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	hartrees
Energy at 0K	-473.814068
Energy at 298.15K	-473.816406
HF Energy	-473.487835
Nuclear repulsion energy	56.476621

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3742	3534	51.00
2	A	2666	2518	47.05
3	A	1276	1205	49.55
4	A	1029	972	4.58
5	A	776	733	42.78
6	A	505	477	102.49

Atom	x (Å)	y (Å)	z (Å)
S1	-0.586	-0.090	0.008
O2	1.100	0.028	-0.118
H3	-0.870	1.232	0.037
H4	1.449	-0.011	0.790

	S1	O2	H3	H4
S1		1.6949	1.3522	2.1817
O2	1.6949		2.3142	0.9736
H3	1.3522	2.3142		2.7367
H4	2.1817	0.9736	2.7367

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

using model chemistry: CCSD/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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