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	hartrees
Energy at 0K	-334.567176
Energy at 298.15K
HF Energy	-334.263329
Nuclear repulsion energy	58.232348

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2170	2008	442.55
2	Σ	565	523	192.73
3	Π	123	114	1.19
3	Π	123	114	1.19

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.205
N2	0.000	0.000	-0.660
C3	0.000	0.000	-1.839

	Al1	N2	C3
Al1		1.8648	3.0439
N2	1.8648		1.1791
C3	3.0439	1.1791

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

using model chemistry: CISD/6-311G*

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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