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	hartrees
Energy at 0K	-931.859604
Energy at 298.15K	-931.860210
HF Energy	-931.859604
Nuclear repulsion energy	140.549316

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1061	966	27.53
2	A'	534	486	107.79
3	A'	327	298	1.14

Atom	x (Å)	y (Å)
Cl1	-0.697	-1.123
S2	0.000	0.819
O3	1.480	0.750

	Cl1	S2	O3
Cl1		2.0628	2.8716
S2	2.0628		1.4818
O3	2.8716	1.4818

Number	Element	Mulliken
1	Cl	-0.274
2	S	0.948
3	O	-0.674

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

using model chemistry: HF/aug-cc-pVDZ

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
	-1.370	0.919	0.000	1.649
CHELPG
AIM
ESP

	x	y	z
x	6.736	1.396	0.000
y	1.396	6.688	0.000
z	0.000	0.000	3.982

<r²>	81.817
(<r²>)^1/2	9.045