0 B6R0.1 CC(CC=O)SC PI-48524 [0,0,0,0,0,0|2,1,1]=4 1 B6R0.1 CC(CCN)CO PI-48961 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 CCC(C)N=C=S PI-22956 [0,0,0,0,0,0|0,0,0]=0 3 B6R0.1 CCCC(CC)Cl PI-46859 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 C[C@@H](CCO)CO PI-48285 [0,0,0,0,0,0|2,1,1]=4 5 B5R0.1 O=C=NC(C)C PI-11403 [1,0,0,0,0,0|0,1,0]=2 6 B5R0.2 C(CBr)N=C=S PI-21421 [1,0,0,0,0,0|1,0,0]=2 7 B5R0.2 CCCSSC PI-48493 [1,0,0,0,0,0|3,0,0]=4 8 B5R0.2 ClCCN=C=O PI-22789 [1,0,0,0,0,0|1,1,0]=3 9 B5R0.3 CCC(CO)N PI-45910 [1,0,0,0,0,0|1,1,1]=4 10 B7R0.2 CCC(C)NC(=O)N PI-19842 [0,1,0,0,0,0|0,1,2]=4 11 B7R0.2 NC(C)CC(C)CC PI-36995 [0,1,0,0,0,0|2,0,1]=4 12 B7R0.7 CC(CCBr)CCBr PI-25581 [0,1,0,0,0,0|2,0,1]=4 13 B7R0.7 CCOC(=O)N=C=S PI-36556 [0,1,0,0,0,0|1,0,1]=3 14 B7R0.10 CC[C@@H]([C@@H](CO)N)C PI-36847 [0,1,0,0,0,0|1,1,1]=4 15 B7R1.2 CC1CCC(C1)O PI-44641 [0,0,0,1,0,0|1,1,1]=4 16 B7R1.2 C[C@@H]1CCC(=O)O1 PI-27751 [0,0,0,1,0,0|1,1,1]=4 17 B7R1.3 CC1CCOCO1 PI-47110 [0,0,0,1,0,0|1,1,1]=4 18 B7R1.3 C[C@H]1CCCCN1 PI-48288 [0,0,0,1,0,0|1,0,2]=4 19 B4R0.1 CC(C)CN PI-46903 [2,0,0,0,0,0|1,0,1]=4 20 B4R0.1 CC(C)NC PI-41120 [2,0,0,0,0,0|0,0,2]=4 21 B4R0.1 CC(CN)O PI-16659 [2,0,0,0,0,0|1,1,0]=4 22 B4R0.1 CC(CO)O PI-16674 [2,0,0,0,0,0|1,1,0]=4 23 B4R0.1 CCC(=N)N PI-35437 [2,0,0,0,0,0|1,0,1]=4 24 B4R0.1 CCC(C)O PI-15619 [2,0,0,0,0,0|0,1,0]=3 25 B4R0.1 C[C@@H](CO)N PI-12236 [2,0,0,0,0,0|1,0,1]=4 26 B4R0.1 C[C@@H](N)CO PI-16472 [2,0,0,0,0,0|1,0,1]=4 27 B4R0.1 C[C@@H](O)CN PI-12234 [2,0,0,0,0,0|1,1,0]=4 28 B4R0.1 NC[C@@H](N)C PI-39121 [2,0,0,0,0,0|1,0,1]=4 29 B4R0.1 NNC(C)C PI-37110 [2,0,0,0,0,0|1,0,1]=4 30 B4R0.1 OC[C@H](O)C PI-16673 [2,0,0,0,0,0|1,1,0]=4 31 B4R0.2 CCCCCl PI-44613 [2,0,0,0,0,0|1,0,1]=4 32 B4R0.2 CCCNC PI-39187 [2,0,0,0,0,0|0,0,2]=4 33 B6R0.2 CC(C)OC(=S)[S-] PI-47168 [1,1,0,0,0,0|1,0,1]=4 34 B6R0.5 CC(C)(C)N=C=S PI-22958 [1,1,0,0,0,0|0,0,0]=2 35 B6R0.6 C(CN=C=S)CBr PI-22582 [1,1,0,0,0,0|0,0,0]=2 36 B6R0.6 CCCCN=C=S PI-22957 [1,1,0,0,0,0|0,0,0]=2 37 B6R0.8 CC(N)(CC)C#C PI-36167 [1,1,0,0,0,0|1,0,1]=4 38 B6R0.9 CCC(CC)CBr PI-47059 [1,1,0,0,0,0|1,0,1]=4 39 B6R0.9 CCN(CC)N=O PI-47046 [1,1,0,0,0,0|1,1,0]=4 40 B6R0.9 OCC(CC)CO PI-41977 [1,1,0,0,0,0|0,1,1]=4 41 B6R1.7 SCC1(C)CC1 PI-37767 [1,0,0,1,0,0|0,0,2]=4 42 B8R1.8 O=C=NC1CCCC1 PI-26670 [0,1,0,1,0,0|0,1,0]=3