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QUESTDB_website/data/structures/QUEST2/carbon_dimer.xyz
2020-11-24 18:21:58 +00:00

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Carbon dimer,^1\Sigma_g^+,CC3,aug-cc-pVTZ
C 0.00000000 0.00000000 0.62402126
C 0.00000000 0.00000000 -0.62402126