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	hartrees
Energy at 0K	-332.652498
Energy at 298.15K
HF Energy	-332.427784
Nuclear repulsion energy	54.770784

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2279	2120	88.91
2	Σ	511	476	131.47
3	Π	289	269	7.01
3	Π	289	269	7.01

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.316
C2	0.000	0.000	-0.686
N3	0.000	0.000	-1.857

	Al1	C2	N3
Al1		2.0020	3.1731
C2	2.0020		1.1711
N3	3.1731	1.1711

All results from a given calculation for AlCN (Aluminum monocyanide)

using model chemistry: CID/3-21G*

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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