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	hartrees
Energy at 0K	-334.610771
Energy at 298.15K
HF Energy	-334.236203
Nuclear repulsion energy	58.350102

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2110	1999	385.18
2	Σ	578	547	168.41
3	Π	106	101	2.75
3	Π	106	101	2.75

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.199
N2	0.000	0.000	-0.651
C3	0.000	0.000	-1.838

	Al1	N2	C3
Al1		1.8505	3.0368
N2	1.8505		1.1863
C3	3.0368	1.1863

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

using model chemistry: QCISD/6-31G(2df,p)

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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