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	hartrees
Energy at 0K	-1461.637557
Energy at 298.15K	-1461.638529
Nuclear repulsion energy	351.465399

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	945	912	37.73
2	A₁	435	420	57.24
3	A₁	266	257	0.95
4	A₁	117	113	0.45
5	A₂	159	153	0.00
6	B₁	409	395	149.09
7	B₁	236	228	0.48
8	B₂	1121	1082	31.49
9	B₂	217	209	8.88

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.624
O2	0.000	1.371	1.391
O3	0.000	-1.371	1.391
Cl4	1.780	0.000	-0.949
Cl5	-1.780	0.000	-0.949

	S1	O2	O3	Cl4	Cl5
S1		1.5709	1.5709	2.3756	2.3756
O2	1.5709		2.7421	3.2439	3.2439
O3	1.5709	2.7421		3.2439	3.2439
Cl4	2.3756	3.2439	3.2439		3.5604
Cl5	2.3756	3.2439	3.2439	3.5604

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	121.573	O2	S1	Cl4	108.855
O2	S1	Cl5	108.855	O3	S1	Cl4	108.855
O3	S1	Cl5	108.855	Cl4	S1	Cl5	97.074

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

using model chemistry: B3LYP/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	S	1.116
2	O	-0.413
3	O	-0.413
4	Cl	-0.144
5	Cl	-0.144

	x	y	z	Total
	0.000	0.000	0.517	0.517
CHELPG
AIM
ESP

<r²>	237.772
(<r²>)^1/2	15.420

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

using model chemistry: B3LYP/3-21G

States and conformations

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