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	hartrees
Energy at 0K	-389.939246
Energy at 298.15K	-389.936884
HF Energy	-388.980697
Nuclear repulsion energy	88.469394

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2217	2217
2	Σ	508	508
3	Π	325	325
3	Π	325	325

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.515
C2	0.000	0.000	-1.471
N3	0.000	0.000	-2.635

	I1	C2	N3
I1		1.9859	3.1495
C2	1.9859		1.1636
N3	3.1495	1.1636

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

using model chemistry: CCSD(T)=FULL/Def2TZVPP

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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