C10H5F5Fe-1

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1,2,3,4,5-Pentafluoroferrocene

Experimental (GED) re structure <bib id="SuenkelJACS2015" />:

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  21
  GEDRe

Fe 0.536298410683 0.000000000000 -0.000000000000 C -1.069227446742 -1.167631560225 -0.306075650097 C -1.069227446742 -0.651913236782 1.015901026540 C -1.069227446742 0.764727022178 0.933937013704 C -1.069227446742 1.124540528604 -0.438696208719 C -1.069227446742 -0.069722753774 -1.205066181428 C 2.215463044824 -1.172765586733 -0.307421451765 C 2.215463044824 -0.070029321769 -1.210364806380 C 2.215463044824 1.129485085671 -0.440625137365 C 2.215463044824 0.768089494500 0.938043495191 C 2.215463044824 -0.654779671668 1.020367900319 F -1.155712078416 -2.454479424446 -0.643401918103 F -1.155712078416 -1.370387441307 2.135526523825 F -1.155712078416 1.607533407963 1.963229893704 F -1.155712078416 2.363897725479 -0.922183721786 F -1.155712078416 -0.146564267689 -2.533170777639 H 2.185193552209 -2.222494532069 -0.582590846216 H 2.185193552209 -0.132711759687 -2.293748379403 H 2.185193552209 2.140474153876 -0.835023613895 H 2.185193552209 1.455597538823 1.777675404607 H 2.185193552209 -1.240865400942 1.933687434907

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