0  B9R1.8  C1CCC(CC1)N=C=S 5699 [1,0,0,0,0,0|1,1,1]=4
1  B9R1.8  C1COCCN1CCO 5713 [1,0,0,0,0,0|2,0,1]=4
2  B9R1.6  C1CC(CC=C1)C(=O)O 5455 [0,0,0,0,1,0|0,0,2]=3
3  B9R1.6  C1CC(CC=C1)C(=O)O 8425 [0,0,0,0,1,0|0,0,2]=3
4  B9R1.6  C1CC(CNC1)C(=O)O 5653 [0,0,0,0,1,0|1,0,0]=2
5  B9R1.6  C1CCNC(C1)C(=O)O 5668 [0,0,0,0,1,0|1,0,0]=2
6  B9R1.6  C1CCNC(C1)C(=O)O 9852 [0,0,0,0,1,0|1,0,0]=2
7  B9R1.6  C1CNC(CN1)C(=O)O 8992 [0,0,0,0,1,0|2,0,0]=3
8  B9R1.6  C1CNCCC1C(=O)O 5224 [0,0,0,0,1,0|1,0,0]=2
9  B9R1.6  C1CNCCC1C(=O)O 8612 [0,0,0,0,1,0|1,0,0]=2
10  B8R0.4  C=CCCCCCCBr 10114 [1,0,1,0,0,0|2,0,0]=4
11  B8R1.2  C1CCNC(C1)CO 6795 [2,0,0,0,0,0|1,0,0]=3
12  B8R1.2  C1CNCCC1CO 10405 [2,0,0,0,0,0|1,0,0]=3
13  B8R1.2  C1COCCC1CN 6624 [2,0,0,0,0,0|2,0,0]=4
14  B10R0.74  CCCCCCCC(=O)NO 8621 [0,1,1,0,0,0|0,0,0]=2
15  B10R0.97  C(CCC(=O)O)CCC(=O)O 10648 [0,1,1,0,0,0|1,0,1]=4
16  B10R0.79  C(CO)N(CCO)CC(=O)O 8092 [0,1,1,0,0,0|2,0,0]=4
17  B10R1.13  CN1CCC(CC1)C(=O)O M0072 [0,1,0,0,1,0|1,0,0]=3
18  B10R1.13  C[NH+]1CCC(CC1)C(=O)O 5019 [0,1,0,0,1,0|1,0,0]=3
19  B12R1.3862  C1CCC(CC1)(CC(=O)O)CN 10142 [0,2,0,0,0,0|0,0,0]=2
20  B10R2.62  C1CN2CCC1C(=O)C2 6743 [1,0,0,1,0,0|1,0,0]=3
21  B12R2.2918  C1CCC2(CC1)CC(=O)NC2 10425 [0,0,0,1,0,1|1,0,0]=3
22  B8R1.7  C1CC(NC1)C(=O)O 9203 [0,0,0,0,2,0|1,0,0]=3
23  B8R1.7  C1CCC(C1)C(=O)O 8636 [0,0,0,0,2,0|0,0,0]=2
24  B8R1.7  C1COCC1C(=O)O 8251 [0,0,0,0,2,0|1,0,0]=3
25  B8R1.7  C1CSC(N1)C(=O)O 9309 [0,0,0,0,2,0|2,0,0]=4
26  B8R1.7  C1C[C@H]([NH2+]C1)C(=O)[O-] 9557 [0,0,0,0,2,0|1,0,1]=4