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	hartrees
Energy at 0K	-473.814629
Energy at 298.15K	-473.816966
HF Energy	-473.487781
Nuclear repulsion energy	56.453348

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3737	3559	50.83
2	A	2662	2535	48.96
3	A	1274	1213	49.67
4	A	1027	978	4.60
5	A	774	737	43.20
6	A	506	482	102.07

Atom	x (Å)	y (Å)	z (Å)
S1	-0.586	-0.090	0.007
O2	1.101	0.028	-0.118
H3	-0.872	1.232	0.037
H4	1.449	-0.011	0.790

	S1	O2	H3	H4
S1		1.6957	1.3526	2.1821
O2	1.6957		2.3161	0.9738
H3	1.3526	2.3161		2.7385
H4	2.1821	0.9738	2.7385

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

using model chemistry: QCISD/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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