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	hartrees
Energy at 0K	-279.796698
Energy at 298.15K	-279.795361
HF Energy	-279.655854
Nuclear repulsion energy	20.956015

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.622
C2	0.000	0.000	-1.348

	Al1	C2
Al1		1.9696
C2	1.9696

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

using model chemistry: QCISD/6-311G*

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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