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	hartrees
Energy at 0K	-7009.645580
Energy at 298.15K
HF Energy	-7009.116139
Nuclear repulsion energy	163.833075

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2189	2108
2	Σ	488	470
3	Π	301	290
3	Π	301	290

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.522
C2	0.000	0.000	-1.497
N3	0.000	0.000	-2.669

	I1	C2	N3
I1		2.0191	3.1910
C2	2.0191		1.1719
N3	3.1910	1.1719

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

using model chemistry: QCISD(T)/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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