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	hartrees
Energy at 0K	-7009.618781
Energy at 298.15K
HF Energy	-7009.118160
Nuclear repulsion energy	164.623240

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2290	2187	0.33
2	Σ	503	480	1.81
3	Π	314	300	1.80
3	Π	314	300	1.80

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.520
C2	0.000	0.000	-1.493
N3	0.000	0.000	-2.654

	I1	C2	N3
I1		2.0128	3.1733
C2	2.0128		1.1606
N3	3.1733	1.1606

All results from a given calculation for ICN (Cyanogen iodide)

using model chemistry: CCD/6-311G*

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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