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	hartrees
Energy at 0K	-151.302595
Energy at 298.15K
HF Energy	-150.776575
Nuclear repulsion energy	35.536024

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3680	3582
2	A'	1607	1564
3	A'	924	900
4	A'	726	706
5	A"	3786	3685
6	A"	893	869

Atom	x (Å)	y (Å)	z (Å)
O1	0.062	-0.660	0.000
O2	0.062	0.869	0.000
H3	-0.493	-0.835	0.778
H4	-0.493	-0.835	-0.778

	O1	O2	H3	H4
O1		1.5295	0.9712	0.9712
O2	1.5295		1.9532	1.9532
H3	0.9712	1.9532		1.5568
H4	0.9712	1.9532	1.5568

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	100.329		O2	O1	H4	100.329
H3	O1	H4	106.541

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

using model chemistry: MP4/aug-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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All results from a given calculation for H2OO (water oxide)

using model chemistry: MP4/aug-cc-pVTZ

States and conformations

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