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	hartrees
Energy at 0K	-334.649215
Energy at 298.15K
HF Energy	-334.279159
Nuclear repulsion energy	57.808522

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	2043	1940	296.01	96.53	0.15	0.26
2	Σ	542	515	185.69	15.47	0.71	0.83
3	Π	100	95	4.16	8.51	0.75	0.86
3	Π	100	95	4.16	8.51	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.213
N2	0.000	0.000	-0.663
C3	0.000	0.000	-1.853

	Al1	N2	C3
Al1		1.8761	3.0660
N2	1.8761		1.1899
C3	3.0660	1.1899

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

using model chemistry: MP2/cc-pVTZ

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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