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	hartrees
Energy at 0K	-589.975848
Energy at 298.15K
HF Energy	-589.737359
Nuclear repulsion energy	84.562982

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1863	1787	559.17	7.29	0.49	0.66
2	A'	600	576	106.55	3.94	0.13	0.23
3	A'	334	320	80.54	20.08	0.21	0.34

Atom	x (Å)	y (Å)
Cl1	-0.527	-0.948
N2	0.000	0.983
O3	1.120	1.155

	Cl1	N2	O3
Cl1		2.0017	2.6712
N2	2.0017		1.1327
O3	2.6712	1.1327

Number	Element	Mulliken
1	Cl	-0.124
2	N	0.169
3	O	-0.045

All results from a given calculation for ClNO (Nitrosyl chloride)

using model chemistry: B2PLYP=FULLultrafine/aug-cc-pVTZ

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
	1.058	1.967	0.000	2.234
CHELPG
AIM
ESP

	x	y	z
x	4.803	1.837	-0.001
y	1.837	7.083	-0.002
z	-0.001	-0.002	3.385

<r²>	61.969
(<r²>)^1/2	7.872