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	hartrees
Energy at 0K	-933.502541
Energy at 298.15K	-933.503104
HF Energy	-933.502541
Nuclear repulsion energy	139.714738

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1172	1116	94.57
2	A'	501	477	116.90
3	A'	304	290	4.83

Atom	x (Å)	y (Å)
Cl1	-0.697	-1.144
S2	0.000	0.811
O3	1.481	0.809

	Cl1	S2	O3
Cl1		2.0752	2.9250
S2	2.0752		1.4806
O3	2.9250	1.4806

Number	Element	Mulliken
1	Cl	-0.118
2	S	0.520
3	O	-0.402

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

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

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
	-1.529	1.049	0.000	1.854
CHELPG
AIM
ESP

	x	y	z
x	5.564	1.787	0.000
y	1.787	6.273	0.000
z	0.000	0.000	3.037

<r²>	83.187
(<r²>)^1/2	9.121