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	hartrees
Energy at 0K	-151.403151
Energy at 298.15K
HF Energy	-150.786895
Nuclear repulsion energy	35.584720

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3731	3575
2	A'	1623	1555
3	A'	911	873
4	A'	696	667
5	A"	3832	3671
6	A"	885	848

Atom	x (Å)	y (Å)	z (Å)
O1	0.061	-0.660	0.000
O2	0.061	0.870	0.000
H3	-0.486	-0.839	0.775
H4	-0.486	-0.839	-0.775

	O1	O2	H3	H4
O1		1.5296	0.9655	0.9655
O2	1.5296		1.9543	1.9543
H3	0.9655	1.9543		1.5509
H4	0.9655	1.9543	1.5509

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	100.682		O2	O1	H4	100.682
H3	O1	H4	106.863

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

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

using model chemistry: CCSD(T)=FULL/aug-cc-pVQZ

States and conformations

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