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	hartrees
Energy at 0K	-736.527408
Energy at 298.15K	-736.529571
HF Energy	-736.527408
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1439	1414	99.20
2	A'	1082	1063	218.16
3	A'	748	735	95.54
4	A'	701	689	4.54
5	A'	537	528	1.84
6	A'	376	370	1.01
7	A'	201	197	0.21
8	A"	592	582	7.36
9	A"	125	123	0.18

Atom	x (Å)	y (Å)
Cl1	-1.717	0.314
O2	0.000	0.918
N3	1.032	-0.320
O4	0.556	-1.471
O5	2.189	0.166

	Cl1	O2	N3	O4	O5
Cl1		1.8201	2.8214	2.8898	3.9086
O2	1.8201		1.6117	2.4523	2.3142
N3	2.8214	1.6117		1.2453	1.2546
O4	2.8898	2.4523	1.2453		2.3120
O5	3.9086	2.3142	1.2546	2.3120

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl1	O2	N3	116.971		O2	N3	O4	118.889
O2	N3	O5	108.517		O4	N3	O5	132.594

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

using model chemistry: B97D3/3-21G

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	0.144
2	O	-0.229
3	N	0.506
4	O	-0.216
5	O	-0.204

	x	y	z	Total
	-0.302	-0.325	0.000	0.444
CHELPG
AIM
ESP

	x	y	z
x	8.127	-0.173	0.000
y	-0.173	3.758	0.000
z	0.000	0.000	1.059

<r²>	145.873
(<r²>)^1/2	12.078

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

using model chemistry: B97D3/3-21G

States and conformations

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