0  B7R0.1  O=CNCCNC=O BB31-6256 [1,0,0,0,0,0|3,0,0]=4
1  B7R0.4  N#CCCCC(=O)O BB31-7795 [1,0,0,0,0,0|2,0,1]=4
2  B7R0.4  NC(=O)CCCCO BB31-4574 [1,0,0,0,0,0|2,0,1]=4
3  B9R0.2  C\C=C\C=C\COC(C)=O BB31-2942 [0,1,0,0,0,0|0,0,2]=3
4  B9R0.47  C=CCCC[C@@H](N)C(=O)O BB31-8480 [0,1,0,0,0,0|2,0,0]=3
5  B9R1.2  CCC1CCCC(=O)C1 BB31-8126 [0,0,0,1,0,0|1,0,2]=4
6  B9R1.2  NCC1CCNC(=O)C1 BB32-0239 [0,0,0,1,0,0|2,0,1]=4
7  B9R1.2  O=C1CC(CO)CCN1 BB32-2912 [0,0,0,1,0,0|2,0,1]=4
8  B9R1.7  CCCC1COC(=O)O1 BB31-8496 [0,0,0,1,0,0|1,0,2]=4
9  B9R1.13  CC(=O)N[C@H]1CCNC1 BB31-0573 [0,0,0,1,0,0|2,0,1]=4
10  B9R1.13  CC(=O)OC1CCCO1 BB31-3264 [0,0,0,1,0,0|1,0,1]=3
11  B9R1.48  O=C1CCCNC(=O)C1 BB31-4559 [0,0,0,1,0,0|2,0,0]=3
12  B6R0.4  CC(=O)CCCBr BB31-6000 [2,0,0,0,0,0|1,0,0]=3
13  B6R0.4  COCOC(C)=O BB32-2824 [2,0,0,0,0,0|1,0,0]=3
14  B8R0.5  CCCC(C)CC(C)=O BB32-3065 [1,1,0,0,0,0|0,0,2]=4
15  B8R0.8  C=CCC[C@H](N)C(=O)O BB31-7442 [1,1,0,0,0,0|1,0,0]=3
16  B8R0.9  CCC(C)CCC(C)=O BB31-3584 [1,1,0,0,0,0|0,0,2]=4
17  B8R0.28  CC(=O)CCOC(C)=O BB31-0205 [1,1,0,0,0,0|0,0,1]=3
18  B8R0.28  NC(=O)CCCC(N)=O BB31-6283 [1,1,0,0,0,0|2,0,0]=4
19  B10R0.97  CC(=O)NCSCCC(=O)O BB31-6087 [0,2,0,0,0,0|2,0,0]=4
20  B8R1.22  O=C1CCCOCC1 BB32-3102 [1,0,0,1,0,0|1,0,1]=4
21  B8R1.1  C=CC1CCC(=O)N1 BB31-7031 [1,0,0,1,0,0|1,0,0]=3
22  B8R1.1  N#CC1CCC(=O)C1 BB32-2063 [1,0,0,1,0,0|1,0,1]=4
23  B8R1.1  O=C1N[C@@H](CI)CO1 BB31-2803 [1,0,0,1,0,0|2,0,0]=4
24  B8R1.1  O=C1N[C@H](CO)CO1 BB31-1953 [1,0,0,1,0,0|2,0,0]=4
25  B8R1.4  CC1CCNC(=O)C1 BB31-5195 [1,0,0,1,0,0|1,0,1]=4
26  B8R1.4  CC1CCOC(=O)O1 BB31-3403 [1,0,0,1,0,0|1,0,1]=4
27  B8R1.4  CN1CCCC(=O)C1 BB31-5533 [1,0,0,1,0,0|1,0,1]=4
28  B8R1.4  O=C1CCCC(O)C1 BB31-8636 [1,0,0,1,0,0|1,0,1]=4
29  B8R1.4  O=C1C[C@H](O)CCN1 BB31-8745 [1,0,0,1,0,0|2,0,0]=4
30  B8R1.6  COCC1CC(=O)C1 BB31-5157 [1,0,0,1,0,0|1,0,1]=4
31  B8R1.6  N#CCC1CC(=O)C1 BB31-3932 [1,0,0,1,0,0|1,0,1]=4
32  B8R1.7  CC(=O)[C@@H]1CCCO1 BB31-1725 [1,0,0,1,0,0|1,0,1]=4
33  B8R1.7  O=C(O)[C@@H]1C=CCN1 BB31-3955 [1,0,0,1,0,0|2,0,0]=4
34  B8R1.7  O=C(O)[C@@H]1C=CCN1 BB31-5745 [1,0,0,1,0,0|2,0,0]=4
35  B10R1.54  CC(=O)O[C@H]1C=C[C@@H](O)C1 BB31-4648 [0,1,0,1,0,0|0,0,0]=2
36  B10R1.54  O=C(O)CC1CCC(=O)C1 BB31-7997 [0,1,0,1,0,0|2,0,0]=4
37  B10R1.39  CC(=O)N1CCCC1C=O BB31-0666 [0,1,0,1,0,0|1,0,1]=4
38  B10R1.61  CC(=O)N1CCCCC1=O BB32-1384 [0,1,0,1,0,0|1,0,1]=4
39  B10R1.15  COC(=O)C1=COCCC1 BB31-6594 [0,1,0,1,0,0|2,0,0]=4
40  B10R2.71  O=C1CC2C=CC(C1)O2 BB31-4964 [0,0,0,2,0,0|2,0,0]=4