0  B4R0.3  CC(C)(C)Br SBB060197 [0,0,0,0,0,0|2,0,0]=2
1  B4R0.3  C[N+](C)(C)C SBB087926 [0,0,0,0,0,0|1,0,0]=1
2  B3R0.2  CC(C)Br SBB060452 [1,0,0,0,0,0|2,0,0]=3
3  B5R0.4  CC(C)(C)NO SBB056490 [0,1,0,0,0,0|1,0,1]=3
4  B5R0.4  CC(C)(N)C#N SBB043968 [0,1,0,0,0,0|2,0,1]=4
5  B5R0.4  COS(C)(=O)=O SBB058203 [0,1,0,0,0,0|2,0,1]=4
6  B5R0.4  NNC(C)(C)C SBB005864 [0,1,0,0,0,0|2,0,0]=3
7  B2R0.1  CCBr SBB040912 [2,0,0,0,0,0|2,0,0]=4
8  B2R0.1  ONC SBB005850 [2,0,0,0,0,0|0,0,2]=4
9  B4R0.1  CC(Br)CBr SBB060202 [1,1,0,0,0,0|2,0,0]=4
10  B4R0.1  CC(Br)CCl SBB061477 [1,1,0,0,0,0|2,0,0]=4
11  B4R0.1  CC(C)CBr SBB059932 [1,1,0,0,0,0|1,0,0]=3
12  B4R0.1  CC(C)NN SBB002129 [1,1,0,0,0,0|2,0,0]=4
13  B4R0.1  CC(Cl)CCl SBB059979 [1,1,0,0,0,0|2,0,0]=4
14  B4R0.1  CCC(C)Br SBB059931 [1,1,0,0,0,0|2,0,0]=4
15  B4R0.1  CCN(C)N SBB107453 [1,1,0,0,0,0|1,0,1]=4
16  B4R0.1  NCC(=O)[O-] SBB116671 [1,1,0,0,0,0|2,0,0]=4
17  B6R0.5  CC#CC(C)(C)O SBB009136 [0,2,0,0,0,0|1,0,1]=4
18  B6R0.5  CC(C)(C)CCCl SBB059953 [0,2,0,0,0,0|2,0,0]=4
19  B6R0.5  CC(C)(C)CCN SBB059532 [0,2,0,0,0,0|2,0,0]=4
20  B6R0.5  CC(C)(C)N=C=O SBB067148 [0,2,0,0,0,0|1,0,1]=4
21  B6R0.5  CC(C)(C)N=C=S SBB066555 [0,2,0,0,0,0|1,1,0]=4
22  B6R0.5  CC(C)(C)ON=O SBB007659 [0,2,0,0,0,0|1,0,1]=4
23  B6R0.5  CCCC(C)(C)N SBB052122 [0,2,0,0,0,0|2,0,0]=4
24  B6R0.5  CCNC(C)(C)C SBB052124 [0,2,0,0,0,0|2,0,0]=4
25  B6R0.5  C[N+](C)(C)CCO SBB060960 [0,2,0,0,0,0|0,0,1]=3
26  B6R0.7  CC(=O)C(C)(C)C SBB060385 [0,2,0,0,0,0|1,0,1]=4
27  B6R0.7  CC(=O)C(C)(C)Cl SBB008903 [0,2,0,0,0,0|2,0,0]=4
28  B6R0.7  CC(=O)C(C)(C)N SBB013635 [0,2,0,0,0,0|2,0,0]=4
29  B6R0.7  CC(C)(C)C(=N)N SBB072322 [0,2,0,0,0,0|2,0,0]=4
30  B6R0.7  CC(C)(C)C(=O)Cl SBB060922 [0,2,0,0,0,0|1,0,1]=4
31  B6R0.7  CC(C)(C)C(N)=O SBB028170 [0,2,0,0,0,0|1,0,1]=4
32  B6R0.7  CC(C)(C)[S@](N)=O SBB056498 [0,2,0,0,0,0|1,0,1]=4
33  B6R0.7  NC(C)C(C)(C)C SBB005830 [0,2,0,0,0,0|2,0,0]=4
34  B6R0.8  C#CC(C)(C)OC SBB014168 [0,2,0,0,0,0|2,0,0]=4
35  B6R0.8  CC(C)(CN)CN SBB061381 [0,2,0,0,0,0|2,0,0]=4
36  B6R0.8  CC(C)(CN)CO SBB028181 [0,2,0,0,0,0|1,0,1]=4
37  B6R0.8  CC(C)(CO)CO SBB056814 [0,2,0,0,0,0|1,0,1]=4
38  B6R0.8  CCC(C)(O)CC SBB060948 [0,2,0,0,0,0|1,0,1]=4
39  B6R0.8  CNC(C)(C)C#N SBB078156 [0,2,0,0,0,0|2,0,0]=4
40  B6R0.8  OCC(C)(CO)N SBB004360 [0,2,0,0,0,0|2,0,0]=4
41  B6R1.7  CC1(CCl)CO1 SBB054966 [0,1,0,1,0,0|1,0,1]=4
42  B6R1.7  CC1(CO)CC1 SBB084505 [0,1,0,1,0,0|1,0,1]=4
43  B6R1.10  CC1(N)CCC1 SBB072407 [0,1,0,1,0,0|2,0,0]=4