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	hartrees
Energy at 0K	-677.290871
Energy at 298.15K	-677.291343
HF Energy	-677.251072
Nuclear repulsion energy	4.996975

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.101
H2	0.000	0.000	-2.017

	Ca1	H2
Ca1		2.1180
H2	2.1180

All results from a given calculation for CaH (Calcium monohydride)

using model chemistry: CCD/6-31G**

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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