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	hartrees
Energy at 0K	-389.940104
Energy at 298.15K	-389.937741
HF Energy	-388.980574
Nuclear repulsion energy	88.438945

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2210	2210
2	Σ	507	507
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	-1.472
N3	0.000	0.000	-2.636

	I1	C2	N3
I1		1.9863	3.1506
C2	1.9863		1.1643
N3	3.1506	1.1643

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

using model chemistry: QCISD(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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