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	hartrees
Energy at 0K	-151.332880
Energy at 298.15K
HF Energy	-150.777379
Nuclear repulsion energy	35.482919

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3728	3728
2	A'	1612	1612
3	A'	907	907
4	A'	695	695
5	A"	3818	3818
6	A"	872	872

Atom	x (Å)	y (Å)	z (Å)
O1	0.061	-0.662	0.000
O2	0.061	0.872	0.000
H3	-0.489	-0.840	0.775
H4	-0.489	-0.840	-0.775

	O1	O2	H3	H4
O1		1.5349	0.9672	0.9672
O2	1.5349		1.9587	1.9587
H3	0.9672	1.9587		1.5508
H4	0.9672	1.9587	1.5508

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	100.579		O2	O1	H4	100.579
H3	O1	H4	106.582

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

using model chemistry: CCSD(T)=FULL/daug-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: CCSD(T)=FULL/daug-cc-pVTZ

States and conformations

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