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	hartrees
Energy at 0K	-332.673288
Energy at 298.15K
HF Energy	-332.449591
Nuclear repulsion energy	57.555210

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	1957	1862	242.38	98.12	0.19	0.32
2	Σ	583	554	159.82	17.82	0.68	0.81
3	Π	132	125	3.42	10.44	0.75	0.86
3	Π	132	125	3.42	10.44	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.213
N2	0.000	0.000	-0.654
C3	0.000	0.000	-1.865

	Al1	N2	C3
Al1		1.8669	3.0780
N2	1.8669		1.2111
C3	3.0780	1.2111

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

using model chemistry: MP2/3-21G*

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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