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	hartrees
Energy at 0K	-30.836444
Energy at 298.15K	-30.832493
Nuclear repulsion energy	17.479937

Atom	x (Å)	y (Å)
O1	0.066	0.866
H2	-0.857	1.144
Cl3	0.066	-0.906

	O1	H2	Cl3
O1		0.9642	1.7724
H2	0.9642		2.2487
Cl3	1.7724	2.2487

Number	Element	Mulliken
1	O	-0.576
2	H	0.401
3	Cl	0.175

	x	y	z	Total
	-2.277	0.154	0.000	2.282
CHELPG
AIM
ESP

All results from a given calculation for DOCl (Hypochlorous acid-d)

using model chemistry: HF/CEP-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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	x	y	z
x	0.909	-0.315	0.000
y	-0.315	4.224	0.000
z	0.000	0.000	0.292

<r²>	23.152
(<r²>)^1/2	4.812