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	hartrees
Energy at 0K	-678.152592
Energy at 298.15K	-678.153056
HF Energy	-678.152592
Nuclear repulsion energy	4.882021

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.103
H2	0.000	0.000	-2.065

	Ca1	H2
Ca1		2.1679
H2	2.1679

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Ca	0.339
2	H	-0.339

	x	y	z	Total
	0.000	0.000	2.651	2.651
CHELPG
AIM
ESP

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

using model chemistry: B1B95/6-31G

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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<r²>	20.528
(<r²>)^1/2	4.531