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	hartrees
Energy at 0K	-589.957687
Energy at 298.15K
HF Energy	-589.737597
Nuclear repulsion energy	84.474695

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'	1858	1858	555.91	6.91	0.56	0.72
2	A'	599	599	105.94	4.34	0.11	0.19
3	A'	333	333	80.13	20.75	0.19	0.32

Atom	x (Å)	y (Å)
Cl1	-0.527	-0.949
N2	0.000	0.984
O3	1.121	1.156

	Cl1	N2	O3
Cl1		2.0041	2.6738
N2	2.0041		1.1338
O3	2.6738	1.1338

Number	Element	Mulliken
1	Cl	-0.083
2	N	0.130
3	O	-0.047

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

using model chemistry: B2PLYP/daug-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
	1.062	1.981	0.000	2.247
CHELPG
AIM
ESP

	x	y	z
x	4.889	1.827	-0.001
y	1.827	7.139	-0.002
z	-0.001	-0.002	3.478

<r²>	62.066
(<r²>)^1/2	7.878