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	hartrees
Energy at 0K	-151.087840
Energy at 298.15K
HF Energy	-150.719373
Nuclear repulsion energy	35.795678

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3723	3502	86.97	68.48	0.06	0.12
2	A'	1628	1531	112.85	2.32	0.70	0.82
3	A'	966	908	84.51	6.85	0.31	0.48
4	A'	800	753	116.71	14.27	0.31	0.47
5	A"	3858	3629	206.47	24.24	0.75	0.86
6	A"	950	893	1.55	5.09	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.060	-0.648	0.000
O2	0.060	0.861	0.000
H3	-0.477	-0.854	0.785
H4	-0.477	-0.854	-0.785

	O1	O2	H3	H4
O1		1.5093	0.9729	0.9729
O2	1.5093		1.9616	1.9616
H3	0.9729	1.9616		1.5699
H4	0.9729	1.9616	1.5699

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	102.258		O2	O1	H4	102.258
H3	O1	H4	107.569

All results from a given calculation for H₂OO (water oxide)

using model chemistry: MP2/6-31+G**

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 H2OO (water oxide)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for H₂OO (water oxide)