0  B3R0.2  CB(O)O SPC-j988 [0,0,0,0,0,0|3,0,0]=3
1  B4R0.1  C#C[C@H](C)O SPC-s670 [0,1,0,0,0,0|2,0,1]=4
2  B4R0.1  C#C[C@H](C)O SPC-t138 [0,1,0,0,0,0|2,0,1]=4
3  B4R0.1  CC(=O)CN SPC-t886 [0,1,0,0,0,0|1,0,1]=3
4  B4R0.1  NC(=O)CI SPC-s873 [0,1,0,0,0,0|1,0,1]=3
5  B4R1.2  OC1CC1 SPC-h306 [0,0,0,1,0,0|2,0,1]=4
6  B5R0.1  C[C@@H](N)CCO SPC-g658 [0,2,0,0,0,0|1,0,1]=4
7  B5R0.1  C[C@H](N)CCO SPC-n760 [0,2,0,0,0,0|1,0,1]=4
8  B5R0.3  C=C(CO)CO SPC-g493 [0,2,0,0,0,0|2,0,0]=4
9  B5R0.3  NC[C@@H](F)CO SPC-s654 [0,2,0,0,0,0|1,0,1]=4
10  B5R0.3  NC[C@H](F)CO SPC-s667 [0,2,0,0,0,0|1,0,1]=4
11  B5R0.4  CC(C)(O)CN SPC-g498 [0,2,0,0,0,0|1,0,1]=4
12  B5R1.2  NC1COC1 SPC-a019 [0,1,0,1,0,0|1,0,1]=4
13  B5R1.2  O=C1CCN1 SPC-t120 [0,1,0,1,0,0|1,0,1]=4
14  B5R1.2  O=C1CNC1 SPC-h722 [0,1,0,1,0,0|1,0,1]=4
15  B5R1.2  OC1CNC1 SPC-a234 [0,1,0,1,0,0|1,0,1]=4