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QUESTDB_website/static/data/structures/QUEST4/difluorodiazirine.xyz

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2020-08-31 17:22:15 +02:00
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^1A_1,CC3,aug-cc-pVTZ
C 0.00000000 0.00000000 -0.08087430
F 0.00000000 1.09051409 -0.83454859
F 0.00000000 -1.09051409 -0.83454859
N 0.63703539 0.00000000 1.16718935
N -0.63703539 0.00000000 1.16718935