0 B12R2.509 CC1(C(=O)[C@@]2(CC[C@H]1C2)C)C Z1255402987 [0,0,0,0,0,0|0,0,2]=2 1 B12R2.509 CC1(C(=O)[C@]2(CC[C@@H]1C2)C)C Z1255427411 [0,0,0,0,0,0|0,0,2]=2 2 B12R2.509 CC12CCC(C1)C(C2=O)(C)C Z804948554 [0,0,0,0,0,0|0,0,2]=2 3 B12R2.509 CC12CCC(C1)C(C2N)(C)C Z235536768 [0,0,0,0,0,0|1,0,0]=1 4 B11R2.204 C=C1C2CCC(C2)C1(C)C Z104478010 [1,0,0,0,0,0|1,0,1]=3 5 B11R2.204 CC1(C2CCC(C2)C1N)C Z3014734826 [1,0,0,0,0,0|1,0,0]=2 6 B11R2.2312 NC12CCC(C1)[C@@H]([C@@H]2O)O Z3967656597 [1,0,0,0,0,0|2,0,0]=3 7 B13R2.2794 CC12CCC(C1)C(C2C#N)(C)C Z1389061595 [0,1,0,0,0,0|1,0,0]=2 8 B11R1.1322 CC1(CCCC(N1[O])(C)C)C Z1255386734 [0,0,1,0,0,0|1,0,1]=3 9 B11R1.1322 CC1(CNCC(C1O)(C)C)C Z2941175709 [0,0,1,0,0,0|1,0,0]=2 10 B10R1.6 CC(C)(C=O)C1CCCC1 Z1813208695 [1,0,1,0,0,0|0,0,2]=4 11 B10R1.6 CC(C)(CN)C1CCCC1 Z1434265756 [1,0,1,0,0,0|1,0,0]=3 12 B10R1.6 CC(C)(CN)C1CCCO1 Z2943543564 [1,0,1,0,0,0|2,0,0]=4 13 B10R1.6 CC(C)(CN)N1CCCC1 Z3074473275 [1,0,1,0,0,0|2,0,0]=4 14 B10R1.6 CC(C)(CO)C1CCCC1 Z1517090454 [1,0,1,0,0,0|0,0,0]=2 15 B10R1.6 CC(O)(CN)C1CCCC1 Z993956456 [1,0,1,0,0,0|2,0,0]=4 16 B10R1.6 CCC(C)(C)C1CCCN1 Z995037218 [1,0,1,0,0,0|2,0,0]=4 17 B10R1.55 CC(C)(C)C1CCC(C1)N Z1203638087 [1,0,1,0,0,0|1,0,0]=3 18 B10R1.31 CC(C)N1CCC(C1)CN Z317026946 [1,0,1,0,0,0|2,0,0]=4 19 B10R1.540 CC1(CNC(C1O)(C)C)C Z2732454449 [1,0,1,0,0,0|1,0,0]=3 20 B10R1.560 CC1(CC(C(O1)(C)C)O)C Z1255488775 [1,0,1,0,0,0|2,0,0]=4 21 B10R1.114 C[C@]1([C@H](CCC[C@H]1O)O)N Z1203582313 [1,0,1,0,0,0|2,0,0]=4 22 B10R1.120 CC1(CC(CCC1O)N)C Z3444439845 [1,0,1,0,0,0|2,0,0]=4 23 B10R1.238 CC1(CCC(C1)(N)CO)C Z3063838727 [1,0,1,0,0,0|2,0,0]=4 24 B10R1.238 CC1(CCC(C1)(O)CN)C Z4475201912 [1,0,1,0,0,0|2,0,0]=4 25 B10R1.238 CC1(CNC(C1)(C)C)CO Z4438567716 [1,0,1,0,0,0|2,0,0]=4 26 B10R1.370 CC(C)CC1(CCCC1)O Z449370858 [1,0,1,0,0,0|1,0,0]=3 27 B10R1.370 CC(C)CC1(CCCN1)C Z1295563367 [1,0,1,0,0,0|1,0,0]=3 28 B10R1.370 