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	hartrees
Energy at 0K	-737.772912
Energy at 298.15K	-737.775234
HF Energy	-737.772912
Nuclear repulsion energy	218.940214

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1719	1684	170.31
2	A'	1264	1239	210.34
3	A'	769	753	120.95
4	A'	729	714	11.53
5	A'	542	531	26.47
6	A'	413	405	5.49
7	A'	211	207	0.11
8	A"	666	652	6.68
9	A"	140	137	0.55

Atom	x (Å)	y (Å)
Cl1	-1.697	0.279
O2	0.000	0.875
N3	1.016	-0.286
O4	0.582	-1.425
O5	2.136	0.208

	Cl1	O2	N3	O4	O5
Cl1		1.7991	2.7717	2.8455	3.8345
O2	1.7991		1.5427	2.3718	2.2378
N3	2.7717	1.5427		1.2185	1.2248
O4	2.8455	2.3718	1.2185		2.2549
O5	3.8345	2.2378	1.2248	2.2549

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl1	O2	N3	111.849		O2	N3	O4	117.929
O2	N3	O5	107.365		O4	N3	O5	134.706

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

using model chemistry: LSDA/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	0.230
2	O	-0.292
3	N	0.356
4	O	-0.152
5	O	-0.142

	x	y	z	Total
	-0.794	-0.308	0.000	0.852
CHELPG
AIM
ESP

	x	y	z
x	8.449	-0.072	0.000
y	-0.072	4.112	0.000
z	0.000	0.000	1.415

<r²>	141.372
(<r²>)^1/2	11.890

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

using model chemistry: LSDA/6-31G

States and conformations

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