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	hartrees
Energy at 0K	-433.469042
Energy at 298.15K	-433.467796
HF Energy	-433.244822
Nuclear repulsion energy	32.633477

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.132
S2	0.000	0.000	0.425

	C1	S2
C1		1.5567
S2	1.5567

All results from a given calculation for CS (carbon monosulfide)

using model chemistry: MP2=FULL/3-21G*

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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