0  B6R0.3  CCC(C)C(C)N 214338 [0,0,0,0,0,0|3,0,1]=4
1  B6R0.3  CCC(N)C(C)C 214340 [0,0,0,0,0,0|2,0,1]=3
2  B6R0.3  CNC(=O)[C@H](C)N 105085 [0,0,0,0,0,0|2,0,0]=2
3  B5R0.3  CCC(S)CC 105148 [1,0,0,0,0,0|1,1,1]=4
4  B5R0.3  CNC(=O)NN 237741 [1,0,0,0,0,0|3,0,0]=4
5  B5R0.5  O=C(Cl)C(F)Cl 104873 [1,0,0,0,0,0|3,0,0]=4
6  B7R0.5  CCCC(N)C(C)C 214316 [0,1,0,0,0,0|2,0,1]=4
7  B7R0.10  COC(=O)C(C)CBr 104870 [0,1,0,0,0,0|0,0,0]=1
8  B7R0.14  CC(C)(C)C(=O)ON 105751 [0,1,0,0,0,0|1,0,0]=2
9  B7R0.16  CN(C)C(=O)C(F)F 105296 [0,1,0,0,0,0|3,0,0]=4
10  B7R0.2  CC(C)CC(=O)NN 061371 [0,0,0,0,0,1|2,0,0]=3
11  B4R0.1  COC(N)=S 105257 [2,0,0,0,0,0|1,1,0]=4
12  B4R0.1  [13CH](=O)N(C)C 105188 [2,0,0,0,0,0|1,0,0]=3
13  B4R0.1  [2H]C(=O)OC 105254 [2,0,0,0,0,0|1,0,0]=3
14  B6R0.1  COCC(C)CN 105383 [1,1,0,0,0,0|0,0,1]=3
15  B6R0.2  CC(C)NC(C)C 005001 [1,1,0,0,0,0|2,0,0]=4
16  B6R0.4  CC(C)CCCBr 113000 [1,1,0,0,0,0|1,0,1]=4
17  B6R0.7  CC(C)(F)C(=O)Cl 105008 [1,1,0,0,0,0|1,0,0]=3
18  B6R0.7  CC(C)S(=O)(=O)F 070500 [1,1,0,0,0,0|1,0,1]=4
19  B8R0.23  CC(C)NC(=O)C(C)C 069270 [0,1,0,0,0,1|1,0,0]=3
20  B8R0.3  CCOC(=O)C(C)CCl 104850 [0,2,0,0,0,0|0,0,0]=2
21  B8R0.15  CCC(N=C=O)C(C)C 097764 [0,2,0,0,0,0|1,0,1]=4
22  B8R0.36  COC(C)(CN)C(C)C 214331 [0,2,0,0,0,0|1,0,1]=4
23  B8R1.4  C[C@@H]1CCCC(=O)O1 329497 [0,0,0,1,0,1|1,0,0]=3
24  B8R1.11  N#CC1CCSC1=O 094227 [0,1,0,1,0,0|0,1,1]=4