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	hartrees
Energy at 0K	-474.034640
Energy at 298.15K	-474.036990
HF Energy	-473.542008
Nuclear repulsion energy	57.061435

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3968	3968	72.79
2	A	2753	2753	26.64
3	A	1225	1225	35.76
4	A	1064	1064	7.06
5	A	775	775	42.95
6	A	507	507	100.80

Atom	x (Å)	y (Å)	z (Å)
S1	-0.581	-0.089	0.009
O2	1.090	0.023	-0.116
H3	-0.856	1.222	0.016
H4	1.432	0.017	0.775

	S1	O2	H3	H4
S1		1.6794	1.3392	2.1561
O2	1.6794		2.2901	0.9547
H3	1.3392	2.2901		2.6947
H4	2.1561	0.9547	2.6947

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

using model chemistry: MP3=FULL/6-311G**

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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