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	hartrees
Energy at 0K	-933.672247
Energy at 298.15K	-933.672715
HF Energy	-933.672247
Nuclear repulsion energy	136.872501

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1108	1108	76.84
2	A'	436	436	83.01
3	A'	271	271	2.97

Atom	x (Å)	y (Å)
Cl1	-0.701	-1.189
S2	0.000	0.824
O3	1.489	0.878

	Cl1	S2	O3
Cl1		2.1314	3.0116
S2	2.1314		1.4905
O3	3.0116	1.4905

Number	Element	Mulliken
1	Cl	-0.146
2	S	0.445
3	O	-0.299

All results from a given calculation for ClSO (Sulfur chloride oxide)

using model chemistry: BLYP/cc-pCVTZ

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-1.222	0.848	0.000	1.488
CHELPG
AIM
ESP

	x	y	z
x	5.455	1.883	0.000
y	1.883	6.912	0.000
z	0.000	0.000	3.139

<r²>	86.246
(<r²>)^1/2	9.287