0  B7R0.9  CC(C)(C)CB(O)O CS-0063198 [0,0,0,0,0,0|2,0,2]=4
1  B6R0.2  C[C@H](N)CC(=O)O CS-0031371 [1,0,0,0,0,0|2,0,1]=4
2  B6R0.5  CNCC(C)(C)C CS-W020152 [1,0,0,0,0,0|3,0,0]=4
3  B6R0.5  C[Si](C)(C)\C=C\I CS-0022088 [1,0,0,0,0,0|2,0,1]=4
4  B8R0.24  CC(C)(C)OC(=O)CN CS-W007408 [0,1,0,0,0,0|3,0,0]=4
5  B8R0.24  C[N+](C)(C)C[C@@H](O)CCl CS-0102622 [0,1,0,0,0,0|1,0,2]=4
6  B8R0.24  C[N+](C)(C)C[C@H](O)CCl CS-0102620 [0,1,0,0,0,0|1,0,2]=4
7  B8R0.34  CC(C)(CN)CC(=O)O CS-M3329 [0,1,0,0,0,0|1,0,1]=3
8  B8R1.51  CC1(C)CNC(=O)C1 CS-M3328 [0,0,0,1,0,0|2,0,0]=3
9  B6R0.7  CC(C)(C)C(=O)[O-] CS-W022935 [0,0,0,0,1,0|1,0,0]=2
10  B6R0.7  CC(C)(C)[S@@](N)=O CS-B0438 [0,0,0,0,1,0|3,0,0]=4
11  B6R0.7  CC(C)(C)[S@](N)=O CS-W018485 [0,0,0,0,1,0|3,0,0]=4
12  B8R0.29  CC(C)(C)NCC(=O)O CS-W021463 [0,0,0,0,0,1|1,0,1]=3
13  B7R0.16  CC(C)[C@@H](O)C(=O)O CS-B0167 [1,1,0,0,0,0|1,0,1]=4
14  B7R0.13  COC(C)(C)C(=O)O CS-0046912 [0,1,0,0,1,0|1,0,1]=4
15  B9R0.57  CC(C)(C)C[C@H](N)C(=O)O CS-0011700 [0,1,0,0,0,1|1,0,1]=4
16  B9R0.25  CNC(=O)[C@@H](N)C(C)(C)C CS-M2950 [0,2,0,0,0,0|2,0,0]=4
17  B7R1.20  O=C(O)CC1CC1 CS-W011326 [1,0,0,1,0,0|1,0,1]=4
18  B9R1.66  CC1(C)CCCC(=O)C1 CS-0010863 [0,1,0,1,0,0|2,0,0]=4
19  B5R0.5  CC(C)S(=O)[O-] CS-M3052 [1,0,0,0,1,0|2,0,0]=4
20  B5R0.5  CC(O)C(=O)[O-] CS-0021602 [1,0,0,0,1,0|2,0,0]=4