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	hartrees
Energy at 0K	-7018.952501
Energy at 298.15K
HF Energy	-7018.804305
Nuclear repulsion energy	180.806032

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1398	1398	487.11
2	A'	506	506	61.28
3	A'	247	247	30.91

Atom	x (Å)	y (Å)
N1	0.502	-1.707
O2	-0.439	-2.454
I3	0.000	0.596

	N1	O2	I3
N1		1.2016	2.3565
O2	1.2016		3.0807
I3	2.3565	3.0807

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

using model chemistry: B2PLYP=FULLultrafine/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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