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	hartrees
Energy at 0K	-355.299538
Energy at 298.15K	-355.303510
HF Energy	-354.321573
Nuclear repulsion energy	187.510632

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3809	3611	45.27
2	A	1872	1774	509.00
3	A	1462	1386	67.45
4	A	1395	1323	213.24
5	A	1045	990	11.61
6	A	875	830	165.58
7	A	766	726	9.01
8	A	706	669	13.76
9	A	544	516	9.72
10	A	394	373	54.01
11	A	324	307	49.33
12	A	121	115	10.91

Atom	x (Å)	y (Å)	z (Å)
N1	0.605	0.074	0.003
O2	-0.588	-0.768	0.113
O3	-1.724	-0.001	-0.172
O4	1.583	-0.596	-0.048
O5	0.440	1.250	0.019
H6	-1.926	0.409	0.680

	N1	O2	O3	O4	O5	H6
N1		1.4638	2.3360	1.1867	1.1872	2.6412
O2	1.4638		1.3996	2.1831	2.2662	1.8703
O3	2.3360	1.3996		3.3616	2.5065	0.9671
O4	1.1867	2.1831	3.3616		2.1719	3.7219
O5	1.1872	2.2662	2.5065	2.1719		2.5969
H6	2.6412	1.8703	0.9671	3.7219	2.5969

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	O2	O3	109.315	O2	N1	O4	110.473
O2	N1	O5	117.104	O2	O3	H6	102.887
O4	N1	O5	132.382

All results from a given calculation for HOONO₂ (peroxy nitric acid)

using model chemistry: CCD/TZVP

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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All results from a given calculation for HOONO2 (peroxy nitric acid)

using model chemistry: CCD/TZVP

States and conformations

All results from a given calculation for HOONO₂ (peroxy nitric acid)