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	hartrees
Energy at 0K	-334.665720
Energy at 298.15K
HF Energy	-334.280608
Nuclear repulsion energy	58.281276

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2110	2110	400.56
2	Σ	556	556	188.64
3	Π	108	108	2.62
3	Π	108	108	2.62

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.203
N2	0.000	0.000	-0.658
C3	0.000	0.000	-1.838

	Al1	N2	C3
Al1		1.8602	3.0411
N2	1.8602		1.1809
C3	3.0411	1.1809

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

using model chemistry: QCISD/Def2TZVPP

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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