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	hartrees
Energy at 0K	-76.156895
Energy at 298.15K	-76.157991
HF Energy	-76.009489
Nuclear repulsion energy	8.977530

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3655	3655
2	A₁	1635	1635
3	B₂	3837	3837

Atom	y (Å)	z (Å)
O1	0.000	0.112
H2	0.804	-0.447
H3	-0.804	-0.447

	O1	H2	H3
O1		0.9790	0.9790
H2	0.9790		1.6076
H3	0.9790	1.6076

All results from a given calculation for H₂O (Water)

using model chemistry: MP4=FULL/SDD

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 H2O (Water)

using model chemistry: MP4=FULL/SDD

States and conformations

All results from a given calculation for H₂O (Water)