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	hartrees
Energy at 0K	-334.550438
Energy at 298.15K
HF Energy	-334.223477
Nuclear repulsion energy	57.819686

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2140	2021	372.36
2	Σ	561	530	176.88
3	Π	129	122	0.83
3	Π	129	122	0.83

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.212
N2	0.000	0.000	-0.662
C3	0.000	0.000	-1.853

	Al1	N2	C3
Al1		1.8738	3.0652
N2	1.8738		1.1914
C3	3.0652	1.1914

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

using model chemistry: CCSD/6-31G*

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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