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	hartrees
Energy at 0K	-678.107532
Energy at 298.15K	-678.108000
HF Energy	-678.107532
Nuclear repulsion energy	4.896581

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.103
H2	0.000	0.000	-2.063

	Ca1	H2
Ca1		2.1661
H2	2.1661

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Ca	0.488
2	H	-0.488

	x	y	z	Total
	0.000	0.000	3.299	3.299
CHELPG
AIM
ESP

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

using model chemistry: wB97X-D/TZVP

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>	19.928
(<r²>)^1/2	4.464