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	hartrees
Energy at 0K	-26.845474
Energy at 298.15K	-26.847576
HF Energy	-26.678150
Nuclear repulsion energy	18.649207

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3616	3494	31.90
2	A	2505	2420	65.86
3	A	1163	1124	40.20
4	A	899	869	4.00
5	A	636	615	15.25
6	A	353	341	153.33

Atom	x (Å)	y (Å)	z (Å)
S1	-0.642	-0.092	-0.004
O2	1.196	0.059	-0.110
H3	-0.862	1.264	0.196
H4	1.568	-0.269	0.752

	S1	O2	H3	H4
S1		1.8470	1.3887	2.3426
O2	1.8470		2.4046	0.9946
H3	1.3887	2.4046		2.9272
H4	2.3426	0.9946	2.9272

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

using model chemistry: MP2/CEP-31G

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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