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	hartrees
Energy at 0K	-474.017244
Energy at 298.15K	-474.019587
HF Energy	-473.572373
Nuclear repulsion energy	57.433090

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3879	3879	75.02
2	A	2688	2688	14.08
3	A	1238	1238	42.52
4	A	1053	1053	3.07
5	A	803	803	60.19
6	A	489	489	78.97

Atom	x (Å)	y (Å)	z (Å)
S1	-0.576	-0.089	0.010
O2	1.080	0.019	-0.117
H3	-0.858	1.222	-0.001
H4	1.430	0.043	0.774

	S1	O2	H3	H4
S1		1.6638	1.3404	2.1503
O2	1.6638		2.2831	0.9583
H3	1.3404	2.2831		2.6875
H4	2.1503	0.9583	2.6875

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

using model chemistry: CCSD/Def2TZVPP

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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