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	hartrees
Energy at 0K	-151.164123
Energy at 298.15K
HF Energy	-150.754519
Nuclear repulsion energy	35.068647

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3818	3643	75.37
2	A'	1617	1543	75.67
3	A'	860	821	105.12
4	A'	619	591	105.17
5	A"	3912	3732	148.16
6	A"	822	784	1.06

Atom	x (Å)	y (Å)	z (Å)
O1	0.060	-0.670	0.000
O2	0.060	0.890	0.000
H3	-0.482	-0.881	0.768
H4	-0.482	-0.881	-0.768

	O1	O2	H3	H4
O1		1.5597	0.9637	0.9637
O2	1.5597		2.0047	2.0047
H3	0.9637	2.0047		1.5359
H4	0.9637	2.0047	1.5359

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	102.640		O2	O1	H4	102.640
H3	O1	H4	105.671

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

using model chemistry: QCISD/6-311G**

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: QCISD/6-311G**

States and conformations

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