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	hartrees
Energy at 0K	-76.135419
Energy at 298.15K
Nuclear repulsion energy	8.979009

Atom	y (Å)	z (Å)
O1	0.000	0.111
H2	0.805	-0.446
H3	-0.805	-0.446

	O1	H2	H3
O1		0.9788	0.9788
H2	0.9788		1.6093
H3	0.9788	1.6093

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

using model chemistry: MP2/LANL2DZ

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: MP2/LANL2DZ

States and conformations

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