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	hartrees
Energy at 0K
Energy at 298.15K	0.012245
HF Energy	0.012245
Nuclear repulsion energy	41.277323

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'	3957	3854	54.53	70.00	0.15	0.26
2	A'	1675	1632	66.71	16.79	0.56	0.72
3	A'	1182	1152	43.58	4.71	0.59	0.75
4	A'	688	670	326.31	16.42	0.47	0.64
5	A"	3810	3711	110.15	39.58	0.75	0.86
6	A"	1064	1036	3.29	11.51	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.059	-0.754	0.000
O2	0.059	0.913	0.000
H3	-0.471	-0.635	0.791
H4	-0.471	-0.635	-0.791

	O1	O2	H3	H4
O1		1.6669	0.9590	0.9590
O2	1.6669		1.8171	1.8171
H3	0.9590	1.8171		1.5811
H4	0.9590	1.8171	1.5811

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	82.882		O2	O1	H4	82.882
H3	O1	H4	111.040

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

using model chemistry: PM3

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: PM3

States and conformations

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