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	hartrees
Energy at 0K	-677.292278
Energy at 298.15K	-677.292748
HF Energy	-677.251074
Nuclear repulsion energy	4.982878

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.101
H2	0.000	0.000	-2.023

	Ca1	H2
Ca1		2.1240
H2	2.1240

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

using model chemistry: QCISD/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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