,1,0,1,0,0|1,0,1]=4 8485 B14R2.2647 C=CCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000749702 [0,1,0,1,0,0|1,0,1]=4 8486 B14R2.2647 C=CCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000749702 [0,1,0,1,0,0|1,0,1]=4 8487 B14R2.2647 CC=CCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100121576822 [0,1,0,1,0,0|1,0,1]=4 8488 B14R2.2647 CC=CCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100121576822 [0,1,0,1,0,0|1,0,1]=4 8489 B14R2.2647 CC=CCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100121576822 [0,1,0,1,0,0|1,0,1]=4 8490 B14R2.2647 CC=CCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100121576822 [0,1,0,1,0,0|1,0,1]=4 8491 B14R2.2647 CCC=CC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000212282 [0,1,0,1,0,0|1,0,1]=4 8492 B14R2.2647 CCC=CC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000212282 [0,1,0,1,0,0|1,0,1]=4 8493 B14R2.2647 CCC=CC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000212282 [0,1,0,1,0,0|1,0,1]=4 8494 B14R2.2647 CCCCC(=O)C1CC2CCC1C2 1458a_100000181847_100000210211 [0,1,0,1,0,0|2,0,0]=4 8495 B14R2.2647 CCCCC(=O)C1CC2CCC1C2 1458a_100000210183_100000727232 [0,1,0,1,0,0|2,0,0]=4 8496 B14R2.2647 CCCCC(=O)N1CC2CCC1C2 11a_100000743476_100000210183 [0,1,0,1,0,0|2,0,0]=4 8497 B14R2.2647 CCCCC(=O)N1CC2CCC1C2 1626a_100000743476_100000210183 [0,1,0,1,0,0|2,0,0]=4 8498 B14R2.2647 CCCCC(=O)N1CC2CCC1C2 240690a_100000743476_100000210183 [0,1,0,1,0,0|2,0,0]=4 8499 B14R2.2647 CCCCC(=O)N1CC2CCC1C2 527a_100000743476_100000210183 [0,1,0,1,0,0|2,0,0]=4 8500 B14R2.2647 CCCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000210183 [0,1,0,1,0,0|1,0,0]=3 8501 B14R2.2647 CCCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000210183 [0,1,0,1,0,0|1,0,0]=3 8502 B14R2.2647 CCCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210183 [0,1,0,1,0,0|1,0,0]=3 8503 B14R2.2647 CCCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000210183 [0,1,0,1,0,0|1,0,0]=3 8504 B14R2.2647 CCCNC(=O)C1CC2CCC1C2 11a_100020643023_100000181847 [0,1,0,1,0,0|2,0,0]=4 8505 B14R2.2647 CCCNC(=O)C1CC2CCC1C2 1626a_100020643023_100000181847 [0,1,0,1,0,0|2,0,0]=4 8506 B14R2.2647 CCCNC(=O)C1CC2CCC1C2 240690a_100020643023_100000181847 [0,1,0,1,0,0|2,0,0]=4 8507 B14R2.2647 CCCNC(=O)C1CC2CCC1C2 527a_100020643023_100000181847 [0,1,0,1,0,0|2,0,0]=4 8508 B14R2.2647 CCCNC(=O)N1CC2CCC1C2 2708a_100020643023_100000743476 [0,1,0,1,0,0|2,0,0]=4 8509 B14R2.2647 CCCNC(=O)N1CC2CCC1C2 273464a_100020643023_100000743476 [0,1,0,1,0,0|2,0,0]=4 8510 B14R2.2647 CCCNC(=O)N1C[C@H]2C[C@@H]1CO2 2708a_100020643023_100016995552 [0,1,0,1,0,0|1,0,0]=3 8511 B14R2.2647 CCCNC(=O)N1C[C@H]2C[C@@H]1CO2 273464a_100020643023_100016995552 [0,1,0,1,0,0|1,0,0]=3 8512 B14R2.2647 CCOCC(=O)C1CC2CCC1C2 1458a_100000211967_100000727232 [0,1,0,1,0,0|2,0,0]=4 8513 B14R2.2647 CCOCC(=O)N1CC2CCC1C2 11a_100000743476_100000211967 [0,1,0,1,0,0|2,0,0]=4 8514 B14R2.2647 CCOCC(=O)N1CC2CCC1C2 1626a_100000743476_100000211967 [0,1,0,1,0,0|2,0,0]=4 8515 B14R2.2647 CCOCC(=O)N1CC2CCC1C2 240690a_100000743476_100000211967 [0,1,0,1,0,0|2,0,0]=4 8516 B14R2.2647 CCOCC(=O)N1CC2CCC1C2 527a_100000743476_100000211967 [0,1,0,1,0,0|2,0,0]=4 8517 B14R2.2647 CCOCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000211967 [0,1,0,1,0,0|1,0,0]=3 8518 B14R2.2647 CCOCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000211967 [0,1,0,1,0,0|1,0,0]=3 8519 B14R2.2647 CCOCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000211967 [0,1,0,1,0,0|1,0,0]=3 8520 B14R2.2647 CCOCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000211967 [0,1,0,1,0,0|1,0,0]=3 8521 B14R2.2647 CCSCC(=O)C1CC2CCC1C2 1458a_100000230394_100000727232 [0,1,0,1,0,0|2,0,0]=4 8522 B14R2.2647 CCSCC(=O)N1CC2CCC1C2 11a_100000743476_100000230394 [0,1,0,1,0,0|2,0,0]=4 8523 B14R2.2647 CCSCC(=O)N1CC2CCC1C2 1626a_100000743476_100000230394 [0,1,0,1,0,0|2,0,0]=4 8524 B14R2.2647 CCSCC(=O)N1CC2CCC1C2 240690a_100000743476_100000230394 [0,1,0,1,0,0|2,0,0]=4 8525 B14R2.2647 CCSCC(=O)N1CC2CCC1C2 527a_100000743476_100000230394 [0,1,0,1,0,0|2,0,0]=4 8526 B14R2.2647 CCSCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000230394 [0,1,0,1,0,0|1,0,0]=3 8527 B14R2.2647 CCSCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000230394 [0,1,0,1,0,0|1,0,0]=3 8528 B14R2.2647 CCSCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000230394 [0,1,0,1,0,0|1,0,0]=3 8529 B14R2.2647 CCSCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000230394 [0,1,0,1,0,0|1,0,0]=3 8530 B14R2.2647 COCCC(=O)C1CC2CCC1C2 1458a_100000181847_100000233755 [0,1,0,1,0,0|2,0,0]=4 8531 B14R2.2647 COCCC(=O)C1CC2CCC1C2 1458a_100000749529_100000727232 [0,1,0,1,0,0|2,0,0]=4 8532 B14R2.2647 COCCC(=O)N1CC2CCC1C2 11a_100000743476_100000749529 [0,1,0,1,0,0|2,0,0]=4 8533 B14R2.2647 COCCC(=O)N1CC2CCC1C2 1626a_100000743476_100000749529 [0,1,0,1,0,0|2,0,0]=4 8534 B14R2.2647 COCCC(=O)N1CC2CCC1C2 240690a_100000743476_100000749529 [0,1,0,1,0,0|2,0,0]=4 8535 B14R2.2647 COCCC(=O)N1CC2CCC1C2 527a_100000743476_100000749529 [0,1,0,1,0,0|2,0,0]=4 8536 B14R2.2647 COCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000749529 [0,1,0,1,0,0|1,0,0]=3 8537 B14R2.2647 COCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000749529 [0,1,0,1,0,0|1,0,0]=3 8538 B14R2.2647 COCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000749529 [0,1,0,1,0,0|1,0,0]=3 8539 B14R2.2647 COCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000749529 [0,1,0,1,0,0|1,0,0]=3 8540 B14R2.2647 CSCCC(=O)C1CC2CCC1C2 1458a_100000174002_100000727232 [0,1,0,1,0,0|2,0,0]=4 8541 B14R2.2647 CSCCC(=O)C1CC2CCC1C2 1458a_100000181847_100000751147 [0,1,0,1,0,0|2,0,0]=4 8542 B14R2.2647 CSCCC(=O)N1CC2CCC1C2 11a_100000743476_100000174002 [0,1,0,1,0,0|2,0,0]=4 8543 B14R2.2647 CSCCC(=O)N1CC2CCC1C2 1626a_100000743476_100000174002 [0,1,0,1,0,0|2,0,0]=4 8544 B14R2.2647 CSCCC(=O)N1CC2CCC1C2 240690a_100000743476_100000174002 [0,1,0,1,0,0|2,0,0]=4 8545 B14R2.2647 CSCCC(=O)N1CC2CCC1C2 527a_100000743476_100000174002 [0,1,0,1,0,0|2,0,0]=4 8546 B14R2.2647 CSCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000174002 [0,1,0,1,0,0|1,0,0]=3 8547 B14R2.2647 CSCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000174002 [0,1,0,1,0,0|1,0,0]=3 8548 B14R2.2647 CSCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000174002 [0,1,0,1,0,0|1,0,0]=3 8549 B14R2.2647 CSCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000174002 [0,1,0,1,0,0|1,0,0]=3 8550 B14R2.2647 N#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100011934036 [0,1,0,1,0,0|1,0,1]=4 8551 B14R2.2647 N#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100011934036 [0,1,0,1,0,0|1,0,1]=4 8552 B14R2.2647 N#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100011934036 [0,1,0,1,0,0|1,0,1]=4 8553 B14R2.2647 N#CCCC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100011934036 [0,1,0,1,0,0|1,0,1]=4 8554 B14R2.2647 O=C(CCCF)C1CC2CCC1C2 1458a_100000181847_100011934791 [0,1,0,1,0,0|2,0,0]=4 8555 B14R2.2647 O=C(CCCO)C1CC2CCC1C2 1458a_100000181847_100011215043 [0,1,0,1,0,0|2,0,0]=4 8556 B14R2.2647 O=C(NCCF)N1C[C@H]2C[C@@H]1CO2 273464a_100000724931_100016995552 [0,1,0,1,0,0|2,0,0]=4 8557 B14R2.2647 O=C(NCCO)N1C[C@H]2C[C@@H]1CO2 273464a_100000210304_100016995552 [0,1,0,1,0,0|2,0,0]=4 8558 B14R2.5478 CC1(CCCC1)OCC2CCCO2 7a_100000751722_100000203698 [0,1,0,1,0,0|1,0,1]=4 8559 B14R2.13184 O=C(CC1CC1)NCC2CCCC2 11a_100000737975_100000738066 [0,1,0,1,0,0|2,0,0]=4 8560 B14R2.13184 O=C(CC1CC1)NCC2CCCC2 1626a_100000737975_100000738066 [0,1,0,1,0,0|2,0,0]=4 8561 B14R2.13184 O=C(CC1CC1)NCC2CCCC2 240690a_100000737975_100000738066 [0,1,0,1,0,0|2,0,0]=4 8562 B14R2.13184 O=C(CC1CC1)NCC2CCCC2 527a_100000737975_100000738066 [0,1,0,1,0,0|2,0,0]=4 8563 B14R2.13184 O=C(CC1CC1)NCC2OCCO2 11a_100000036311_100000738066 [0,1,0,1,0,0|2,0,0]=4 8564 B14R2.13184 O=C(CC1CC1)NCC2OCCO2 1626a_100000036311_100000738066 [0,1,0,1,0,0|2,0,0]=4 8565 B14R2.13184 O=C(CC1CC1)NCC2OCCO2 527a_100000036311_100000738066 [0,1,0,1,0,0|2,0,0]=4 8566 B14R2.13184 O=C(CC1CC1)NC[C@@H]2CCCO2 11a_100020590478_100000738066 [0,1,0,1,0,0|1,0,0]=3 8567 B14R2.13184 O=C(CC1CC1)NC[C@@H]2CCCO2 1626a_100020590478_100000738066 [0,1,0,1,0,0|1,0,0]=3 8568 B14R2.13184 O=C(CC1CC1)NC[C@@H]2CCCO2 240690a_100020590478_100000738066 [0,1,0,1,0,0|1,0,0]=3 8569 B14R2.13184 O=C(CC1CC1)NC[C@@H]2CCCO2 527a_100020590478_100000738066 [0,1,0,1,0,0|1,0,0]=3 8570 B14R2.13184 O=C(CCC1CCCC1)CC2CC2 1458a_100000211120_100000742324 [0,1,0,1,0,0|2,0,0]=4 8571 B14R2.13184 O=C(CCC1CCCC1)CC2CC2 1458a_100000738066_100000760354 [0,1,0,1,0,0|2,0,0]=4 8572 B14R2.13184 O=C(CCC1CCCC1)CC2CO2 1458a_100000211120_100011216344 [0,1,0,1,0,0|2,0,0]=4 8573 B14R2.13184 O=C(CCC1CCCC1)CC2CS2 1458a_100000211120_100000031435 [0,1,0,1,0,0|2,0,0]=4 8574 B14R2.13184 O=C(CCC1CCCC1)C[C@@H]2CO2 1458a_100000211120_100000745022 [0,1,0,1,0,0|2,0,0]=4 8575 B14R2.13184 O=C(CCC1CCCC1)NC2CC2 1626a_100000212008_100000211120 [0,1,0,1,0,0|2,0,0]=4 8576 B14R2.13184 O=C(CCC1CCCC1)NC2CC2 240690a_100000212008_100000211120 [0,1,0,1,0,0|2,0,0]=4 8577 B14R2.13184 O=C(CCC1CCCC1)NC2CC2 527a_100000212008_100000211120 [0,1,0,1,0,0|2,0,0]=4 8578 B14R2.13184 O=C(CCC1CCCO1)CC2CC2 1458a_100011247709_100000742324 [0,1,0,1,0,0|1,0,0]=3 8579 B14R2.13184 O=C(CCC1CCCO1)CC2CO2 1458a_100011247709_100011216344 [0,1,0,1,0,0|1,0,0]=3 8580 B14R2.13184 O=C(CCC1CCCO1)CC2CS2 1458a_100011247709_100000031435 [0,1,0,1,0,0|1,0,0]=3 8581 B14R2.13184 O=C(CCC1CCCO1)C[C@@H]2CO2 1458a_100011247709_100000745022 [0,1,0,1,0,0|1,0,0]=3 8582 B14R2.13184 O=C(CCC1CCCO1)NC2CC2 1626a_100000212008_100011247709 [0,1,0,1,0,0|1,0,0]=3 8583 B14R2.13184 O=C(CCC1CCCO1)NC2CC2 240690a_100000212008_100011247709 [0,1,0,1,0,0|1,0,0]=3 8584 B14R2.13184 O=C(CCC1CCCO1)NC2CC2 527a_100000212008_100011247709 [0,1,0,1,0,0|1,0,0]=3 8585 B14R2.13184 O=C(CCC1OCCO1)CC2CC2 1458a_100000082924_100000742324 [0,1,0,1,0,0|2,0,0]=4 8586 B14R2.13184 O=C(CCC1OCCO1)CC2CC2 1458a_100000738066_100000740749 [0,1,0,1,0,0|2,0,0]=4 8587 B14R2.13184 O=C(CCC1OCCO1)CC2CO2 1458a_100000082924_100011216344 [0,1,0,1,0,0|2,0,0]=4 8588 B14R2.13184 O=C(CCC1OCCO1)CC2CS2 1458a_100000082924_100000031435 [0,1,0,1,0,0|2,0,0]=4 8589 B14R2.13184 O=C(CCC1OCCO1)C[C@@H]2CO2 1458a_100000082924_100000745022 [0,1,0,1,0,0|2,0,0]=4 8590 B14R2.13184 O=C(CCN1CCCO1)CC2CC2 1458a_200015187630_100000742324 [0,1,0,1,0,0|2,0,0]=4 8591 B14R2.13184 O=C(CCN1CCCO1)CC2CO2 1458a_200015187630_100011216344 [0,1,0,1,0,0|2,0,0]=4 8592 B14R2.13184 O=C(CCN1CCCO1)CC2CS2 1458a_200015187630_100000031435 [0,1,0,1,0,0|2,0,0]=4 8593 B14R2.13184 O=C(CCN1CCCO1)C[C@@H]2CO2 1458a_200015187630_100000745022 [0,1,0,1,0,0|2,0,0]=4 8594 B14R2.13184 O=C(CCN1CCCO1)NC2CC2 240690a_100000212008_200015187630 [0,1,0,1,0,0|2,0,0]=4 8595 B14R2.13184 O=C(COC1CCCO1)NC2CC2 34a_100000085407_100000182950 [0,1,0,1,0,0|2,0,0]=4 8596 B14R2.13184 O=C(NCC1CCCC1)NC2CC2 2708a_100000212008_100000737975 [0,1,0,1,0,0|2,0,0]=4 8597 B14R2.13184 O=C(NCC1CCCC1)NC2CC2 2708a_100000737975_100000212008 [0,1,0,1,0,0|2,0,0]=4 8598 B14R2.13184 O=C(NCC1CCCC1)NC2CC2 273464a_100000212008_100000737975 [0,1,0,1,0,0|2,0,0]=4 8599 B14R2.13184 O=C(NCC1CCCC1)NC2CC2 273464a_100000737975_100000212008 [0,1,0,1,0,0|2,0,0]=4 8600 B14R2.13184 O=C(NCC1CCCC1)NC2CC2 512a_100000212008_100000737975 [0,1,0,1,0,0|2,0,0]=4 8601 B14R2.13184 O=C(NCC1OCCO1)NC2CC2 2708a_100000036311_100000212008 [0,1,0,1,0,0|2,0,0]=4 8602 B14R2.13184 O=C(NCC1OCCO1)NC2CC2 2708a_100000212008_100000036311 [0,1,0,1,0,0|2,0,0]=4 8603 B14R2.13184 O=C(NCC1OCCO1)NC2CC2 273464a_100000036311_100000212008 [0,1,0,1,0,0|2,0,0]=4 8604 B14R2.13184 O=C(NCC1OCCO1)NC2CC2 