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	hartrees
Energy at 0K	-665.270066
Energy at 298.15K	-665.271449
HF Energy	-665.270066
Nuclear repulsion energy	144.891022

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1626	1629	234.08
2	A'	1043	1044	85.40
3	A'	753	754	70.30
4	A'	316	317	90.88
5	A'	154	154	7.02
6	A"	478	479	1.48

Atom	x (Å)	y (Å)
Cl1	-1.317	-0.557
O2	0.000	0.980
N3	1.230	0.692
O4	1.724	-0.401

	Cl1	O2	N3	O4
Cl1		2.0244	2.8365	3.0448
O2	2.0244		1.2629	2.2088
N3	2.8365	1.2629		1.1994
O4	3.0448	2.2088	1.1994

Number	Element	Mulliken
1	Cl	-0.094
2	O	-0.072
3	N	0.244
4	O	-0.079

All results from a given calculation for ClONO (chlorine nitrite)

using model chemistry: BLYP/cc-pVDZ

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	1.080	0.701	0.000	1.287
CHELPG
AIM
ESP

	x	y	z
x	7.926	1.446	0.000
y	1.446	3.922	0.000
z	0.000	0.000	1.669

<r²>	98.897
(<r²>)^1/2	9.945