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	hartrees
Energy at 0K	-335.096455
Energy at 298.15K	-335.091609
HF Energy	-335.264546
Nuclear repulsion energy	54.696218

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2253	2174	92.80	73.34	0.11	0.20
2	Σ	472	455	146.55	18.41	0.71	0.83
3	Π	149	144	8.16	8.38	0.75	0.86
3	Π	149	144	8.16	8.38	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.321
C2	0.000	0.000	-0.694
N3	0.000	0.000	-1.858

	Al1	C2	N3
Al1		2.0148	3.1794
C2	2.0148		1.1646
N3	3.1794	1.1646

Number	Element	Mulliken
1	Al	0.178
2	C	-0.002
3	N	-0.176

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

using model chemistry: G4

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>	65.375
(<r²>)^1/2	8.085