0  B8R1.8  c1cn(cn1)CCN AEZ-0001 [0,0,0,0,0,0|3,0,0]=3
1  B8R1.8  c1cn(cn1)CCN MIX-1087 [0,0,0,0,0,0|3,0,0]=3
2  B8R1.8  c1cnn(c1)CCN AEZ-0002 [0,0,0,0,0,0|2,0,0]=2
3  B9R1.7  CCCc1nnc(s1)N ATD-0016 [0,1,0,0,0,0|3,0,0]=4
4  B9R1.12  c1cnn(c1)CCCN MIX-1091 [0,1,0,0,0,0|2,0,0]=3
5  B9R1.33  Cc1nccn1CCN MIX-1088 [0,1,0,0,0,0|3,0,0]=4
6  B9R1.8  [C-]#[N+]Cc1ccccc1 ISN-0155 [0,0,0,0,0,1|3,0,0]=4
7  B9R1.8  [C-]#[N+]Cc1cccnc1 ISN-0012 [0,0,0,0,0,1|3,0,0]=4
8  B6R1.2  Cc1ccn[nH]1 MIX-0636 [2,0,0,0,0,0|2,0,0]=4
9  B6R1.2  c1c[nH]nc1N MIX-0347 [2,0,0,0,0,0|2,0,0]=4
10  B8R1.1  CCc1nnc(s1)N ATD-0010 [1,1,0,0,0,0|2,0,0]=4
11  B10R1.17  [C-]#[N+]CCc1ccncc1 ISN-0736 [0,1,0,0,0,1|1,0,1]=4
12  B10R1.14  Cc1ccc(s1)C(C)[N+]#[C-] ISN-0300 [0,2,0,0,0,0|2,0,0]=4
13  B10R1.16  Cc1cnn(c1)CCCN MIX-0205 [0,2,0,0,0,0|2,0,0]=4
14  B10R1.54  Cc1ccc(s1)CC(=O)O PAA-0191 [0,2,0,0,0,0|1,0,1]=4
15  B10R1.54  c1cc(sc1CC(=O)O)Cl PAA-0189 [0,2,0,0,0,0|1,0,1]=4
16  B10R1.23  c1cc(sc1)C(C(=O)O)N AAA-0365 [0,2,0,0,0,0|1,0,1]=4