0 B5R0.2 CSCCCCl Y14621 [1,0,0,0,0,0|1,1,1]=4 1 B7R0.3 CNC(=O)CCCO F10217 [0,1,0,0,0,0|1,0,0]=2 2 B7R0.3 COC(=O)\C=C\CN AT20735 [0,1,0,0,0,0|0,0,2]=3 3 B7R0.10 C=C(OC)C(=O)OC 78623 [0,1,0,0,0,0|1,0,1]=3 4 B7R1.1 CC[C@H]1CCCN1 Y11636 [0,0,0,1,0,0|2,0,1]=4 5 B7R1.2 C[C@@H]1COC(=O)C1 64712 [0,0,0,1,0,0|0,0,0]=1 6 B7R1.2 C[C@@H]1COC(=O)C1 69011 [0,0,0,1,0,0|0,0,0]=1 7 B7R1.2 N[C@@H]1CCC(=O)N1 D72820 [0,0,0,1,0,0|3,0,0]=4 8 B7R1.2 N[C@@H]1CNC(=O)C1 P12719 [0,0,0,1,0,0|2,0,0]=3 9 B7R1.2 O=C1C=C[C@@H](O)C1 86273 [0,0,0,1,0,0|2,0,1]=4 10 B7R1.4 CN1CC=CC1=O N13365 [0,0,0,1,0,0|1,0,2]=4 11 B7R1.4 C[C@H]1CCNC1=O D72754 [0,0,0,1,0,0|2,0,0]=3 12 B7R1.6 BrCC[C@H]1CCO1 D79156 [0,0,0,1,0,0|2,0,1]=4 13 B7R1.6 ICC[C@H]1CCO1 D79155 [0,0,0,1,0,0|2,0,1]=4 14 B7R1.6 NCC[C@H]1CCO1 D79157 [0,0,0,1,0,0|2,0,1]=4 15 B7R1.6 NCC[C@H]1CCO1 P17247 [0,0,0,1,0,0|2,0,1]=4 16 B7R1.6 OCC[C@H]1CCO1 D84844 [0,0,0,1,0,0|2,0,1]=4 17 B7R1.6 OCC[C@H]1CCO1 P19429 [0,0,0,1,0,0|2,0,1]=4 18 B7R1.10 CO[C@H]1C[C@@H](O)C1 W15861 [0,0,0,1,0,0|2,0,1]=4 19 B7R1.10 CO[C@H]1C[C@H](O)C1 C77446 [0,0,0,1,0,0|2,0,1]=4 20 B4R0.2 CNCCF AC6046 [2,0,0,0,0,0|2,0,0]=4 21 B6R0.2 C[C@H](O)CN(C)C AT22519 [1,1,0,0,0,0|2,0,0]=4 22 B6R0.2 O=C(O)CC(F)F P18472 [1,1,0,0,0,0|1,0,0]=3 23 B6R0.3 C=C[C@H](N)C(=O)O F31036 [1,1,0,0,0,0|0,0,2]=4 24 B6R0.3 C[C@@H](CN)C(=O)O 31999 [1,1,0,0,0,0|1,0,0]=3 25 B6R0.3 N[C@H](CS)S(=O)O D72263 [1,1,0,0,0,0|2,0,0]=4 26 B6R0.4 C[C@H](Cl)CCCO AC5969 [1,1,0,0,0,0|1,0,1]=4 27 B6R0.4 O=C(O)\C=C\CF AT12709 [1,1,0,0,0,0|0,0,2]=4 28 B6R0.4 O=C(O)\C=C\CO AT11505 [1,1,0,0,0,0|0,0,2]=4 29 B6R0.9 C\C=C(\C=O)CC AC9866 [1,1,0,0,0,0|1,0,0]=3 30 B8R0.19 CC[C@H](N)CC(=O)OC Y11154 [0,2,0,0,0,0|0,0,0]=2 31 B8R0.3 CO\C=C(/I)C(=O)OC 78865 [0,2,0,0,0,0|0,0,2]=4 32 B6R1.5 CC1CC(O)C1 P19103 [1,0,0,1,0,0|0,0,2]=4 33 B6R1.5 C[C@H]1C[C@H](C)N1 D79632 [1,0,0,1,0,0|1,0,1]=4 34 B6R1.5 