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	hartrees
Energy at 0K	-473.616109
Energy at 298.15K	-473.618263
HF Energy	-473.414878
Nuclear repulsion energy	53.104505

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3607	3461	25.98
2	A	2414	2317	71.61
3	A	1224	1174	41.77
4	A	902	865	2.42
5	A	663	636	7.62
6	A	381	366	142.02

Atom	x (Å)	y (Å)	z (Å)
S1	-0.633	-0.092	-0.003
O2	1.183	0.055	-0.111
H3	-0.878	1.263	0.171
H4	1.544	-0.225	0.760

	S1	O2	H3	H4
S1		1.8261	1.3883	2.3110
O2	1.8261		2.4058	0.9830
H3	1.3883	2.4058		2.9028
H4	2.3110	0.9830	2.9028

All results from a given calculation for HOSH (hydrogen thioperoxide)

using model chemistry: CCD/6-31G

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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