0  B13R1.3251  COc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_200009813841_200000210301 [0,1,0,0,0,0|0,0,0]=1
1  B13R1.3251  COc1c(c(c(c(c1Br)Br)Br)Br)C 34a_100009814330_200000210301 [0,1,0,0,0,0|1,0,0]=2
2  B13R1.3251  COc1c(c(c(c(c1Br)Br)Br)Br)C 7a_100009814330_200000210301 [0,1,0,0,0,0|1,0,0]=2
3  B13R1.3251  COc1c(c(c(c(c1Br)Br)C)Br)Br 34a_100009813884_200000210301 [0,1,0,0,0,0|1,0,0]=2
4  B13R1.3251  COc1c(c(c(c(c1Br)Br)C)Br)Br 7a_100009813884_200000210301 [0,1,0,0,0,0|1,0,0]=2
5  B13R1.3251  Cc1c(c(c(c(c1Br)Br)O[13CH3])Br)Br 34a_100009813884_200025704644 [0,1,0,0,0,0|1,0,0]=2
6  B13R1.3251  Cc1c(c(c(c(c1Br)Br)O[13CH3])Br)Br 7a_100009813884_200025704644 [0,1,0,0,0,0|1,0,0]=2
7  B13R1.3251  Cc1c(c(c(c(c1O[13CH3])Br)Br)Br)Br 34a_100009814330_200025704644 [0,1,0,0,0,0|1,0,0]=2
8  B13R1.3251  Cc1c(c(c(c(c1O[13CH3])Br)Br)Br)Br 7a_100009814330_200025704644 [0,1,0,0,0,0|1,0,0]=2
9  B13R1.3251  [13CH3]Oc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_200009813841_200025704644 [0,1,0,0,0,0|0,0,0]=1
10  B14R1.5287  CCOc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_200009813841_100000210202 [0,2,0,0,0,0|0,0,0]=2
11  B14R1.5287  CCOc1c(c(c(c(c1Br)Br)Br)Br)C 34a_100009814330_100000210202 [0,2,0,0,0,0|1,0,0]=3
12  B14R1.5287  CCOc1c(c(c(c(c1Br)Br)Br)Br)C 7a_100009814330_100000210202 [0,2,0,0,0,0|1,0,0]=3
13  B14R1.5287  CCOc1c(c(c(c(c1Br)Br)C)Br)Br 34a_100009813884_100000210202 [0,2,0,0,0,0|1,0,0]=3
14  B14R1.5287  CCOc1c(c(c(c(c1Br)Br)C)Br)Br 7a_100009813884_100000210202 [0,2,0,0,0,0|1,0,0]=3
15  B14R1.5287  CNCc1c(c(c(c(c1Br)Br)Br)Br)Br 2230a_106832991635_100010005494 [0,2,0,0,0,0|1,0,0]=3
16  B14R1.5287  CNCc1c(c(c(c(c1Br)Br)Br)Br)Br 26a_100102657272_200009813841 [0,2,0,0,0,0|1,0,0]=3
17  B14R1.5287  CNCc1c(c(c(c(c1Br)Br)Br)Br)Br 34a_100102657272_100010005494 [0,2,0,0,0,0|1,0,0]=3
18  B14R1.5287  CNCc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_106832991635_100010005494 [0,2,0,0,0,0|1,0,0]=3
19  B14R1.5287  COCc1c(c(c(c(c1Br)Br)Br)Br)Br 34a_100138415774_100010005494 [0,2,0,0,0,0|0,0,0]=2
20  B14R1.5287  COCc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_100009813355_200000210301 [0,2,0,0,0,0|0,0,0]=2
21  B14R1.5287  Cc1c(c(c(c(c1Br)Br)OCF)Br)Br 34a_100009813884_100015361967 [0,2,0,0,0,0|1,0,0]=3
22  B14R1.5287  Cc1c(c(c(c(c1Br)Br)OCF)Br)Br 7a_100009813884_100015361967 [0,2,0,0,0,0|1,0,0]=3
23  B14R1.5287  Cc1c(c(c(c(c1OCF)Br)Br)Br)Br 34a_100009814330_100015361967 [0,2,0,0,0,0|1,0,0]=3
24  B14R1.5287  Cc1c(c(c(c(c1OCF)Br)Br)Br)Br 7a_100009814330_100015361967 [0,2,0,0,0,0|1,0,0]=3
25  B14R1.5287  FCOc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_200009813841_100015361967 [0,2,0,0,0,0|0,0,0]=2
26  B14R1.5287  [13CH3]OCc1c(c(c(c(c1Br)Br)Br)Br)Br 7a_100009813355_200025704644 [0,2,0,0,0,0|0,0,0]=2