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	hartrees
Energy at 0K	-928.953422
Energy at 298.15K	-928.953705
HF Energy	-928.953422
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	968	952	35.50
2	A'	364	358	33.93
3	A'	208	205	2.79

Atom	x (Å)	y (Å)
Cl1	-0.760	-1.337
S2	0.000	0.928
O3	1.614	0.985

	Cl1	S2	O3
Cl1		2.3882	3.3205
S2	2.3882		1.6153
O3	3.3205	1.6153

Number	Element	Mulliken
1	Cl	-0.231
2	S	0.580
3	O	-0.348

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

using model chemistry: B97D3/3-21G

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
	-0.354	2.236	0.000	2.264
CHELPG
AIM
ESP

	x	y	z
x	4.777	2.677	0.000
y	2.677	7.049	0.000
z	0.000	0.000	1.396

<r²>	102.038
(<r²>)^1/2	10.101