0 B15R2.4058 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)C 269862a_100000210545_200016156988 [1,0,1,0,0,0|1,0,0]=3 1 B15R2.4058 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)O 269862a_200000755665_200016156988 [1,0,1,0,0,0|2,0,0]=4 2 B15R2.4058 C=C1C([C@H]2CC[C@@H]1C2)NCCN(C)C 269862a_100000210585_200016156988 [1,0,1,0,0,0|2,0,0]=4 3 B15R2.4058 CC(C)CCSC1C(=O)[C@H]2CC[C@@H]1C2 62a_100000210312_200015607011 [1,0,1,0,0,0|2,0,0]=4 4 B15R2.4058 CC(C)CCSC1C(=O)[C@H]2CC[C@@H]1C2 62a_200015607011_100000210312 [1,0,1,0,0,0|2,0,0]=4 5 B15R1.513 CC(C)CCCC(C)N(C)C1CCCC1 270004a_100000207505_100000753411 [0,0,2,0,0,0|1,0,1]=4 6 B15R1.1347 CCC(C)C(=O)C1CCCN1CC(C)C 1458a_100000737922_100000758301 [0,0,2,0,0,0|2,0,0]=4 7 B15R1.1347 CCC(C)C(=O)N1CCCC1CC(C)C 11a_100000748429_100011192722 [0,0,2,0,0,0|2,0,0]=4 8 B15R1.1347 CCC(C)C(=O)N1CCCC1CC(C)C 1626a_100000748429_100011192722 [0,0,2,0,0,0|2,0,0]=4 9 B15R1.1347 CCC(C)C(=O)N1CCCC1CC(C)C 240690a_100000748429_100011192722 [0,0,2,0,0,0|2,0,0]=4 10 B15R1.1347 CCC(C)C(=O)N1CCCC1CC(C)C 527a_100000748429_100011192722 [0,0,2,0,0,0|2,0,0]=4 11 B14R1.107 CCCCCC(C)C(=O)C1CCCC1 1458a_100000210718_200011218191 [1,0,2,0,0,0|1,0,0]=4 12 B14R1.107 CCCCCC(C)C(=O)C1CCCC1 1458a_100011215998_100000179811 [1,0,2,0,0,0|1,0,0]=4 13 B14R1.418 CC(C)CCCCC(=O)C1CCCC1 1458a_100000210718_100011216152 [1,0,2,0,0,0|1,0,0]=4 14 B14R1.418 CC(C)CCCCC(=O)C1CCCC1 1458a_100011933920_100000179811 [1,0,2,0,0,0|1,0,0]=4 15 B14R1.810 CC(C)CCCC(C)NC1CCCC1 2230a_100000210607_100000179811 [1,0,2,0,0,0|1,0,0]=4 16 B14R1.810 CC(C)CCCC(C)NC1CCCC1 270004a_100000210607_100000210133 [1,0,2,0,0,0|1,0,0]=4 17 B14R1.810 CC(C)CCCC(C)NC1CCCC1 270004a_100000211070_100000753411 [1,0,2,0,0,0|1,0,0]=4 18 B14R1.810 CC(C)CCCC(C)OC1CCCC1 34a_200011218570_100000179811 [1,0,2,0,0,0|1,0,0]=4 19 B14R1.810 CC(C)CCCC(C)OC1CCCC1 7a_200011218570_100000179811 [1,0,2,0,0,0|1,0,0]=4 20 B14R1.3109 C=CCCCN(C(C)C)C1CCCC1 2230a_100000736669_100011713584 [1,0,2,0,0,0|1,0,0]=4 21 B14R1.3109 C=CCCCN(C(C)C)C1CCCC1 269982a_100000736669_100000757094 [1,0,2,0,0,0|1,0,0]=4 22 B14R1.3109 C=CCCCN(C(C)C)C1CCCC1 34a_100000736669_100000757094 [1,0,2,0,0,0|1,0,0]=4 23 B14R1.885 C=CCCCN1CC(CCC1C)CC 2230a_100011219223_100011713584 [1,0,2,0,0,0|1,0,0]=4 24 B14R1.885 C=CCCCN1CC(CCC1C)CC 269982a_100011219223_100000757094 [1,0,2,0,0,0|1,0,0]=4 25 B14R1.885 C=CCCCN1CC(CCC1C)CC 34a_100011219223_100000757094 [1,0,2,0,0,0|1,0,0]=4 26 B14R1.610 CCCC(=O)[C@H]1CC[C@@H](CC1)C(C)C 1458a_100009816688_100000210303 [1,0,2,0,0,0|1,0,0]=4 27 B14R2.9631 