0  B6R0.4  CC(C)NCC#N 78909 [1,0,0,0,0,0|2,0,1]=4
1  B6R0.4  C[C@H](Cl)CCCO AC5969 [1,0,0,0,0,0|1,1,1]=4
2  B8R1.1  CC1CCC(CO)C1 72724 [0,0,0,1,0,0|1,1,1]=4
3  B8R1.7  CC(C)[C@H]1CCNC1 P17773 [0,0,0,1,0,0|1,0,2]=4
4  B7R0.5  CC(C)[C@@H](N)CC#N Y14204 [1,1,0,0,0,0|1,0,1]=4
5  B7R0.8  C#CCCC(C)(C)O D79338 [1,1,0,0,0,0|1,0,1]=4
6  B7R0.8  CC(C)(N)CCC#N 79588 [1,1,0,0,0,0|1,0,1]=4
7  B7R1.17  CC1(C)CC[C@@H]1O P17222 [1,0,0,1,0,0|0,1,1]=4