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	hartrees
Energy at 0K	-6979.868064
Energy at 298.15K	-6979.865764
HF Energy	-6979.603522
Nuclear repulsion energy	160.516792

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2059	1997
2	Σ	477	463
3	Π	365	354
3	Π	365	354

Atom	x (Å)	y (Å)	z (Å)
I1	0.000	0.000	0.533
C2	0.000	0.000	-1.531
N3	0.000	0.000	-2.722

	I1	C2	N3
I1		2.0640	3.2547
C2	2.0640		1.1907
N3	3.2547	1.1907

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

using model chemistry: MP4/3-21G

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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