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	hartrees
Energy at 0K	-17.386159
Energy at 298.15K
HF Energy	-17.089868
Nuclear repulsion energy	14.893557

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	1985	1885	289.75	80.98	0.21	0.35
2	Σ	497	471	175.96	16.32	0.66	0.80
3	Π	47	44	1.32	10.00	0.75	0.86
3	Π	47	44	1.32	10.00	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.231
N2	0.000	0.000	-0.667
C3	0.000	0.000	-1.887

	Al1	N2	C3
Al1		1.8979	3.1180
N2	1.8979		1.2201
C3	3.1180	1.2201

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

using model chemistry: MP2/CEP-31G*

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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