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	hartrees
Energy at 0K	-317.068465
Energy at 298.15K	-317.068543
Nuclear repulsion energy	33.546295

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.625
O2	0.000	0.000	-1.015

	Al1	O2
Al1		1.6404
O2	1.6404

All results from a given calculation for AlO (Aluminum monoxide)

using model chemistry: MP4/cc-pVTZ

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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