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	hartrees
Energy at 0K	-6982.929344
Energy at 298.15K	-6982.927140
HF Energy	-6982.929344
Nuclear repulsion energy	163.341841

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2273	2184	5.46
2	Σ	499	479	0.58
3	Π	404	389	0.53
3	Π	404	389	0.53

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.524
C2	0.000	0.000	-1.505
N3	0.000	0.000	-2.674

	I1	C2	N3
I1		2.0290	3.1979
C2	2.0290		1.1688
N3	3.1979	1.1688

Number	Element	Mulliken
1	I	0.497
2	C	-0.112
3	N	-0.385

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

using model chemistry: B3PW91/3-21G

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>	103.789
(<r²>)^1/2	10.188