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	hartrees
Energy at 0K	-334.649866
Energy at 298.15K	-334.651981
HF Energy	-334.649866
Nuclear repulsion energy	161.114198

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1885	1804	1.24
2	A₁	1081	1035	34.30
3	A₁	475	455	1.54
4	A₁	268	256	0.35
5	A₂	257	246	0.00
6	B₁	146	139	0.12
7	B₂	1828	1749	441.44
8	B₂	771	738	1.12
9	B₂	522	499	936.29

Atom	y (Å)	z (Å)
O1	0.000	0.438
N2	1.141	-0.447
N3	-1.141	-0.447
O4	2.120	0.172
O5	-2.120	0.172

	O1	N2	N3	O4	O5
O1		1.4441	1.4441	2.1363	2.1363
N2	1.4441		2.2815	1.1586	3.3188
N3	1.4441	2.2815		3.3188	1.1586
O4	2.1363	1.1586	3.3188		4.2394
O5	2.1363	3.3188	1.1586	4.2394

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	N2	O4	109.845		O1	N3	O5	109.845
N2	O1	N3	104.355

All results from a given calculation for ONONO (Nitrosyl nitrite)

using model chemistry: PBE1PBE/6-31G(2df,p)

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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Number	Element	Mulliken
1	O	-0.297
2	N	0.315
3	N	0.315
4	O	-0.167
5	O	-0.167

	x	y	z	Total
	0.000	0.000	-0.260	0.260
CHELPG
AIM
ESP

<r²>	111.398
(<r²>)^1/2	10.555