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	hartrees
Energy at 0K	-474.177192
Energy at 298.15K	-474.179518
HF Energy	-473.584981
Nuclear repulsion energy	57.292717

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3832	3671
2	A	2640	2529
3	A	1209	1158
4	A	1032	989
5	A	782	749
6	A	480	460

Atom	x (Å)	y (Å)	z (Å)
S1	-0.577	-0.089	0.010
O2	1.082	0.020	-0.117
H3	-0.857	1.225	0.005
H4	1.434	0.035	0.776

	S1	O2	H3	H4
S1		1.6681	1.3436	2.1555
O2	1.6681		2.2861	0.9601
H3	1.3436	2.2861		2.6937
H4	2.1555	0.9601	2.6937

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

using model chemistry: CCSD(T)=FULL/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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