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	hartrees
Energy at 0K	-1461.419915
Energy at 298.15K	-1461.420952
Nuclear repulsion energy	354.233273

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	964	927	42.03
2	A₁	442	425	61.63
3	A₁	275	264	0.90
4	A₁	121	116	0.47
5	A₂	163	157	0.00
6	B₁	419	403	160.65
7	B₁	243	234	0.46
8	B₂	1149	1105	34.58
9	B₂	222	214	9.35

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.619
O2	0.000	1.368	1.381
O3	0.000	-1.368	1.381
Cl4	1.759	0.000	-0.941
Cl5	-1.759	0.000	-0.941

	S1	O2	O3	Cl4	Cl5
S1		1.5654	1.5654	2.3518	2.3518
O2	1.5654		2.7358	3.2183	3.2183
O3	1.5654	2.7358		3.2183	3.2183
Cl4	2.3518	3.2183	3.2183		3.5189
Cl5	2.3518	3.2183	3.2183	3.5189

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	121.812	O2	S1	Cl4	108.823
O2	S1	Cl5	108.823	O3	S1	Cl4	108.823
O3	S1	Cl5	108.823	Cl4	S1	Cl5	96.855

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

using model chemistry: B3PW91/3-21G

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	1.122
2	O	-0.421
3	O	-0.421
4	Cl	-0.140
5	Cl	-0.140

	x	y	z	Total
	0.000	0.000	0.459	0.459
CHELPG
AIM
ESP

<r²>	234.115
(<r²>)^1/2	15.301

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

using model chemistry: B3PW91/3-21G

States and conformations

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