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	hartrees
Energy at 0K	-387.577734
Energy at 298.15K
HF Energy	-386.976549
Nuclear repulsion energy	88.420587

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2116	2116	0.00
2	Σ	524	524	0.40
3	Π	331	331	1.01
3	Π	331	331	1.01

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.514
C2	0.000	0.000	-1.466
N3	0.000	0.000	-2.638

	I1	C2	N3
I1		1.9801	3.1525
C2	1.9801		1.1724
N3	3.1525	1.1724

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

using model chemistry: MP2=FULL/cc-pVTZ-PP

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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