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06-Jan-2023 GDB_13 Smiles: CC1(N)CNC2C3CC(CC12)N3 RHF 6-31G(d) (6D,10F) C1 167.142248 |X|Y|Z| 21.701020 34.482570 16.707212 23.209258 10 6 7 8 2 |36.858105| |12.460204|36.858105| |7.932369|13.048739|53.358707| |7.414428|12.024681|10.095673|36.858105| |5.381801|7.628677|7.202142|12.911668|53.358707| |5.961466|7.972102|7.104880|8.319552|17.783898|36.858105| |4.179356|5.037646|5.314109|5.065115|9.899570|12.386687|36.858105| |4.065648|4.403180|4.768916|4.047518|6.739251|7.732259|12.339592|36.858105| |4.204213|4.821334|5.501520|4.065200|6.399546|7.011251|9.213769|12.358712|36.858105| |5.933053|6.961669|7.691971|4.928167|6.940798|7.530892|6.798031|7.467766|12.256660|36.858105| |7.420652|12.419957|10.567147|7.983977|11.066582|12.495559|7.634259|6.321906|7.709989|12.455268|36.858105| |3.722697|4.573091|5.289140|4.255622|7.375880|7.564056|12.884205|9.255185|12.870444|7.502885|7.147560|53.358707| 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|4.485931|4.492073|4.743808|4.077521|6.449504|7.222332|8.400534|17.587300|8.403151|6.931725|5.951980|8.518171|0.120036|0.147499|0.101077|0.085156|0.090307|0.093061|0.108226|0.115088|0.236322|0.179816|0.297966|0.500000| |3.564288|3.929937|4.765961|3.335324|5.064572|5.013327|6.269699|8.428285|17.585496|8.657346|5.587688|11.969926|0.103224|0.100754|0.082367|0.082679|0.095256|0.082171|0.082826|0.101875|0.125972|0.135069|0.211026|0.180348|0.500000| |5.185556|6.080609|7.891681|4.296266|5.798514|5.532184|5.155182|5.449416|8.685415|17.550389|8.815013|8.430630|0.161389|0.130987|0.113722|0.125672|0.149997|0.105665|0.102166|0.115435|0.135441|0.111240|0.122537|0.140345|0.216888|0.500000| |6.520967|6.347673|6.915372|4.517594|6.109266|6.389152|5.655943|6.977170|8.788845|17.536453|8.686851|7.633822|0.206516|0.184595|0.132582|0.117070|0.122981|0.104209|0.113919|0.112317|0.179974|0.119660|0.144941|0.210765|0.199490|0.303021|0.500000| 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