0  B3R0.1  CC[N+]#[C-] ISN-0734 [1,0,0,0,0,0|2,0,0]=3
1  B5R0.1  C(C#N)C(=S)N MIX-0610 [0,1,0,0,0,0|1,1,1]=4
2  B5R0.3  CCC(C)[N+]#[C-] ISN-0025 [0,1,0,0,0,0|2,0,1]=4
3  B6R0.8  CCC(C)(CO)N BAL-0315 [0,2,0,0,0,0|1,0,1]=4