C=C1C([C@H]2CC[C@@H]1C2)NCCCC 269862a_100000102301_200016156988 [2,0,1,0,0,0|1,0,0]=4 28 B16R2.5919 C=C1C([C@H]2CC[C@@H]1C2)NCC(O)C(C)C 269862a_100000759067_200016156988 [1,1,1,0,0,0|1,0,0]=4 29 B16R2.5929 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)(C)C 269862a_100000738805_200016156988 [1,1,1,0,0,0|1,0,0]=4 30 B16R2.5929 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)(C)F 269862a_100016253952_200016156988 [1,1,1,0,0,0|1,0,0]=4 31 B16R2.5929 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)(C)O 269862a_100000707701_200016156988 [1,1,1,0,0,0|1,0,0]=4 32 B16R2.5931 C=C1C([C@H]2CC[C@@H]1C2)NC(C)CC(C)C 269862a_100000692259_200016156988 [1,1,1,0,0,0|1,0,0]=4 33 B16R2.35308 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)CC 269862a_100020591266_200016156988 [1,1,1,0,0,0|1,0,0]=4 34 B16R2.35308 C=C1C([C@H]2CC[C@@H]1C2)NCCC(C)CO 269862a_106354213184_200016156988 [1,1,1,0,0,0|1,0,0]=4 35 B14R0.131 CCC(C)C(=O)CCCCCCC(C)C 1458a_100000040743_100000758301 [0,0,3,0,0,0|1,0,0]=4 36 B14R0.333 C=CCCCCCN(CCCC)C(C)C 2230a_100000207398_100000700193 [0,0,3,0,0,0|1,0,0]=4 37 B14R0.333 C=CCCCCCN(CCCC)C(C)C 269982a_100000207398_100000700193 [0,0,3,0,0,0|1,0,0]=4 38 B14R0.333 C=CCCCCNC(CCCC)C(C)C 270004a_100000703577_200011215219 [0,0,3,0,0,0|1,0,0]=4 39 B14R0.304 C=CC(C)OCCC(C)CCCC(C)C 34a_100000695699_100009816328 [0,0,3,0,0,0|1,0,0]=4 40 B14R0.304 C=CC(C)SCCC(C)CCCC(C)C 62a_100011215867_100009816328 [0,0,3,0,0,0|1,0,0]=4 41 B14R0.2429 C=CC(C)(CCCC(C)C)OCCCC 34a_200000067283_100000210210 [0,0,3,0,0,0|1,0,0]=4 42 B14R0.2429 C=CC(C)(CCCC(C)C)OCCCC 7a_200000067283_100000210211 [0,0,3,0,0,0|1,0,0]=4 43 B14R0.4203 CCC(C)(CC)C(=O)C(C)CCC(C)C 1458a_100000760562_100011261404 [0,0,3,0,0,0|1,0,0]=4 44 B14R0.3528 CCCC(C)(CC)C(=O)CCCC(C)C 1458a_100011216857_200000040151 [0,0,3,0,0,0|1,0,0]=4 45 B14R0.3528 CCCC(C)(CC)C(=O)CCCC(C)C 1458a_200000724995_100011214892 [0,0,3,0,0,0|1,0,0]=4 46 B16R2.85832 CCCCC(C(C)C)N1CC2C=CC1C2 270004a_100000732668_200011215219 [0,0,2,1,0,0|1,0,0]=4 47 B16R2.156803 C=C1C([C@H]2CC[C@@H]1C2)NC(CC)C(C)C 269862a_100000745074_200016156988 [0,0,2,1,0,0|1,0,0]=4 48 B16R2.58023 C=CCCNC1CC2(CC2C1C)C(C)C 269862a_100015191253_200000039778 [0,0,2,1,0,0|1,0,0]=4 49 B16R2.260964 C=CCCNC1CC2CCC1(C2(C)C)C 2230a_100000716156_100000754431 [0,0,2,1,0,0|1,0,0]=4 50 B16R2.260964 C=CCCNC1CC2CCC1(C2(C)C)C 34a_100000716156_100000754431 [0,0,2,1,0,0|1,0,0]=4 51 B16R2.260964 C=CCCO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 34a_100000686805_100000754431 [0,0,2,1,0,0|1,0,0]=4 52 B16R2.260964 