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	hartrees
Energy at 0K	-280.211296
Energy at 298.15K	-280.209946
HF Energy	-280.145919
Nuclear repulsion energy	20.842524

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.625
C2	0.000	0.000	-1.355

	Al1	C2
Al1		1.9804
C2	1.9804

All results from a given calculation for AlC (Aluminum carbide)

using model chemistry: B2PLYP=FULL/TZVP

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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