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	hartrees
Energy at 0K	-354.684414
Energy at 298.15K	-354.687704
HF Energy	-353.954892
Nuclear repulsion energy	173.654449

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3535	3358	9.96
2	A	1901	1806	64.75
3	A	1301	1236	76.60
4	A	1208	1148	151.15
5	A	806	766	94.75
6	A	726	690	139.58
7	A	600	570	6.63
8	A	513	487	53.87
9	A	376	358	84.54
10	A	310	294	79.73
11	A	242	230	8.46
12	A	114	108	8.63

Atom	x (Å)	y (Å)	z (Å)
N1	0.713	0.098	0.007
O2	-0.722	-0.887	0.049
O3	-1.837	0.102	-0.146
O4	1.703	-0.645	-0.021
O5	0.499	1.311	0.014
H6	-2.132	0.267	0.783

	N1	O2	O3	O4	O5	H6
N1		1.7410	2.5541	1.2380	1.2321	2.9535
O2	1.7410		1.5021	2.4379	2.5150	1.9638
O3	2.5541	1.5021		3.6193	2.6354	0.9890
O4	1.2380	2.4379	3.6193		2.2972	4.0227
O5	1.2321	2.5150	2.6354	2.2972		2.9338
H6	2.9535	1.9638	0.9890	4.0227	2.9338

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	O2	O3	103.668	O2	N1	O4	108.667
O2	N1	O5	114.454	O2	O3	H6	102.085
O4	N1	O5	136.879

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

using model chemistry: MP2=FULL/6-31G

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: MP2=FULL/6-31G

States and conformations

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