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	hartrees
Energy at 0K	-113.132943
Energy at 298.15K	-113.131691
HF Energy	-112.780532
Nuclear repulsion energy	22.695443

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.640
O2	0.000	0.000	0.480

	C1	O2
C1		1.1192
O2	1.1192

All results from a given calculation for CO (Carbon monoxide)

using model chemistry: MP3/6-311+G(3df,2p)

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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