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MUNgauss RevisionA2.1 retrievium 07-Sep-2022 GDB_13 Smiles: CC1C2=NN=CC22CCC1(C)C2 RHF 6-31G(d) (6D,10F) C1 162.115699 |X|Y|Z| 31.032736 22.113019 16.600516
22.500728 10 6 7 8 2
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