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	hartrees
Energy at 0K	-151.177207
Energy at 298.15K	-151.179460
HF Energy	-150.783702
Nuclear repulsion energy	36.721186

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3808	3640	13.72
2	A	1442	1378	0.11
3	A	921	880	1.28
4	A	338	324	192.30
5	B	3806	3638	56.97
6	B	1306	1248	114.36

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.728	-0.055
O2	0.000	-0.728	-0.055
H3	0.824	0.876	0.436
H4	-0.824	-0.876	0.436

	O1	O2	H3	H4
O1		1.4569	0.9703	1.8693
O2	1.4569		1.8693	0.9703
H3	0.9703	1.8693		2.4052
H4	1.8693	0.9703	2.4052

All results from a given calculation for H₂O₂ (Hydrogen peroxide)

using model chemistry: MP2/cc-pCVDZ

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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All results from a given calculation for H2O2 (Hydrogen peroxide)

using model chemistry: MP2/cc-pCVDZ

States and conformations

All results from a given calculation for H₂O₂ (Hydrogen peroxide)