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	hartrees
Energy at 0K	-933.629109
Energy at 298.15K	-933.629704
HF Energy	-933.629109
Nuclear repulsion energy	141.475632

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1229	1229	92.64
2	A'	511	511	109.38
3	A'	314	314	2.91

Atom	x (Å)	y (Å)
Cl1	-0.685	-1.135
S2	0.000	0.801
O3	1.456	0.810

	Cl1	S2	O3
Cl1		2.0534	2.8934
S2	2.0534		1.4565
O3	2.8934	1.4565

Number	Element	Mulliken
1	Cl	-0.136
2	S	0.455
3	O	-0.319

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

using model chemistry: wB97X-D/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
	-1.381	0.713	0.000	1.554
CHELPG
AIM
ESP

	x	y	z
x	5.195	1.596	0.000
y	1.596	6.295	0.000
z	0.000	0.000	3.076

<r²>	81.242
(<r²>)^1/2	9.013