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	hartrees
Energy at 0K	-57.253191
Energy at 298.15K	-57.255280
HF Energy	-56.550844
Nuclear repulsion energy	62.884534

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1329	1266	162.59
2	A₁	901	858	79.42
3	A₁	613	584	0.07
4	B₁	701	667	6.55
5	B₂	1854	1767	220.98
6	B₂	430	410	9.87

Atom	y (Å)	z (Å)
N1	0.000	-0.108
O2	0.000	1.294
O3	1.127	-0.600
O4	-1.127	-0.600

	N1	O2	O3	O4
N1		1.4017	1.2297	1.2297
O2	1.4017		2.2040	2.2040
O3	1.2297	2.2040		2.2536
O4	1.2297	2.2040	2.2536

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	N1	O3	113.609		O2	N1	O4	113.609
O3	N1	O4	132.783

All results from a given calculation for NO₃ (Nitrogen trioxide)

using model chemistry: MP2/CEP-121G*

States and conformations

Conformer 1 (all bonds equal)

Conformer 2 (one short, two long)

Conformer 3 (one long, two short)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for NO3 (Nitrogen trioxide)

using model chemistry: MP2/CEP-121G*

States and conformations

Conformer 1 (all bonds equal)

Conformer 2 (one short, two long)

Conformer 3 (one long, two short)

All results from a given calculation for NO₃ (Nitrogen trioxide)