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	hartrees
Energy at 0K	-334.579759
Energy at 298.15K
HF Energy	-334.248751
Nuclear repulsion energy	56.741855

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	2015	1953	296.87	109.40	0.13	0.23
2	Σ	502	487	204.04	17.19	0.64	0.78
3	Π	80	78	2.84	6.81	0.75	0.86
3	Π	80	78	2.84	6.81	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.238
N2	0.000	0.000	-0.682
C3	0.000	0.000	-1.886

	Al1	N2	C3
Al1		1.9207	3.1246
N2	1.9207		1.2040
C3	3.1246	1.2040

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

using model chemistry: MP2=FULL/aug-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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