C=CCCO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 7a_100000686805_100000754431 [0,0,2,1,0,0|1,0,0]=4 53 B16R2.261073 C=CCCNC1CC2CC(C1C)C2(C)C 2230a_100000032975_100000754431 [0,0,2,1,0,0|1,0,0]=4 54 B16R2.261073 C=CCCNC1CC2CC(C1C)C2(C)C 34a_100000032975_100000754431 [0,0,2,1,0,0|1,0,0]=4 55 B16R2.261073 C=CCCO[C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C 34a_100009816352_100000754431 [0,0,2,1,0,0|1,0,0]=4 56 B16R2.261073 C=CCCO[C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C 7a_100009816352_100000754431 [0,0,2,1,0,0|1,0,0]=4 57 B16R3.5288 C=C1C([C@H]2CC[C@@H]1C2)NCCC3CC3 269862a_100000764129_200016156988 [1,0,1,1,0,0|1,0,0]=4 58 B14R1.808 CC(C)CCC(C)C(=O)C1CCCC1 1458a_100000210718_100011261404 [0,0,2,0,1,0|1,0,0]=4 59 B14R2.2937 C=C1C([C@H]2CC[C@@H]1C2)NCC(C)C 269862a_100000210953_200016156988 [1,0,1,0,1,0|1,0,0]=4 60 B16R1.601 CC(C)CCCC(C)NC(=O)C1CCCC1 11a_100000210607_100000210718 [0,0,2,0,0,1|1,0,0]=4 61 B16R1.601 CC(C)CCCC(C)NC(=O)C1CCCC1 1626a_100000210607_100000210718 [0,0,2,0,0,1|1,0,0]=4 62 B16R1.601 CC(C)CCCC(C)NC(=O)C1CCCC1 240690a_100000210607_100000210718 [0,0,2,0,0,1|1,0,0]=4 63 B16R1.601 CC(C)CCCC(C)NC(=O)C1CCCC1 527a_100000210607_100000210718 [0,0,2,0,0,1|1,0,0]=4 64 B16R1.7260 C=CC(CC)O[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100000766422_200009893639 [0,0,2,0,0,1|0,0,0]=3 65 B16R1.7260 C=C[C@@H](CO)NC1C[C@@H](CC[C@H]1C(C)C)C 269862a_100016989147_100009815803 [0,0,2,0,0,1|1,0,0]=4 66 B16R1.7260 C=C[C@@H](CO)N[C@H]1C[C@H](CC[C@@H]1C(C)C)C 34a_100016989147_200009893639 [0,0,2,0,0,1|1,0,0]=4 67 B16R1.30474 C=CC(C)(CCCC(C)C)OC1CCCC1 34a_200000067283_100000179811 [0,0,2,0,0,1|0,0,0]=3 68 B16R1.30474 C=CC(C)(CCCC(C)C)OC1CCCC1 7a_200000067283_100000179811 [0,0,2,0,0,1|0,0,0]=3 69 B16R1.30474 C=CC(C)(CCCC(C)C)OC1CCOC1 34a_200000067283_100000690089 [0,0,2,0,0,1|1,0,0]=4 70 B16R1.30474 C=CC(C)(CCCC(C)C)OC1CCOC1 7a_200000067283_100000731011 [0,0,2,0,0,1|1,0,0]=4 71 B16R2.5917 C=C1C([C@H]2CC[C@@H]1C2)NCCCC(C)C 269862a_200000737386_200016156988 [1,0,1,0,0,1|0,0,0]=3 72 B16R2.5917 C=C1C([C@H]2CC[C@@H]1C2)NCCCN(C)C 269862a_102531767803_200016156988 [1,0,1,0,0,1|1,0,0]=4 73 B16R2.5917 C=C1C([C@H]2CC[C@@H]1C2)NCCOC(C)C 269862a_100000701111_200016156988 [1,0,1,0,0,1|1,0,0]=4 74 B16R2.5917 C=C1C([C@H]2CC[C@@H]1C2)NCCSC(C)C 269862a_100000731138_200016156988 [1,0,1,0,0,1|1,0,0]=4 75 B16R2.5917 CC(C)CCCSC1C(=O)[C@H]2CC[C@@H]1C2 62a_100011214892_200015607011 [1,0,1,0,0,1|1,0,0]=4 76 B16R2.5917 CC(C)CCCSC1C(=O)[C@H]2CC[C@@H]1C2 62a_200015607011_100011214892 [1,0,1,0,0,1|1,0,0]=4