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	hartrees
Energy at 0K	-76.244557
Energy at 298.15K
Nuclear repulsion energy	9.133671

Atom	y (Å)	z (Å)
O1	0.000	0.117
H2	0.766	-0.467
H3	-0.766	-0.467

	O1	H2	H3
O1		0.9634	0.9634
H2	0.9634		1.5322
H3	0.9634	1.5322

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

using model chemistry: QCISD(T)/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 D2O (Deuterium oxide)

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

States and conformations

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