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	hartrees
Energy at 0K	-334.589810
Energy at 298.15K
HF Energy	-334.243951
Nuclear repulsion energy	54.566018

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2241	2141	86.26
2	Σ	477	456	150.28
3	Π	171	163	4.71
3	Π	171	163	4.71

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.325
C2	0.000	0.000	-0.697
N3	0.000	0.000	-1.864

	Al1	C2	N3
Al1		2.0219	3.1886
C2	2.0219		1.1667
N3	3.1886	1.1667

All results from a given calculation for AlCN (Aluminum monocyanide)

using model chemistry: CCD/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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