0  B16R1.57  CCc1ccccc1SCCCCC(C)C 62a_100011215823_100011216152 [1,0,0,0,0,0|2,1,0]=4
1  B16R1.57  CCc1ccccc1SCCCCC(C)C 62a_100011216152_100011215823 [1,0,0,0,0,0|2,1,0]=4
2  B16R1.57  CSc1ccccc1SCCCCC(C)C 62a_100011216152_100011217816 [1,0,0,0,0,0|1,2,0]=4
3  B16R1.57  CSc1ccccc1SCCCCC(C)C 62a_100011217816_100011216152 [1,0,0,0,0,0|1,2,0]=4
4  B17R1.747  CCOc1ccccc1SCCCCC(C)C 62a_100000230754_100011216152 [1,1,0,0,0,0|1,1,0]=4
5  B17R1.747  CCOc1ccccc1SCCCCC(C)C 62a_100011216152_100000230754 [1,1,0,0,0,0|1,1,0]=4
6  B17R1.4712  COc1ccc(cc1SCCCCC(C)C)Br 62a_100011216152_100012351588 [1,1,0,0,0,0|1,1,0]=4
7  B17R1.4712  COc1ccc(cc1SCCCCC(C)C)Br 62a_100012351588_100011216152 [1,1,0,0,0,0|1,1,0]=4
8  B17R1.4712  COc1ccc(cc1SCCCCC(C)C)Cl 62a_100011215930_100011216152 [1,1,0,0,0,0|1,1,0]=4
9  B17R1.4712  COc1ccc(cc1SCCCCC(C)C)Cl 62a_100011216152_100011215930 [1,1,0,0,0,0|1,1,0]=4
10  B17R1.5310  CCc1cc(ccc1OCCCCC(C)C)Br 34a_100012338938_100011216152 [1,1,0,0,0,0|2,0,0]=4
11  B17R1.5310  CCc1cc(ccc1OCCCCC(C)C)Br 7a_100012338938_100011216152 [1,1,0,0,0,0|2,0,0]=4
12  B17R1.5310  COc1cc(ccc1SCCCCC(C)C)Br 62a_100010245111_100011216152 [1,1,0,0,0,0|1,1,0]=4
13  B17R1.5310  COc1cc(ccc1SCCCCC(C)C)Br 62a_100011216152_100010245111 [1,1,0,0,0,0|1,1,0]=4
14  B17R1.5310  COc1cc(ccc1SCCCCC(C)C)Cl 62a_100000050115_100011216152 [1,1,0,0,0,0|1,1,0]=4
15  B17R1.5310  COc1cc(ccc1SCCCCC(C)C)Cl 62a_100011216152_100000050115 [1,1,0,0,0,0|1,1,0]=4
16  B17R1.7390  COc1c(cccc1SCCCCC(C)C)Br 62a_100010146560_100011216152 [1,1,0,0,0,0|1,1,0]=4
17  B17R1.7390  COc1c(cccc1SCCCCC(C)C)Br 62a_100011216152_100010146560 [1,1,0,0,0,0|1,1,0]=4
18  B17R1.7390  COc1c(cccc1SCCCCC(C)C)Cl 62a_100010147678_100011216152 [1,1,0,0,0,0|1,1,0]=4
19  B17R1.7390  COc1c(cccc1SCCCCC(C)C)Cl 62a_100011216152_100010147678 [1,1,0,0,0,0|1,1,0]=4
20  B17R1.16398  CC(C)CCCCOc1ccccc1C(C)C 34a_100000211617_100011216152 [1,1,0,0,0,0|2,0,0]=4
21  B17R1.16398  CC(C)CCCCOc1ccccc1C(C)C 7a_100000211617_100011216152 [1,1,0,0,0,0|2,0,0]=4
22  B17R1.28458  CCc1cccc(c1OCCCCC(C)C)Br 34a_200010001580_100011216152 [1,1,0,0,0,0|2,0,0]=4
23  B17R1.28458  CCc1cccc(c1OCCCCC(C)C)Br 7a_200010001580_100011216152 [1,1,0,0,0,0|2,0,0]=4
24  B17R1.28458  COc1cccc(c1SCCCCC(C)C)Br 62a_100010131421_100011216152 [1,1,0,0,0,0|1,1,0]=4
25  B17R1.28458  COc1cccc(c1SCCCCC(C)C)Br 62a_100011216152_100010131421 [1,1,0,0,0,0|1,1,0]=4
26  B17R1.1419  COc1ccccc1SCCCCCC(C)C 62a_100000210334_100000210682 [1,0,0,0,0,1|1,1,0]=4
27  B17R1.1419  COc1ccccc1SCCCCCC(C)C 62a_100000210682_100000210334 [1,0,0,0,0,1|1,1,0]=4
28  B17R1.1419  CSc1ccccc1OCCCCCC(C)C 34a_100011216402_100000210682 [1,0,0,0,0,1|1,1,0]=4