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	hartrees
Energy at 0K	-707.217382
Energy at 298.15K	-707.216234
HF Energy	-707.199052
Nuclear repulsion energy	25.170246

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.582
C2	0.000	0.000	-1.941

	Ca1	C2
Ca1		2.5229
C2	2.5229

All results from a given calculation for CaC (Calcium monocarbide)

using model chemistry: MP2/STO-3G

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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