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	hartrees
Energy at 0K	-151.100986
Energy at 298.15K
HF Energy	-150.720640
Nuclear repulsion energy	35.599397

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3839	3577	83.60
2	A'	1664	1550	110.56
3	A'	942	878	131.15
4	A'	763	711	107.41
5	A"	3950	3680	188.57
6	A"	950	885	2.20

Atom	x (Å)	y (Å)	z (Å)
O1	0.059	-0.654	0.000
O2	0.059	0.871	0.000
H3	-0.468	-0.869	0.780
H4	-0.468	-0.869	-0.780

	O1	O2	H3	H4
O1		1.5247	0.9657	0.9657
O2	1.5247		1.9783	1.9783
H3	0.9657	1.9783		1.5606
H4	0.9657	1.9783	1.5606

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	O1	H3	102.879		O2	O1	H4	102.879
H3	O1	H4	107.812

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

using model chemistry: MP3=FULL/6-31+G**

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: MP3=FULL/6-31+G**

States and conformations

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