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	hartrees
Energy at 0K	-334.251819
Energy at 298.15K
HF Energy	-334.251819
Nuclear repulsion energy	58.079579

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2283	2079	582.22	91.31	0.09	0.16
2	Σ	545	496	226.42	11.48	0.75	0.86
3	Π	98	89	1.26	7.19	0.75	0.86
3	Π	98	89	1.26	7.19	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.213
N2	0.000	0.000	-0.673
C3	0.000	0.000	-1.841

	Al1	N2	C3
Al1		1.8860	3.0539
N2	1.8860		1.1679
C3	3.0539	1.1679

Number	Element	Mulliken
1	Al	0.744
2	N	-0.445
3	C	-0.299

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

using model chemistry: HF/aug-cc-pVDZ

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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<r²>	58.803
(<r²>)^1/2	7.668