0  B8R0.7  C\C=C\CCCC(=O)O 4074621 [1,0,0,0,0,0|1,0,1]=3
1  B10R1.54  CC1=NN(CC(=O)O)CC1 4035241 [0,0,0,1,0,0|3,0,0]=4
2  B10R1.54  CN1CCC(CC(=O)O)C1 4004912 [0,0,0,1,0,0|3,0,0]=4
3  B10R1.54  O=C(O)C[C@@H]1CCC(=O)N1 4080838 [0,0,0,1,0,0|1,0,0]=2
4  B10R1.54  O=C(O)C[C@H]1CCC(=O)N1 4079802 [0,0,0,1,0,0|1,0,0]=2
5  B10R1.113  O=C(O)[C@@H]1CCC[C@@H](O)C1 4110383 [0,0,0,1,0,0|1,0,1]=3
6  B10R1.113  O=C(O)[C@@H]1CCC[C@H](O)C1 4110843 [0,0,0,1,0,0|1,0,1]=3
7  B8R0.28  NC(=O)CCCC(=O)O 4027348 [0,0,0,0,1,0|1,0,0]=2
8  B8R0.28  NC(=O)COCC(=O)O 4026979 [0,0,0,0,1,0|2,0,0]=3
9  B8R0.28  NC(=O)CSCC(=O)O 4029864 [0,0,0,0,1,0|2,0,0]=3
10  B7R0.4  C=CCSCC(=O)O 4026839 [2,0,0,0,0,0|1,0,1]=4
11  B7R0.4  CC(=O)NCCCO 4032317 [2,0,0,0,0,0|2,0,0]=4
12  B7R0.4  CCCOCC(=O)O 4020861 [2,0,0,0,0,0|1,0,1]=4
13  B7R0.4  CCCSCC(=O)O 4028731 [2,0,0,0,0,0|1,0,1]=4
14  B7R0.4  CCSCCC(=O)O 4028457 [2,0,0,0,0,0|1,0,1]=4
15  B9R0.2  COCCCCCC(=O)O 4021515 [1,1,0,0,0,0|0,0,1]=3
16  B9R0.4  CCCCC(N)CC(=O)O 4012458 [1,1,0,0,0,0|1,0,1]=4
17  B9R0.53  CC(=O)NC(C)CC(=O)O 4027009 [0,1,0,0,1,0|2,0,0]=4
18  B9R1.6  O=C(O)C1CCCCO1 4014945 [1,0,0,1,0,0|0,0,1]=3
19  B9R1.13  O=C(O)CC1CCCN1 4004817 [1,0,0,1,0,0|1,0,1]=4
20  B9R1.13  O=C(O)CC1CCOC1 4004832 [1,0,0,1,0,0|2,0,0]=4
21  B9R1.41  CN1CCC[C@H]1C(=O)O 4030671 [1,0,0,1,0,0|2,0,0]=4
22  B9R1.84  O=C(O)CCC1CCC1 4030352 [1,0,0,1,0,0|1,0,1]=4
23  B9R1.35  O=C1CC(C(=O)O)CN1 4002892 [0,0,0,1,1,0|2,0,0]=4
24  B9R1.35  O=C1NCC(C(=O)O)N1 4029000 [0,0,0,1,1,0|2,0,0]=4
25  B9R1.35  O=C1N[C@H](C(=O)O)CO1 4045606 [0,0,0,1,1,0|2,0,0]=4
26  B11R1.157  O=C(O)CN1CCNC(=O)C1 4014694 [0,0,0,1,0,1|2,0,0]=4
27  B11R1.178  NC(=O)N1CCCC1C(=O)O 6050310 [0,0,0,1,0,1|1,0,0]=3
28  B11R1.178  NC(=O)N1CCC[C@H]1C(=O)O 4045607 [0,0,0,1,0,1|1,0,0]=3
29  B11R1.710  O=C(O)CC1CCS(=O)(=O)C1 4002025 [0,1,0,1,0,0|1,0,1]=4
30  B11R1.20  O=C(O)CC1CCC(=O)CC1 4018513 [0,1,0,1,0,0|1,0,0]=3
31  B11R2.845  O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 4066258 [0,0,0,2,0,0|1,0,1]=4
32  B11R2.845  O=C(O)[C@H]1C[C@@H]2CC[C@H]1O2 4073739 [0,0,0,2,0,0|1,0,1]=4