273464a_100000212008_100000036311 [0,1,0,1,0,0|2,0,0]=4 8605 B14R2.13184 O=C(NC[C@@H]1CCCO1)NC2CC2 2708a_100000212008_100020590478 [0,1,0,1,0,0|1,0,0]=3 8606 B14R2.13184 O=C(NC[C@@H]1CCCO1)NC2CC2 2708a_100020590478_100000212008 [0,1,0,1,0,0|1,0,0]=3 8607 B14R2.13184 O=C(NC[C@@H]1CCCO1)NC2CC2 273464a_100000212008_100020590478 [0,1,0,1,0,0|1,0,0]=3 8608 B14R2.13184 O=C(NC[C@@H]1CCCO1)NC2CC2 273464a_100020590478_100000212008 [0,1,0,1,0,0|1,0,0]=3 8609 B14R2.40225 CC(OCC1CCCO1)C2CCC2 7a_100000766398_100000203698 [0,1,0,1,0,0|1,0,1]=4 8610 B14R2.40225 O=C(CCC1CCCC1)C2CCC2 1458a_100000209988_100000760354 [0,1,0,1,0,0|2,0,0]=4 8611 B14R2.40225 O=C(CCC1CCCC1)C2CCC2 1458a_100000211120_100000749161 [0,1,0,1,0,0|2,0,0]=4 8612 B14R2.40225 O=C(CCC1CCCC1)C2CCO2 1458a_100000089072_100000760354 [0,1,0,1,0,0|2,0,0]=4 8613 B14R2.40225 O=C(CCC1CCCC1)C2COC2 1458a_100000211120_100000687716 [0,1,0,1,0,0|2,0,0]=4 8614 B14R2.40225 O=C(CCC1CCCC1)C2COC2 1458a_100000758290_100000760354 [0,1,0,1,0,0|2,0,0]=4 8615 B14R2.40225 O=C(CCC1CCCC1)N2CCC2 11a_100000754969_100000211120 [0,1,0,1,0,0|2,0,0]=4 8616 B14R2.40225 O=C(CCC1CCCC1)N2CCC2 240690a_100000754969_100000211120 [0,1,0,1,0,0|2,0,0]=4 8617 B14R2.40225 O=C(CCC1CCCC1)N2CCC2 527a_100000754969_100000211120 [0,1,0,1,0,0|2,0,0]=4 8618 B14R2.40225 O=C(CCC1CCCO1)C2CCC2 1458a_100011247709_100000749161 [0,1,0,1,0,0|1,0,0]=3 8619 B14R2.40225 O=C(CCC1CCCO1)C2COC2 1458a_100011247709_100000687716 [0,1,0,1,0,0|1,0,0]=3 8620 B14R2.40225 O=C(CCC1CCCO1)N2CCC2 11a_100000754969_100011247709 [0,1,0,1,0,0|1,0,0]=3 8621 B14R2.40225 O=C(CCC1CCCO1)N2CCC2 240690a_100000754969_100011247709 [0,1,0,1,0,0|1,0,0]=3 8622 B14R2.40225 O=C(CCC1CCCO1)N2CCC2 527a_100000754969_100011247709 [0,1,0,1,0,0|1,0,0]=3 8623 B14R2.40225 O=C(CCC1OCCO1)C2CCC2 1458a_100000082924_100000749161 [0,1,0,1,0,0|2,0,0]=4 8624 B14R2.40225 O=C(CCC1OCCO1)C2CCC2 1458a_100000209988_100000740749 [0,1,0,1,0,0|2,0,0]=4 8625 B14R2.40225 O=C(CCC1OCCO1)C2CCO2 1458a_100000089072_100000740749 [0,1,0,1,0,0|2,0,0]=4 8626 B14R2.40225 O=C(CCC1OCCO1)C2COC2 1458a_100000082924_100000687716 [0,1,0,1,0,0|2,0,0]=4 8627 B14R2.40225 O=C(CCC1OCCO1)C2COC2 1458a_100000758290_100000740749 [0,1,0,1,0,0|2,0,0]=4 8628 B14R2.40225 O=C(CCN1CCCO1)C2CCC2 1458a_200015187630_100000749161 [0,1,0,1,0,0|2,0,0]=4 8629 B14R2.40225 O=C(CCN1CCCO1)C2COC2 1458a_200015187630_100000687716 [0,1,0,1,0,0|2,0,0]=4 8630 B14R2.40225 O=C(CCN1CCCO1)N2CCC2 240690a_100000754969_200015187630 [0,1,0,1,0,0|2,0,0]=4 8631 B14R2.40225 O=C(COC1CCCO1)C2CCC2 34a_100000085407_100000686122 [0,1,0,1,0,0|2,0,0]=4 8632 B14R2.40225 O=C(COC1CCCO1)N2CCC2 34a_100000085407_100000185095 [0,1,0,1,0,0|2,0,0]=4 8633 B14R2.40225 O=C(NCC1CCCC1)C2CCC2 11a_100000737975_100000209988 [0,1,0,1,0,0|2,0,0]=4 8634 B14R2.40225 O=C(NCC1CCCC1)C2CCC2 1626a_100000737975_100000209988 [0,1,0,1,0,0|2,0,0]=4 8635 B14R2.40225 O=C(NCC1CCCC1)C2CCC2 240690a_100000737975_100000209988 [0,1,0,1,0,0|2,0,0]=4 8636 B14R2.40225 O=C(NCC1CCCC1)C2CCC2 527a_100000737975_100000209988 [0,1,0,1,0,0|2,0,0]=4 8637 B14R2.40225 O=C(NCC1CCCC1)C2CCO2 11a_100000737975_100000089072 [0,1,0,1,0,0|2,0,0]=4 8638 B14R2.40225 O=C(NCC1CCCC1)C2CCO2 1626a_100000737975_100000089072 [0,1,0,1,0,0|2,0,0]=4 8639 B14R2.40225 O=C(NCC1CCCC1)C2CCO2 240690a_100000737975_100000089072 [0,1,0,1,0,0|2,0,0]=4 8640 B14R2.40225 O=C(NCC1CCCC1)C2CCO2 527a_100000737975_100000089072 [0,1,0,1,0,0|2,0,0]=4 8641 B14R2.40225 O=C(NCC1CCCC1)C2COC2 11a_100000737975_100000758290 [0,1,0,1,0,0|2,0,0]=4 8642 B14R2.40225 O=C(NCC1CCCC1)C2COC2 1626a_100000737975_100000758290 [0,1,0,1,0,0|2,0,0]=4 8643 B14R2.40225 O=C(NCC1CCCC1)C2COC2 240690a_100000737975_100000758290 [0,1,0,1,0,0|2,0,0]=4 8644 B14R2.40225 O=C(NCC1CCCC1)C2COC2 527a_100000737975_100000758290 [0,1,0,1,0,0|2,0,0]=4 8645 B14R2.40225 O=C(NCC1CCCC1)N2CCC2 2708a_100000737975_100000754969 [0,1,0,1,0,0|2,0,0]=4 8646 B14R2.40225 O=C(NCC1CCCC1)N2CCC2 273464a_100000737975_100000754969 [0,1,0,1,0,0|2,0,0]=4 8647 B14R2.40225 O=C(NCC1OCCO1)C2CCC2 11a_100000036311_100000209988 [0,1,0,1,0,0|2,0,0]=4 8648 B14R2.40225 O=C(NCC1OCCO1)C2CCC2 1626a_100000036311_100000209988 [0,1,0,1,0,0|2,0,0]=4 8649 B14R2.40225 O=C(NCC1OCCO1)C2CCC2 527a_100000036311_100000209988 [0,1,0,1,0,0|2,0,0]=4 8650 B14R2.40225 O=C(NCC1OCCO1)C2CCO2 11a_100000036311_100000089072 [0,1,0,1,0,0|2,0,0]=4 8651 B14R2.40225 O=C(NCC1OCCO1)C2CCO2 1626a_100000036311_100000089072 [0,1,0,1,0,0|2,0,0]=4 8652 B14R2.40225 O=C(NCC1OCCO1)C2CCO2 527a_100000036311_100000089072 [0,1,0,1,0,0|2,0,0]=4 8653 B14R2.40225 O=C(NCC1OCCO1)C2COC2 11a_100000036311_100000758290 [0,1,0,1,0,0|2,0,0]=4 8654 B14R2.40225 O=C(NCC1OCCO1)C2COC2 1626a_100000036311_100000758290 [0,1,0,1,0,0|2,0,0]=4 8655 B14R2.40225 O=C(NCC1OCCO1)C2COC2 527a_100000036311_100000758290 [0,1,0,1,0,0|2,0,0]=4 8656 B14R2.40225 O=C(NCC1OCCO1)N2CCC2 2708a_100000036311_100000754969 [0,1,0,1,0,0|2,0,0]=4 8657 B14R2.40225 O=C(NCC1OCCO1)N2CCC2 273464a_100000036311_100000754969 [0,1,0,1,0,0|2,0,0]=4 8658 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCC2 11a_100020590478_100000209988 [0,1,0,1,0,0|1,0,0]=3 8659 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCC2 1626a_100020590478_100000209988 [0,1,0,1,0,0|1,0,0]=3 8660 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCC2 240690a_100020590478_100000209988 [0,1,0,1,0,0|1,0,0]=3 8661 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCC2 527a_100020590478_100000209988 [0,1,0,1,0,0|1,0,0]=3 8662 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCO2 11a_100020590478_100000089072 [0,1,0,1,0,0|1,0,0]=3 8663 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCO2 1626a_100020590478_100000089072 [0,1,0,1,0,0|1,0,0]=3 8664 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCO2 240690a_100020590478_100000089072 [0,1,0,1,0,0|1,0,0]=3 8665 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2CCO2 527a_100020590478_100000089072 [0,1,0,1,0,0|1,0,0]=3 8666 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2COC2 11a_100020590478_100000758290 [0,1,0,1,0,0|1,0,0]=3 8667 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2COC2 1626a_100020590478_100000758290 [0,1,0,1,0,0|1,0,0]=3 8668 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2COC2 240690a_100020590478_100000758290 [0,1,0,1,0,0|1,0,0]=3 8669 B14R2.40225 O=C(NC[C@@H]1CCCO1)C2COC2 527a_100020590478_100000758290 [0,1,0,1,0,0|1,0,0]=3 8670 B14R2.40225 O=C(NC[C@@H]1CCCO1)N2CCC2 2708a_100020590478_100000754969 [0,1,0,1,0,0|1,0,0]=3 8671 B14R2.40225 O=C(NC[C@@H]1CCCO1)N2CCC2 273464a_100020590478_100000754969 [0,1,0,1,0,0|1,0,0]=3 8672 B14R2.4730 CN1CCCC1CCC(=O)C2CC2 1458a_100000210395_100000005710 [0,1,0,1,0,0|2,0,0]=4 8673 B14R2.4730 CN1CCC[C@H]1CNC(=O)C2CC2 240690a_100009821018_100000210395 [0,1,0,1,0,0|2,0,0]=4 8674 B14R2.4730 CN1CCC[C@H]1CNC(=O)C2CC2 527a_100009821018_100000210395 [0,1,0,1,0,0|2,0,0]=4 8675 B14R2.4730 C[C@@H]1CCCN1COC(=O)C2CC2 2230a_100015189458_100000140896 [0,1,0,1,0,0|2,0,0]=4 8676 B14R2.4730 C[C@@H]1CCCN1COC(=O)C2CC2 269982a_100015189458_100000140896 [0,1,0,1,0,0|2,0,0]=4 8677 B14R2.4730 C[C@@H]1CCCN1COC(=O)C2CC2 34a_100015189458_100000140896 [0,1,0,1,0,0|2,0,0]=4 8678 B14R2.4730 C[C@H]1CCCN1COC(=O)C2CC2 2230a_100020605311_100000140896 [0,1,0,1,0,0|2,0,0]=4 8679 B14R2.4730 C[C@H]1CCCN1COC(=O)C2CC2 269982a_100020605311_100000140896 [0,1,0,1,0,0|2,0,0]=4 8680 B14R2.9962 CCCC(=O)N1C[C@@H]2C[C@H]1CN2C 240690a_100025763010_100000211992 [0,1,0,1,0,0|2,0,0]=4 8681 B14R2.9962 CCCC(=O)N1C[C@@H]2C[C@H]1CN2C 527a_100025763010_100000211992 [0,1,0,1,0,0|2,0,0]=4 8682 B14R2.2782 CCC(C)C(=O)C1CC2CCC1C2 1458a_100000181847_100000758301 [0,1,0,1,0,0|2,0,0]=4 8683 B14R2.2782 CCC(C)C(=O)C1CC2CCC1C2 1458a_100011192722_100000727232 [0,1,0,1,0,0|2,0,0]=4 8684 B14R2.2782 CCC(C)C(=O)N1CC2CCC1C2 11a_100000743476_100011192722 [0,1,0,1,0,0|2,0,0]=4 8685 B14R2.2782 CCC(C)C(=O)N1CC2CCC1C2 1626a_100000743476_100011192722 [0,1,0,1,0,0|2,0,0]=4 8686 B14R2.2782 CCC(C)C(=O)N1CC2CCC1C2 240690a_100000743476_100011192722 [0,1,0,1,0,0|2,0,0]=4 8687 B14R2.2782 CCC(C)C(=O)N1CC2CCC1C2 527a_100000743476_100011192722 [0,1,0,1,0,0|2,0,0]=4 8688 B14R2.2782 CCC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100011192722 [0,1,0,1,0,0|1,0,0]=3 8689 B14R2.2782 CCC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100011192722 [0,1,0,1,0,0|1,0,0]=3 8690 B14R2.2782 CCC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100011192722 [0,1,0,1,0,0|1,0,0]=3 8691 B14R2.2782 CCC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100011192722 [0,1,0,1,0,0|1,0,0]=3 8692 B14R2.2782 CCC(O)C(=O)C1CC2CCC1C2 1458a_100011196387_100000727232 [0,1,0,1,0,0|2,0,0]=4 8693 B14R2.2782 CCC(O)C(=O)N1CC2CCC1C2 240690a_100000743476_100011196387 [0,1,0,1,0,0|2,0,0]=4 8694 B14R2.2782 CCC(O)C(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100011196387 [0,1,0,1,0,0|1,0,0]=3 8695 B14R2.2782 COC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000743197 [0,1,0,1,0,0|2,0,0]=4 8696 B14R2.2782 COC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000743197 [0,1,0,1,0,0|2,0,0]=4 8697 B14R2.2782 COC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000743197 [0,1,0,1,0,0|2,0,0]=4 8698 B14R2.2782 COC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000743197 [0,1,0,1,0,0|2,0,0]=4 8699 B14R2.2782 CSC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000149566 [0,1,0,1,0,0|2,0,0]=4 8700 B14R2.2782 CSC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000149566 [0,1,0,1,0,0|2,0,0]=4 8701 B14R2.2782 CSC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000149566 [0,1,0,1,0,0|2,0,0]=4 8702 B14R2.2782 CSC(C)C(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000149566 [0,1,0,1,0,0|2,0,0]=4 8703 B14R2.2782 O=C(C(O)CO)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100011215603 [0,1,0,1,0,0|2,0,0]=4 8704 B14R2.13183 CC1(CC1)C(=O)CCC2CCCC2 1458a_100000756474_100000760354 [0,1,0,1,0,0|2,0,0]=4 8705 B14R2.13183 CC1(CC1)C(=O)CCC2OCCO2 1458a_100000756474_100000740749 [0,1,0,1,0,0|2,0,0]=4 8706 B14R2.13183 CC1(CC1)C(=O)NCC2CCCC2 11a_100000737975_100000756474 [0,1,0,1,0,0|2,0,0]=4 8707 B14R2.13183 CC1(CC1)C(=O)NCC2CCCC2 1626a_100000737975_100000756474 [0,1,0,1,0,0|2,0,0]=4 8708 B14R2.13183 CC1(CC1)C(=O)NCC2CCCC2 240690a_100000737975_100000756474 [0,1,0,1,0,0|2,0,0]=4 8709 B14R2.13183 CC1(CC1)C(=O)NCC2CCCC2 527a_100000737975_100000756474 [0,1,0,1,0,0|2,0,0]=4 8710 B14R2.13183 CC1(CC1)C(=O)NCC2OCCO2 11a_100000036311_100000756474 [0,1,0,1,0,0|2,0,0]=4 8711 B14R2.13183 CC1(CC1)C(=O)NCC2OCCO2 1626a_100000036311_100000756474 [0,1,0,1,0,0|2,0,0]=4 8712 B14R2.13183 CC1(CC1)C(=O)NCC2OCCO2 527a_100000036311_100000756474 [0,1,0,1,0,0|2,0,0]=4 8713 B14R2.13183 CC1(CC1)C(=O)NC[C@@H]2CCCO2 11a_100020590478_100000756474 [0,1,0,1,0,0|1,0,0]=3 8714 B14R2.13183 CC1(CC1)C(=O)NC[C@@H]2CCCO2 1626a_100020590478_100000756474 [0,1,0,1,0,0|1,0,0]=3 8715 B14R2.13183 CC1(CC1)C(=O)NC[C@@H]2CCCO2 240690a_100020590478_100000756474 [0,1,0,1,0,0|1,0,0]=3 8716 B14R2.13183 CC1(CC1)C(=O)NC[C@@H]2CCCO2 527a_100020590478_100000756474 [0,1,0,1,0,0|1,0,0]=3 8717 B14R2.13183 O=C(CCC1CCCC1)C2(CC2)F 1458a_100000055089_100000760354 [0,1,0,1,0,0|2,0,0]=4 8718 B14R2.13183 O=C(CCC1CCCC1)C2(CC2)O 1458a_100000241761_100000760354 [0,1,0,1,0,0|2,0,0]=4 8719 B14R2.13183 O=C(CCC1OCCO1)C2(CC2)F 1458a_100000055089_100000740749 [0,1,0,1,0,0|2,0,0]=4 8720 B14R2.13183 O=C(CCC1OCCO1)C2(CC2)O 1458a_100000241761_100000740749 [0,1,0,1,0,0|2,0,0]=4 8721 B14R2.13183 O=C(NCC1CCCC1)C2(CC2)F 11a_100000737975_100000055089 [0,1,0,1,0,0|2,0,0]=4 8722 B14R2.13183 O=C(NCC1CCCC1)C2(CC2)F 1626a_100000737975_100000055089 [0,1,0,1,0,0|2,0,0]=4 8723 B14R2.13183 O=C(NCC1CCCC1)C2(CC2)F 240690a_100000737975_100000055089 [0,1,0,1,0,0|2,0,0]=4 8724 B14R2.13183 O=C(NCC1CCCC1)C2(CC2)F 527a_100000737975_100000055089 [0,1,0,1,0,0|2,0,0]=4 8725 B14R2.13183 O=C(NCC1CCCC1)C2(CC2)O 240690a_100000737975_100000241761 [0,1,0,1,0,0|2,0,0]=4 8726 B14R2.13183 O=C(NCC1OCCO1)C2(CC2)F 11a_100000036311_100000055089 [0,1,0,1,0,0|2,0,0]=4 8727 B14R2.13183 O=C(NCC1OCCO1)C2(CC2)F 1626a_100000036311_100000055089 [0,1,0,1,0,0|2,0,0]=4 8728 B14R2.13183 O=C(NCC1OCCO1)C2(CC2)F 527a_100000036311_100000055089 [0,1,0,1,0,0|2,0,0]=4 8729 B14R2.13183 O=C(NC[C@@H]1CCCO1)C2(CC2)F 11a_100020590478_100000055089 [0,1,0,1,0,0|1,0,0]=3 8730 B14R2.13183 O=C(NC[C@@H]1CCCO1)C2(CC2)F 1626a_100020590478_100000055089 [0,1,0,1,0,0|1,0,0]=3 8731 B14R2.13183 O=C(NC[C@@H]1CCCO1)C2(CC2)F 240690a_100020590478_100000055089 [0,1,0,1,0,0|1,0,0]=3 8732 B14R2.13183 O=C(NC[C@@H]1CCCO1)C2(CC2)F 527a_100020590478_100000055089 [0,1,0,1,0,0|1,0,0]=3 8733 B14R2.13183 O=C(NC[C@@H]1CCCO1)C2(CC2)O 240690a_100020590478_100000241761 [0,1,0,1,0,0|1,0,0]=3 8734 B14R2.20712 CC(C)CC(=O)C1CC2CCC1C2 1458a_100000181847_100000210624 [0,1,0,1,0,0|2,0,0]=4 8735 B14R2.20712 CC(C)CC(=O)C1CC2CCC1C2 1458a_100000210554_100000727232 [0,1,0,1,0,0|2,0,0]=4 8736 B14R2.20712 CC(C)CC(=O)N1CC2CCC1C2 11a_100000743476_100000210554 [0,1,0,1,0,0|2,0,0]=4 8737 B14R2.20712 CC(C)CC(=O)N1CC2CCC1C2 1626a_100000743476_100000210554 [0,1,0,1,0,0|2,0,0]=4 8738 B14R2.20712 CC(C)CC(=O)N1CC2CCC1C2 240690a_100000743476_100000210554 [0,1,0,1,0,0|2,0,0]=4 8739 B14R2.20712 CC(C)CC(=O)N1CC2CCC1C2 527a_100000743476_100000210554 [0,1,0,1,0,0|2,0,0]=4 8740 B14R2.20712 CC(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000210554 [0,1,0,1,0,0|1,0,0]=3 8741 B14R2.20712 CC(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_100000210554 [0,1,0,1,0,0|1,0,0]=3 8742 B14R2.20712 CC(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000210554 [0,1,0,1,0,0|1,0,0]=3 8743 B14R2.20712 CC(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000210554 [0,1,0,1,0,0|1,0,0]=3 8744 B14R2.20712 CC(C)NC(=O)N1C[C@H]2C[C@@H]1CO2 2708a_100138425928_100016995552 [0,1,0,1,0,0|2,0,0]=4 8745 B14R2.20712 CC(C)NC(=O)N1C[C@H]2C[C@@H]1CO2 273464a_100138425928_100016995552 [0,1,0,1,0,0|2,0,0]=4 8746 B14R2.20712 CC(O)CC(=O)C1CC2CCC1C2 1458a_100000181847_100011218427 [0,1,0,1,0,0|2,0,0]=4 8747 B14R2.20712 CN(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_100000750896 [0,1,0,1,0,0|2,0,0]=4 8748 B14R2.20712 CN(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100000750896 [0,1,0,1,0,0|2,0,0]=4 8749 B14R2.20712 CN(C)CC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_100000750896 [0,1,0,1,0,0|2,0,0]=4 8750 B14R2.20712 C[C@@H](O)CC(=O)C1CC2CCC1C2 1458a_100011933948_100000727232 [0,1,0,1,0,0|2,0,0]=4 8751 B14R2.20712 C[C@@H](O)CC(=O)N1CC2CCC1C2 240690a_100000743476_100011933948 [0,1,0,1,0,0|2,0,0]=4 8752 B14R2.20712 C[C@@H](O)CC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_100011933948 [0,1,0,1,0,0|1,0,0]=3 8753 B14R2.20712 C[S+](C)CC(=O)N1C[C@H]2C[C@@H]1CO2 11a_100016995552_200159257847 [0,1,0,1,0,0|2,0,0]=4 8754 B14R2.20712 C[S+](C)CC(=O)N1C[C@H]2C[C@@H]1CO2 1626a_100016995552_200159257847 [0,1,0,1,0,0|2,0,0]=4 8755 B14R2.20712 C[S+](C)CC(=O)N1C[C@H]2C[C@@H]1CO2 240690a_100016995552_200159257847 [0,1,0,1,0,0|2,0,0]=4 8756 B14R2.20712 C[S+](C)CC(=O)N1C[C@H]2C[C@@H]1CO2 527a_100016995552_200159257847 [0,1,0,1,0,0|2,0,0]=4 8757 B14R2.19069 CCC(OCC1CCCO1)C2CC2 7a_100011351122_100000203698 [0,1,0,1,0,0|1,0,1]=4 8758 B14R2.15035 CCCS(=O)(=O)N1C[C@H]2C[C@@H]1CO2 270084a_100016995552_100000211391 [0,1,0,1,0,0|2,0,0]=4 8759 B14R2.15035 CCCS(=O)(=O)N1C[C@H]2C[C@@H]1CO2 274078a_100016995552_100000211391 [0,1,0,1,0,0|2,0,0]=4 8760 B14R2.15035 CCCS(=O)(=O)N1C[C@H]2C[C@@H]1CO2 40a_100016995552_100000054278 [0,1,0,1,0,0|2,0,0]=4 8761 B14R2.53926 O=S(=O)(NC[C@@H]1CCCO1)C2CC2 270084a_100020590478_100000750908 [0,1,0,1,0,0|2,0,0]=4 8762 B14R2.53926 O=S(=O)(NC[C@@H]1CCCO1)C2CC2 274078a_100020590478_100000750908 [0,1,0,1,0,0|2,0,0]=4 8763 B14R2.63057 CC1(OCCO1)CCC(=O)C2CC2 1458a_100000210395_100000758764 [0,1,0,1,0,0|2,0,0]=4 8764 B14R2.63057 CC1(OCCO1)CNC(=O)C2CC2 11a_100000691740_100000210395 [0,1,0,1,0,0|2,0,0]=4 8765 B14R2.63057 CC1(OCCO1)CNC(=O)C2CC2 1626a_100000691740_100000210395 [0,1,0,1,0,0|2,0,0]=4 8766 B14R2.63057 CC1(OCCO1)CNC(=O)C2CC2 240690a_100000691740_100000210395 [0,1,0,1,0,0|2,0,0]=4 8767 B14R2.63057 CC1(OCCO1)CNC(=O)C2CC2 527a_100000691740_100000210395 [0,1,0,1,0,0|2,0,0]=4 8768 B14R2.63057 O=C(NCC1(CCCC1)O)C2CC2 11a_100000737848_100000210395 [0,1,0,1,0,0|2,0,0]=4 8769 B14R2.63057 O=C(NCC1(CCCC1)O)C2CC2 1626a_100000737848_100000210395 [0,1,0,1,0,0|2,0,0]=4 8770 B14R2.63057 O=C(NCC1(CCCC1)O)C2CC2 240690a_100000737848_100000210395 [0,1,0,1,0,0|2,0,0]=4 8771 B14R2.63057 O=C(NCC1(CCCC1)O)C2CC2 527a_100000737848_100000210395 [0,1,0,1,0,0|2,0,0]=4 8772 B14R3.19231 O=C(C1CC1)C2CC3CCC2C3 1458a_100000210395_100000727232 [0,0,0,2,0,0|2,0,0]=4 8773 B14R3.19231 O=C(C1CC1)N2CC3CCC2C3 11a_100000743476_100000210395 [0,0,0,2,0,0|2,0,0]=4 8774 B14R3.19231 O=C(C1CC1)N2CC3CCC2C3 1626a_100000743476_100000210395 [0,0,0,2,0,0|2,0,0]=4 8775 B14R3.19231 O=C(C1CC1)N2CC3CCC2C3 240690a_100000743476_100000210395 [0,0,0,2,0,0|2,0,0]=4 8776 B14R3.19231 O=C(C1CC1)N2CC3CCC2C3 527a_100000743476_100000210395 [0,0,0,2,0,0|2,0,0]=4 8777 B14R3.19231 O=C(C1CC1)N2C[C@H]3C[C@@H]2CO3 11a_100016995552_100000210395 [0,0,0,2,0,0|1,0,0]=3 8778 B14R3.19231 O=C(C1CC1)N2C[C@H]3C[C@@H]2CO3 1626a_100016995552_100000210395 [0,0,0,2,0,0|1,0,0]=3 8779 B14R3.19231 O=C(C1CC1)N2C[C@H]3C[C@@H]2CO3 240690a_100016995552_100000210395 [0,0,0,2,0,0|1,0,0]=3 8780 B14R3.19231 O=C(C1CC1)N2C[C@H]3C[C@@H]2CO3 527a_100016995552_100000210395 [0,0,0,2,0,0|1,0,0]=3 8781 B14R3.19231 O=C(C1CO1)N2C[C@H]3C[C@@H]2CO3 11a_100016995552_100000701028 [0,0,0,2,0,0|2,0,0]=4 8782 B14R3.19231 O=C(C1CO1)N2C[C@H]3C[C@@H]2CO3 1626a_100016995552_100000701028 [0,0,0,2,0,0|2,0,0]=4 8783 B14R3.19231 O=C(C1CO1)N2C[C@H]3C[C@@H]2CO3 240690a_100016995552_100000701028 [0,0,0,2,0,0|2,0,0]=4 8784 B14R3.19231 O=C(C1CO1)N2C[C@H]3C[C@@H]2CO3 527a_100016995552_100000701028 [0,0,0,2,0,0|2,0,0]=4 8785 B10R0.34 CCC(CC)CC(=O)CCO 1458a_100011216618_100011215472 [0,0,1,0,1,0|2,0,0]=4 8786 B10R0.34 CCC(CC)CC(=O)COC 1458a_100000210968_100011215472 [0,0,1,0,1,0|2,0,0]=4 8787 B10R0.34 CCC(CC)CC(=O)CSC 1458a_100000184570_100011215472 [0,0,1,0,1,0|2,0,0]=4 8788 B10R0.34 CCCC(=O)CC(CC)CC 1458a_100000211992_100011215472 [0,0,1,0,1,0|1,0,0]=3 8789 B10R0.34 CCCC(=O)CC(OC)OC 1458a_100000082724_100000210303 [0,0,1,0,1,0|1,0,0]=3 8790 B10R0.34 CCCC(=O)CC(OC)OC 1458a_100000211992_100000751394 [0,0,1,0,1,0|1,0,0]=3 8791 B10R0.34 CCCC(=O)CN(CC)CC 1458a_100000758533_100000210303 [0,0,1,0,1,0|2,0,0]=4 8792 B10R0.34 CCCC(=O)CN(CC)CC 2230a_100000724800_100000747444 [0,0,1,0,1,0|2,0,0]=4 8793 B10R0.34 CCCC(=O)CN(CC)CC 269956a_100000042499_100000747444 [0,0,1,0,1,0|2,0,0]=4 8794 B10R0.34 CCCC(=O)CN(CC)CC 269982a_100000724800_100000747444 [0,0,1,0,1,0|2,0,0]=4 8795 B10R0.34 CCCC(=O)NC(CC)CC 11a_100000199018_100000211992 [0,0,1,0,1,0|2,0,0]=4 8796 B10R0.34 CCCC(=O)NC(CC)CC 1626a_100000199018_100000211992 [0,0,1,0,1,0|2,0,0]=4 8797 B10R0.34 CCCC(=O)NC(CC)CC 240690a_100000199018_100000211992 [0,0,1,0,1,0|2,0,0]=4 8798 B10R0.34 CCCC(=O)NC(CC)CC 527a_100000199018_100000211992 [0,0,1,0,1,0|2,0,0]=4 8799 B10R0.34 CCNC(=O)CC(OC)OC 11a_100015525214_100000082724 [0,0,1,0,1,0|2,0,0]=4 8800 B10R0.34 CCNC(=O)CC(OC)OC 240690a_100015525214_100000082724 [0,0,1,0,1,0|2,0,0]=4 8801 B10R0.34 CCNC(=O)CC(OC)OC 527a_100015525214_100000082724 [0,0,1,0,1,0|2,0,0]=4 8802 B10R0.34 CCOC(=O)C[C@@H](CCl)OC 7a_100000688340_200000210301 [0,0,1,0,1,0|2,0,0]=4 8803 B10R0.34 CCOC(=O)C[C@@H](CCl)O[13CH3] 7a_100000688340_200025704644 [0,0,1,0,1,0|2,0,0]=4 8804 B10R0.34 COC(CC(=O)CCF)OC 1458a_100000082724_100011217306 [0,0,1,0,1,0|2,0,0]=4 8805 B10R0.34 COC(CC(=O)CCO)OC 1458a_100000082724_100000211926 [0,0,1,0,1,0|2,0,0]=4 8806 B10R0.34 COC(CC(=O)CCO)OC 1458a_100011216618_100000751394 [0,0,1,0,1,0|2,0,0]=4 8807 B10R0.34 COC(CC(=O)CSC)OC 1458a_100000184570_100000751394 [0,0,1,0,1,0|2,0,0]=4 8808 B10R0.34 COCC(=O)CC(OC)OC 1458a_100000210968_100000751394 [0,0,1,0,1,0|2,0,0]=4 8809 B10R0.2 C=C(CCC)CC(=O)CCC 1458a_100000138376_100000210303 [0,0,1,0,1,0|1,0,1]=4 8810 B10R0.2 CCCC(=O)CC(=O)CCC 1458a_100000211992_100000747444 [0,0,1,0,1,0|0,0,2]=4 8811 B10R0.2 CCCC(=O)CC(=O)OCC 1458a_100000211992_100000188475 [0,0,1,0,1,0|1,0,1]=4 8812 B10R0.2 CCCC(=O)CC(=O)OCC 1458a_100000243816_100000210303 [0,0,1,0,1,0|1,0,1]=4 8813 B10R0.2 CCCC(=O)CC(C)CCC 1458a_100000211992_100011216630 [0,0,1,0,1,0|1,0,0]=3 8814 B10R0.2 CCCC(=O)CC(C)CCC 1458a_100000748435_100000210303 [0,0,1,0,1,0|1,0,0]=3 8815 B10R0.2 CCCC(=O)CC(C)SCC 1458a_200011311441_100000210303 [0,0,1,0,1,0|0,1,0]=3 8816 B10R0.2 CCCC(=O)CN(C)CCC 2230a_100000747261_100000747444 [0,0,1,0,1,0|2,0,0]=4 8817 B10R0.2 CCCC(=O)CN(C)CCC 269982a_100000747261_100000747444 [0,0,1,0,1,0|2,0,0]=4 8818 B10R0.2 CCCC(=O)CS(=O)CCC 1458a_100011387404_100000210303 [0,0,1,0,1,0|1,0,1]=4 8819 B10R0.2 CCCC(=O)NC(C)CCC 11a_100000741246_100000211992 [0,0,1,0,1,0|2,0,0]=4 8820 B10R0.2 CCCC(=O)NC(C)CCC 1626a_100000741246_100000211992 [0,0,1,0,1,0|2,0,0]=4 8821 B10R0.2 CCCC(=O)NC(C)CCC 240690a_100000741246_100000211992 [0,0,1,0,1,0|2,0,0]=4 8822 B10R0.2 CCCC(=O)NC(C)CCC 527a_100000741246_100000211992 [0,0,1,0,1,0|2,0,0]=4 8823 B10R0.2 CCCC(C)CC(=O)CCF 1458a_100000748435_100011217306 [0,0,1,0,1,0|2,0,0]=4 8824 B10R0.2 CCCC(C)CC(=O)CCO 1458a_100000748435_100000211926 [0,0,1,0,1,0|2,0,0]=4 8825 B10R0.2 CCCC(C)CC(=O)CCO 1458a_100011216618_100011216630 [0,0,1,0,1,0|2,0,0]=4 8826 B10R0.2 CCCC(C)CC(=O)COC 1458a_100000210968_100011216630 [0,0,1,0,1,0|2,0,0]=4 8827 B10R0.2 CCCC(C)CC(=O)CSC 1458a_100000184570_100011216630 [0,0,1,0,1,0|2,0,0]=4 8828 B10R0.2 CCCC(C)CC(=O)NCC 11a_100015525214_100000748435 [0,0,1,0,1,0|2,0,0]=4 8829 B10R0.2 CCCC(C)CC(=O)NCC 240690a_100015525214_100000748435 [0,0,1,0,1,0|2,0,0]=4 8830 B10R0.2 CCCC(C)CC(=O)NCC 527a_100015525214_100000748435 [0,0,1,0,1,0|2,0,0]=4 8831 B10R0.2 CCNC(=O)CC(C)SCC 11a_100015525214_200011311441 [0,0,1,0,1,0|1,1,0]=4 8832 B10R0.2 CCNC(=O)CC(C)SCC 240690a_100015525214_200011311441 [0,0,1,0,1,0|1,1,0]=4 8833 B10R0.2 CCNC(=O)CC(C)SCC 527a_100015525214_200011311441 [0,0,1,0,1,0|1,1,0]=4 8834 B10R0.2 CCNC(C)CC(=O)OCC 2230a_100015525214_100009817359 [0,0,1,0,1,0|2,0,0]=4 8835 B10R0.2 CCOC(=O)CC(C)SCC 62a_100000210202_100009817359 [0,0,1,0,1,0|1,1,0]=4 8836 B10R0.2 CCOC(=O)CC(C)SCC 62a_100009817359_100000210202 [0,0,1,0,1,0|1,1,0]=4 8837 B10R0.2 CCOC(=O)C[C@@H](C)OCC 7a_100009816390_100000210202 [0,0,1,0,1,0|1,0,0]=3 8838 B10R0.2 CCOC(=O)C[C@@H](C)OCF 7a_100009816390_100015361967 [0,0,1,0,1,0|2,0,0]=4 8839 B10R0.2 CCOC(=O)C[C@H](O)CNC 34a_100102657272_100000688340 [0,0,1,0,1,0|2,0,0]=4 8840 B10R0.2 CCOC(=O)C[C@H](O)CNC 7a_106832991635_100000688340 [0,0,1,0,1,0|2,0,0]=4 8841 B10R0.2 CCOC(=O)C[C@H](O)COC 34a_100138415774_100000688340 [0,0,1,0,1,0|2,0,0]=4 8842 B10R0.2 CCOC(=O)C[C@H](O)CSC 62a_100000688340_200000210301 [0,0,1,0,1,0|2,0,0]=4 8843 B10R0.2 CCOC(=O)C[C@H](O)CSC 62a_200000210301_100000688340 [0,0,1,0,1,0|2,0,0]=4 8844 B10R0.2 CCOC(=O)C[C@H](O)CS[13CH3] 62a_100000688340_200025704644 [0,0,1,0,1,0|2,0,0]=4 8845 B10R0.2 CCOC(=O)C[C@H](O)CS[13CH3] 62a_200025704644_100000688340 [0,0,1,0,1,0|2,0,0]=4 8846 B10R0.2 CCOC(=O)OC(C)SCC 62a_100000036008_100000210202 [0,0,1,0,1,0|1,1,0]=4 8847 B10R0.2 CCOC(=O)OC(C)SCC 62a_100000210202_100000036008 [0,0,1,0,1,0|1,1,0]=4 8848 B10R0.2 CCSC(C)CC(=O)CCF 1458a_200011311441_100011217306 [0,0,1,0,1,0|1,1,0]=4 8849 B10R0.2 CCSC(C)CC(=O)CCO 1458a_200011311441_100000211926 [0,0,1,0,1,0|1,1,0]=4 8850 B10R1.57 BrCCCOCC1CCC1 34a_100011217188_100000763275 [1,0,0,0,1,0|1,0,1]=4 8851 B10R1.57 BrCCCOCC1CCO1 34a_100011217188_100000103362 [1,0,0,0,1,0|1,0,1]=4 8852 B10R1.57 CCCC=NNC1CCC1 4a_100000736358_100000185831 [1,0,0,0,1,0|2,0,0]=4 8853 B10R1.57 CCCCNCC1CCC1 2230a_100000102301_100000763275 [1,0,0,0,1,0|1,0,1]=4 8854 B10R1.57 CCCCNCC1CCC1 2230a_100000738700_100000210211 [1,0,0,0,1,0|1,0,1]=4 8855 B10R1.57 CCCCNCC1CCC1 269862a_100000102301_100000753134 [1,0,0,0,1,0|1,0,1]=4 8856 B10R1.57 CCCCNCC1CCC1 34a_100000738700_100000210210 [1,0,0,0,1,0|1,0,1]=4 8857 B10R1.57 CCCCNCC1CCC1 7a_106832991798_100000763275 [1,0,0,0,1,0|1,0,1]=4 8858 B10R1.57 CCCCNCC1CCO1 2230a_100000102301_100000103362 [1,0,0,0,1,0|1,0,1]=4 8859 B10R1.57 CCCCNCC1CCO1 7a_106832991798_100000103362 [1,0,0,0,1,0|1,0,1]=4 8860 B10R1.57 CCCCNC[C@@H]1CCO1 2230a_100020831831_100000210211 [1,0,0,0,1,0|1,0,1]=4 8861 B10R1.57 CCCCNC[C@@H]1CCO1 34a_100020831831_100000210210 [1,0,0,0,1,0|1,0,1]=4 8862 B10R1.57 CCCCOCC1CCC1 34a_100000210227_100000763275 [1,0,0,0,1,0|0,0,1]=3 8863 B10R1.57 CCCCOCC1CCC1 34a_100000760304_100000210210 [1,0,0,0,1,0|0,0,1]=3 8864 B10R1.57 CCCCOCC1CCC1 7a_100000210227_100000763275 [1,0,0,0,1,0|0,0,1]=3 8865 B10R1.57 CCCCOCC1CCO1 34a_100000039022_100000210210 [1,0,0,0,1,0|0,0,1]=3 8866 B10R1.57 CCCCOCC1CCO1 34a_100000210227_100000103362 [1,0,0,0,1,0|0,0,1]=3 8867 B10R1.57 CCCCOCC1CCO1 7a_100000210227_100000103362 [1,0,0,0,1,0|0,0,1]=3 8868 B10R1.57 CCCCOCC1CNC1 34a_100016987283_100000210210 [1,0,0,0,1,0|1,0,1]=4 8869 B10R1.57 CCCCOCC1COC1 34a_100000060846_100000210210 [1,0,0,0,1,0|1,0,1]=4 8870 B10R1.57 CCCCOCC1COC1 34a_100000210227_100010264016 [1,0,0,0,1,0|1,0,1]=4 8871 B10R1.57 CCCCOCC1COC1 7a_100000210227_100010264016 [1,0,0,0,1,0|1,0,1]=4 8872 B10R1.57 CCCCOCN1CCC1 269982a_100000754969_100011995733 [1,0,0,0,1,0|1,0,1]=4 8873 B10R1.57 CCCCSCC1CCC1 62a_100000210211_100000763275 [1,0,0,0,1,0|0,1,1]=4 8874 B10R1.57 CCCCSCC1CCC1 62a_100000763275_100000210210 [1,0,0,0,1,0|0,1,1]=4 8875 B10R1.57 CCCCSCC1CCO1 62a_100000103362_100000210210 [1,0,0,0,1,0|0,1,1]=4 8876 B10R1.57 CCCCSCC1CCO1 62a_100000210211_100000103362 [1,0,0,0,1,0|0,1,1]=4 8877 B10R1.57 COCCOCC1CCC1 34a_100000210237_100000763275 [1,0,0,0,1,0|1,0,1]=4 8878 B10R1.57 COCCOCC1CCC1 34a_100000760304_100011201679 [1,0,0,0,1,0|1,0,1]=4 8879 B10R1.57 COCCOCC1CCO1 34a_100000039022_100011201679 [1,0,0,0,1,0|1,0,1]=4 8880 B10R1.57 COCCOCC1CCO1 34a_100000210237_100000103362 [1,0,0,0,1,0|1,0,1]=4 8881 B10R1.57 CSCCOCC1CCC1 34a_100000230434_100000763275 [1,0,0,0,1,0|1,0,1]=4 8882 B10R1.57 CSCCOCC1CCC1 34a_100000760304_100000212216 [1,0,0,0,1,0|1,0,1]=4 8883 B10R1.57 CSCCOCC1CCC1 7a_100000230434_100000763275 [1,0,0,0,1,0|1,0,1]=4 8884 B10R1.57 CSCCOCC1CCO1 34a_100000039022_100000212216 [1,0,0,0,1,0|1,0,1]=4 8885 B10R1.57 CSCCOCC1CCO1 34a_100000230434_100000103362 [1,0,0,0,1,0|1,0,1]=4 8886 B10R1.57 CSCCOCC1CCO1 7a_100000230434_100000103362 [1,0,0,0,1,0|1,0,1]=4 8887 B10R1.57 ClCCCOCC1CCC1 34a_100000230001_100000763275 [1,0,0,0,1,0|1,0,1]=4 8888 B10R1.57 ClCCCOCC1CCO1 34a_100000230001_100000103362 [1,0,0,0,1,0|1,0,1]=4 8889 B10R1.57 FCCCOCC1CCC1 34a_100000759539_100000763275 [1,0,0,0,1,0|1,0,1]=4 8890 B10R1.57 FCCCOCC1CCC1 34a_100000760304_100011934791 [1,0,0,0,1,0|1,0,1]=4 8891 B10R1.57 FCCCOCC1CCO1 34a_100000039022_100011934791 [1,0,0,0,1,0|1,0,1]=4 8892 B10R1.57 FCCCOCC1CCO1 34a_100000759539_100000103362 [1,0,0,0,1,0|1,0,1]=4 8893 B10R1.57 NCCCOCC1CCC1 34a_100000182051_100000763275 [1,0,0,0,1,0|1,0,1]=4 8894 B10R1.57 NCCCOCC1CCO1 34a_100000182051_100000103362 [1,0,0,0,1,0|1,0,1]=4 8895 B10R1.57 OCCCOCC1CCC1 34a_100000760304_100000230001 [1,0,0,0,1,0|1,0,1]=4 8896 B10R1.57 OCCCOCC1CCO1 34a_100000039022_100000230001 [1,0,0,0,1,0|1,0,1]=4 8897 B10R1.27 C#CC(=O)CC1CCCO1 1458a_100000211873_100000203698 [1,0,0,0,1,0|0,0,2]=4 8898 B10R1.27 C=CC(=O)CC1CCCO1 1458a_100000185746_100000203698 [1,0,0,0,1,0|0,0,2]=4 8899 B10R1.27 CCC(=O)CC1=CCCC1 1458a_100000050221_100000210202 [1,0,0,0,1,0|1,0,1]=4 8900 B10R1.27 CCC(=O)CC1C=CCC1 1458a_100000212241_100000210202 [1,0,0,0,1,0|1,0,1]=4 8901 B10R1.27 CCC(=O)CC1CCCC1 1458a_100000210414_100000740388 [1,0,0,0,1,0|1,0,0]=3 8902 B10R1.27 CCC(=O)CC1CCCC1 1458a_100000210891_100000210202 [1,0,0,0,1,0|1,0,0]=3 8903 B10R1.27 CCC(=O)CC1CCCO1 1458a_100000210414_100000203698 [1,0,0,0,1,0|0,0,0]=2 8904 B10R1.27 CCC(=O)CC1CCOC1 1458a_100000210414_100000702531 [1,0,0,0,1,0|2,0,0]=4 8905 B10R1.27 CCC(=O)CC1CCOC1 1458a_100011218419_100000210202 [1,0,0,0,1,0|2,0,0]=4 8906 B10R1.27 CCC(=O)CC1OCCO1 1458a_100000210414_100000755774 [1,0,0,0,1,0|1,0,0]=3 8907 B10R1.27 CCC(=O)CN1CCCC1 1458a_100000740243_100000210202 [1,0,0,0,1,0|2,0,0]=4 8908 B10R1.27 CCC(=O)CN1CCCC1 269982a_100000188435_100000747405 [1,0,0,0,1,0|2,0,0]=4 8909 B10R1.27 CCC(=O)NC1CCCC1 11a_100000211070_100000210414 [1,0,0,0,1,0|2,0,0]=4 8910 B10R1.27 CCC(=O)NC1CCCC1 1626a_100000211070_100000210414 [1,0,0,0,1,0|2,0,0]=4 8911 B10R1.27 CCC(=O)NC1CCCC1 240690a_100000211070_100000210414 [1,0,0,0,1,0|2,0,0]=4 8912 B10R1.27 CCC(=O)NC1CCCC1 527a_100000211070_100000210414 [1,0,0,0,1,0|2,0,0]=4 8913 B10R1.27 CCC(C)OC1CCCO1 34a_100000085407_100011215416 [1,0,0,0,1,0|1,0,1]=4 8914 B10R1.27 CCN(C)CC1CCCO1 2230a_100000186375_200000210301 [1,0,0,0,1,0|2,0,0]=4 8915 B10R1.27 CCN(C)CC1CCCO1 2230a_100000225621_100000203698 [1,0,0,0,1,0|2,0,0]=4 8916 B10R1.27 CCN(C)CC1CCCO1 2230a_100102946541_100000210202 [1,0,0,0,1,0|2,0,0]=4 8917 B10R1.27 CCN(C)CC1CCCO1 269982a_100000186375_200000210301 [1,0,0,0,1,0|2,0,0]=4 8918 B10R1.27 CCN(C)CC1CCCO1 269982a_100000225621_100000183445 [1,0,0,0,1,0|2,0,0]=4 8919 B10R1.27 CCN(C)CC1CCCO1 269982a_100102946541_100000204670 [1,0,0,0,1,0|2,0,0]=4 8920 B10R1.27 CCN(C)CC1CCCO1 34a_100000186375_200000210301 [1,0,0,0,1,0|2,0,0]=4 8921 B10R1.27 CCN(C)CC1CCCO1 34a_100102946541_100000210202 [1,0,0,0,1,0|2,0,0]=4 8922 B10R1.27 CCN([13CH3])CC1CCCO1 2230a_100000186375_200025704644 [1,0,0,0,1,0|2,0,0]=4 8923 B10R1.27 CCN([13CH3])CC1CCCO1 269982a_100000186375_200025704644 [1,0,0,0,1,0|2,0,0]=4 8924 B10R1.27 CCN([13CH3])CC1CCCO1 34a_100000186375_200025704644 [1,0,0,0,1,0|2,0,0]=4 8925 B10R1.27 CNC(=O)CC1CCCC1 11a_106832991635_100000210891 [1,0,0,0,1,0|2,0,0]=4 8926 B10R1.27 CNC(=O)CC1CCCC1 1626a_100102657272_100000210891 [1,0,0,0,1,0|2,0,0]=4 8927 B10R1.27 CNC(=O)CC1CCCC1 240690a_100102657272_100000210891 [1,0,0,0,1,0|2,0,0]=4 8928 B10R1.27 CNC(=O)CC1CCCC1 527a_100102657272_100000210891 [1,0,0,0,1,0|2,0,0]=4 8929 B10R1.27 O=C(CF)CC1CCCC1 1458a_100000210891_100015361967 [1,0,0,0,1,0|2,0,0]=4 8930 B10R1.27 O=C(CO)CC1CCCC1 1458a_100000210174_100000740388 [1,0,0,0,1,0|2,0,0]=4 8931 B10R1.27 O=C(CO)CC1CCCO1 1458a_100000210174_100000203698 [1,0,0,0,1,0|1,0,0]=3 8932 B10R1.27 O=C(CO)CC1OCCO1 1458a_100000210174_100000755774 [1,0,0,0,1,0|2,0,0]=4 8933 B10R1.151 CCC(=O)COC1CCC1 34a_100000725409_100000749161 [1,0,0,0,1,0|2,0,0]=4 8934 B10R1.151 CCC(=O)CSC1CCC1 62a_100000747405_100000749161 [1,0,0,0,1,0|2,0,0]=4 8935 B10R1.151 CCC(=O)NCC1CCC1 11a_100000738700_100000210414 [1,0,0,0,1,0|1,0,0]=3 8936 B10R1.151 CCC(=O)NCC1CCC1 1626a_100000738700_100000210414 [1,0,0,0,1,0|1,0,0]=3 8937 B10R1.151 CCC(=O)NCC1CCC1 240690a_100000738700_100000210414 [1,0,0,0,1,0|1,0,0]=3 8938 B10R1.151 CCC(=O)NCC1CCC1 527a_100000738700_100000210414 [1,0,0,0,1,0|1,0,0]=3 8939 B10R1.151 CCC(=O)NCC1COC1 11a_100015281925_100000210414 [1,0,0,0,1,0|2,0,0]=4 8940 B10R1.151 CCC(=O)NCC1COC1 1626a_100015281925_100000210414 [1,0,0,0,1,0|2,0,0]=4 8941 B10R1.151 CCC(=O)NCC1COC1 240690a_100015281925_100000210414 [1,0,0,0,1,0|2,0,0]=4 8942 B10R1.151 CCC(=O)NCC1COC1 527a_100015281925_100000210414 [1,0,0,0,1,0|2,0,0]=4 8943 B10R1.151 CCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210414 [1,0,0,0,1,0|1,0,0]=3 8944 B10R1.151 CCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210414 [1,0,0,0,1,0|1,0,0]=3 8945 B10R1.151 CCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210414 [1,0,0,0,1,0|1,0,0]=3 8946 B10R1.151 CCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210414 [1,0,0,0,1,0|1,0,0]=3 8947 B10R1.151 CCC(=O)NNC1CCC1 22a_100000736358_100000210414 [1,0,0,0,1,0|2,0,0]=4 8948 B10R1.151 CCC(C)OCC1CCC1 34a_100000760304_100011215416 [1,0,0,0,1,0|1,0,1]=4 8949 B10R1.151 CCC(C)OCC1CCC1 7a_100000210228_100000763275 [1,0,0,0,1,0|1,0,1]=4 8950 B10R1.151 CCC(C)OCC1CCO1 34a_100000039022_100011215416 [1,0,0,0,1,0|1,0,1]=4 8951 B10R1.151 CCC(C)OCC1CCO1 7a_100000210228_100000103362 [1,0,0,0,1,0|1,0,1]=4 8952 B10R1.151 CNC(=O)NCC1CCC1 2708a_100000738700_106832991635 [1,0,0,0,1,0|2,0,0]=4 8953 B10R1.151 CNC(=O)NCC1CCC1 2708a_100102657272_100000738700 [1,0,0,0,1,0|2,0,0]=4 8954 B10R1.151 CNC(=O)NCC1CCC1 273464a_100000738700_100102657272 [1,0,0,0,1,0|2,0,0]=4 8955 B10R1.151 CNC(=O)NCC1CCC1 273464a_100102657272_100000738700 [1,0,0,0,1,0|2,0,0]=4 8956 B10R1.151 CNC(=O)NCC1CCC1 512a_100000738700_100102657272 [1,0,0,0,1,0|2,0,0]=4 8957 B10R1.151 CNC(=O)NCC1CCC1 512a_106832991638_100000738700 [1,0,0,0,1,0|2,0,0]=4 8958 B10R1.151 CNC(=O)NC[C@@H]1CCO1 2708a_100020831831_106832991635 [1,0,0,0,1,0|2,0,0]=4 8959 B10R1.151 CNC(=O)NC[C@@H]1CCO1 2708a_100102657272_100020831831 [1,0,0,0,1,0|2,0,0]=4 8960 B10R1.151 CNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100102657272 [1,0,0,0,1,0|2,0,0]=4 8961 B10R1.151 CNC(=O)NC[C@@H]1CCO1 273464a_100102657272_100020831831 [1,0,0,0,1,0|2,0,0]=4 8962 B10R1.151 CNC(=O)NC[C@@H]1CCO1 512a_100020831831_100102657272 [1,0,0,0,1,0|2,0,0]=4 8963 B10R1.151 CNC(=O)NC[C@@H]1CCO1 512a_106832991638_100020831831 [1,0,0,0,1,0|2,0,0]=4 8964 B10R1.151 O=C(CO)NCC1CCC1 240690a_100000738700_100000210174 [1,0,0,0,1,0|2,0,0]=4 8965 B10R1.151 O=C(CO)NCC1CCC1 527a_100000738700_100000210174 [1,0,0,0,1,0|2,0,0]=4 8966 B10R1.151 O=C(CO)NC[C@@H]1CCO1 240690a_100020831831_100000210174 [1,0,0,0,1,0|2,0,0]=4 8967 B10R1.151 O=C(CO)NC[C@@H]1CCO1 527a_100020831831_100000210174 [1,0,0,0,1,0|2,0,0]=4 8968 B10R1.11 C#CCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000184674 [0,0,0,0,2,0|0,0,2]=4 8969 B10R1.11 C=CCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210623 [0,0,0,0,2,0|0,0,2]=4 8970 B10R1.11 CCCC(=O)C1=CCCC1 1458a_100000038896_100000210303 [0,0,0,0,2,0|1,0,1]=4 8971 B10R1.11 CCCC(=O)C1CCCC1 1458a_100000210718_100000210303 [0,0,0,0,2,0|1,0,0]=3 8972 B10R1.11 CCCC(=O)C1CCCC1 1458a_100000211992_100000179811 [0,0,0,0,2,0|1,0,0]=3 8973 B10R1.11 CCCC(=O)C1CCCS1 1458a_100012002731_100000210303 [0,0,0,0,2,0|0,1,0]=3 8974 B10R1.11 CCCC(=O)C1CCOC1 1458a_100000211992_100000690089 [0,0,0,0,2,0|2,0,0]=4 8975 B10R1.11 CCCC(=O)C1CCOC1 1458a_100011219752_100000210303 [0,0,0,0,2,0|2,0,0]=4 8976 B10R1.11 CCCC(=O)N1CCCC1 240690a_100000188435_100000211992 [0,0,0,0,2,0|2,0,0]=4 8977 B10R1.11 CCCC(=O)N1CCCC1 527a_100000188435_100000211992 [0,0,0,0,2,0|2,0,0]=4 8978 B10R1.11 CCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210303 [0,0,0,0,2,0|0,0,0]=2 8979 B10R1.11 CCNC(=O)C1CCCC1 11a_100015525214_100000210718 [0,0,0,0,2,0|2,0,0]=4 8980 B10R1.11 CCNC(=O)C1CCCC1 240690a_100015525214_100000210718 [0,0,0,0,2,0|2,0,0]=4 8981 B10R1.11 CCNC(=O)C1CCCC1 527a_100015525214_100000210718 [0,0,0,0,2,0|2,0,0]=4 8982 B10R1.11 CCNC(=O)C1CCCS1 11a_100015525214_100012002731 [0,0,0,0,2,0|1,1,0]=4 8983 B10R1.11 CCNC(=O)C1CCCS1 240690a_100015525214_100012002731 [0,0,0,0,2,0|1,1,0]=4 8984 B10R1.11 CCNC(=O)C1CCCS1 527a_100015525214_100012002731 [0,0,0,0,2,0|1,1,0]=4 8985 B10R1.11 CCNC(=O)[C@@H]1CCCO1 11a_100015525214_100000686382 [0,0,0,0,2,0|1,0,0]=3 8986 B10R1.11 CCNC(=O)[C@@H]1CCCO1 240690a_100015525214_100000686382 [0,0,0,0,2,0|1,0,0]=3 8987 B10R1.11 CCNC(=O)[C@@H]1CCCO1 527a_100015525214_100000686382 [0,0,0,0,2,0|1,0,0]=3 8988 B10R1.11 CNNC(=O)[C@@H]1CCCO1 22a_100016993582_100000686382 [0,0,0,0,2,0|2,0,0]=4 8989 B10R1.11 COCC(=O)C1CCCC1 1458a_100000210968_100000179811 [0,0,0,0,2,0|2,0,0]=4 8990 B10R1.11 CSCC(=O)C1CCCC1 1458a_100000184570_100000179811 [0,0,0,0,2,0|2,0,0]=4 8991 B10R1.11 N#CCC(=O)[C@@H]1CCCO1 1458a_100000686382_100011214920 [0,0,0,0,2,0|1,0,1]=4 8992 B10R1.11 O=C(CCF)C1CCCC1 1458a_100000210718_100011217306 [0,0,0,0,2,0|2,0,0]=4 8993 B10R1.11 O=C(CCF)C1CCCS1 1458a_100012002731_100011217306 [0,0,0,0,2,0|1,1,0]=4 8994 B10R1.11 O=C(CCF)[C@@H]1CCCO1 1458a_100000686382_100011217306 [0,0,0,0,2,0|1,0,0]=3 8995 B10R1.11 O=C(CCO)C1CCCC1 1458a_100000210718_100000211926 [0,0,0,0,2,0|2,0,0]=4 8996 B10R1.11 O=C(CCO)C1CCCC1 1458a_100011216618_100000179811 [0,0,0,0,2,0|2,0,0]=4 8997 B10R1.11 O=C(CCO)C1CCCS1 1458a_100012002731_100000211926 [0,0,0,0,2,0|1,1,0]=4 8998 B10R1.11 O=C(CCO)[C@@H]1CCCO1 1458a_100000686382_100000211926 [0,0,0,0,2,0|1,0,0]=3 8999 B10R1.137 C#CCC(=O)CC1CCC1 1458a_100000763092_100000184674 [0,0,0,0,2,0|0,0,2]=4 9000 B10R1.137 C#CCC(=O)CC1CCC1 1458a_100011220946_100000763275 [0,0,0,0,2,0|0,0,2]=4 9001 B10R1.137 C#CCC(=O)CC1CCO1 1458a_100011220946_100000103362 [0,0,0,0,2,0|0,0,2]=4 9002 B10R1.137 C=CCC(=O)CC1CCC1 1458a_100000210193_100000763275 [0,0,0,0,2,0|0,0,2]=4 9003 B10R1.137 C=CCC(=O)CC1CCC1 1458a_100000763092_100000210623 [0,0,0,0,2,0|0,0,2]=4 9004 B10R1.137 C=CCC(=O)CC1CCO1 1458a_100000210193_100000103362 [0,0,0,0,2,0|0,0,2]=4 9005 B10R1.137 CC#CC(=O)CC1CCC1 1458a_100000763181_100000763275 [0,0,0,0,2,0|0,0,2]=4 9006 B10R1.137 CC#CC(=O)CC1CCO1 1458a_100000763181_100000103362 [0,0,0,0,2,0|0,0,2]=4 9007 B10R1.137 CC=CC(=O)CC1CCC1 1458a_100000210699_100000763275 [0,0,0,0,2,0|0,0,2]=4 9008 B10R1.137 CC=CC(=O)CC1CCO1 1458a_100000210699_100000103362 [0,0,0,0,2,0|0,0,2]=4 9009 B10R1.137 CCCC(=O)C=C1CCC1 1458a_100000686340_100000210303 [0,0,0,0,2,0|0,0,2]=4 9010 B10R1.137 CCCC(=O)CC1CCC1 1458a_100000211992_100000763275 [0,0,0,0,2,0|0,0,0]=2 9011 B10R1.137 CCCC(=O)CC1CCC1 1458a_100000763092_100000210303 [0,0,0,0,2,0|0,0,0]=2 9012 B10R1.137 CCCC(=O)CC1CCO1 1458a_100000211992_100000103362 [0,0,0,0,2,0|0,0,0]=2 9013 B10R1.137 CCCC(=O)CC1COC1 1458a_100000211992_100010264016 [0,0,0,0,2,0|1,0,0]=3 9014 B10R1.137 CCCC(=O)CC1COC1 1458a_100000687760_100000210303 [0,0,0,0,2,0|1,0,0]=3 9015 B10R1.137 CCCC(=O)CN1CCC1 269982a_100000754969_100000747444 [0,0,0,0,2,0|1,0,0]=3 9016 B10R1.137 CCCC(=O)NC1CCC1 11a_100000749019_100000211992 [0,0,0,0,2,0|1,0,0]=3 9017 B10R1.137 CCCC(=O)NC1CCC1 1626a_100000749019_100000211992 [0,0,0,0,2,0|1,0,0]=3 9018 B10R1.137 CCCC(=O)NC1CCC1 240690a_100000749019_100000211992 [0,0,0,0,2,0|1,0,0]=3 9019 B10R1.137 CCCC(=O)NC1CCC1 527a_100000749019_100000211992 [0,0,0,0,2,0|1,0,0]=3 9020 B10R1.137 CCCC(=O)NC1COC1 11a_100016991112_100000211992 [0,0,0,0,2,0|2,0,0]=4 9021 B10R1.137 CCCC(=O)NC1COC1 1626a_100016991112_100000211992 [0,0,0,0,2,0|2,0,0]=4 9022 B10R1.137 CCCC(=O)NC1COC1 240690a_100016991112_100000211992 [0,0,0,0,2,0|2,0,0]=4 9023 B10R1.137 CCCC(=O)NC1COC1 527a_100016991112_100000211992 [0,0,0,0,2,0|2,0,0]=4 9024 B10R1.137 CCCC(=O)NC1CSC1 11a_100016994217_100000211992 [0,0,0,0,2,0|2,0,0]=4 9025 B10R1.137 CCCC(=O)NC1CSC1 1626a_100016994217_100000211992 [0,0,0,0,2,0|2,0,0]=4 9026 B10R1.137 CCCC(=O)NC1CSC1 240690a_100016994217_100000211992 [0,0,0,0,2,0|2,0,0]=4 9027 B10R1.137 CCCC(=O)NC1CSC1 527a_100016994217_100000211992 [0,0,0,0,2,0|2,0,0]=4 9028 B10R1.137 CCCC(C)OC1CCC1 34a_100000748187_100000766640 [0,0,0,0,2,0|1,0,1]=4 9029 B10R1.137 CCCC(C)OC1CCC1 34a_100000764384_100000749161 [0,0,0,0,2,0|1,0,1]=4 9030 B10R1.137 CCCN(C)CC1CCC1 2230a_100000747261_100000763275 [0,0,0,0,2,0|2,0,0]=4 9031 B10R1.137 CCCN(C)CC1CCC1 2230a_200000750244_100000210303 [0,0,0,0,2,0|2,0,0]=4 9032 B10R1.137 CCCN(C)CC1CCC1 269982a_100000747261_100000763275 [0,0,0,0,2,0|2,0,0]=4 9033 B10R1.137 CCCN(C)CC1CCC1 269982a_200000750244_100000210303 [0,0,0,0,2,0|2,0,0]=4 9034 B10R1.137 CCCN(C)CC1CCC1 34a_200000750244_100000210303 [0,0,0,0,2,0|2,0,0]=4 9035 B10R1.137 CCCN(C)CC1CCO1 2230a_100000747261_100000103362 [0,0,0,0,2,0|2,0,0]=4 9036 B10R1.137 CCCN(C)CC1CCO1 269982a_100000747261_100000103362 [0,0,0,0,2,0|2,0,0]=4 9037 B10R1.137 CCNC(=O)CC1CCC1 11a_100015525214_100000763092 [0,0,0,0,2,0|1,0,0]=3 9038 B10R1.137 CCNC(=O)CC1CCC1 240690a_100015525214_100000763092 [0,0,0,0,2,0|1,0,0]=3 9039 B10R1.137 CCNC(=O)CC1CCC1 527a_100015525214_100000763092 [0,0,0,0,2,0|1,0,0]=3 9040 B10R1.137 CCNC(=O)CC1COC1 11a_100015525214_100000687760 [0,0,0,0,2,0|2,0,0]=4 9041 B10R1.137 CCNC(=O)CN1CCC1 269982a_100000754969_100000183381 [0,0,0,0,2,0|2,0,0]=4 9042 B10R1.137 CCNC(=O)NC1CCC1 2708a_100015525214_100000749019 [0,0,0,0,2,0|2,0,0]=4 9043 B10R1.137 CCNC(=O)NC1CCC1 273464a_100000749019_100015525214 [0,0,0,0,2,0|2,0,0]=4 9044 B10R1.137 CCNC(=O)NC1CCC1 273464a_100015525214_100000749019 [0,0,0,0,2,0|2,0,0]=4 9045 B10R1.137 CCNC(=O)NC1CCC1 512a_100000749019_100015525214 [0,0,0,0,2,0|2,0,0]=4 9046 B10R1.137 CCNC(=O)NC1CCC1 512a_100015525214_100000749019 [0,0,0,0,2,0|2,0,0]=4 9047 B10R1.137 CCOC(=O)CN1CCC1 269982a_100000754969_100000188475 [0,0,0,0,2,0|2,0,0]=4 9048 B10R1.137 CNNC(=O)CC1CCC1 22a_100016993582_100000763092 [0,0,0,0,2,0|2,0,0]=4 9049 B10R1.137 COCC(=O)CC1CCC1 1458a_100000210968_100000763275 [0,0,0,0,2,0|1,0,0]=3 9050 B10R1.137 COCC(=O)CC1CCO1 1458a_100000210968_100000103362 [0,0,0,0,2,0|1,0,0]=3 9051 B10R1.137 COCC(=O)CC1COC1 1458a_100000210968_100010264016 [0,0,0,0,2,0|2,0,0]=4 9052 B10R1.137 COCC(=O)NC1CCC1 11a_100000749019_100000210968 [0,0,0,0,2,0|2,0,0]=4 9053 B10R1.137 COCC(=O)NC1CCC1 1626a_100000749019_100000210968 [0,0,0,0,2,0|2,0,0]=4 9054 B10R1.137 COCC(=O)NC1CCC1 240690a_100000749019_100000210968 [0,0,0,0,2,0|2,0,0]=4 9055 B10R1.137 COCC(=O)NC1CCC1 527a_100000749019_100000210968 [0,0,0,0,2,0|2,0,0]=4 9056 B10R1.137 CSCC(=O)CC1CCC1 1458a_100000184570_100000763275 [0,0,0,0,2,0|1,0,0]=3 9057 B10R1.137 CSCC(=O)CC1CCO1 1458a_100000184570_100000103362 [0,0,0,0,2,0|1,0,0]=3 9058 B10R1.137 CSCC(=O)CC1COC1 1458a_100000184570_100010264016 [0,0,0,0,2,0|2,0,0]=4 9059 B10R1.137 CSCC(=O)NC1CCC1 11a_100000749019_100000184570 [0,0,0,0,2,0|2,0,0]=4 9060 B10R1.137 CSCC(=O)NC1CCC1 1626a_100000749019_100000184570 [0,0,0,0,2,0|2,0,0]=4 9061 B10R1.137 CSCC(=O)NC1CCC1 240690a_100000749019_100000184570 [0,0,0,0,2,0|2,0,0]=4 9062 B10R1.137 CSCC(=O)NC1CCC1 527a_100000749019_100000184570 [0,0,0,0,2,0|2,0,0]=4 9063 B10R1.137 N#CCC(=O)CC1CCC1 1458a_100000763092_100011214920 [0,0,0,0,2,0|1,0,1]=4 9064 B10R1.137 N#CCC(=O)CC1CCC1 1458a_100051588842_100000763275 [0,0,0,0,2,0|1,0,1]=4 9065 B10R1.137 N#CCC(=O)CC1CCO1 1458a_100051588842_100000103362 [0,0,0,0,2,0|1,0,1]=4 9066 B10R1.137 O=C(CCF)CC1CCC1 1458a_100000763092_100011217306 [0,0,0,0,2,0|1,0,0]=3 9067 B10R1.137 O=C(CCF)CC1COC1 1458a_100000687760_100011217306 [0,0,0,0,2,0|2,0,0]=4 9068 B10R1.137 O=C(CCO)CC1CCC1 1458a_100000763092_100000211926 [0,0,0,0,2,0|1,0,0]=3 9069 B10R1.137 O=C(CCO)CC1CCC1 1458a_100011216618_100000763275 [0,0,0,0,2,0|1,0,0]=3 9070 B10R1.137 O=C(CCO)CC1CCO1 1458a_100011216618_100000103362 [0,0,0,0,2,0|1,0,0]=3 9071 B10R1.137 O=C(CCO)CC1COC1 1458a_100000687760_100000211926 [0,0,0,0,2,0|2,0,0]=4 9072 B10R1.137 O=C(CCO)CC1COC1 1458a_100011216618_100010264016 [0,0,0,0,2,0|2,0,0]=4 9073 B10R1.137 O=C(CCO)NC1CCC1 240690a_100000749019_100011216618 [0,0,0,0,2,0|2,0,0]=4 9074 B10R1.138 CCCC(=O)C=CC1CC1 1458a_100102529529_100000210303 [0,0,0,0,2,0|1,0,1]=4 9075 B10R1.138 CCCC(=O)CCC1CC1 1458a_100000211992_100000694398 [0,0,0,0,2,0|1,0,0]=3 9076 B10R1.138 CCCC(=O)CCC1CC1 1458a_100000756386_100000210303 [0,0,0,0,2,0|1,0,0]=3 9077 B10R1.138 CCCC(=O)CCC1CO1 1458a_100000211992_100000732470 [0,0,0,0,2,0|1,0,0]=3 9078 B10R1.138 CCCC(=O)CSC1CC1 62a_100000747444_100000211595 [0,0,0,0,2,0|2,0,0]=4 9079 B10R1.138 CCCC(=O)NCC1CC1 11a_100000735609_100000211992 [0,0,0,0,2,0|1,0,0]=3 9080 B10R1.138 CCCC(=O)NCC1CC1 1626a_100000735609_100000211992 [0,0,0,0,2,0|1,0,0]=3 9081 B10R1.138 CCCC(=O)NCC1CC1 240690a_100000735609_100000211992 [0,0,0,0,2,0|1,0,0]=3 9082 B10R1.138 CCCC(=O)NCC1CC1 527a_100000735609_100000211992 [0,0,0,0,2,0|1,0,0]=3 9083 B10R1.138 CCCC(=O)NNC1CC1 22a_100000701032_100000211992 [0,0,0,0,2,0|2,0,0]=4 9084 B10R1.138 CCCC(C)OCC1CC1 34a_100000211283_100000766640 [0,0,0,0,2,0|1,0,1]=4 9085 B10R1.138 CCCC(C)OCC1CC1 34a_100000764384_100000742324 [0,0,0,0,2,0|1,0,1]=4 9086 B10R1.138 CCCC(C)OCC1CC1 7a_100000764384_100000742324 [0,0,0,0,2,0|1,0,1]=4 9087 B10R1.138 CCCC(C)OCC1CO1 34a_100000764384_102125554688 [0,0,0,0,2,0|1,0,1]=4 9088 B10R1.138 CCCC(C)OCC1CO1 7a_100000764384_102125554688 [0,0,0,0,2,0|1,0,1]=4 9089 B10R1.138 CCCC(C)OC[C@@H]1CO1 34a_100000757423_100000766640 [0,0,0,0,2,0|1,0,1]=4 9090 B10R1.138 CCCC(C)OC[C@@H]1CO1 7a_100000764384_100000745022 [0,0,0,0,2,0|1,0,1]=4 9091 B10R1.138 CCNC(=O)CCC1CC1 11a_100015525214_100000756386 [0,0,0,0,2,0|2,0,0]=4 9092 B10R1.138 CCNC(=O)CCC1CC1 240690a_100015525214_100000756386 [0,0,0,0,2,0|2,0,0]=4 9093 B10R1.138 CCNC(=O)CCC1CC1 527a_100015525214_100000756386 [0,0,0,0,2,0|2,0,0]=4 9094 B10R1.138 CCNC(=O)NCC1CC1 2708a_100000735609_100015525214 [0,0,0,0,2,0|2,0,0]=4 9095 B10R1.138 CCNC(=O)NCC1CC1 2708a_100015525214_100000735609 [0,0,0,0,2,0|2,0,0]=4 9096 B10R1.138 CCNC(=O)NCC1CC1 273464a_100000735609_100015525214 [0,0,0,0,2,0|2,0,0]=4 9097 B10R1.138 CCNC(=O)NCC1CC1 273464a_100015525214_100000735609 [0,0,0,0,2,0|2,0,0]=4 9098 B10R1.138 CCNC(=O)NCC1CC1 512a_100000735609_100015525214 [0,0,0,0,2,0|2,0,0]=4 9099 B10R1.138 CCNC(=O)NCC1CC1 512a_100015525214_100000735609 [0,0,0,0,2,0|2,0,0]=4 9100 B10R1.138 COCC(=O)CCC1CC1 1458a_100000210968_100000694398 [0,0,0,0,2,0|2,0,0]=4 9101 B10R1.138 COCC(=O)CCC1CO1 1458a_100000210968_100000732470 [0,0,0,0,2,0|2,0,0]=4 9102 B10R1.138 COCC(=O)NCC1CC1 11a_100000735609_100000210968 [0,0,0,0,2,0|2,0,0]=4 9103 B10R1.138 COCC(=O)NCC1CC1 1626a_100000735609_100000210968 [0,0,0,0,2,0|2,0,0]=4 9104 B10R1.138 COCC(=O)NCC1CC1 240690a_100000735609_100000210968 [0,0,0,0,2,0|2,0,0]=4 9105 B10R1.138 COCC(=O)NCC1CC1 527a_100000735609_100000210968 [0,0,0,0,2,0|2,0,0]=4 9106 B10R1.138 CSCC(=O)CCC1CC1 1458a_100000184570_100000694398 [0,0,0,0,2,0|2,0,0]=4 9107 B10R1.138 CSCC(=O)CCC1CO1 1458a_100000184570_100000732470 [0,0,0,0,2,0|2,0,0]=4 9108 B10R1.138 CSCC(=O)NCC1CC1 11a_100000735609_100000184570 [0,0,0,0,2,0|2,0,0]=4 9109 B10R1.138 CSCC(=O)NCC1CC1 1626a_100000735609_100000184570 [0,0,0,0,2,0|2,0,0]=4 9110 B10R1.138 CSCC(=O)NCC1CC1 240690a_100000735609_100000184570 [0,0,0,0,2,0|2,0,0]=4 9111 B10R1.138 CSCC(=O)NCC1CC1 527a_100000735609_100000184570 [0,0,0,0,2,0|2,0,0]=4 9112 B10R1.138 O=C(CCF)CCC1CC1 1458a_100000756386_100011217306 [0,0,0,0,2,0|2,0,0]=4 9113 B10R1.138 O=C(CCO)CCC1CC1 1458a_100000756386_100000211926 [0,0,0,0,2,0|2,0,0]=4 9114 B10R1.138 O=C(CCO)CCC1CC1 1458a_100011216618_100000694398 [0,0,0,0,2,0|2,0,0]=4 9115 B10R1.138 O=C(CCO)CCC1CO1 1458a_100011216618_100000732470 [0,0,0,0,2,0|2,0,0]=4 9116 B10R1.138 O=C(CCO)NCC1CC1 240690a_100000735609_100011216618 [0,0,0,0,2,0|2,0,0]=4 9117 B12R0.265 C#CC(CC)OCOC(=O)CCC 34a_100000758843_100000034017 [0,0,1,0,0,1|1,0,1]=4 9118 B12R0.265 C=CC(CC)OCOC(=O)CCC 34a_100000766422_100000034017 [0,0,1,0,0,1|1,0,1]=4 9119 B12R0.265 CCC(COCC(=O)NCO)OC 34a_100011934954_100000185155 [0,0,1,0,0,1|2,0,0]=4 9120 B12R0.265 CCC(COCC(=O)NCO)OC 7a_100011934954_100000185155 [0,0,1,0,0,1|2,0,0]=4 9121 B12R0.265 CCCC(=O)CCCC(OC)OC 1458a_100000211992_100000069011 [0,0,1,0,0,1|2,0,0]=4 9122 B12R0.265 CCCC(=O)CNCC(CC)CC 2230a_100102946423_100000747444 [0,0,1,0,0,1|2,0,0]=4 9123 B12R0.265 CCCC(=O)COCC(CC)CC 7a_100000703878_100000747444 [0,0,1,0,0,1|1,0,0]=3 9124 B12R0.265 CCCC(=O)COCC(CC)OC 7a_100011934954_100000747444 [0,0,1,0,0,1|0,0,0]=2 9125 B12R0.265 CCCC(=O)COCN(CC)CC 7a_200015374951_100000747444 [0,0,1,0,0,1|2,0,0]=4 9126 B12R0.265 CCCC(=O)CSCC(CC)CC 62a_100000747444_100011215472 [0,0,1,0,0,1|1,1,0]=4 9127 B12R0.265 CCCC(=O)CSCC(CC)CC 62a_100011215472_100000747444 [0,0,1,0,0,1|1,1,0]=4 9128 B12R0.265 CCCC(=O)CSCC(OC)OC 62a_100000747444_100000751394 [0,0,1,0,0,1|1,1,0]=4 9129 B12R0.265 CCCC(=O)CSCC(OC)OC 62a_100000751394_100000747444 [0,0,1,0,0,1|1,1,0]=4 9130 B12R0.265 CCCC(=O)OCNC(CC)CC 2230a_100000199018_100000034017 [0,0,1,0,0,1|1,0,0]=3 9131 B12R0.265 CCCC(=O)OCN[C@@H](CC)CO 2230a_100000709445_100000034017 [0,0,1,0,0,1|2,0,0]=4 9132 B12R0.265 CCCC(=O)OCSC(CC)CC 62a_100000210505_100000034017 [0,0,1,0,0,1|1,0,0]=3 9133 B12R0.265 CCCC(C)COCC(CC)OC 34a_100011934954_100011216630 [0,0,1,0,0,1|1,0,1]=4 9134 B12R0.265 CCCC(C)COCC(CC)OC 7a_100011934954_100011216630 [0,0,1,0,0,1|1,0,1]=4 9135 B12R0.265 CCNC(=O)COCC(CC)CC 7a_100000703878_100000183381 [0,0,1,0,0,1|2,0,0]=4 9136 B12R0.265 CCNC(=O)COCC(CC)OC 34a_100011934954_100000183381 [0,0,1,0,0,1|1,0,0]=3 9137 B12R0.265 CCNC(=O)COCC(CC)OC 7a_100011934954_100000183381 [0,0,1,0,0,1|1,0,0]=3 9138 B12R0.265 CCNC(=O)COCC(OC)OC 34a_100011216393_100000183381 [0,0,1,0,0,1|2,0,0]=4 9139 B12R0.265 CCOC(=O)COCC(CC)CC 7a_100000703878_100000188475 [0,0,1,0,0,1|2,0,0]=4 9140 B12R0.265 CCOC(=O)COCC(CC)OC 34a_100011934954_100000188475 [0,0,1,0,0,1|1,0,0]=3 9141 B12R0.265 CCOC(=O)COCC(CC)OC 7a_100011934954_100000188475 [0,0,1,0,0,1|1,0,0]=3 9142 B12R0.265 CCOC(=O)COCC(OC)OC 34a_100011216393_100000188475 [0,0,1,0,0,1|2,0,0]=4 9143 B12R0.265 CCOC(=O)OCSC(CC)CC 62a_100000210505_100000075025 [0,0,1,0,0,1|2,0,0]=4 9144 B12R1.8 BrCCCOCC1CCCCO1 34a_100011217188_100000211543 [1,0,0,0,0,1|1,0,1]=4 9145 B12R1.8 BrCCCOCC1CCCOC1 34a_100011217188_100000741521 [1,0,0,0,0,1|1,0,1]=4 9146 B12R1.8 CCCCNCC1CCCCO1 2230a_100000102301_100000211543 [1,0,0,0,0,1|1,0,1]=4 9147 B12R1.8 CCCCNCC1CCCCO1 2230a_100000174945_100000210211 [1,0,0,0,0,1|1,0,1]=4 9148 B12R1.8 CCCCNCC1CCCCO1 34a_100000174945_100000210210 [1,0,0,0,0,1|1,0,1]=4 9149 B12R1.8 CCCCNCC1CCCCO1 7a_106832991798_100000211543 [1,0,0,0,0,1|1,0,1]=4 9150 B12R1.8 CCCCNCC1CCCOC1 2230a_100000102301_100000741521 [1,0,0,0,0,1|1,0,1]=4 9151 B12R1.8 CCCCNCC1CCCOC1 2230a_100000720124_100000210211 [1,0,0,0,0,1|1,0,1]=4 9152 B12R1.8 CCCCNCC1CCCOC1 34a_100000720124_100000210210 [1,0,0,0,0,1|1,0,1]=4 9153 B12R1.8 CCCCNCC1CCCOC1 7a_106832991798_100000741521 [1,0,0,0,0,1|1,0,1]=4 9154 B12R1.8 CCCCNC[C@H]1COCCO1 2230a_100010981119_100000210211 [1,0,0,0,0,1|1,0,1]=4 9155 B12R1.8 CCCCNC[C@H]1COCCO1 34a_100010981119_100000210210 [1,0,0,0,0,1|1,0,1]=4 9156 B12R1.8 CCCCOCC1CCC=CO1 34a_100011217868_100000210210 [1,0,0,0,0,1|0,0,2]=4 9157 B12R1.8 CCCCOCC1CCCCC1 34a_100000210227_100000211423 [1,0,0,0,0,1|1,0,1]=4 9158 B12R1.8 CCCCOCC1CCCCC1 34a_100000212181_100000210210 [1,0,0,0,0,1|1,0,1]=4 9159 B12R1.8 CCCCOCC1CCCCC1 7a_100000210227_100000211423 [1,0,0,0,0,1|1,0,1]=4 9160 B12R1.8 CCCCOCC1CCCCC1 7a_100000212181_100000210211 [1,0,0,0,0,1|1,0,1]=4 9161 B12R1.8 CCCCOCC1CCCCN1 34a_100000210821_100000210210 [1,0,0,0,0,1|1,0,1]=4 9162 B12R1.8 CCCCOCC1CCCCO1 34a_100000210227_100000211543 [1,0,0,0,0,1|0,0,1]=3 9163 B12R1.8 CCCCOCC1CCCCO1 34a_100000211370_100000210210 [1,0,0,0,0,1|0,0,1]=3 9164 B12R1.8 CCCCOCC1CCCCO1 7a_100000210227_100000211543 [1,0,0,0,0,1|0,0,1]=3 9165 B12R1.8 CCCCOCC1CCCCO1 7a_100000211370_100000210211 [1,0,0,0,0,1|0,0,1]=3 9166 B12R1.8 CCCCOCC1CCCNC1 34a_100000211344_100000210210 [1,0,0,0,0,1|1,0,1]=4 9167 B12R1.8 CCCCOCC1CCCOC1 34a_100000210227_100000741521 [1,0,0,0,0,1|0,0,1]=3 9168 B12R1.8 CCCCOCC1CCCOC1 34a_100000741520_100000210210 [1,0,0,0,0,1|0,0,1]=3 9169 B12R1.8 CCCCOCC1CCCOC1 7a_100000210227_100000741521 [1,0,0,0,0,1|0,0,1]=3 9170 B12R1.8 CCCCOCC1CCNCC1 34a_100000738675_100000210210 [1,0,0,0,0,1|1,0,1]=4 9171 B12R1.8 CCCCOCC1CCOCC1 34a_100000210227_100000754603 [1,0,0,0,0,1|1,0,1]=4 9172 B12R1.8 CCCCOCC1CCOCC1 34a_100000749013_100000210210 [1,0,0,0,0,1|1,0,1]=4 9173 B12R1.8 CCCCOCC1CCOCC1 7a_100000210227_100000754603 [1,0,0,0,0,1|1,0,1]=4 9174 B12R1.8 CCCCOCC1CCSCC1 34a_100000070558_100000210210 [1,0,0,0,0,1|1,0,1]=4 9175 B12R1.8 CCCCOCC1CCSCC1 7a_100000070558_100000210211 [1,0,0,0,0,1|1,0,1]=4 9176 B12R1.8 CCCCOCN1CCCOC1 2230a_100000131196_100011995733 [1,0,0,0,0,1|1,0,1]=4 9177 B12R1.8 CCCCOCN1CCCOC1 269982a_100000131196_100011995733 [1,0,0,0,0,1|1,0,1]=4 9178 B12R1.8 CCCCOCN1CCCOC1 34a_100000131196_100011995733 [1,0,0,0,0,1|1,0,1]=4 9179 B12R1.8 CCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210210 [1,0,0,0,0,1|0,0,1]=3 9180 B12R1.8 CCCCOC[C@@H]1COCCN1 34a_100000717676_100000210210 [1,0,0,0,0,1|1,0,1]=4 9181 B12R1.8 CCCCOC[C@H]1COCCO1 34a_100009875890_100000210210 [1,0,0,0,0,1|0,0,1]=3 9182 B12R1.8 CCCCSCC1CCCCO1 62a_100000210211_100000211543 [1,0,0,0,0,1|0,1,1]=4 9183 B12R1.8 CCCCSCC1CCCCO1 62a_100000211543_100000210210 [1,0,0,0,0,1|0,1,1]=4 9184 B12R1.8 CCCCSCC1CCCOC1 62a_100000210211_100000741521 [1,0,0,0,0,1|0,1,1]=4 9185 B12R1.8 CCCCSCC1CCCOC1 62a_100000741521_100000210210 [1,0,0,0,0,1|0,1,1]=4 9186 B12R1.8 CCCNCCC1CCCCO1 2230a_100015183643_100000210303 [1,0,0,0,0,1|2,0,0]=4 9187 B12R1.8 CCCNCCC1CCCCO1 34a_100015183643_100000210303 [1,0,0,0,0,1|2,0,0]=4 9188 B12R1.8 CCCOCCC1OCCCO1 34a_100000210258_100000764188 [1,0,0,0,0,1|2,0,0]=4 9189 B12R1.8 CCCSCCC1OCCCO1 62a_100000210303_100000764188 [1,0,0,0,0,1|2,0,0]=4 9190 B12R1.8 CCCSCCC1OCCCO1 62a_100000764188_100000210303 [1,0,0,0,0,1|2,0,0]=4 9191 B12R1.8 COCCOCC1CCCCO1 34a_100000210237_100000211543 [1,0,0,0,0,1|1,0,1]=4 9192 B12R1.8 COCCOCC1CCCCO1 34a_100000211370_100011201679 [1,0,0,0,0,1|1,0,1]=4 9193 B12R1.8 COCCOCC1CCCCO1 7a_100000211370_100000233755 [1,0,0,0,0,1|1,0,1]=4 9194 B12R1.8 COCCOCC1CCCOC1 34a_100000210237_100000741521 [1,0,0,0,0,1|1,0,1]=4 9195 B12R1.8 COCCOCC1CCCOC1 34a_100000741520_100011201679 [1,0,0,0,0,1|1,0,1]=4 9196 B12R1.8 COCCOC[C@@H]1CNCCO1 34a_100015189573_100011201679 [1,0,0,0,0,1|1,0,1]=4 9197 B12R1.8 COCCOC[C@H]1COCCO1 34a_100009875890_100011201679 [1,0,0,0,0,1|1,0,1]=4 9198 B12R1.8 CSCCOCC1CCCCO1 34a_100000211370_100000212216 [1,0,0,0,0,1|1,0,1]=4 9199 B12R1.8 CSCCOCC1CCCCO1 34a_100000230434_100000211543 [1,0,0,0,0,1|1,0,1]=4 9200 B12R1.8 CSCCOCC1CCCCO1 7a_100000211370_100000212216 [1,0,0,0,0,1|1,0,1]=4 9201 B12R1.8 CSCCOCC1CCCCO1 7a_100000230434_100000211543 [1,0,0,0,0,1|1,0,1]=4 9202 B12R1.8 CSCCOCC1CCCOC1 34a_100000230434_100000741521 [1,0,0,0,0,1|1,0,1]=4 9203 B12R1.8 CSCCOCC1CCCOC1 34a_100000741520_100000212216 [1,0,0,0,0,1|1,0,1]=4 9204 B12R1.8 CSCCOCC1CCCOC1 7a_100000230434_100000741521 [1,0,0,0,0,1|1,0,1]=4 9205 B12R1.8 CSCCOC[C@@H]1CNCCO1 34a_100015189573_100000212216 [1,0,0,0,0,1|1,0,1]=4 9206 B12R1.8 CSCCOC[C@H]1COCCO1 34a_100009875890_100000212216 [1,0,0,0,0,1|1,0,1]=4 9207 B12R1.8 ClCCCOCC1CCCCO1 34a_100000230001_100000211543 [1,0,0,0,0,1|1,0,1]=4 9208 B12R1.8 ClCCCOCC1CCCOC1 34a_100000230001_100000741521 [1,0,0,0,0,1|1,0,1]=4 9209 B12R1.8 FCCCOCC1CCCCO1 34a_100000211370_100011934791 [1,0,0,0,0,1|1,0,1]=4 9210 B12R1.8 FCCCOCC1CCCCO1 34a_100000759539_100000211543 [1,0,0,0,0,1|1,0,1]=4 9211 B12R1.8 FCCCOCC1CCCCO1 7a_100000211370_100011934791 [1,0,0,0,0,1|1,0,1]=4 9212 B12R1.8 FCCCOCC1CCCOC1 34a_100000741520_100011934791 [1,0,0,0,0,1|1,0,1]=4 9213 B12R1.8 FCCCOCC1CCCOC1 34a_100000759539_100000741521 [1,0,0,0,0,1|1,0,1]=4 9214 B12R1.8 FCCCOC[C@@H]1CNCCO1 34a_100015189573_100011934791 [1,0,0,0,0,1|1,0,1]=4 9215 B12R1.8 FCCCOC[C@H]1COCCO1 34a_100009875890_100011934791 [1,0,0,0,0,1|1,0,1]=4 9216 B12R1.8 NCCCOCC1CCCCO1 34a_100000182051_100000211543 [1,0,0,0,0,1|1,0,1]=4 9217 B12R1.8 NCCCOCC1CCCOC1 34a_100000182051_100000741521 [1,0,0,0,0,1|1,0,1]=4 9218 B12R1.8 OCCCOCC1CCCCO1 34a_100000211370_100000230001 [1,0,0,0,0,1|1,0,1]=4 9219 B12R1.8 OCCCOCC1CCCCO1 7a_100000211370_100011215043 [1,0,0,0,0,1|1,0,1]=4 9220 B12R1.8 OCCCOCC1CCCOC1 34a_100000741520_100000230001 [1,0,0,0,0,1|1,0,1]=4 9221 B12R1.8 OCCCOC[C@@H]1CNCCO1 34a_100015189573_100000230001 [1,0,0,0,0,1|1,0,1]=4 9222 B12R1.8 OCCCOC[C@H]1COCCO1 34a_100009875890_100000230001 [1,0,0,0,0,1|1,0,1]=4 9223 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000210414_100011273959 [1,0,0,0,0,1|2,0,0]=4 9224 B12R1.27 CCC(=O)CCC1CCCCC1 1458a_100000211375_100000210202 [1,0,0,0,0,1|2,0,0]=4 9225 B12R1.27 CCC(=O)CCC1CCOCC1 1458a_100000210414_100011934994 [1,0,0,0,0,1|2,0,0]=4 9226 B12R1.27 CCC(=O)CCC1OCCCO1 1458a_100000210414_100000764188 [1,0,0,0,0,1|1,0,0]=3 9227 B12R1.27 CCC(=O)CCN1CCCCO1 1458a_200015184090_100000210202 [1,0,0,0,0,1|2,0,0]=4 9228 B12R1.27 CCC(=O)COC1CCCOC1 34a_100000725409_100000693364 [1,0,0,0,0,1|2,0,0]=4 9229 B12R1.27 CCC(=O)CSC1CCCOC1 62a_100000747405_100000693364 [1,0,0,0,0,1|2,0,0]=4 9230 B12R1.27 CCC(=O)NCC1CCCCC1 11a_100000210473_100000210414 [1,0,0,0,0,1|2,0,0]=4 9231 B12R1.27 CCC(=O)NCC1CCCCC1 1626a_100000210473_100000210414 [1,0,0,0,0,1|2,0,0]=4 9232 B12R1.27 CCC(=O)NCC1CCCCC1 240690a_100000210473_100000210414 [1,0,0,0,0,1|2,0,0]=4 9233 B12R1.27 CCC(=O)NCC1CCCCC1 527a_100000210473_100000210414 [1,0,0,0,0,1|2,0,0]=4 9234 B12R1.27 CCC(=O)NCC1CCCCO1 11a_100000174945_100000210414 [1,0,0,0,0,1|1,0,0]=3 9235 B12R1.27 CCC(=O)NCC1CCCCO1 1626a_100000174945_100000210414 [1,0,0,0,0,1|1,0,0]=3 9236 B12R1.27 CCC(=O)NCC1CCCCO1 240690a_100000174945_100000210414 [1,0,0,0,0,1|1,0,0]=3 9237 B12R1.27 CCC(=O)NCC1CCCCO1 527a_100000174945_100000210414 [1,0,0,0,0,1|1,0,0]=3 9238 B12R1.27 CCC(=O)NCC1CCCOC1 11a_100000720124_100000210414 [1,0,0,0,0,1|1,0,0]=3 9239 B12R1.27 CCC(=O)NCC1CCCOC1 1626a_100000720124_100000210414 [1,0,0,0,0,1|1,0,0]=3 9240 B12R1.27 CCC(=O)NCC1CCCOC1 240690a_100000720124_100000210414 [1,0,0,0,0,1|1,0,0]=3 9241 B12R1.27 CCC(=O)NCC1CCCOC1 527a_100000720124_100000210414 [1,0,0,0,0,1|1,0,0]=3 9242 B12R1.27 CCC(=O)NCC1CCOCC1 11a_100000746373_100000210414 [1,0,0,0,0,1|2,0,0]=4 9243 B12R1.27 CCC(=O)NCC1CCOCC1 1626a_100000746373_100000210414 [1,0,0,0,0,1|2,0,0]=4 9244 B12R1.27 CCC(=O)NCC1CCOCC1 240690a_100000746373_100000210414 [1,0,0,0,0,1|2,0,0]=4 9245 B12R1.27 CCC(=O)NCC1CCOCC1 527a_100000746373_100000210414 [1,0,0,0,0,1|2,0,0]=4 9246 B12R1.27 CCC(=O)NCC1CCSCC1 11a_100015188806_100000210414 [1,0,0,0,0,1|2,0,0]=4 9247 B12R1.27 CCC(=O)NCC1CCSCC1 240690a_100015188806_100000210414 [1,0,0,0,0,1|2,0,0]=4 9248 B12R1.27 CCC(=O)NCC1CCSCC1 527a_100015188806_100000210414 [1,0,0,0,0,1|2,0,0]=4 9249 B12R1.27 CCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000210414 [1,0,0,0,0,1|1,0,0]=3 9250 B12R1.27 CCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000210414 [1,0,0,0,0,1|1,0,0]=3 9251 B12R1.27 CCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000210414 [1,0,0,0,0,1|1,0,0]=3 9252 B12R1.27 CCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000210414 [1,0,0,0,0,1|1,0,0]=3 9253 B12R1.27 CCC(C)OCC1CCCCO1 34a_100000211370_100011215416 [1,0,0,0,0,1|1,0,1]=4 9254 B12R1.27 CCC(C)OCC1CCCCO1 7a_100000210228_100000211543 [1,0,0,0,0,1|1,0,1]=4 9255 B12R1.27 CCC(C)OCC1CCCCO1 7a_100000211370_100000758301 [1,0,0,0,0,1|1,0,1]=4 9256 B12R1.27 CCC(C)OCC1CCCOC1 34a_100000741520_100011215416 [1,0,0,0,0,1|1,0,1]=4 9257 B12R1.27 CCC(C)OCC1CCCOC1 