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	hartrees
Energy at 0K	-678.094441
Energy at 298.15K	-678.094909
HF Energy	-678.094441
Nuclear repulsion energy	4.989325

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.101
H2	0.000	0.000	-2.020

	Ca1	H2
Ca1		2.1212
H2	2.1212

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Ca	0.300
2	H	-0.300

	x	y	z	Total
	0.000	0.000	2.382	2.382
CHELPG
AIM
ESP

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

using model chemistry: B3LYP/6-31+G**

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>	20.033
(<r²>)^1/2	4.476