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	hartrees
Energy at 0K	-103.415820
Energy at 298.15K	-103.413559
HF Energy	-103.415820
Nuclear repulsion energy	38.480799

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	2465	2220	8.84	77.08	0.20	0.34
2	Σ	512	461	11.28	7.48	0.30	0.46
3	Π	374	337	0.86	0.62	0.75	0.86
3	Π	374	337	0.86	0.62	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.519
C2	0.000	0.000	-1.497
N3	0.000	0.000	-2.650

	I1	C2	N3
I1		2.0164	3.1693
C2	2.0164		1.1530
N3	3.1693	1.1530

Number	Element	Mulliken
1	I	0.398
2	C	-0.367
3	N	-0.032

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

using model chemistry: HF/SDD

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>	85.847
(<r²>)^1/2	9.265