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	hartrees
Energy at 0K	-474.027583
Energy at 298.15K
HF Energy	-474.027583
Nuclear repulsion energy	50.103620

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'	3814	3814	103.48	75.51	0.25	0.40
2	A'	1176	1176	47.78	6.57	0.58	0.74
3	A'	888	888	73.77	14.22	0.24	0.38

Atom	x (Å)	y (Å)
S1	0.036	-0.597
O2	0.036	1.026
H3	-0.873	1.338

	S1	O2	H3
S1		1.6228	2.1377
O2	1.6228		0.9616
H3	2.1377	0.9616

Number	Element	Mulliken
1	S	0.019
2	O	-0.247
3	H	0.227

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

using model chemistry: B1B95/Def2TZVPP

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
	-1.556	0.735	0.000	1.721
CHELPG
AIM
ESP

	x	y	z
x	2.516	-0.204	0.000
y	-0.204	4.082	0.000
z	0.000	0.000	2.233

<r²>	27.927
(<r²>)^1/2	5.285