0  B7R0.1  CCCCCCNN 653 [0,0,0,0,0,0|4,0,0]=4
1  B8R1.2  O=CC1CCCSC1 1910 [0,0,0,1,0,0|2,0,1]=4
2  B5R0.2  OCCCCF 1386 [2,0,0,0,0,0|2,0,0]=4
3  B7R1.3  C[C@@H]1CNCCO1 906 [1,0,0,1,0,0|2,0,0]=4
4  B7R1.3  C[C@H]1CNCCO1 907 [1,0,0,1,0,0|2,0,0]=4
5  B7R1.3  NC1CCCCC1 4172 [1,0,0,1,0,0|2,0,0]=4