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	hartrees
Energy at 0K	-2742.887462
Energy at 298.15K	-2742.885998
HF Energy	-2742.887462
Nuclear repulsion energy	132.390303

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	-1.414
Se2	0.000	0.000	0.624

	P1	Se2
P1		2.0385
Se2	2.0385

Number	Element	Mulliken	CHELPG	AIM	ESP
1	P	0.121
2	Se	-0.121

	x	y	z	Total
	0.000	0.000	-0.454	0.454
CHELPG
AIM
ESP

All results from a given calculation for PSe (Phosphorus monoselenide)

using model chemistry: M06-2X/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>	62.630
(<r²>)^1/2	7.914