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	hartrees
Energy at 0K	-279.270704
Energy at 298.15K	-279.269361
HF Energy	-279.270704
Nuclear repulsion energy	21.101321

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.618
C2	0.000	0.000	-1.338

	Al1	C2
Al1		1.9561
C2	1.9561

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Al	0.190
2	C	-0.190

	x	y	z	Total
	0.000	0.000	1.368	1.368
CHELPG
AIM
ESP

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

using model chemistry: LSDA/6-31G*

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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<r²>	27.728
(<r²>)^1/2	5.266