0 B6R0.5 CC(C)(O)CCBr CS-W018816 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.5 CS(=O)(=O)CCO CS-0059238 [0,0,0,0,0,0|1,1,0]=2 2 B5R0.1 CC(O)CCN CS-0113030 [1,0,0,0,0,0|3,0,0]=4 3 B5R0.1 CC(O)CCN CS-0113103 [1,0,0,0,0,0|3,0,0]=4 4 B5R0.1 C[C@@H](O)CCN CS-0113026 [1,0,0,0,0,0|3,0,0]=4 5 B5R0.1 C[C@@H](O)CCN CS-0113150 [1,0,0,0,0,0|3,0,0]=4 6 B5R0.1 C[C@H](O)CCN CS-0113024 [1,0,0,0,0,0|3,0,0]=4 7 B5R0.1 C[C@H](O)CCN CS-0113046 [1,0,0,0,0,0|3,0,0]=4 8 B5R0.1 O=C(O)CCF CS-0038385 [1,0,0,0,0,0|2,0,0]=3 9 B5R0.4 C=CS(N)(=O)=O CS-0091212 [1,0,0,0,0,0|1,0,2]=4 10 B7R0.8 C=CCCS(=O)(=O)[O-] CS-0105965 [0,1,0,0,0,0|1,0,1]=3 11 B7R0.8 CS(=O)(=O)NCCN CS-0046960 [0,1,0,0,0,0|2,0,0]=3 12 B7R0.8 NCCCS(N)(=O)=O CS-0088483 [0,1,0,0,0,0|2,0,0]=3 13 B7R0.8 NCCNS(N)(=O)=O CS-0112947 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.11 CNS(=O)(=O)CCN CS-0089525 [0,1,0,0,0,0|2,0,0]=3 15 B7R0.11 CNS(=O)(=O)CCN CS-0091302 [0,1,0,0,0,0|2,0,0]=3 16 B7R1.14 O=S1(=O)NCCO1 CS-0052184 [0,0,0,1,0,0|2,0,0]=3 17 B7R1.16 O=C1CS(=O)(=O)C1 CS-0091734 [0,0,0,1,0,0|1,1,1]=4 18 B7R1.16 O=S1(=O)CC(O)C1 CS-0051343 [0,0,0,1,0,0|1,1,0]=3 19 B4R0.3 CS(=O)([O-])=S CS-W013381 [2,0,0,0,0,0|0,1,1]=4 20 B6R0.3 C[C@@H](CN)C(=O)O CS-0059829 [1,1,0,0,0,0|2,0,0]=4 21 B6R0.3 C[C@H](CN)C(=O)O CS-0059837 [1,1,0,0,0,0|2,0,0]=4 22 B6R0.3 NCC(F)C(=O)O CS-W011291 [1,1,0,0,0,0|2,0,0]=4 23 B6R0.3 NC[C@@H](O)C(=O)O CS-0105320 [1,1,0,0,0,0|2,0,0]=4 24 B6R0.4 CNCCC(=O)O CS-0112815 [1,1,0,0,0,0|2,0,0]=4 25 B6R0.8 CCS(=O)(=O)CCl CS-0035589 [1,1,0,0,0,0|1,0,0]=3 26 B8R0.21 CCCCCS(=O)(=O)[O-] CS-W017507 [0,2,0,0,0,0|1,0,1]=4 27 B8R0.21 CCCCNS(N)(=O)=O CS-0108693 [0,2,0,0,0,0|2,0,0]=4 28 B8R0.21 NCCCNS(N)(=O)=O CS-0112948 [0,2,0,0,0,0|2,0,0]=4 29 B8R0.24 CCC(C)OS(C)(=O)=O CS-0049315 [0,2,0,0,0,0|2,0,0]=4 30 B8R0.12 CN(C)S(=O)(=O)CCN CS-0088482 [0,2,0,0,0,0|2,0,0]=4 31 B6R1.11 O=C(O)[C@@H]1CN1 CS-0111707 [1,0,0,1,0,0|2,0,0]=4 32 B8R1.51 CC1CCS(=O)(=O)O1 CS-0108609 [0,1,0,1,0,0|1,0,0]=3 33 B8R1.51 O=C1CCS(=O)(=O)C1 CS-0036770 [0,1,0,1,0,0|1,1,0]=4 34 B8R1.53 NCC1CS(=O)(=O)C1 CS-0046405 [0,1,0,1,0,0|2,0,0]=4 35 B8R1.72 O=S1(=O)CCCCN1 CS-W005956 [0,1,0,1,0,0|2,0,0]=4 36 B8R1.72 O=S1(=O)COCCN1 CS-0057466 [0,1,0,1,0,0|1,1,0]=4 37 B8R1.73 CC1(N)CS(=O)(=O)C1 CS-0051218 [0,1,0,1,0,0|2,0,0]=4 38 B8R1.19 CC1CCOS1(=O)=O CS-0109864 [0,1,0,1,0,0|1,0,0]=3