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	hartrees
Energy at 0K	-473.939475
Energy at 298.15K
HF Energy	-473.939475
Nuclear repulsion energy	49.852644

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'	3791	3629	99.88	84.94	0.21	0.34
2	A'	1175	1125	48.32	8.28	0.42	0.59
3	A'	863	826	73.58	12.85	0.28	0.43

Atom	x (Å)	y (Å)
S1	0.037	-0.600
O2	0.037	1.032
H3	-0.876	1.343

	S1	O2	H3
S1		1.6314	2.1468
O2	1.6314		0.9646
H3	2.1468	0.9646

Number	Element	Mulliken
1	S	0.001
2	O	-0.263
3	H	0.263

All results from a given calculation for SOH (Sulfur Hydroxide)

using model chemistry: B3PW91/6-311+G(3df,2p)

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
	-1.478	0.792	0.000	1.677
CHELPG
AIM
ESP

	x	y	z
x	3.590	-0.152	0.000
y	-0.152	4.601	0.000
z	0.000	0.000	3.059

<r²>	28.254
(<r²>)^1/2	5.315