7a_100000210228_100000741521 [1,0,0,0,0,1|1,0,1]=4 9258 B12R1.27 CCC(C)OC[C@@H]1CNCCO1 34a_100015189573_100011215416 [1,0,0,0,0,1|1,0,1]=4 9259 B12R1.27 CCC(C)OC[C@H]1COCCO1 34a_100009875890_100011215416 [1,0,0,0,0,1|1,0,1]=4 9260 B12R1.27 CNC(=O)NCC1CCCCO1 2708a_100000174945_106832991635 [1,0,0,0,0,1|2,0,0]=4 9261 B12R1.27 CNC(=O)NCC1CCCCO1 2708a_100102657272_100000174945 [1,0,0,0,0,1|2,0,0]=4 9262 B12R1.27 CNC(=O)NCC1CCCCO1 273464a_100000174945_100102657272 [1,0,0,0,0,1|2,0,0]=4 9263 B12R1.27 CNC(=O)NCC1CCCCO1 273464a_100102657272_100000174945 [1,0,0,0,0,1|2,0,0]=4 9264 B12R1.27 CNC(=O)NCC1CCCCO1 512a_100000174945_100102657272 [1,0,0,0,0,1|2,0,0]=4 9265 B12R1.27 CNC(=O)NCC1CCCCO1 512a_106832991638_100000174945 [1,0,0,0,0,1|2,0,0]=4 9266 B12R1.27 CNC(=O)NCC1CCCOC1 2708a_100000720124_106832991635 [1,0,0,0,0,1|2,0,0]=4 9267 B12R1.27 CNC(=O)NCC1CCCOC1 2708a_100102657272_100000720124 [1,0,0,0,0,1|2,0,0]=4 9268 B12R1.27 CNC(=O)NCC1CCCOC1 273464a_100000720124_100102657272 [1,0,0,0,0,1|2,0,0]=4 9269 B12R1.27 CNC(=O)NCC1CCCOC1 273464a_100102657272_100000720124 [1,0,0,0,0,1|2,0,0]=4 9270 B12R1.27 CNC(=O)NCC1CCCOC1 512a_100000720124_100102657272 [1,0,0,0,0,1|2,0,0]=4 9271 B12R1.27 CNC(=O)NCC1CCCOC1 512a_106832991638_100000720124 [1,0,0,0,0,1|2,0,0]=4 9272 B12R1.27 CNC(=O)NC[C@H]1COCCO1 2708a_100010981119_106832991635 [1,0,0,0,0,1|2,0,0]=4 9273 B12R1.27 CNC(=O)NC[C@H]1COCCO1 2708a_100102657272_100010981119 [1,0,0,0,0,1|2,0,0]=4 9274 B12R1.27 CNC(=O)NC[C@H]1COCCO1 273464a_100010981119_100102657272 [1,0,0,0,0,1|2,0,0]=4 9275 B12R1.27 CNC(=O)NC[C@H]1COCCO1 273464a_100102657272_100010981119 [1,0,0,0,0,1|2,0,0]=4 9276 B12R1.27 CNC(=O)NC[C@H]1COCCO1 512a_100010981119_100102657272 [1,0,0,0,0,1|2,0,0]=4 9277 B12R1.27 CNC(=O)NC[C@H]1COCCO1 512a_106832991638_100010981119 [1,0,0,0,0,1|2,0,0]=4 9278 B12R1.27 O=C(CO)CCC1OCCCO1 1458a_100000210174_100000764188 [1,0,0,0,0,1|2,0,0]=4 9279 B12R1.27 O=C(CO)NCC1CCCCO1 240690a_100000174945_100000210174 [1,0,0,0,0,1|2,0,0]=4 9280 B12R1.27 O=C(CO)NCC1CCCCO1 527a_100000174945_100000210174 [1,0,0,0,0,1|2,0,0]=4 9281 B12R1.27 O=C(CO)NCC1CCCOC1 240690a_100000720124_100000210174 [1,0,0,0,0,1|2,0,0]=4 9282 B12R1.27 O=C(CO)NCC1CCCOC1 527a_100000720124_100000210174 [1,0,0,0,0,1|2,0,0]=4 9283 B12R1.27 O=C(CO)NC[C@H]1COCCO1 240690a_100010981119_100000210174 [1,0,0,0,0,1|2,0,0]=4 9284 B12R1.27 O=C(CO)NC[C@H]1COCCO1 527a_100010981119_100000210174 [1,0,0,0,0,1|2,0,0]=4 9285 B14R1.520 C#CCC(=O)COCC1CCCCO1 1458a_100011223378_100000184674 [0,0,0,0,0,2|0,0,2]=4 9286 B14R1.520 C=CCC(=O)COCC1CCCCO1 1458a_100011223378_100000210623 [0,0,0,0,0,2|0,0,2]=4 9287 B14R1.520 CCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000210303 [0,0,0,0,0,2|2,0,0]=4 9288 B14R1.520 CCCC(=O)CCCC1CCCCC1 1458a_100000211992_100011713725 [0,0,0,0,0,2|2,0,0]=4 9289 B14R1.520 CCCC(=O)CCOC1CCCCC1 1458a_100000211992_100011211530 [0,0,0,0,0,2|2,0,0]=4 9290 B14R1.520 CCCC(=O)CCOC1CCCCO1 1458a_100000211992_100000744793 [0,0,0,0,0,2|1,0,0]=3 9291 B14R1.520 CCCC(=O)CNCC1CCCCC1 2230a_100000210473_100000747444 [0,0,0,0,0,2|2,0,0]=4 9292 B14R1.520 CCCC(=O)CNCC1CCCCO1 2230a_100000174945_100000747444 [0,0,0,0,0,2|1,0,0]=3 9293 B14R1.520 CCCC(=O)CNCC1CCCOC1 2230a_100000720124_100000747444 [0,0,0,0,0,2|1,0,0]=3 9294 B14R1.520 CCCC(=O)CNCC1CCOCC1 2230a_100000746373_100000747444 [0,0,0,0,0,2|2,0,0]=4 9295 B14R1.520 CCCC(=O)CNCC1CCSCC1 2230a_100015188806_100000747444 [0,0,0,0,0,2|2,0,0]=4 9296 B14R1.520 CCCC(=O)CNC[C@H]1COCCO1 2230a_100010981119_100000747444 [0,0,0,0,0,2|1,0,0]=3 9297 B14R1.520 CCCC(=O)COCC1CCCCC1 7a_100000212181_100000747444 [0,0,0,0,0,2|1,0,0]=3 9298 B14R1.520 CCCC(=O)COCC1CCCCO1 1458a_100011223378_100000210303 [0,0,0,0,0,2|0,0,0]=2 9299 B14R1.520 CCCC(=O)COCC1CCCCO1 7a_100000211370_100000747444 [0,0,0,0,0,2|0,0,0]=2 9300 B14R1.520 CCCC(=O)COCC1CCSCC1 7a_100000070558_100000747444 [0,0,0,0,0,2|1,0,0]=3 9301 B14R1.520 CCCC(=O)CSCC1CCCCC1 62a_100000211423_100000747444 [0,0,0,0,0,2|1,1,0]=4 9302 B14R1.520 CCCC(=O)CSCC1CCCCC1 62a_100000747444_100000211423 [0,0,0,0,0,2|1,1,0]=4 9303 B14R1.520 CCCC(=O)CSCC1CCCCO1 62a_100000211543_100000747444 [0,0,0,0,0,2|0,1,0]=3 9304 B14R1.520 CCCC(=O)CSCC1CCCCO1 62a_100000747444_100000211543 [0,0,0,0,0,2|0,1,0]=3 9305 B14R1.520 CCCC(=O)CSCC1CCCOC1 62a_100000741521_100000747444 [0,0,0,0,0,2|0,1,0]=3 9306 B14R1.520 CCCC(=O)CSCC1CCCOC1 62a_100000747444_100000741521 [0,0,0,0,0,2|0,1,0]=3 9307 B14R1.520 CCCC(=O)CSCC1CCOCC1 62a_100000747444_100000749018 [0,0,0,0,0,2|1,1,0]=4 9308 B14R1.520 CCCC(=O)CSCC1CCOCC1 62a_100000754603_100000747444 [0,0,0,0,0,2|1,1,0]=4 9309 B14R1.520 CCCC(=O)NCCC1CCCCC1 11a_100000738074_100000211992 [0,0,0,0,0,2|2,0,0]=4 9310 B14R1.520 CCCC(=O)NCCC1CCCCC1 1626a_100000738074_100000211992 [0,0,0,0,0,2|2,0,0]=4 9311 B14R1.520 CCCC(=O)NCCC1CCCCC1 240690a_100000738074_100000211992 [0,0,0,0,0,2|2,0,0]=4 9312 B14R1.520 CCCC(=O)NCCC1CCCCC1 527a_100000738074_100000211992 [0,0,0,0,0,2|2,0,0]=4 9313 B14R1.520 CCCC(=O)NCCC1CCCCO1 11a_100015183643_100000211992 [0,0,0,0,0,2|1,0,0]=3 9314 B14R1.520 CCCC(=O)NCCC1CCCCO1 1626a_100015183643_100000211992 [0,0,0,0,0,2|1,0,0]=3 9315 B14R1.520 CCCC(=O)NCCC1CCCCO1 240690a_100015183643_100000211992 [0,0,0,0,0,2|1,0,0]=3 9316 B14R1.520 CCCC(=O)NCCC1CCCCO1 527a_100015183643_100000211992 [0,0,0,0,0,2|1,0,0]=3 9317 B14R1.520 CCCC(=O)NCCC1CCOCC1 11a_100000755988_100000211992 [0,0,0,0,0,2|2,0,0]=4 9318 B14R1.520 CCCC(=O)NCCC1CCOCC1 1626a_100000755988_100000211992 [0,0,0,0,0,2|2,0,0]=4 9319 B14R1.520 CCCC(=O)NCCC1CCOCC1 240690a_100000755988_100000211992 [0,0,0,0,0,2|2,0,0]=4 9320 B14R1.520 CCCC(=O)NCCC1CCOCC1 527a_100000755988_100000211992 [0,0,0,0,0,2|2,0,0]=4 9321 B14R1.520 CCCC(=O)NN=CC1CCCOC1 4a_100000189770_100000753300 [0,0,0,0,0,2|1,0,1]=4 9322 B14R1.520 CCCC(=O)NNCC1CCCCC1 22a_100000740227_100000211992 [0,0,0,0,0,2|2,0,0]=4 9323 B14R1.520 CCCC(=O)NNCC1CCOCC1 22a_200000757053_100000211992 [0,0,0,0,0,2|2,0,0]=4 9324 B14R1.520 CCCC(=O)OCNC1CCCCC1 2230a_100000182618_100000034017 [0,0,0,0,0,2|1,0,0]=3 9325 B14R1.520 CCCC(=O)OCNC1CCCCC1 34a_100000182618_100000034017 [0,0,0,0,0,2|1,0,0]=3 9326 B14R1.520 CCCC(=O)OCNC1CCCOC1 2230a_100000719290_100000034017 [0,0,0,0,0,2|0,0,0]=2 9327 B14R1.520 CCCC(=O)OCNC1CCCOC1 34a_100000719290_100000034017 [0,0,0,0,0,2|0,0,0]=2 9328 B14R1.520 CCCC(=O)OCNC1CCOCC1 2230a_100000741149_100000034017 [0,0,0,0,0,2|1,0,0]=3 9329 B14R1.520 CCCC(=O)OCNC1CCOCC1 34a_100000741149_100000034017 [0,0,0,0,0,2|1,0,0]=3 9330 B14R1.520 CCCC(=O)OCNC1CCSCC1 2230a_100000748639_100000034017 [0,0,0,0,0,2|1,0,0]=3 9331 B14R1.520 CCCC(=O)OCNC1CCSCC1 34a_100000748639_100000034017 [0,0,0,0,0,2|1,0,0]=3 9332 B14R1.520 CCCC(=O)OCOC1C=CCCC1 34a_100011215024_100000034017 [0,0,0,0,0,2|1,0,0]=3 9333 B14R1.520 CCCC(=O)OCOC1CC=CCC1 34a_100000073881_100000034017 [0,0,0,0,0,2|1,0,1]=4 9334 B14R1.520 CCCC(=O)OCOC1CCCCC1 34a_100000210231_100000034017 [0,0,0,0,0,2|1,0,0]=3 9335 B14R1.520 CCCC(=O)OCOC1CCCCO1 34a_100000033831_100000034017 [0,0,0,0,0,2|0,0,0]=2 9336 B14R1.520 CCCC(=O)OCOC1CCCOC1 34a_100000754041_100000034017 [0,0,0,0,0,2|0,0,0]=2 9337 B14R1.520 CCCC(=O)OCOC1CCOCC1 34a_100000744328_100000034017 [0,0,0,0,0,2|1,0,0]=3 9338 B14R1.520 CCCC(=O)OCOC1CCSCC1 34a_100000731022_100000034017 [0,0,0,0,0,2|1,0,0]=3 9339 B14R1.520 CCCC(=O)OCSC1C=CCCC1 62a_100000751183_100000034017 [0,0,0,0,0,2|1,0,0]=3 9340 B14R1.520 CCCC(=O)OCSC1CCCCC1 62a_100000210327_100000034017 [0,0,0,0,0,2|1,0,0]=3 9341 B14R1.520 CCCC(C)COCC1CCCCO1 34a_100000211370_100011216630 [0,0,0,0,0,2|1,0,1]=4 9342 B14R1.520 CCCC(C)COCC1CCCCO1 34a_100000688023_100000211543 [0,0,0,0,0,2|1,0,1]=4 9343 B14R1.520 CCCC(C)COCC1CCCCO1 7a_100000211370_100011216630 [0,0,0,0,0,2|1,0,1]=4 9344 B14R1.520 CCCC(C)COCC1CCCCO1 7a_100000688023_100000211543 [0,0,0,0,0,2|1,0,1]=4 9345 B14R1.520 CCCC(C)COCC1CCCOC1 34a_100000688023_100000741521 [0,0,0,0,0,2|1,0,1]=4 9346 B14R1.520 CCCC(C)COCC1CCCOC1 34a_100000741520_100011216630 [0,0,0,0,0,2|1,0,1]=4 9347 B14R1.520 CCCC(C)COCC1CCCOC1 7a_100000688023_100000741521 [0,0,0,0,0,2|1,0,1]=4 9348 B14R1.520 CCCC(C)COC[C@@H]1CNCCO1 34a_100015189573_100011216630 [0,0,0,0,0,2|1,0,1]=4 9349 B14R1.520 CCCC(C)COC[C@H]1COCCO1 34a_100009875890_100011216630 [0,0,0,0,0,2|1,0,1]=4 9350 B14R1.520 CCCC(C)OCCC1OCCCO1 34a_100000764384_100000764188 [0,0,0,0,0,2|1,0,1]=4 9351 B14R1.520 CCCC(C)OCCC1OCCCO1 7a_100000764384_100000764188 [0,0,0,0,0,2|1,0,1]=4 9352 B14R1.520 CCC[C@H](N)COCC1CCCCO1 34a_100000732646_100000211543 [0,0,0,0,0,2|1,0,1]=4 9353 B14R1.520 CCC[C@H](N)COCC1CCCOC1 34a_100000732646_100000741521 [0,0,0,0,0,2|1,0,1]=4 9354 B14R1.520 CCNC(=O)CCNC1CCCOC1 2230a_100000719290_100000737597 [0,0,0,0,0,2|2,0,0]=4 9355 B14R1.520 CCNC(=O)CCNC1CCCOC1 270004a_100025743525_100000753404 [0,0,0,0,0,2|2,0,0]=4 9356 B14R1.520 CCNC(=O)CCNC1CCCOC1 34a_100025743525_100000693364 [0,0,0,0,0,2|2,0,0]=4 9357 B14R1.520 CCNC(=O)CCSC1CCCOC1 62a_100000737597_100000693364 [0,0,0,0,0,2|2,0,0]=4 9358 B14R1.520 CCNC(=O)CNCC1CCCCO1 2230a_100000174945_100000183381 [0,0,0,0,0,2|2,0,0]=4 9359 B14R1.520 CCNC(=O)CNCC1CCCCO1 2230a_100016988866_100000211543 [0,0,0,0,0,2|2,0,0]=4 9360 B14R1.520 CCNC(=O)CNCC1CCCCO1 34a_100000174945_100000183381 [0,0,0,0,0,2|2,0,0]=4 9361 B14R1.520 CCNC(=O)CNCC1CCCOC1 2230a_100000720124_100000183381 [0,0,0,0,0,2|2,0,0]=4 9362 B14R1.520 CCNC(=O)CNCC1CCCOC1 2230a_100016988866_100000741521 [0,0,0,0,0,2|2,0,0]=4 9363 B14R1.520 CCNC(=O)CNCC1CCCOC1 34a_100000720124_100000183381 [0,0,0,0,0,2|2,0,0]=4 9364 B14R1.520 CCNC(=O)CNC[C@H]1COCCO1 2230a_100010981119_100000183381 [0,0,0,0,0,2|2,0,0]=4 9365 B14R1.520 CCNC(=O)CNC[C@H]1COCCO1 34a_100010981119_100000183381 [0,0,0,0,0,2|2,0,0]=4 9366 B14R1.520 CCNC(=O)COCC1CCC=CO1 34a_100011217868_100000183381 [0,0,0,0,0,2|1,0,1]=4 9367 B14R1.520 CCNC(=O)COCC1CCCCC1 34a_100000212181_100000183381 [0,0,0,0,0,2|2,0,0]=4 9368 B14R1.520 CCNC(=O)COCC1CCCCC1 7a_100000212181_100000183381 [0,0,0,0,0,2|2,0,0]=4 9369 B14R1.520 CCNC(=O)COCC1CCCCN1 34a_100000210821_100000183381 [0,0,0,0,0,2|2,0,0]=4 9370 B14R1.520 CCNC(=O)COCC1CCCCO1 11a_100015525214_100011223378 [0,0,0,0,0,2|1,0,0]=3 9371 B14R1.520 CCNC(=O)COCC1CCCCO1 240690a_100015525214_100011223378 [0,0,0,0,0,2|1,0,0]=3 9372 B14R1.520 CCNC(=O)COCC1CCCCO1 34a_100000211370_100000183381 [0,0,0,0,0,2|1,0,0]=3 9373 B14R1.520 CCNC(=O)COCC1CCCCO1 527a_100015525214_100011223378 [0,0,0,0,0,2|1,0,0]=3 9374 B14R1.520 CCNC(=O)COCC1CCCCO1 7a_100000211370_100000183381 [0,0,0,0,0,2|1,0,0]=3 9375 B14R1.520 CCNC(=O)COCC1CCCNC1 34a_100000211344_100000183381 [0,0,0,0,0,2|2,0,0]=4 9376 B14R1.520 CCNC(=O)COCC1CCCOC1 34a_100000741520_100000183381 [0,0,0,0,0,2|1,0,0]=3 9377 B14R1.520 CCNC(=O)COCC1CCNCC1 34a_100000738675_100000183381 [0,0,0,0,0,2|2,0,0]=4 9378 B14R1.520 CCNC(=O)COCC1CCOCC1 34a_100000749013_100000183381 [0,0,0,0,0,2|2,0,0]=4 9379 B14R1.520 CCNC(=O)COCC1CCSCC1 34a_100000070558_100000183381 [0,0,0,0,0,2|2,0,0]=4 9380 B14R1.520 CCNC(=O)COCC1CCSCC1 7a_100000070558_100000183381 [0,0,0,0,0,2|2,0,0]=4 9381 B14R1.520 CCNC(=O)COC[C@@H]1CNCCO1 34a_100015189573_100000183381 [0,0,0,0,0,2|1,0,0]=3 9382 B14R1.520 CCNC(=O)COC[C@@H]1COCCN1 34a_100000717676_100000183381 [0,0,0,0,0,2|2,0,0]=4 9383 B14R1.520 CCNC(=O)COC[C@H]1COCCO1 34a_100009875890_100000183381 [0,0,0,0,0,2|1,0,0]=3 9384 B14R1.520 CCNC(=O)CSCC1CCCCO1 62a_100000183381_100000211543 [0,0,0,0,0,2|1,1,0]=4 9385 B14R1.520 CCNC(=O)CSCC1CCCCO1 62a_100000211543_100000183381 [0,0,0,0,0,2|1,1,0]=4 9386 B14R1.520 CCNC(=O)CSCC1CCCOC1 62a_100000183381_100000741521 [0,0,0,0,0,2|1,1,0]=4 9387 B14R1.520 CCNC(=O)CSCC1CCCOC1 62a_100000741521_100000183381 [0,0,0,0,0,2|1,1,0]=4 