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	hartrees
Energy at 0K	-75.291953
Energy at 298.15K	-75.289810
Nuclear repulsion energy	8.447806

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2470	2285	40.58
2	A₁	1437	1329	1.30
3	B₂	2647	2449	32.46

Atom	y (Å)	z (Å)
O1	0.000	0.140
H2	0.777	-0.558
H3	-0.777	-0.558

	O1	H2	H3
O1		1.0443	1.0443
H2	1.0443		1.5541
H3	1.0443	1.5541

Number	Element	Mulliken
1	O	-0.275
2	H	0.138
3	H	0.138

All results from a given calculation for D₂O (Deuterium oxide)

using model chemistry: BLYP/STO-3G

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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<r²>	5.342
(<r²>)^1/2	2.311

All results from a given calculation for D2O (Deuterium oxide)

using model chemistry: BLYP/STO-3G

States and conformations

All results from a given calculation for D₂O (Deuterium oxide)