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5 lines
207 B
Plaintext
5 lines
207 B
Plaintext
3
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\ce{CON},,CC3,aug-cc-pVTZ
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C 0.00000000 0.00000000 -1.29152344
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O 0.00000000 0.00000000 -0.10824635
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N 0.00000000 0.00000000 1.23042072 |