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	hartrees
Energy at 0K	-933.495326
Energy at 298.15K	-933.495883
HF Energy	-933.495326
Nuclear repulsion energy	139.611717

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1175	1115	76.97
2	A'	503	477	110.99
3	A'	303	287	4.66

Atom	x (Å)	y (Å)
Cl1	-0.697	-1.146
S2	0.000	0.810
O3	1.481	0.816

	Cl1	S2	O3
Cl1		2.0762	2.9314
S2	2.0762		1.4810
O3	2.9314	1.4810

Number	Element	Mulliken
1	Cl	-0.194
2	S	0.601
3	O	-0.407

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

using model chemistry: wB97X-D/6-31G*

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
	-1.277	1.185	0.000	1.742
CHELPG
AIM
ESP

	x	y	z
x	4.652	1.752	0.000
y	1.752	5.744	0.000
z	0.000	0.000	2.343

<r²>	83.067
(<r²>)^1/2	9.114