0 B8R0.23 C(C(C(=O)O)O)C(=O)O 525 [0,1,0,0,0,0|2,0,1]=4 1 B8R0.23 CC(C)CC(=O)C(=O)[O-] 23680490 [0,1,0,0,0,0|0,0,2]=3 2 B8R0.23 CC(C)CC(=O)C(=O)[O-] 4137900 [0,1,0,0,0,0|0,0,2]=3 3 B6R0.2 C[C@@H](CC(=O)[O-])O 23665017 [0,0,0,0,1,0|1,0,1]=3 4 B5R0.2 C(CCO)CO 8064 [2,0,0,0,0,0|1,0,1]=4