0  B11R1.12  CCC(c1ccccc1)NC 21630 [0,0,0,0,0,0|2,0,0]=2
1  B11R1.12  CCN(c1ccccc1)N=O 21063 [0,0,0,0,0,0|4,0,0]=4
2  B11R1.12  COC(c1ccncn1)OC 10007120 [0,0,0,0,0,0|2,0,0]=2
3  B10R1.15  CC(CN)c1ccccc1 17742 [1,0,0,0,0,0|2,0,0]=3
4  B10R1.15  c1ccc(cc1)[C@H](CO)N 10007132 [1,0,0,0,0,0|3,0,0]=4
5  B12R1.478  CC(=O)C(C#N)c1ccccc1 21105 [0,1,0,0,0,0|3,0,0]=4
6  B12R1.118  CCC(Cc1ccccc1)NC 15961 [0,0,0,0,0,1|2,0,0]=3
7  B9R1.8  c1ccc(cc1)CCBr 20087 [2,0,0,0,0,0|2,0,0]=4
8  B9R1.8  c1ccc(cc1)CCN 14206 [2,0,0,0,0,0|2,0,0]=4
9  B11R1.16  CC(CNC)c1ccccc1 18563 [1,1,0,0,0,0|1,0,0]=3
10  B11R1.22  c1cc(ccc1C(CN)O)O 14279 [1,1,0,0,0,0|2,0,0]=4
11  B11R1.36  C[C@@H]([C@H](c1ccccc1)O)N 13868 [1,1,0,0,0,0|1,0,0]=3
12  B11R1.36  C[C@H]([C@@H](c1ccccc1)O)N 15975 [1,1,0,0,0,0|1,0,0]=3
13  B11R1.36  C[C@H]([C@H](c1ccccc1)O)N 14212 [1,1,0,0,0,0|1,0,0]=3
14  B11R1.36  c1ccc(cc1)[C@H](C(=O)O)O 10007128 [1,1,0,0,0,0|2,0,0]=4
15  B13R1.79  CCC(Cc1ccccc1)NCC 9001863 [0,1,0,0,0,1|2,0,0]=4
16  B13R1.86  CCC(C(=O)c1ccccc1)NC 11283 [0,1,0,0,0,1|2,0,0]=4
17  B13R1.86  CC[C@@H]([C@@H](c1ccccc1)O)NC 9001432 [0,1,0,0,0,1|2,0,0]=4
18  B13R1.86  CC[C@H]([C@@H](c1ccccc1)O)NC 9001438 [0,1,0,0,0,1|2,0,0]=4
19  B11R2.4  c1ccc(cc1)[C@H]2C[C@@H]2N 10010494 [1,0,0,1,0,0|2,0,0]=4
20  B11R1.40  CCC(Cc1ccccc1)N 9001864 [1,0,0,0,0,1|2,0,0]=4
21  B11R1.40  C[C@@H](Cc1ccccc1)NC 13997 [1,0,0,0,0,1|1,0,0]=3
22  B11R1.40  C[C@H](Cc1ccccc1)NC 13998 [1,0,0,0,0,1|1,0,0]=3