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	hartrees
Energy at 0K	-535.992323
Energy at 298.15K	-535.993424
HF Energy	-535.992323
Nuclear repulsion energy	50.790389

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3830	3654	77.49	53.26	0.27	0.43
2	A'	1244	1187	38.49	4.62	0.73	0.85
3	A'	765	730	4.45	20.22	0.28	0.44

Atom	x (Å)	y (Å)
O1	0.036	1.107
H2	-0.904	1.324
Cl3	0.036	-0.599

	O1	H2	Cl3
O1		0.9645	1.7055
H2	0.9645		2.1401
Cl3	1.7055	2.1401

Number	Element	Mulliken
1	O	-0.356
2	H	0.300
3	Cl	0.056

All results from a given calculation for HOCl (hypochlorous acid)

using model chemistry: mPW1PW91/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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	x	y	z	Total
	-1.770	0.176	0.000	1.779
CHELPG
AIM
ESP

	x	y	z
x	1.621	-0.181	0.000
y	-0.181	3.396	0.000
z	0.000	0.000	1.287

<r²>	29.475
(<r²>)^1/2	5.429