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	hartrees
Energy at 0K	-334.632447
Energy at 298.15K
HF Energy	-334.282507
Nuclear repulsion energy	58.404313

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2178	2178	453.35
2	Σ	558	558	199.42
3	Π	107	107	2.64
3	Π	107	107	2.64

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	1.202
N2	0.000	0.000	-0.661
C3	0.000	0.000	-1.833

	Al1	N2	C3
Al1		1.8624	3.0353
N2	1.8624		1.1729
C3	3.0353	1.1729

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

using model chemistry: CISD/daug-cc-pVTZ

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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