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	hartrees
Energy at 0K	-535.873627
Energy at 298.15K	-535.869684
Nuclear repulsion energy	50.639285

Atom	x (Å)	y (Å)
O1	0.036	1.109
H2	-0.907	1.336
Cl3	0.036	-0.600

	O1	H2	Cl3
O1		0.9702	1.7094
H2	0.9702		2.1544
Cl3	1.7094	2.1544

Number	Element	Mulliken
1	O	-0.475
2	H	0.374
3	Cl	0.100

	x	y	z	Total
	-1.768	0.195	0.000	1.779
CHELPG
AIM
ESP

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

using model chemistry: B3PW91/6-31+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>	29.674
(<r²>)^1/2	5.447