0  B8R0.4  CCCCSCCCN BB01-5322 [0,0,0,0,0,0|2,0,1]=3
1  B8R0.4  CCOCCCN=C=O BB01-4450 [0,0,0,0,0,0|2,0,1]=3
2  B7R0.1  COCCCN=C=O BB01-4449 [1,0,0,0,0,0|2,0,1]=4
3  B9R0.2  NCCCCCCC(=O)O BB58-1683 [0,1,0,0,0,0|1,0,0]=2
4  B9R0.5  CCCCSC(C)CCN BB01-5423 [0,1,0,0,0,0|2,0,1]=4
5  B9R1.5  NC1CCCCNC1=O BB57-3738 [0,0,0,1,0,0|2,0,0]=3
6  B9R1.5  O=C1NCCCCC1Br BB58-3108 [0,0,0,1,0,0|2,0,0]=3
7  B9R1.8  C=CCN1CCNCC1 BB55-0127 [0,0,0,1,0,0|3,0,0]=4
8  B9R1.8  CCCC1CCCCN1 BB55-6200 [0,0,0,1,0,0|1,0,1]=3
9  B9R1.8  COCC1CCNCC1 BB01-5648 [0,0,0,1,0,0|3,0,0]=4
10  B9R1.8  ClCCN1CCCCC1 BB20-1615 [0,0,0,1,0,0|2,0,1]=4
11  B9R1.8  NCCN1CCCCC1 BB01-5223 [0,0,0,1,0,0|2,0,1]=4
12  B9R1.8  O=C=NC1CCCCC1 BB01-7794 [0,0,0,1,0,0|1,0,1]=3
13  B9R1.8  OCCC1CCCCN1 BB01-6270 [0,0,0,1,0,0|1,0,2]=4
14  B9R1.8  OCCN1CCCCC1 BB01-7783 [0,0,0,1,0,0|1,0,2]=4
15  B9R1.12  C=CCNC1CCCC1 BB57-0235 [0,0,0,1,0,0|2,0,0]=3
16  B9R1.12  ClCCCN1CCCC1 BB01-5069 [0,0,0,1,0,0|2,0,1]=4
17  B9R1.12  NCCCN1CCCC1 BB01-5154 [0,0,0,1,0,0|2,0,1]=4
18  B9R1.14  CCN1CCCC1CN BB01-6119 [0,0,0,1,0,0|2,0,1]=4
19  B9R1.15  CN1CCCCC1CO BB57-3381 [0,0,0,1,0,0|1,0,2]=4
20  B9R1.33  CN1CCCC1CCO BB57-3382 [0,0,0,1,0,0|1,0,2]=4
21  B9R1.33  O=C1CCCN1CCO BB55-7853 [0,0,0,1,0,0|2,0,0]=3
22  B9R1.83  CCCCOCC1CO1 BB01-8032 [0,0,0,1,0,0|1,0,2]=4
23  B9R1.89  O=CN1CCCNCC1 BB57-0181 [0,0,0,1,0,0|2,0,0]=3
24  B8R0.1  CCCCN(C)CCN BB01-5193 [1,1,0,0,0,0|2,0,0]=4
25  B8R0.7  CCCCCSC(=N)N BB58-4675 [1,1,0,0,0,0|2,0,0]=4
26  B8R0.7  CN(C)CCCCCN BB57-6433 [1,1,0,0,0,0|2,0,0]=4
27  B8R0.7  COCCOCC(=O)O BB57-6814 [1,1,0,0,0,0|2,0,0]=4
28  B8R0.7  NCCCCCC(=O)O BB57-3834 [1,1,0,0,0,0|1,0,0]=3
29  B8R1.2  N#CC1CCCCC1 BB58-4600 [1,0,0,1,0,0|1,0,1]=4
30  B8R1.2  NCC1CCNCC1 BB01-6277 [1,0,0,1,0,0|2,0,0]=4
31  B8R1.2  O=CC1CCCCC1 BB01-6149 [1,0,0,1,0,0|0,0,0]=2
32  B8R1.2  OCC1CCCCO1 BB01-4802 [1,0,0,1,0,0|1,0,1]=4
33  B8R1.2  OCC1CCNCC1 BB58-3415 [1,0,0,1,0,0|1,0,1]=4
34  B8R1.2  OCC1CCOCC1 BB55-3597 [1,0,0,1,0,0|1,0,1]=4
35  B8R1.5  CC1SCCNC1=O BB57-3772 [1,0,0,1,0,0|2,0,0]=4
36  B8R1.5  CN1CCCNC1=O BB58-3630 [1,0,0,1,0,0|2,0,0]=4
37  B8R1.5  NC1CCCNC1=O BB01-4609 [1,0,0,1,0,0|2,0,0]=4
38  B8R1.8  ClCCN1CCCC1 BB58-4124 [1,0,0,1,0,0|2,0,0]=4
39  B8R1.8  NCCN1CCCC1 BB57-0243 [1,0,0,1,0,0|2,0,0]=4
40  B8R1.8  O=C=NC1CCCC1 BB01-4455 [1,0,0,1,0,0|1,0,1]=4
41  B8R1.11  O=C1CCCN1CO BB58-4363 [1,0,0,1,0,0|2,0,0]=4
42  B8R1.49  C1CCCNCCC1 BB57-3737 [1,0,0,1,0,0|1,0,0]=3
43  B10R1.18  CC(=O)NC1CCCNC1 BB58-0018 [0,1,0,1,0,0|2,0,0]=4
44  B10R1.18  O=C(Cl)CC1CCCCC1 BB20-1593 [0,1,0,1,0,0|0,0,0]=2
45  B10R1.18  O=C(O)CN1CCOCC1 BB01-3856 [0,1,0,1,0,0|2,0,0]=4
46  B10R1.61  CC1CCCCC1C(=O)O BB58-4370 [0,1,0,1,0,0|0,0,0]=2
47  B10R1.78  O=C1CCCCCCCN1 BB58-3251 [0,1,0,1,0,0|0,0,0]=2
48  B10R1.348  O=C(O)C1CCCCCC1 BB58-4365 [0,1,0,1,0,0|0,0,0]=2
49  B10R1.21  CCCNCC1CCCO1 BB55-3513 [0,1,0,1,0,0|0,0,2]=4
50  B10R1.21  N#CCCCN1CCCC1 BB01-7796 [0,1,0,1,0,0|1,0,1]=4
51  B10R1.21  NCCCCN1CCCC1 BB57-6675 [0,1,0,1,0,0|1,0,1]=4
52  B10R1.29  NCCCN1CCCC1=O BB01-3614 [0,1,0,1,0,0|1,0,0]=3
53  B10R1.4  CC1CCCCN1CCN BB01-5207 [0,1,0,1,0,0|1,0,1]=4
54  B10R1.17  CCCCC1CCNCC1 BB32-1586 [0,1,0,1,0,0|1,0,1]=4
55  B10R1.17  N#CCCN1CCCCC1 BB05-1525 [0,1,0,1,0,0|1,0,1]=4
56  B10R1.17  NCCCN1CCCCC1 BB01-5125 [0,1,0,1,0,0|1,0,1]=4
57  B10R1.1  CCCC1CCC(O)CC1 BB01-6231 [0,1,0,1,0,0|1,0,1]=4
58  B10R1.2  CNC1CCCC(C)C1C BB01-5286 [0,1,0,1,0,0|2,0,0]=4
59  B10R2.99  NCC1CC2C=CC1C2 BB01-4403 [0,0,0,2,0,0|2,0,0]=4