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	hartrees
Energy at 0K	-473.911681
Energy at 298.15K	-473.914011
HF Energy	-473.552257
Nuclear repulsion energy	56.776769

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3932	3677	65.64
2	A	2728	2552	21.33
3	A	1203	1125	39.71
4	A	1065	996	4.51
5	A	789	738	46.75
6	A	477	446	98.60

Atom	x (Å)	y (Å)	z (Å)
S1	-0.585	-0.089	0.008
O2	1.096	0.024	-0.116
H3	-0.845	1.229	0.029
H4	1.437	-0.003	0.778

	S1	O2	H3	H4
S1		1.6892	1.3433	2.1654
O2	1.6892		2.2891	0.9581
H3	1.3433	2.2891		2.6992
H4	2.1654	0.9581	2.6992

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

using model chemistry: MP3/TZVP

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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