0 B6R0.5 CC(C)(O)CCN CS-0043489 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.5 CS(=O)(=O)CCBr CS-0084612 [0,0,0,0,0,0|2,0,0]=2 2 B5R0.1 CC(=O)CCCl CS-W022162 [1,0,0,0,0,0|3,0,0]=4 3 B5R0.1 CCCB(O)O CS-W007470 [1,0,0,0,0,0|2,0,1]=4 4 B5R0.1 CNCC(=O)O CS-W013507 [1,0,0,0,0,0|3,0,0]=4 5 B5R0.1 COCC(=O)O CS-W020123 [1,0,0,0,0,0|3,0,0]=4 6 B5R0.1 N=C(O)CCN CS-W007497 [1,0,0,0,0,0|3,0,0]=4 7 B5R0.4 NOS(=O)(=O)O CS-D1413 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.8 CCCNS(N)(=O)=O CS-0008706 [0,1,0,0,0,0|2,0,0]=3 9 B7R0.8 CCCNS(N)(=O)=O CS-0012532 [0,1,0,0,0,0|2,0,0]=3 10 B7R0.8 CCCNS(N)(=O)=O CS-M1494 [0,1,0,0,0,0|2,0,0]=3 11 B7R0.8 CS(=O)(=O)CCCO CS-W004952 [0,1,0,0,0,0|1,1,0]=3 12 B7R0.8 NCCOS(=O)(=O)O CS-0059227 [0,1,0,0,0,0|1,0,0]=2 13 B7R0.9 CS(=O)(=O)CC(=O)O CS-W004723 [0,1,0,0,0,0|1,1,1]=4 14 B7R1.14 O=S1(=O)CCCO1 CS-W011195 [0,0,0,1,0,0|1,0,0]=2 15 B7R1.14 O=S1(=O)OCCO1 CS-W007741 [0,0,0,1,0,0|2,0,0]=3 16 B7R1.26 NS(=O)(=O)C1CC1 CS-D1514 [0,0,0,1,0,0|2,0,0]=3 17 B4R0.1 CCS(=O)[O-] CS-0020098 [2,0,0,0,0,0|0,0,2]=4 18 B4R0.2 OCCCBr CS-W007337 [2,0,0,0,0,0|2,0,0]=4 19 B4R0.2 OCCCO CS-W018490 [2,0,0,0,0,0|1,1,0]=4 20 B4R0.3 NS(=O)(=O)Cl CS-0008551 [2,0,0,0,0,0|2,0,0]=4 21 B4R0.3 O=S(=O)(O)O CS-W013315 [2,0,0,0,0,0|0,1,0]=3 22 B4R0.3 O=S(=O)([O-])[O-] CS-0021580 [2,0,0,0,0,0|0,1,1]=4 23 B4R0.3 O=S(=O)([O-])[O-] CS-B1716 [2,0,0,0,0,0|0,1,1]=4 24 B6R0.1 COC(=O)CCBr CS-W008728 [1,1,0,0,0,0|2,0,0]=4 25 B6R0.3 CCC(N)C(=O)O CS-W011306 [1,1,0,0,0,0|2,0,0]=4 26 B6R0.3 CC[C@H](N)C(=O)O CS-0044026 [1,1,0,0,0,0|2,0,0]=4 27 B6R0.3 N[C@H](CCl)C(=O)O CS-0100201 [1,1,0,0,0,0|2,0,0]=4 28 B6R0.3 N[C@H](CS)C(=O)O CS-0046802 [1,1,0,0,0,0|1,0,0]=3 29 B6R0.3 N[C@H](CS)C(=O)O CS-W002074 [1,1,0,0,0,0|1,0,0]=3 30 B6R0.3 N[C@H](CS)C(=O)O CS-W019341 [1,1,0,0,0,0|1,0,0]=3 31 B6R0.4 C#CCCC(=O)O CS-W008784 [1,1,0,0,0,0|2,0,0]=4 32 B6R0.4 C=CCCC(=O)O CS-W009138 [1,1,0,0,0,0|2,0,0]=4 33 B6R0.4 CCOCC(=O)O CS-0071579 [1,1,0,0,0,0|2,0,0]=4 34 B6R0.4 N#CCCC(=O)O CS-W018565 [1,1,0,0,0,0|2,0,0]=4 35 B6R0.4 O=C(O)CCCBr CS-W016047 [1,1,0,0,0,0|2,0,0]=4 36 B6R0.7 CC(C)S(N)(=O)=O CS-W005008 [1,1,0,0,0,0|1,0,0]=3 37 B8R0.21 CCCCOS(C)(=O)=O CS-W018582 [0,2,0,0,0,0|2,0,0]=4 38 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 CS-B0948 [0,1,0,1,0,0|2,0,0]=4 39 B8R1.72 O=S1(=O)CCCCO1 CS-W018691 [0,1,0,1,0,0|1,0,0]=3 40 B8R1.72 O=S1(=O)CCNCC1 CS-W005419 [0,1,0,1,0,0|2,0,0]=4 41 B8R1.72 O=S1(=O)CCNCC1 CS-W009111 [0,1,0,1,0,0|2,0,0]=4 42 B8R1.70 CC1(S(N)(=O)=O)CC1 CS-W005664 [0,1,0,1,0,0|2,0,0]=4