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	hartrees
Energy at 0K	-473.869311
Energy at 298.15K	-473.871615
HF Energy	-473.519751
Nuclear repulsion energy	56.130821

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3833	3631	58.38
2	A	2675	2534	28.75
3	A	1217	1153	36.41
4	A	1013	960	2.42
5	A	754	715	32.53
6	A	470	445	80.60

Atom	x (Å)	y (Å)	z (Å)
S1	-0.591	-0.090	0.008
O2	1.111	0.022	-0.118
H3	-0.863	1.241	0.015
H4	1.429	0.018	0.796

	S1	O2	H3	H4
S1		1.7102	1.3583	2.1707
O2	1.7102		2.3239	0.9679
H3	1.3583	2.3239		2.7130
H4	2.1707	0.9679	2.7130

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

using model chemistry: CCSD/cc-pVDZ

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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