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	hartrees
Energy at 0K	-473.863547
Energy at 298.15K	-473.865858
HF Energy	-473.520099
Nuclear repulsion energy	56.286772

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3895	3692	65.89
2	A	2711	2569	24.80
3	A	1228	1164	37.20
4	A	1023	970	2.89
5	A	767	728	32.00
6	A	468	444	82.32

Atom	x (Å)	y (Å)	z (Å)
S1	-0.589	-0.090	0.008
O2	1.108	0.022	-0.117
H3	-0.859	1.239	0.014
H4	1.426	0.019	0.793

	S1	O2	H3	H4
S1		1.7054	1.3553	2.1653
O2	1.7054		2.3168	0.9644
H3	1.3553	2.3168		2.7049
H4	2.1653	0.9644	2.7049

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

using model chemistry: MP3/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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