0  B3R0.1  COCCl 1789 [1,0,0,0,0,0|2,0,1]=4
1  B5R0.1  COC[C@@H](C)N 3696 [0,1,0,0,0,0|3,0,0]=4
2  B5R0.2  OCCCCF 1386 [0,1,0,0,0,0|1,1,1]=4