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	hartrees
Energy at 0K	-474.016757
Energy at 298.15K	-474.019099
HF Energy	-473.571661
Nuclear repulsion energy	57.214364

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3875	3647	73.10
2	A	2673	2516	15.68
3	A	1241	1168	42.19
4	A	1041	980	2.78
5	A	797	750	52.87
6	A	487	458	77.34

Atom	x (Å)	y (Å)	z (Å)
S1	-0.578	-0.089	0.010
O2	1.085	0.020	-0.117
H3	-0.861	1.225	0.001
H4	1.428	0.040	0.778

	S1	O2	H3	H4
S1		1.6714	1.3446	2.1517
O2	1.6714		2.2920	0.9592
H3	1.3446	2.2920		2.6917
H4	2.1517	0.9592	2.6917

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

using model chemistry: CCSD/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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