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	hartrees
Energy at 0K	-17.050807
Energy at 298.15K
HF Energy	-17.050807
Nuclear repulsion energy	15.216427

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	2178	1988	571.06	85.08	0.12	0.22
2	Σ	545	497	211.37	16.71	0.74	0.85
3	Π	266	243	0.02	12.50	0.75	0.86
3	Π	266	243	0.02	12.50	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.211
N2	0.000	0.000	-0.663
C3	0.000	0.000	-1.851

	Al1	N2	C3
Al1		1.8747	3.0627
N2	1.8747		1.1880
C3	3.0627	1.1880

Number	Element	Mulliken
1	Al	0.718
2	N	-0.505
3	C	-0.213

All results from a given calculation for AlNC (Aluminum isocyanide)

using model chemistry: HF/CEP-121G

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>	35.552
(<r²>)^1/2	5.963