0  B9R1.35  O=C(O)C1CC(O)CN1 BB57-0232 [0,0,0,0,0,0|0,0,0]=0
1  B9R1.35  O=C1CCC(C(=O)O)C1 BB01-6440 [0,0,0,0,0,0|1,0,2]=3
2  B8R1.7  O=C(O)C1CC=CC1 BB01-7889 [1,0,0,0,0,0|1,0,2]=4
3  B8R1.7  O=C(O)C1CCOC1 BB58-1384 [1,0,0,0,0,0|2,0,0]=3
4  B8R1.7  O=C(O)C1CSCN1 BB57-0213 [1,0,0,0,0,0|1,0,0]=2
5  B8R0.8  CCCCC(C)C(=O)O BB58-4619 [0,0,1,0,0,0|2,0,0]=3
6  B8R0.8  CCCNC(=O)C(=O)O BB55-4706 [0,0,1,0,0,0|2,0,1]=4
7  B8R0.8  NCCCC(N)C(=O)O BB57-0193 [0,0,1,0,0,0|3,0,0]=4
8  B8R0.28  O=C(O)CSCC(=O)O BB01-8012 [0,0,1,0,0,0|2,0,1]=4
9  B10R1.13  CC1CCC(C(=O)O)CC1 BB58-4355 [0,0,0,0,0,1|2,0,0]=3
10  B10R1.113  CC1CCCC(C(=O)O)C1 BB58-4369 [0,0,0,0,0,1|2,0,0]=3
11  B7R0.3  CC(CO)CCCO BB58-5344 [1,0,1,0,0,0|1,0,1]=4
12  B7R0.4  CC(=O)CCCCCl BB57-6752 [1,0,1,0,0,0|2,0,0]=4
13  B7R0.4  CCOCCC(=O)O BB57-3742 [1,0,1,0,0,0|2,0,0]=4
14  B7R0.4  CNCCCC(=O)O BB58-0143 [1,0,1,0,0,0|2,0,0]=4
15  B7R0.5  CCNC(C)C(N)=O BB58-3590 [1,0,1,0,0,0|1,0,0]=3
16  B7R0.5  NCCC(N)C(=O)O BB57-6108 [1,0,1,0,0,0|1,0,0]=3
17  B7R0.6  CC(C)OCC(=O)O BB55-5141 [1,0,1,0,0,0|2,0,0]=4
18  B7R0.2  CC(C)CC(N)CO BB20-2191 [1,0,1,0,0,0|1,0,1]=4
19  B7R1.1  OCC1CCCN1 BB01-5343 [2,0,0,0,0,0|0,0,1]=3
20  B7R1.1  OC[C@H]1CCCO1 BB31-4654 [2,0,0,0,0,0|1,0,1]=4
21  B9R0.42  CC(NC(=O)CN)C(=O)O BB58-4661 [0,1,1,0,0,0|1,0,1]=4
22  B9R0.53  CC(C)CC(N)CC(=O)O BB57-0289 [0,1,1,0,0,0|2,0,0]=4
23  B9R1.11  COC(=O)C1CCCN1 BB58-4127 [1,1,0,0,0,0|0,0,0]=2
24  B11R1.3  NCC1CCC(C(=O)O)CC1 BB57-0219 [0,1,0,0,0,1|2,0,0]=4
25  B9R1.6  O=C(O)C1CCCCC1 BB01-5902 [0,0,1,1,0,0|2,0,0]=4
26  B9R1.6  O=C(O)C1CNCCN1 BB01-8283 [0,0,1,1,0,0|1,0,0]=3
27  B9R1.13  O=C(Cl)CC1CCCC1 BB20-1616 [1,0,0,0,0,1|2,0,0]=4