0  B5R0.3  C(C(CO)O)O 5220 [0,0,0,0,0,0|0,0,0]=0
1  B4R0.1  C(C(=O)O)N 0219 [1,0,0,0,0,0|1,0,2]=4
2  B6R0.3  C([C@@H](C(=O)O)N)O 0227 [0,1,0,0,0,0|1,0,1]=3
3  B6R0.3  C([C@H](C(=O)O)N)O 0226 [0,1,0,0,0,0|1,0,1]=3
4  B3R0.1  C(C[O-])[O-] 2446 [2,0,0,0,0,0|0,0,2]=4
5  B3R0.2  B(O)(O)O 3177 [2,0,0,0,0,0|1,0,0]=3
6  B3R0.2  CS(=O)C 3176 [2,0,0,0,0,0|1,0,1]=4
7  B5R0.5  C[C@@H](C(=O)O)N 0205 [1,1,0,0,0,0|1,0,1]=4
8  B7R0.10  C([C@H]([C@@H](CS)O)O)S 3154 [0,2,0,0,0,0|0,1,0]=3
9  B7R0.18  C(C(CO)(CO)N)O 3163 [0,2,0,0,0,0|0,0,0]=2
10  B7R0.18  C(C(CO)(CO)N)O 3164 [0,2,0,0,0,0|0,0,0]=2