0  B6R0.3  N[C@H](C(=O)N)CC AP00372 [0,0,0,0,0,0|2,0,2]=4
1  B6R0.3  N[C@H](CO)C(=O)O AP10045 [0,0,0,0,0,0|2,0,2]=4
2  B5R0.5  CC(C(=O)N)N AP10196 [1,0,0,0,0,0|2,0,1]=4
3  B7R1.18  C1(CCC1)C(=O)O AP00003 [0,0,0,1,0,0|0,0,2]=3
4  B8R1.7  S1C(=NC=C1)C(=O)O AP00240 [0,1,0,1,0,0|1,0,1]=4
5  B8R1.7  S1C=NC=C1C(=O)O AP00203 [0,1,0,1,0,0|1,0,1]=4
6  B8R1.78  NC1(CCC1)C(=O)O AP10325 [0,1,0,1,0,0|0,0,2]=4