CC(C)CC1(OCCO1)C Z1416171321 [1,0,1,0,0,0|2,0,0]=4 29 B10R1.307 CC1(CCCC(C1)(C)N)C Z4351247918 [1,0,1,0,0,0|1,0,0]=3 30 B10R1.307 CC1(CCCC(C1)(C)O)C Z1229797357 [1,0,1,0,0,0|1,0,0]=3 31 B10R1.307 CC1(CCCC(N1)(C)C)C Z238876086 [1,0,1,0,0,0|1,0,0]=3 32 B10R1.307 CC1(CNCC(C1)(C)C)C Z1704732757 [1,0,1,0,0,0|1,0,0]=3 33 B10R1.307 CC1(CNCC(N1)(C)C)C Z1203732979 [1,0,1,0,0,0|2,0,0]=4 34 B10R1.307 CC1(COCC(N1)(C)C)C Z3039029029 [1,0,1,0,0,0|2,0,0]=4 35 B10R2.25 O[C@H]1[C@@H]2CN[C@@H](C2)[C@H]1O Z3247759184 [2,0,0,0,0,0|2,0,0]=4 36 B10R2.28 C[C@]1(C[C@@H]2CN[C@H]1C2)O Z4882042053 [2,0,0,0,0,0|2,0,0]=4 37 B10R2.28 C[C@]1(C[C@H]2C[C@@H]1CN2)O Z4690434296 [2,0,0,0,0,0|2,0,0]=4 38 B10R2.115 C[C@]12CO[C@H](C1)[C@@H](C2)N Z4767895815 [2,0,0,0,0,0|2,0,0]=4 39 B10R2.19 NC1CC2CCC1(C2)N Z3615226863 [2,0,0,0,0,0|2,0,0]=4 40 B12R1.2514 CC1(CCCC(C1CO)(C)C)C Z1896798779 [0,1,1,0,0,0|0,0,0]=2 41 B10R0.65 CC(=O)CCCC(C)(C)CO Z1513606539 [0,0,2,0,0,0|1,0,1]=4 42 B12R2.2786 CC1(C2CCC1(C(C2)N)C)C Z56827745 [0,0,1,1,0,0|2,0,0]=4 43 B12R2.2786 CC1(C2CCC1(C(C2)O)C)C Z104478138 [0,0,1,1,0,0|2,0,0]=4 44 B12R2.2786 CC1([C@@H]2CC[C@]1([C@H](C2)O)C)C Z1255372631 [0,0,1,1,0,0|2,0,0]=4 45 B12R2.2786 CC1([C@H]2CC[C@@]1([C@@H](C2)O)C)C Z1255364889 [0,0,1,1,0,0|2,0,0]=4 46 B12R2.4179 CC1([C@@H]2[C@H]1C[C@](C2)(C)C=O)C Z2466329334 [0,0,1,1,0,0|0,0,2]=4 47 B12R2.254 CC(C)C1NCC12CCCC2 Z2240988403 [0,0,1,1,0,0|1,0,0]=3 48 B12R2.5111 O[C@@H]1[C@@H](CNC12CCCC2)O Z4497341547 [0,0,1,1,0,0|2,0,0]=4 49 B10R1.315 CC1(C(=O)C(C1O)(C)C)C Z1255383074 [0,0,1,0,1,0|1,0,1]=4 50 B10R1.315 CC1(C(C(C1N)(C)C)N)C Z1203581348 [0,0,1,0,1,0|2,0,0]=4 51 B12R1.9 CCC(C)(C)C1CCC(CC1)N Z90122128 [0,0,1,0,0,1|2,0,0]=4 52 B12R1.9 CCC(C)(C)C1CCC(CC1)O Z335244810 [0,0,1,0,0,1|2,0,0]=4 53 B12R1.10 CC1CCCN(C1)C(C)(C)CN Z316301300 [0,0,1,0,0,1|2,0,0]=4 54 B12R1.2679 CC(C)NC(=O)C1(CCCC1)C Z68108234 [0,0,1,0,0,1|0,0,2]=4