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	hartrees
Energy at 0K	-58.300809
Energy at 298.15K
HF Energy	-58.300809
Nuclear repulsion energy	69.749638

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3714	3586	81.65	50.98	0.28	0.44
2	A'	1757	1697	345.92	1.96	0.67	0.80
3	A'	1350	1304	326.71	8.55	0.28	0.44
4	A'	1323	1278	49.00	6.22	0.62	0.77
5	A'	909	878	158.13	12.21	0.13	0.23
6	A'	637	615	2.54	7.66	0.53	0.69
7	A'	566	547	9.19	3.29	0.67	0.80
8	A"	736	711	6.94	0.04	0.75	0.86
9	A"	487	471	139.56	4.14	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.150
O2	-0.278	-1.243
O3	1.197	0.461
O4	-0.996	0.856
H5	0.621	-1.642

	N1	O2	O3	O4	H5
N1		1.4210	1.2363	1.2211	1.8965
O2	1.4210		2.2537	2.2191	0.9828
O3	1.2363	2.2537		2.2283	2.1805
O4	1.2211	2.2191	2.2283		2.9757
H5	1.8965	0.9828	2.1805	2.9757

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	102.650		O2	N1	O3	115.840
O2	N1	O4	114.044		O3	N1	O4	130.116

All results from a given calculation for HNO₃ (Nitric acid)

using model chemistry: B3LYP/CEP-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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Number	Element	Mulliken
1	N	0.039
2	O	-0.302
3	O	-0.083
4	O	-0.049
5	H	0.396

	x	y	z	Total
	1.168	-2.163	0.000	2.459
CHELPG
AIM
ESP

	x	y	z
x	4.212	-0.345	0.000
y	-0.345	3.714	0.000
z	0.000	0.000	1.339

<r²>	46.748
(<r²>)^1/2	6.837

All results from a given calculation for HNO3 (Nitric acid)

using model chemistry: B3LYP/CEP-31G*

States and conformations

All results from a given calculation for HNO₃ (Nitric acid)