0  B5R0.2  OCCCCF 1386 [0,0,0,0,0,0|2,0,0]=2
1  B6R0.1  C[C@@H](CO)CCO 4679 [0,1,0,0,0,0|2,0,0]=3
2  B6R1.2  N=C1CCCS1 2998 [0,0,0,1,0,0|2,0,1]=4
3  B3R0.1  COCCl 1789 [2,0,0,0,0,0|1,1,0]=4
4  B5R0.1  COC[C@@H](C)N 3696 [1,1,0,0,0,0|1,1,0]=4
5  B5R0.3  C=C[C@@H](O)CO 4518 [1,1,0,0,0,0|0,0,2]=4
6  B7R0.2  CC[C@@H](C)CC(=O)O 911 [0,2,0,0,0,0|1,0,1]=4
7  B7R0.2  CC[C@H](C)CC(=O)O 916 [0,2,0,0,0,0|1,0,1]=4
8  B7R0.4  COCCCC(=O)O 1781 [0,2,0,0,0,0|1,0,1]=4
9  B7R0.1  CCCCCCNN 653 [0,2,0,0,0,0|2,0,0]=4
10  B7R1.3  C[C@@H]1CNCCO1 906 [0,1,0,1,0,0|1,0,0]=3
11  B7R1.3  C[C@H]1CNCCO1 907 [0,1,0,1,0,0|1,0,0]=3
12  B7R1.3  NC1CCCCC1 4172 [0,1,0,1,0,0|2,0,0]=4