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	hartrees
Energy at 0K	-474.049061
Energy at 298.15K	-474.051387
HF Energy	-473.584854
Nuclear repulsion energy	57.282761

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3817	3625	92.59
2	A	2716	2579	6.38
3	A	1199	1139	41.78
4	A	1037	985	2.23
5	A	787	748	64.95
6	A	478	454	75.12

Atom	x (Å)	y (Å)	z (Å)
S1	-0.577	-0.089	0.010
O2	1.083	0.022	-0.118
H3	-0.861	1.221	0.009
H4	1.431	0.030	0.780

	S1	O2	H3	H4
S1		1.6688	1.3399	2.1542
O2	1.6688		2.2873	0.9629
H3	1.3399	2.2873		2.6953
H4	2.1542	0.9629	2.6953

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

using model chemistry: MP2/aug-cc-pVQZ

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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