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	hartrees
Energy at 0K	-279.821363
Energy at 298.15K	-279.820018
HF Energy	-279.666109
Nuclear repulsion energy	20.814461

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.626
C2	0.000	0.000	-1.357

	Al1	C2
Al1		1.9830
C2	1.9830

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

using model chemistry: CCD/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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