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	hartrees
Energy at 0K	-76.207902
Energy at 298.15K	-76.209000
HF Energy	-76.009594
Nuclear repulsion energy	9.065702

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3724	3573
2	A₁	1741	1670
3	B₂	3854	3697

Atom	y (Å)	z (Å)
O1	0.000	0.120
H2	0.765	-0.479
H3	-0.765	-0.479

	O1	H2	H3
O1		0.9710	0.9710
H2	0.9710		1.5292
H3	0.9710	1.5292

All results from a given calculation for H₂O (Water)

using model chemistry: QCISD(T)/6-31G*

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: QCISD(T)/6-31G*

States and conformations

All results from a given calculation for H₂O (Water)