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	hartrees
Energy at 0K	-740.298947
Energy at 298.15K	-740.301552
HF Energy	-740.298947
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1879	1782	339.46
2	A'	1403	1331	279.45
3	A'	852	808	124.47
4	A'	841	798	107.47
5	A'	646	612	37.19
6	A'	479	454	3.60
7	A'	265	251	0.03
8	A"	752	714	16.50
9	A"	130	124	0.23

Atom	x (Å)	y (Å)
Cl1	-1.614	0.299
O2	0.000	0.790
N3	0.946	-0.264
O4	0.552	-1.392
O5	2.049	0.197

	Cl1	O2	N3	O4	O5
Cl1		1.6865	2.6207	2.7481	3.6638
O2	1.6865		1.4160	2.2507	2.1330
N3	2.6207	1.4160		1.1948	1.1952
O4	2.7481	2.2507	1.1948		2.1825
O5	3.6638	2.1330	1.1952	2.1825

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl1	O2	N3	115.004		O2	N3	O4	118.856
O2	N3	O5	109.249		O4	N3	O5	131.895

All results from a given calculation for ClONO₂ (Chlorine nitrate)

using model chemistry: wB97X-D/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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Number	Element	Mulliken
1	Cl	0.252
2	O	-0.379
3	N	0.771
4	O	-0.327
5	O	-0.317

	x	y	z	Total
	-1.263	0.024	0.000	1.263
CHELPG
AIM
ESP

	x	y	z
x	7.134	0.023	0.000
y	0.023	4.036	0.000
z	0.000	0.000	2.071

<r²>	131.111
(<r²>)^1/2	11.450

All results from a given calculation for ClONO2 (Chlorine nitrate)

using model chemistry: wB97X-D/6-31G*

States and conformations

All results from a given calculation for ClONO₂ (Chlorine nitrate)