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	hartrees
Energy at 0K	-334.563563
Energy at 298.15K
HF Energy	-334.230682
Nuclear repulsion energy	57.635451

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2106	1991	399.80
2	Σ	544	515	195.34
3	Π	166	157	0.60
3	Π	166	157	0.60

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.217
N2	0.000	0.000	-0.666
C3	0.000	0.000	-1.859

	Al1	N2	C3
Al1		1.8829	3.0753
N2	1.8829		1.1925
C3	3.0753	1.1925

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

using model chemistry: QCISD/6-31+G**

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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