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https://github.com/pfloos/quack
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5 lines
217 B
Plaintext
5 lines
217 B
Plaintext
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3
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\ce{CNO},^2\Sigma^+,CC3,aug-cc-pVTZ
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C 0.00000000 0.00000000 -1.32654521
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N 0.00000000 0.00000000 -0.11854721
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O 0.00000000 0.00000000 1.09900979
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