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	hartrees
Energy at 0K	-280.947348
Energy at 298.15K
HF Energy	-280.947348
Nuclear repulsion energy	125.531094

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'	3665	3545	77.41	54.27	0.18	0.30
2	A'	1754	1697	376.90	3.45	0.75	0.86
3	A'	1337	1294	298.20	14.80	0.18	0.30
4	A'	1308	1266	40.80	5.02	0.71	0.83
5	A'	875	846	180.64	11.85	0.08	0.15
6	A'	627	607	16.55	8.24	0.36	0.53
7	A'	562	544	7.49	2.29	0.54	0.70
8	A"	762	738	6.96	0.03	0.75	0.86
9	A"	503	487	110.23	1.00	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.156
O2	-0.268	-1.238
O3	1.178	0.464
O4	-0.989	0.840
H5	0.631	-1.622

	N1	O2	O3	O4	H5
N1		1.4195	1.2173	1.2021	1.8870
O2	1.4195		2.2332	2.1993	0.9778
O3	1.2173	2.2332		2.1986	2.1569
O4	1.2021	2.1993	2.1986		2.9472
H5	1.8870	0.9778	2.1569	2.9472

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	102.267		O2	N1	O3	115.546
O2	N1	O4	113.796		O3	N1	O4	130.658

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

using model chemistry: TPSSh/aug-cc-pVDZ

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	1.163
2	O	-0.369
3	O	-0.501
4	O	-0.481
5	H	0.189

	x	y	z	Total
	1.067	-1.952	0.000	2.225
CHELPG
AIM
ESP

	x	y	z
x	4.706	-0.239	0.000
y	-0.239	4.517	0.000
z	0.000	0.000	2.412

<r²>	56.050
(<r²>)^1/2	7.487

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

using model chemistry: TPSSh/aug-cc-pVDZ

States and conformations

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