0  B15R3.441491  CC12CC3CC(C1)(CC(C3)(C2)N)C Z1551429722 [0,0,0,0,0,0|0,0,0]=0
1  B15R3.441491  CC12CC3CC(C1)(CC(C3)(C2)O)C Z56852724 [0,0,0,0,0,0|1,0,0]=1
2  B14R3.63177  CC12CC3CC(C1)CC(C3)(C2)C Z1365497409 [1,0,0,0,0,0|0,0,0]=1
3  B14R3.63177  CC12CC3CC(C1)CC(C3)(C2)O Z56783005 [1,0,0,0,0,0|1,0,0]=2
4  B14R3.63177  NC12CC3CC(C1)CC(C3)(C2)F Z2753047591 [1,0,0,0,0,0|1,0,0]=2
5  B14R3.63177  NC12CC3CC(C1)CC(C3)(C2)O Z1203159519 [1,0,0,0,0,0|1,0,0]=2
6  B14R3.63177  OC12CC3CC(C1)CC(C3)(C2)O Z1509059210 [1,0,0,0,0,0|2,0,0]=3
7  B16R3.1641211  CC12CC3CC(C1)(CC(C3)(C2)CN)C Z2106605416 [0,1,0,0,0,0|0,0,0]=1
8  B16R3.1641211  CC12CC3CC(C1)(CC(C3)(C2)CO)C Z56853712 [0,1,0,0,0,0|1,0,0]=2
9  B16R3.1721476  BrC12CC3(CC(C1)(CC(C2)(C3)Br)Br)Br Z56757726 [0,1,0,0,0,0|3,0,0]=4
10  B16R3.1721476  CC12CC3(CC(C1)(CC(C2)(C3)Br)Br)Br Z56867290 [0,1,0,0,0,0|2,0,0]=3
11  B16R3.1721476  CC12CC3(CC(C1)(CC(C2)(C3)Br)Br)C Z56822538 [0,1,0,0,0,0|1,0,0]=2
12  B16R3.1721476  CC12CC3(CC(C1)(CC(C2)(C3)F)N)C Z3500496284 [0,1,0,0,0,0|0,0,0]=1
13  B16R3.1721476  CC12CC3(CC(C1)(CC(C2)(C3)O)N)C Z1262638303 [0,1,0,0,0,0|0,0,0]=1
14  B13R2.12956  N[C@H]1C[C@@H]2C[C@H](C1)CC(C2)(F)F Z4657066720 [1,0,1,0,0,0|2,0,0]=4
15  B13R3.10150  BrC12CC3CC(C1)CC(C3)C2 Z56762205 [2,0,0,0,0,0|1,0,0]=3
16  B13R3.10150  ClC12CC3CC(C1)CC(C3)C2 Z56771135 [2,0,0,0,0,0|1,0,0]=3
17  B13R3.10150  NC12CC3CC(C1)CC(C3)C2 Z1522567174 [2,0,0,0,0,0|0,0,0]=2
18  B13R3.10150  OC12CC3CC(C1)CC(C3)C2 Z56771134 [2,0,0,0,0,0|1,0,0]=3
19  B13R3.10150  SC12CC3CC(C1)CC(C3)C2 Z111411218 [2,0,0,0,0,0|1,0,0]=3
20  B15R3.273369  N#CC12CC3CC(C1)CC(C3)(C2)Cl Z56852713 [1,1,0,0,0,0|1,0,1]=4
21  B15R3.273369  NC12CC3CC(C1)CC(C3)(O2)CO Z56821446 [1,1,0,0,0,0|1,0,0]=3
22  B15R3.273369  NCC12CC3CC(C1)CC(C3)(C2)Cl Z57018817 [1,1,0,0,0,0|1,0,0]=3
23  B15R3.273369  NCC12CC3CC(C1)CC(C3)(C2)O Z3244922010 [1,1,0,0,0,0|1,0,0]=3
24  B15R3.273369  OCC12CC3CC(C1)CC(C3)(C2)O Z1509060165 [1,1,0,0,0,0|1,0,0]=3
25  B17R3.3912519  CC12CC3(CC(C1)(C([N+](C2)(C3)C)[O-])C)C Z56769416 [0,2,0,0,0,0|2,0,0]=4
26  B17R3.5878818  CC(N)C12CC3CC(C1)(CC(C3)(C2)C)C Z3234944764 [0,2,0,0,0,0|0,0,0]=2
27  B17R3.5878818  CC12CC3CC(C1)(CC(C3)(C2)C(=O)O)Br Z56757116 [0,2,0,0,0,0|1,0,1]=4
28  B17R3.5878818  CC12CC3CC(C1)(CC(C3)(C2)C(=O)O)C Z56757109 [0,2,0,0,0,0|1,0,0]=3