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	hartrees
Energy at 0K	-474.027458
Energy at 298.15K	-474.029787
HF Energy	-473.575305
Nuclear repulsion energy	57.275916

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3908	3908	86.32
2	A	2700	2700	8.46
3	A	1232	1232	46.19
4	A	1043	1043	3.13
5	A	802	802	58.29
6	A	476	476	77.83

Atom	x (Å)	y (Å)	z (Å)
S1	-0.578	-0.089	0.010
O2	1.083	0.020	-0.117
H3	-0.856	1.225	0.004
H4	1.437	0.037	0.773

	S1	O2	H3	H4
S1		1.6693	1.3429	2.1577
O2	1.6693		2.2861	0.9575
H3	1.3429	2.2861		2.6943
H4	2.1577	0.9575	2.6943

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

using model chemistry: MP3/daug-cc-pVTZ

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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