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	hartrees
Energy at 0K	-1253.384419
Energy at 298.15K	-1253.384672
HF Energy	-1253.384419
Nuclear repulsion energy	180.841491

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	666	658	42.25
2	A'	415	411	99.63
3	A'	200	198	4.17

Atom	x (Å)	y (Å)
Cl1	-1.610	-0.628
S2	0.000	0.770
S3	1.711	-0.103

	Cl1	S2	S3
Cl1		2.1322	3.3624
S2	2.1322		1.9208
S3	3.3624	1.9208

Number	Element	Mulliken
1	Cl	-0.145
2	S	0.176
3	S	-0.032

All results from a given calculation for ClS₂ (Sulfur chloride)

using model chemistry: SVWN/TZVP

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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	x	y	z	Total
	0.609	0.778	0.000	0.988
CHELPG
AIM
ESP

	x	y	z
x	12.242	0.600	0.000
y	0.600	5.282	0.000
z	0.000	0.000	3.004

<r²>	131.205
(<r²>)^1/2	11.454

All results from a given calculation for ClS2 (Sulfur chloride)

using model chemistry: SVWN/TZVP

States and conformations

All results from a given calculation for ClS₂ (Sulfur chloride)