9388 B14R1.520 CCNC(=O)NCCC1CCCCO1 2708a_100015183643_100015525214 [0,0,0,0,0,2|2,0,0]=4 9389 B14R1.520 CCNC(=O)NCCC1CCCCO1 2708a_100015525214_100015183643 [0,0,0,0,0,2|2,0,0]=4 9390 B14R1.520 CCNC(=O)NCCC1CCCCO1 273464a_100015183643_100015525214 [0,0,0,0,0,2|2,0,0]=4 9391 B14R1.520 CCNC(=O)NCCC1CCCCO1 273464a_100015525214_100015183643 [0,0,0,0,0,2|2,0,0]=4 9392 B14R1.520 CCNC(=O)NCCC1CCCCO1 512a_100015183643_100015525214 [0,0,0,0,0,2|2,0,0]=4 9393 B14R1.520 CCNC(=O)NCCC1CCCCO1 512a_100015525214_100015183643 [0,0,0,0,0,2|2,0,0]=4 9394 B14R1.520 CCOC(=O)CCNC1CCCOC1 2230a_100000719290_100011206558 [0,0,0,0,0,2|2,0,0]=4 9395 B14R1.520 CCOC(=O)CCNC1CCCOC1 34a_100000719290_100000765890 [0,0,0,0,0,2|2,0,0]=4 9396 B14R1.520 CCOC(=O)CCOC1CCCCO1 34a_100000033831_100000765890 [0,0,0,0,0,2|2,0,0]=4 9397 B14R1.520 CCOC(=O)CCOC1CCCOC1 34a_100000754041_100000765890 [0,0,0,0,0,2|2,0,0]=4 9398 B14R1.520 CCOC(=O)CCSC1CCCOC1 62a_100000765890_100000693364 [0,0,0,0,0,2|2,0,0]=4 9399 B14R1.520 CCOC(=O)CNCC1CCCCO1 2230a_100000174945_100000188475 [0,0,0,0,0,2|2,0,0]=4 9400 B14R1.520 CCOC(=O)CNCC1CCCCO1 34a_100000174945_100000188475 [0,0,0,0,0,2|2,0,0]=4 9401 B14R1.520 CCOC(=O)CNCC1CCCOC1 2230a_100000720124_100000188475 [0,0,0,0,0,2|2,0,0]=4 9402 B14R1.520 CCOC(=O)CNCC1CCCOC1 34a_100000720124_100000188475 [0,0,0,0,0,2|2,0,0]=4 9403 B14R1.520 CCOC(=O)CNC[C@H]1COCCO1 2230a_100010981119_100000188475 [0,0,0,0,0,2|2,0,0]=4 9404 B14R1.520 CCOC(=O)CNC[C@H]1COCCO1 34a_100010981119_100000188475 [0,0,0,0,0,2|2,0,0]=4 9405 B14R1.520 CCOC(=O)COCC1CCC=CO1 34a_100011217868_100000188475 [0,0,0,0,0,2|1,0,1]=4 9406 B14R1.520 CCOC(=O)COCC1CCCCC1 34a_100000212181_100000188475 [0,0,0,0,0,2|2,0,0]=4 9407 B14R1.520 CCOC(=O)COCC1CCCCC1 7a_100000212181_100000188475 [0,0,0,0,0,2|2,0,0]=4 9408 B14R1.520 CCOC(=O)COCC1CCCCN1 34a_100000210821_100000188475 [0,0,0,0,0,2|2,0,0]=4 9409 B14R1.520 CCOC(=O)COCC1CCCCO1 34a_100000211370_100000188475 [0,0,0,0,0,2|1,0,0]=3 9410 B14R1.520 CCOC(=O)COCC1CCCCO1 7a_100000211370_100000188475 [0,0,0,0,0,2|1,0,0]=3 9411 B14R1.520 CCOC(=O)COCC1CCCNC1 34a_100000211344_100000188475 [0,0,0,0,0,2|2,0,0]=4 9412 B14R1.520 CCOC(=O)COCC1CCCOC1 34a_100000741520_100000188475 [0,0,0,0,0,2|1,0,0]=3 9413 B14R1.520 CCOC(=O)COCC1CCNCC1 34a_100000738675_100000188475 [0,0,0,0,0,2|2,0,0]=4 9414 B14R1.520 CCOC(=O)COCC1CCOCC1 34a_100000749013_100000188475 [0,0,0,0,0,2|2,0,0]=4 9415 B14R1.520 CCOC(=O)COCC1CCSCC1 34a_100000070558_100000188475 [0,0,0,0,0,2|2,0,0]=4 9416 B14R1.520 CCOC(=O)COCC1CCSCC1 7a_100000070558_100000188475 [0,0,0,0,0,2|2,0,0]=4 9417 B14R1.520 CCOC(=O)COC[C@@H]1CNCCO1 34a_100015189573_100000188475 [0,0,0,0,0,2|1,0,0]=3 9418 B14R1.520 CCOC(=O)COC[C@@H]1COCCN1 34a_100000717676_100000188475 [0,0,0,0,0,2|2,0,0]=4 9419 B14R1.520 CCOC(=O)COC[C@H]1COCCO1 34a_100009875890_100000188475 [0,0,0,0,0,2|1,0,0]=3 9420 B14R1.520 CCOC(=O)CSCC1CCCCO1 62a_100000188475_100000211543 [0,0,0,0,0,2|1,1,0]=4 9421 B14R1.520 CCOC(=O)CSCC1CCCCO1 62a_100000211543_100000188475 [0,0,0,0,0,2|1,1,0]=4 9422 B14R1.520 CCOC(=O)CSCC1CCCOC1 62a_100000188475_100000741521 [0,0,0,0,0,2|1,1,0]=4 9423 B14R1.520 CCOC(=O)CSCC1CCCOC1 62a_100000741521_100000188475 [0,0,0,0,0,2|1,1,0]=4 9424 B14R1.520 CCOC(=O)OCSC1C=CCCC1 62a_100000751183_100000075025 [0,0,0,0,0,2|2,0,0]=4 9425 B14R1.520 CCOC(=O)OCSC1CCCCC1 62a_100000210327_100000075025 [0,0,0,0,0,2|2,0,0]=4 9426 B14R1.520 CNNC(=O)COCC1CCCCO1 22a_100016993582_100011223378 [0,0,0,0,0,2|2,0,0]=4 9427 B14R1.520 COCC(=O)CCOC1CCCCO1 1458a_100000210968_100000744793 [0,0,0,0,0,2|2,0,0]=4 9428 B14R1.520 COCC(=O)NCCC1CCCCO1 11a_100015183643_100000210968 [0,0,0,0,0,2|2,0,0]=4 9429 B14R1.520 COCC(=O)NCCC1CCCCO1 1626a_100015183643_100000210968 [0,0,0,0,0,2|2,0,0]=4 9430 B14R1.520 COCC(=O)NCCC1CCCCO1 240690a_100015183643_100000210968 [0,0,0,0,0,2|2,0,0]=4 9431 B14R1.520 COCC(=O)NCCC1CCCCO1 527a_100015183643_100000210968 [0,0,0,0,0,2|2,0,0]=4 9432 B14R1.520 CSCC(=O)CCOC1CCCCO1 1458a_100000184570_100000744793 [0,0,0,0,0,2|2,0,0]=4 9433 B14R1.520 CSCC(=O)NCCC1CCCCO1 11a_100015183643_100000184570 [0,0,0,0,0,2|2,0,0]=4 9434 B14R1.520 CSCC(=O)NCCC1CCCCO1 1626a_100015183643_100000184570 [0,0,0,0,0,2|2,0,0]=4 9435 B14R1.520 CSCC(=O)NCCC1CCCCO1 240690a_100015183643_100000184570 [0,0,0,0,0,2|2,0,0]=4 9436 B14R1.520 CSCC(=O)NCCC1CCCCO1 527a_100015183643_100000184570 [0,0,0,0,0,2|2,0,0]=4 9437 B14R1.520 N#CCC(=O)COCC1CCCCO1 1458a_100011223378_100011214920 [0,0,0,0,0,2|1,0,1]=4 9438 B14R1.520 O=C(CCF)COCC1CCCCO1 1458a_100011223378_100011217306 [0,0,0,0,0,2|1,0,0]=3 9439 B14R1.520 O=C(CCO)CCOC1CCCCO1 1458a_100011216618_100000744793 [0,0,0,0,0,2|2,0,0]=4 9440 B14R1.520 O=C(CCO)COCC1CCCCO1 1458a_100011223378_100000211926 [0,0,0,0,0,2|1,0,0]=3 9441 B14R1.520 O=C(CCO)NCCC1CCCCO1 240690a_100015183643_100011216618 [0,0,0,0,0,2|2,0,0]=4 9442 B14R1.520 O=C(COCC1CCCCO1)NCO 34a_100000211370_100000185155 [0,0,0,0,0,2|2,0,0]=4 9443 B14R1.520 O=C(COCC1CCCCO1)NCO 7a_100000211370_100000185155 [0,0,0,0,0,2|2,0,0]=4 9444 B14R1.520 O=C(COCC1CCCOC1)NCO 34a_100000741520_100000185155 [0,0,0,0,0,2|2,0,0]=4 9445 B14R1.520 O=C(COC[C@@H]1CNCCO1)NCO 34a_100015189573_100000185155 [0,0,0,0,0,2|2,0,0]=4 9446 B14R1.520 O=C(COC[C@H]1COCCO1)NCO 34a_100009875890_100000185155 [0,0,0,0,0,2|2,0,0]=4 9447 B14R1.7146 CCCC(=O)NCC1CCCCCC1 11a_100015204231_100000211992 [0,0,0,0,0,2|2,0,0]=4 9448 B14R1.7146 CCCC(=O)NCC1CCCCCC1 1626a_100015204231_100000211992 [0,0,0,0,0,2|2,0,0]=4 9449 B14R1.7146 CCCC(=O)NCC1CCCCCC1 240690a_100015204231_100000211992 [0,0,0,0,0,2|2,0,0]=4 9450 B14R1.7146 CCCC(=O)NCC1CCCCCC1 527a_100015204231_100000211992 [0,0,0,0,0,2|2,0,0]=4 9451 B14R1.7146 CCCC(=O)OCN1CCCCCC1 2230a_100000185865_100000034017 [0,0,0,0,0,2|2,0,0]=4 9452 B14R1.7146 CCCC(=O)OCN1CCCCCC1 269982a_100000185865_100000034017 [0,0,0,0,0,2|2,0,0]=4 9453 B14R1.7146 CCCC(=O)OCN1CCCCCC1 34a_100000185865_100000034017 [0,0,0,0,0,2|2,0,0]=4 9454 B14R1.7146 CCCC(=O)OCN1CCCOCC1 2230a_100000685342_100000034017 [0,0,0,0,0,2|1,0,0]=3 9455 B14R1.7146 CCCC(=O)OCN1CCCOCC1 269982a_100000685342_100000034017 [0,0,0,0,0,2|1,0,0]=3 9456 B14R1.7146 CCCC(=O)OCN1CCCOCC1 34a_100000685342_100000034017 [0,0,0,0,0,2|1,0,0]=3 9457 B14R1.7146 CCCC(C)OCC1CNCCOC1 34a_100103147999_100000766640 [0,0,0,0,0,2|1,0,1]=4 9458 B14R1.609 CCCC(=O)CCCCC1OCCO1 1458a_100000211992_100000034956 [0,0,0,0,0,2|2,0,0]=4 9459 B14R1.609 CCCC(=O)CNCCC1CCCC1 2230a_100000739158_100000747444 [0,0,0,0,0,2|2,0,0]=4 9460 B14R1.609 CCCC(=O)CNCCC1OCCO1 2230a_100000034215_100000747444 [0,0,0,0,0,2|2,0,0]=4 9461 B14R1.609 CCCC(=O)COCCC1CCCC1 7a_100000749090_100000747444 [0,0,0,0,0,2|1,0,0]=3 9462 B14R1.609 CCCC(=O)CSCCC1CCCC1 62a_100000747444_100000760354 [0,0,0,0,0,2|1,1,0]=4 9463 B14R1.609 CCCC(=O)CSCCC1CCCC1 62a_100000760354_100000747444 [0,0,0,0,0,2|1,1,0]=4 9464 B14R1.609 CCCC(=O)CSCCC1OCCO1 62a_100000747444_100000740749 [0,0,0,0,0,2|1,1,0]=4 9465 B14R1.609 CCCC(=O)NCCCC1CCCC1 11a_100000736752_100000211992 [0,0,0,0,0,2|2,0,0]=4 9466 B14R1.609 CCCC(=O)NCCCC1CCCC1 1626a_100000736752_100000211992 [0,0,0,0,0,2|2,0,0]=4 9467 B14R1.609 CCCC(=O)NCCCC1CCCC1 240690a_100000736752_100000211992 [0,0,0,0,0,2|2,0,0]=4 9468 B14R1.609 CCCC(=O)NCCCC1CCCC1 527a_100000736752_100000211992 [0,0,0,0,0,2|2,0,0]=4 9469 B14R1.609 CCCC(=O)NCCOC1CCCC1 11a_100000741755_100000211992 [0,0,0,0,0,2|2,0,0]=4 9470 B14R1.609 CCCC(=O)NCCOC1CCCC1 1626a_100000741755_100000211992 [0,0,0,0,0,2|2,0,0]=4 9471 B14R1.609 CCCC(=O)NCCOC1CCCC1 240690a_100000741755_100000211992 [0,0,0,0,0,2|2,0,0]=4 9472 B14R1.609 CCCC(=O)NCCOC1CCCC1 527a_100000741755_100000211992 [0,0,0,0,0,2|2,0,0]=4 9473 B14R1.609 CCCC(=O)OCNCC1CCCC1 2230a_100000737975_100000034017 [0,0,0,0,0,2|1,0,0]=3 9474 B14R1.609 CCCC(=O)OCNCC1CCCC1 34a_100000737975_100000034017 [0,0,0,0,0,2|1,0,0]=3 9475 B14R1.609 CCCC(=O)OCNCC1CCOC1 2230a_100000737293_100000034017 [0,0,0,0,0,2|2,0,0]=4 9476 B14R1.609 CCCC(=O)OCNCC1CCOC1 34a_100000737293_100000034017 [0,0,0,0,0,2|2,0,0]=4 9477 B14R1.609 CCCC(=O)OCNCC1OCCO1 2230a_100000036311_100000034017 [0,0,0,0,0,2|1,0,0]=3 9478 B14R1.609 CCCC(=O)OCNCC1OCCO1 34a_100000036311_100000034017 [0,0,0,0,0,2|1,0,0]=3 9479 B14R1.609 CCCC(=O)OCNC[C@@H]1CCCO1 2230a_100020590478_100000034017 [0,0,0,0,0,2|0,0,0]=2 9480 B14R1.609 CCCC(=O)OCNC[C@@H]1CCCO1 34a_100020590478_100000034017 [0,0,0,0,0,2|0,0,0]=2 9481 B14R1.609 CCCC(=O)OCOCC1CCCC1 34a_100000742336_100000034017 [0,0,0,0,0,2|1,0,0]=3 9482 B14R1.609 CCCC(=O)OCOCC1CCCO1 34a_100000210270_100000034017 [0,0,0,0,0,2|0,0,0]=2 9483 B14R1.609 CCCC(=O)OCOCC1CCNC1 34a_100000748654_100000034017 [0,0,0,0,0,2|2,0,0]=4 9484 B14R1.609 CCCC(=O)OCOCC1CCOC1 34a_100000740260_100000034017 [0,0,0,0,0,2|2,0,0]=4 9485 B14R1.609 CCCC(=O)OCOCC1COCO1 34a_100011216627_100000034017 [0,0,0,0,0,2|1,0,0]=3 9486 B14R1.609 CCCC(=O)OCOCC1OCCO1 34a_100000087154_100000034017 [0,0,0,0,0,2|1,0,0]=3 9487 B14R1.609 CCCC(=O)OCOC[C@H]1CCCN1 34a_100000745186_100000034017 [0,0,0,0,0,2|1,0,0]=3 9488 B14R1.609 CCCC(=O)OCSCC1CCCC1 62a_100000740388_100000034017 [0,0,0,0,0,2|1,0,0]=3 9489 B14R1.609 CCCC(=O)OCSCC1CCCO1 62a_100000203698_100000034017 [0,0,0,0,0,2|0,0,0]=2 9490 B14R1.609 CCCC(=O)OCSCC1CCOC1 62a_100000702531_100000034017 [0,0,0,0,0,2|2,0,0]=4 9491 B14R1.609 CCCC(=O)OCSCC1OCCO1 62a_100000755774_100000034017 [0,0,0,0,0,2|1,0,0]=3 9492 B14R1.609 CCCC(C)CCOCC1CCCO1 7a_100011217855_100000203698 [0,0,0,0,0,2|1,0,1]=4 9493 B14R1.609 CCNC(=O)CCNC[C@@H]1CCCO1 2230a_100020590478_100000737597 [0,0,0,0,0,2|2,0,0]=4 9494 B14R1.609 CCNC(=O)CCOCC1CCCC1 7a_100000742336_100000737597 [0,0,0,0,0,2|2,0,0]=4 9495 B14R1.609 CCNC(=O)CCOCC1CCCO1 7a_100000210270_100000737597 [0,0,0,0,0,2|1,0,0]=3 9496 B14R1.609 CCNC(=O)CCSCC1CCCO1 62a_100000203698_100000737597 [0,0,0,0,0,2|1,1,0]=4 9497 B14R1.609 CCNC(=O)CCSCC1CCCO1 62a_100000737597_100000203698 [0,0,0,0,0,2|1,1,0]=4 9498 B14R1.609 CCNC(=O)COCCC1CCCC1 34a_100000749090_100000183381 [0,0,0,0,0,2|2,0,0]=4 9499 B14R1.609 CCNC(=O)COCCC1CCCC1 7a_100000749090_100000183381 [0,0,0,0,0,2|2,0,0]=4 9500 B14R1.609 CCOC(=O)/C=C/COC1CCCO1 34a_100000085407_100016267167 [0,0,0,0,0,2|2,0,0]=4 9501 B14R1.609 CCOC(=O)CCCOC1CCCO1 34a_100000085407_100009991533 [0,0,0,0,0,2|2,0,0]=4 9502 B14R1.609 CCOC(=O)CCNC[C@@H]1CCCO1 2230a_100020590478_100011206558 [0,0,0,0,0,2|2,0,0]=4 9503 B14R1.609 CCOC(=O)CCNC[C@@H]1CCCO1 34a_100020590478_100000765890 [0,0,0,0,0,2|2,0,0]=4 9504 B14R1.609 CCOC(=O)CCOCC1CCCC1 34a_100000742336_100000765890 [0,0,0,0,0,2|2,0,0]=4 9505 B14R1.609 CCOC(=O)CCOCC1CCCC1 7a_100000742336_100011206558 [0,0,0,0,0,2|2,0,0]=4 9506 B14R1.609 CCOC(=O)CCOCC1CCCO1 34a_100000210270_100000765890 [0,0,0,0,0,2|1,0,0]=3 9507 B14R1.609 CCOC(=O)CCOCC1CCCO1 7a_100000210270_100011206558 [0,0,0,0,0,2|1,0,0]=3 9508 B14R1.609 CCOC(=O)CCOCC1COCO1 34a_100011216627_100000765890 [0,0,0,0,0,2|2,0,0]=4 9509 B14R1.609 CCOC(=O)CCOCC1OCCO1 34a_100000087154_100000765890 [0,0,0,0,0,2|2,0,0]=4 9510 B14R1.609 CCOC(=O)CCOC[C@H]1CCCN1 34a_100000745186_100000765890 [0,0,0,0,0,2|2,0,0]=4 9511 B14R1.609 CCOC(=O)CCSCC1CCCO1 62a_100000203698_100000765890 [0,0,0,0,0,2|1,1,0]=4 9512 B14R1.609 CCOC(=O)CCSCC1CCCO1 62a_100000765890_100000203698 [0,0,0,0,0,2|1,1,0]=4 9513 B14R1.609 CCOC(=O)COCCC1CCCC1 34a_100000749090_100000188475 [0,0,0,0,0,2|2,0,0]=4 9514 B14R1.609 CCOC(=O)COCCC1CCCC1 7a_100000749090_100000188475 [0,0,0,0,0,2|2,0,0]=4 9515 B14R1.609 CCOC(=O)OCSCC1CCCC1 62a_100000740388_100000075025 [0,0,0,0,0,2|2,0,0]=4 9516 B14R1.609 CCOC(=O)OCSCC1CCCO1 62a_100000203698_100000075025 [0,0,0,0,0,2|1,0,0]=3 9517 B14R1.609 CCOC(=O)OCSCC1OCCO1 62a_100000755774_100000075025 [0,0,0,0,0,2|2,0,0]=4