0  B5R0.2  CCCC[N+]#[C-] ISN-0088 [0,0,0,0,0,0|2,0,0]=2
1  B5R0.2  COCC[N+]#[C-] ISN-0740 [0,0,0,0,0,0|3,0,0]=3
2  B6R0.4  CN(C)CC[N+]#[C-] ISN-0105 [0,1,0,0,0,0|3,0,0]=4
3  B6R0.6  COCCC[N+]#[C-] ISN-0107 [0,1,0,0,0,0|1,0,1]=3
4  B3R0.1  CC[N+]#[C-] ISN-0734 [2,0,0,0,0,0|1,0,1]=4
5  B5R0.3  CCC(C)[N+]#[C-] ISN-0025 [1,1,0,0,0,0|1,0,1]=4
6  B7R0.3  CCCCC(CO)N BAL-0317 [0,2,0,0,0,0|0,0,0]=2
7  B7R0.3  CSCCC(CO)N BAL-0316 [0,2,0,0,0,0|1,0,0]=3
8  B7R0.4  CN(C)CCC[N+]#[C-] ISN-0100 [0,2,0,0,0,0|1,0,1]=4
9  B7R0.1  CCCCCC[N+]#[C-] ISN-0019 [0,2,0,0,0,0|0,0,1]=3
10  B7R1.1  C1CC(NC1)CO C5A-0373 [0,1,0,1,0,0|0,0,0]=2
11  B7R1.1  C1C[C@@H](NC1)CO C5A-0373 [0,1,0,1,0,0|0,0,0]=2