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	hartrees
Energy at 0K	-996.155029
Energy at 298.15K
HF Energy	-996.155029
Nuclear repulsion energy	229.928604

Atom	x (Å)	y (Å)	z (Å)
S1	-0.383	0.863	-0.402
S2	0.383	-0.863	-0.402
F3	0.383	1.778	0.714
F4	-0.383	-1.778	0.714

	S1	S2	F3	F4
S1		1.8888	1.6340	2.8672
S2	1.8888		2.8672	1.6340
F3	1.6340	2.8672		3.6383
F4	2.8672	1.6340	3.6383

Number	Element	Mulliken
1	S	0.437
2	S	0.437
3	F	-0.437
4	F	-0.437

	x	y	z	Total
	0.000	0.000	-1.381	1.381
CHELPG
AIM
ESP

All results from a given calculation for FSSF (Difluorodisulfane)

using model chemistry: mPW1PW91/aug-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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	x	y	z
x	5.364	-0.546	0.000
y	-0.546	8.801	0.000
z	0.000	0.000	5.484

<r²>	124.659
(<r²>)^1/2	11.165