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	hartrees
Energy at 0K	-673.980260
Energy at 298.15K	-673.980720
HF Energy	-673.958249
Nuclear repulsion energy	4.779795

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.105
H2	0.000	0.000	-2.109

	Ca1	H2
Ca1		2.2142
H2	2.2142

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

using model chemistry: CISD/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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