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	hartrees
Energy at 0K	-334.608010
Energy at 298.15K
HF Energy	-334.257092
Nuclear repulsion energy	54.885758

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2328	2151	73.42
2	Σ	473	437	172.17
3	Π	171	158	8.65
3	Π	171	158	8.65

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.321
C2	0.000	0.000	-0.701
N3	0.000	0.000	-1.853

	Al1	C2	N3
Al1		2.0214	3.1734
C2	2.0214		1.1521
N3	3.1734	1.1521

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

using model chemistry: CID/6-311+G(3df,2p)

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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