0  B3R0.2  CB(O)O SPC-j988 [0,0,0,0,0,0|2,0,1]=3
1  B4R0.1  C#C[C@H](C)O SPC-s670 [0,1,0,0,0,0|3,0,0]=4
2  B4R0.1  C#C[C@H](C)O SPC-t138 [0,1,0,0,0,0|3,0,0]=4
3  B4R0.1  CC(=O)CN SPC-t886 [0,1,0,0,0,0|3,0,0]=4
4  B4R0.1  NC(=O)CI SPC-s873 [0,1,0,0,0,0|3,0,0]=4
5  B4R1.2  OC1CC1 SPC-h306 [0,0,0,1,0,0|3,0,0]=4