0  B5R0.1  CC(O)CC#N F1913-2479 [0,0,0,0,0,0|3,0,1]=4
1  B5R0.1  CC(O)CCN F8880-3625 [0,0,0,0,0,0|3,0,1]=4
2  B4R0.1  C#CC(C)N F8880-5914 [1,0,0,0,0,0|2,0,1]=4
3  B4R0.1  CC(Br)CCl F0001-2454 [1,0,0,0,0,0|2,0,1]=4
4  B4R0.1  CC(F)CO F2147-5480 [1,0,0,0,0,0|1,0,2]=4
5  B6R0.1  CCC(C)CNC F8889-4114 [0,1,0,0,0,0|3,0,0]=4
6  B6R0.2  CC(=O)CC(C)N F1791-1136 [0,1,0,0,0,0|2,0,0]=3
7  B6R0.2  CC(=O)CC(C)N F1997-0017 [0,1,0,0,0,0|2,0,0]=3
8  B6R0.4  CC(C)CN=[N+]=[N-] F8886-6502 [0,1,0,0,0,0|3,0,0]=4
9  B6R0.4  CC(C)NCCCl F2147-1524 [0,1,0,0,0,0|2,0,1]=4
10  B6R0.4  CCCNC(C)C F8889-6089 [0,1,0,0,0,0|2,0,1]=4
11  B6R0.4  CCNCC(C)C F8880-2710 [0,1,0,0,0,0|2,0,1]=4
12  B6R0.4  CCOCC(C)N F2167-3742 [0,1,0,0,0,0|2,0,1]=4
13  B6R0.5  CNCC(C)(C)C F8888-7503 [0,1,0,0,0,0|3,0,0]=4
14  B6R1.3  CCNC1CC1 F8889-2389 [0,0,0,1,0,0|2,0,1]=4
15  B6R1.3  NNCC1CC1 F8881-7483 [0,0,0,1,0,0|3,0,0]=4
16  B6R1.3  NOCC1CC1 F8885-6337 [0,0,0,1,0,0|3,0,0]=4
17  B6R1.5  CC1CC(C)N1 F8887-5508 [0,0,0,1,0,0|2,0,1]=4
18  B6R1.10  CC1(C)CNC1 F8889-6575 [0,0,0,1,0,0|3,0,0]=4
19  B5R0.3  COC(C)CN F3377-0028 [1,1,0,0,0,0|0,0,1]=3
20  B5R0.4  C=CC(C)(C)N F1913-0538 [1,1,0,0,0,0|1,0,0]=3
21  B5R0.2  C=CCCNC F1911-1847 [1,1,0,0,0,0|2,0,0]=4
22  B7R0.2  CC(C)C\C(N)=N\O F2145-0870 [0,2,0,0,0,0|1,0,1]=4
23  B7R0.11  C=CCC(C)(C)C=O F2147-6072 [0,2,0,0,0,0|2,0,0]=4
24  B7R0.11  C=CCC(C)(C)CO F2147-6070 [0,2,0,0,0,0|2,0,0]=4
25  B7R0.12  CCC(CC)N=C=O F2190-0554 [0,2,0,0,0,0|1,0,1]=4
26  B7R0.9  CC(C)NS(C)(=O)=O F8883-7098 [0,2,0,0,0,0|2,0,0]=4
27  B7R0.4  CC(C)COCCN F2167-3704 [0,2,0,0,0,0|1,0,1]=4
28  B7R0.6  CC(C)C=C[N+](=O)[O-] F2147-1623 [0,2,0,0,0,0|1,0,0]=3
29  B7R0.8  CC(C)(C)OCCN F2147-1401 [0,2,0,0,0,0|1,0,1]=4
30  B5R1.2  CC1CCN1 F8888-7636 [1,0,0,1,0,0|1,0,1]=4
31  B7R1.1  OC[C@H]1CCCO1 F0001-2349 [0,1,0,1,0,0|1,0,1]=4
32  B7R1.2  NC1CNC(=O)C1 F2158-1004 [0,1,0,1,0,0|2,0,0]=4
33  B7R1.10  C=C1CC(CN)C1 F2147-8211 [0,1,0,1,0,0|2,0,0]=4
34  B7R1.7  ClCCOC1CC1 F2167-2679 [0,1,0,1,0,0|1,0,1]=4