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	hartrees
Energy at 0K	-933.669162
Energy at 298.15K	-933.669654
HF Energy	-933.669162
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1146	1146	78.52
2	A'	443	443	87.84
3	A'	283	283	3.03

Atom	x (Å)	y (Å)
Cl1	-0.695	-1.168
S2	0.000	0.814
O3	1.476	0.854

	Cl1	S2	O3
Cl1		2.0997	2.9663
S2	2.0997		1.4764
O3	2.9663	1.4764

Number	Element	Mulliken
1	Cl	-0.187
2	S	0.486
3	O	-0.299

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

using model chemistry: B97D3/cc-pV(T+d)Z

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
	-1.163	0.798	0.000	1.410
CHELPG
AIM
ESP

	x	y	z
x	6.112	1.661	0.000
y	1.661	7.264	0.000
z	0.000	0.000	3.992

<r²>	84.170
(<r²>)^1/2	9.174