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	hartrees
Energy at 0K	-535.805496
Energy at 298.15K	-535.806605
HF Energy	-535.805496
Nuclear repulsion energy	51.292999

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'	3817	3672	83.88	62.32	0.17	0.29
2	A'	1276	1227	44.57	2.71	0.31	0.48
3	A'	780	750	9.32	15.39	0.21	0.35

Atom	x (Å)	y (Å)
O1	0.036	1.094
H2	-0.902	1.318
Cl3	0.036	-0.592

	O1	H2	Cl3
O1		0.9642	1.6864
H2	0.9642		2.1278
Cl3	1.6864	2.1278

Number	Element	Mulliken
1	O	-0.382
2	H	0.207
3	Cl	0.174

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

using model chemistry: HSEh1PBE/aug-cc-pVTZ

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
	-1.497	0.370	0.000	1.542
CHELPG
AIM
ESP

	x	y	z
x	2.932	-0.150	0.000
y	-0.150	4.184	0.000
z	0.000	0.000	2.786

<r²>	29.164
(<r²>)^1/2	5.400