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	hartrees
Energy at 0K	-334.566022
Energy at 298.15K
HF Energy	-334.226727
Nuclear repulsion energy	53.847249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2203	2114	78.67
2	Σ	456	437	144.98
3	Π	169	162	4.38
3	Π	169	162	4.38

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.344
C2	0.000	0.000	-0.708
N3	0.000	0.000	-1.888

	Al1	C2	N3
Al1		2.0517	3.2320
C2	2.0517		1.1803
N3	3.2320	1.1803

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

using model chemistry: QCISD/cc-pVDZ

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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