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	hartrees
Energy at 0K	-1468.957451
Energy at 298.15K	-1468.959518
HF Energy	-1468.957451
Nuclear repulsion energy	398.616427

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1216	1164	189.08
2	A₁	557	533	129.62
3	A₁	393	376	0.86
4	A₁	205	196	0.01
5	A₂	274	262	0.00
6	B₁	585	560	349.37
7	B₁	377	360	3.40
8	B₂	1471	1407	218.00
9	B₂	357	342	9.67

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.508
O2	0.000	1.261	1.187
O3	0.000	-1.261	1.187
Cl4	1.582	0.000	-0.798
Cl5	-1.582	0.000	-0.798

	S1	O2	O3	Cl4	Cl5
S1		1.4322	1.4322	2.0511	2.0511
O2	1.4322		2.5218	2.8340	2.8340
O3	1.4322	2.5218		2.8340	2.8340
Cl4	2.0511	2.8340	2.8340		3.1639
Cl5	2.0511	2.8340	2.8340	3.1639

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	123.381	O2	S1	Cl4	107.569
O2	S1	Cl5	107.569	O3	S1	Cl4	107.569
O3	S1	Cl5	107.569	Cl4	S1	Cl5	100.937

All results from a given calculation for SO₂Cl₂ (Sulfuryl chloride)

using model chemistry: wB97X-D/6-311G**

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	S	0.964
2	O	-0.392
3	O	-0.392
4	Cl	-0.090
5	Cl	-0.090

	x	y	z	Total
	0.000	0.000	-1.485	1.485
CHELPG
AIM
ESP

<r²>	189.789
(<r²>)^1/2	13.776

All results from a given calculation for SO2Cl2 (Sulfuryl chloride)

using model chemistry: wB97X-D/6-311G**

States and conformations

All results from a given calculation for SO₂Cl₂ (Sulfuryl chloride)