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	hartrees
Energy at 0K	-1712.374396
Energy at 298.15K	-1712.374697
Nuclear repulsion energy	326.879087

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	580	571	16.30
2	A	427	420	39.62
3	A	203	200	0.61
4	A	93	92	0.31
5	B	410	404	165.91
6	B	224	220	7.76

Atom	x (Å)	y (Å)	z (Å)
S1	0.436	0.869	0.734
S2	-0.436	-0.869	0.734
Cl3	-0.436	2.158	-0.691
Cl4	0.436	-2.158	-0.691

	S1	S2	Cl3	Cl4
S1		1.9447	2.1099	3.3455
S2	1.9447		3.3455	2.1099
Cl3	2.1099	3.3455		4.4034
Cl4	3.3455	2.1099	4.4034

Number	Element	Mulliken
1	S	0.088
2	S	0.088
3	Cl	-0.088
4	Cl	-0.088

All results from a given calculation for ClSSCl (Disulfur dichloride)

using model chemistry: LSDA/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
	0.000	0.000	1.334	1.334
CHELPG
AIM
ESP

	x	y	z
x	6.646	-0.913	0.000
y	-0.913	16.488	0.000
z	0.000	0.000	8.343

<r²>	0.000
(<r²>)^1/2	0.000