0  B8R1.27  CNCC1CC1(C)C 4088921 [0,0,0,1,0,0|3,0,0]=4
1  B7R1.10  CO[C@H]1C[C@H](O)C1 4071768 [1,0,0,1,0,0|1,0,1]=4
2  B7R1.23  CC1(C)CC1CN 4091154 [1,0,0,1,0,0|1,0,1]=4