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	hartrees
Energy at 0K	-6982.295943
Energy at 298.15K	-6982.293715
HF Energy	-6982.295943
Nuclear repulsion energy	164.228540

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2286	2195	6.30
2	Σ	509	488	0.21
3	Π	390	375	0.10
3	Π	390	375	0.10

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.521
C2	0.000	0.000	-1.495
N3	0.000	0.000	-2.662

	I1	C2	N3
I1		2.0153	3.1826
C2	2.0153		1.1673
N3	3.1826	1.1673

Number	Element	Mulliken
1	I	0.297
2	C	0.125
3	N	-0.422

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

using model chemistry: HSEh1PBE/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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<r²>	102.887
(<r²>)^1/2	10.143