0  B5R0.2  CCSCCO B049702 [0,0,0,0,0,0|2,0,2]=4
1  B6R0.1  CNC(C)CCO B039563 [0,1,0,0,0,0|1,0,2]=4
2  B5R0.1  C#CCC(=O)O B050921 [1,1,0,0,0,0|0,0,2]=4
3  B5R0.1  CC(N)CCO B039558 [1,1,0,0,0,0|0,0,2]=4
4  B7R0.3  CNCCC(=O)NC B039605 [0,2,0,0,0,0|1,0,0]=3
5  B7R0.4  COCCNC(N)=S B039010 [0,2,0,0,0,0|0,2,0]=4
6  B7R0.1  CCCCSCCO B049703 [0,2,0,0,0,0|1,0,1]=4
7  B5R1.3  NCC1CC1 B041362 [1,0,0,1,0,0|1,0,1]=4
8  B7R1.4  N[C@@H]1CSC[C@H]1O B050646 [0,1,0,1,0,0|0,0,2]=4