C[C@H]1C[C@H](C)N1 D84904 [1,0,0,1,0,0|1,0,1]=4 35 B6R1.5 O=C1CC(F)C1 P13807 [1,0,0,1,0,0|1,0,0]=3 36 B8R1.1 C#C[C@@H]1COC(=O)N1 68852 [0,1,0,1,0,0|0,0,2]=4 37 B8R1.1 C=C[C@@H]1COC(=O)C1 C12022 [0,1,0,1,0,0|0,0,1]=3 38 B8R1.1 C=C[C@@H]1COC(=O)N1 54688 [0,1,0,1,0,0|0,0,2]=4 39 B8R1.1 C=C[C@@H]1COC(=O)N1 54690 [0,1,0,1,0,0|0,0,2]=4 40 B8R1.1 CC[C@H]1COC(=O)N1 D75525 [0,1,0,1,0,0|0,0,0]=2 41 B8R1.1 CN[C@@H]1CNC(=O)C1 P19248 [0,1,0,1,0,0|1,0,0]=3 42 B8R1.1 NC[C@@H]1CNC(=O)C1 38946 [0,1,0,1,0,0|1,0,0]=3 43 B8R1.1 NC[C@@H]1CNC(=O)C1 P14159 [0,1,0,1,0,0|1,0,0]=3 44 B8R1.1 O=C1C[C@H](CO)CO1 72726 [0,1,0,1,0,0|0,0,0]=2 45 B8R1.1 O=C1NC[C@H](CO)O1 P14223 [0,1,0,1,0,0|2,0,0]=4 46 B8R1.4 CC1=CCCC(=O)C1 D79894 [0,1,0,1,0,0|1,0,1]=4 47 B8R1.4 C[C@H]1CC(=O)CCO1 P13205 [0,1,0,1,0,0|1,0,0]=3 48 B8R1.4 C[C@H]1CCCC(=O)N1 D85681 [0,1,0,1,0,0|1,0,0]=3 49 B8R1.4 N[C@@H]1COCC(=O)C1 91465 [0,1,0,1,0,0|1,0,0]=3 50 B8R1.2 CON1CCNCC1 AT26084 [0,1,0,1,0,0|2,0,0]=4 51 B8R1.2 OC[C@H]1CCCCO1 92919 [0,1,0,1,0,0|0,0,2]=4 52 B8R1.2 OC[C@H]1CCCCO1 P13405 [0,1,0,1,0,0|0,0,2]=4 53 B8R1.3 C[C@H]1CCC(=O)CN1 P20466 [0,1,0,1,0,0|1,0,0]=3 54 B8R1.3 C[C@H]1CCC(=O)CN1 P20467 [0,1,0,1,0,0|1,0,0]=3 55 B8R1.3 C[C@H]1CO[C@@H](C)CN1 C73501 [0,1,0,1,0,0|1,0,1]=4 56 B8R1.3 O=C1CCC(=O)NC1 65254 [0,1,0,1,0,0|1,0,1]=4 57 B8R1.3 O=C1CCS(=O)CC1 D86028 [0,1,0,1,0,0|2,0,0]=4 58 B8R1.5 [BH3-]C1=CCCC[C@@H]1C AC8574 [0,1,0,1,0,0|2,0,0]=4 59 B8R1.38 COC(=O)[C@@H]1CCO1 D96911 [0,1,0,1,0,0|0,0,0]=2 60 B8R1.38 O=C(CCl)C1CCC1 P19145 [0,1,0,1,0,0|2,0,0]=4 61 B8R1.52 CO[C@@]1(C)CCNC1 C77432 [0,1,0,1,0,0|1,0,1]=4 62 B8R1.11 CO[C@H]1CCC[C@H]1N P19444 [0,1,0,1,0,0|1,0,1]=4 63 B8R2.4 O=C1CC2CC1C2 P20286 [0,0,0,2,0,0|1,0,0]=3 64 B8R2.18 O=C1CC2CC2N1 P20381 [0,0,0,2,0,0|1,0,0]=3 65 B8R2.38 O=C1CC[C@@H]2C[C@H]12 97892 [0,0,0,2,0,0|1,0,0]=3 66 B8R2.38 O=C1NCC2CC12 AT10538 [0,0,0,2,0,0|1,0,0]=3