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	hartrees
Energy at 0K	-473.787365
Energy at 298.15K	-473.789723
HF Energy	-473.488703
Nuclear repulsion energy	56.845988

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3841	3556	64.20
2	A	2751	2547	43.12
3	A	1293	1197	52.66
4	A	1057	978	5.58
5	A	806	746	48.49
6	A	511	473	106.64

Atom	x (Å)	y (Å)	z (Å)
S1	-0.582	-0.090	0.008
O2	1.092	0.027	-0.118
H3	-0.868	1.224	0.034
H4	1.447	-0.007	0.782

	S1	O2	H3	H4
S1		1.6833	1.3441	2.1731
O2	1.6833		2.3015	0.9672
H3	1.3441	2.3015		2.7258
H4	2.1731	0.9672	2.7258

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

using model chemistry: CISD/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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