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	hartrees
Energy at 0K	-426.689327
Energy at 298.15K	-426.688119
HF Energy	-425.924871
Nuclear repulsion energy	102.914271

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1977	1977	1581.95
2	A'	558	558	99.38
3	A'	254	254	76.03

Atom	x (Å)	y (Å)
N1	0.476	-1.667
O2	-0.416	-2.340
I3	0.000	0.573

	N1	O2	I3
N1		1.1172	2.2905
O2	1.1172		2.9433
I3	2.2905	2.9433

All results from a given calculation for INO (Nitrosyl iodide)

using model chemistry: CID/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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