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	hartrees
Energy at 0K	-6984.856419
Energy at 298.15K	-6984.855180
HF Energy	-6984.856419
Nuclear repulsion energy	179.593522

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1674	1674	130.15
2	A'	558	558	22.80
3	A'	296	296	8.19

Atom	x (Å)	y (Å)
N1	0.527	-1.690
O2	-0.461	-2.473
I3	0.000	0.596

	N1	O2	I3
N1		1.2606	2.3469
O2	1.2606		3.1036
I3	2.3469	3.1036

Number	Element	Mulliken
1	N	0.037
2	O	0.012
3	I	-0.049

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

using model chemistry: B97D3/STO-3G

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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	x	y	z	Total
	-0.234	-1.222	0.000	1.244
CHELPG
AIM
ESP

<r²>	113.190
(<r²>)^1/2	10.639