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	hartrees
Energy at 0K	-1461.600640
Energy at 298.15K	-1461.601728
Nuclear repulsion energy	356.418717

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	975	931	45.41
2	A₁	449	428	65.46
3	A₁	282	269	0.70
4	A₁	126	120	0.49
5	A₂	165	158	0.00
6	B₁	428	409	171.59
7	B₁	248	237	0.64
8	B₂	1164	1111	36.86
9	B₂	227	217	10.04

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.616
O2	0.000	1.364	1.374
O3	0.000	-1.364	1.374
Cl4	1.743	0.000	-0.936
Cl5	-1.743	0.000	-0.936

	S1	O2	O3	Cl4	Cl5
S1		1.5604	1.5604	2.3340	2.3340
O2	1.5604		2.7284	3.1992	3.1992
O3	1.5604	2.7284		3.1992	3.1992
Cl4	2.3340	3.1992	3.1992		3.4859
Cl5	2.3340	3.1992	3.1992	3.4859

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	121.913	O2	S1	Cl4	108.838
O2	S1	Cl5	108.838	O3	S1	Cl4	108.838
O3	S1	Cl5	108.838	Cl4	S1	Cl5	96.618

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

using model chemistry: mPW1PW91/3-21G

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	1.139
2	O	-0.434
3	O	-0.434
4	Cl	-0.136
5	Cl	-0.136

	x	y	z	Total
	0.000	0.000	0.337	0.337
CHELPG
AIM
ESP

<r²>	231.364
(<r²>)^1/2	15.211

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

using model chemistry: mPW1PW91/3-21G

States and conformations

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