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                                            XinChenQC@computation

atomic valence of O atom inconsistent with RDkit

> 13 O=[C]c1ccccc1,C7H5O1 C 60.148399 7.311 88.774498 O 59.610699 6.74176 89.587196 C 60.923199 8.0155 87.707703 C 60.375198 9.24672 87.064796 C 62.044102 7.49395 86.800697 C 60.619598 9.44654 85.701401 H 59.479 9.73245...