0  B9R1.6  CC(=O)C1=CCCCC1 1458a_100000765259_200000210301 [1,0,0,0,0,0|2,0,0]=3
1  B9R1.6  CC(=O)C1=CCCCO1 1458a_100000764163_200000210301 [1,0,0,0,0,0|3,0,0]=4
2  B9R1.6  CC(=O)C1=COCCC1 1458a_100000749935_200000210301 [1,0,0,0,0,0|3,0,0]=4
3  B9R1.6  [13CH3]C(=O)C1=CCCCC1 1458a_100000765259_200025704644 [1,0,0,0,0,0|2,0,0]=3
4  B9R1.6  [13CH3]C(=O)C1=CCCCO1 1458a_100000764163_200025704644 [1,0,0,0,0,0|3,0,0]=4
5  B9R1.6  [13CH3]C(=O)C1=COCCC1 1458a_100000749935_200025704644 [1,0,0,0,0,0|3,0,0]=4
6  B8R0.8  CCC/C=C(\C)/C(=O)C 1458a_200020648666_200000210301 [1,0,1,0,0,0|2,0,0]=4
7  B8R0.8  CCC/C=C(\C)/C(=O)[13CH3] 1458a_200020648666_200025704644 [1,0,1,0,0,0|2,0,0]=4
8  B8R0.7  CCCCC=CC(=O)C 1458a_100016266645_200000210301 [1,0,1,0,0,0|2,0,0]=4
9  B8R0.7  CCCCC=CC(=O)[13CH3] 1458a_100016266645_200025704644 [1,0,1,0,0,0|2,0,0]=4
10  B8R0.7  CCNC/C=C/B(O)O 2230a_100015525214_100016262062 [1,0,1,0,0,0|1,0,1]=4
11  B10R1.15  CCC(=O)C1=CCCCC1 1458a_100000765259_100000210202 [1,1,0,0,0,0|2,0,0]=4
12  B10R1.15  CNC(=O)C1=CCCCC1 11a_106832991635_100000765259 [1,1,0,0,0,0|2,0,0]=4
13  B10R1.15  CNC(=O)C1=CCCCC1 1626a_100102657272_100000765259 [1,1,0,0,0,0|2,0,0]=4
14  B10R1.15  CNC(=O)C1=CCCCC1 240690a_100102657272_100000765259 [1,1,0,0,0,0|2,0,0]=4
15  B10R1.15  CNC(=O)C1=CCCCC1 527a_100102657272_100000765259 [1,1,0,0,0,0|2,0,0]=4
16  B10R1.15  O=C(CF)C1=CCCCC1 1458a_100000765259_100015361967 [1,1,0,0,0,0|2,0,0]=4
17  B10R1.95  CCNC1C=CS(=O)(=O)C1 2230a_100000687631_100000210202 [0,0,1,1,0,0|1,0,1]=4
18  B10R1.95  CCNC1C=CS(=O)(=O)C1 2230a_100015525214_100000702656 [0,0,1,1,0,0|1,0,1]=4
19  B10R1.95  CCNC1C=CS(=O)(=O)C1 34a_100000687631_100000210202 [0,0,1,1,0,0|1,0,1]=4
20  B8R1.7  CC(=O)C1=CCCC1 1458a_100000038896_200000210301 [1,0,0,0,1,0|1,0,0]=3
21  B8R1.7  CC(=O)C1=CCOC1 1458a_100000139269_200000210301 [1,0,0,0,1,0|2,0,0]=4
22  B8R1.7  CC(=O)C1=COCC1 1458a_100000750620_200000210301 [1,0,0,0,1,0|2,0,0]=4
23  B8R1.7  [13CH3]C(=O)C1=CCCC1 1458a_100000038896_200025704644 [1,0,0,0,1,0|1,0,0]=3
24  B8R1.7  [13CH3]C(=O)C1=CCOC1 1458a_100000139269_200025704644 [1,0,0,0,1,0|2,0,0]=4
25  B8R1.7  [13CH3]C(=O)C1=COCC1 1458a_100000750620_200025704644 [1,0,0,0,1,0|2,0,0]=4
26  B10R1.18  CC(=O)CC1=CCCCC1 1458a_100000039269_200000210301 [1,0,0,0,0,1|2,0,0]=4
27  B10R1.18  [13CH3]C(=O)CC1=CCCCC1 1458a_100000039269_200025704644 [1,0,0,0,0,1|2,0,0]=4