data_1007066
_chemical_name_systematic          'Trimanganese(IV) dilithium zinc oxide'
_chemical_formula_structural       'Mn3 Li2 Zn O8'
_chemical_formula_sum              'Li2 Mn3 O8 Zn'
_publ_section_title
;
Etude de deux types d'ordre dans le spinelle Mn~3~ Li~2~ Zn O~8~
;
loop_
_publ_author_name
  'Joubert, J C'
  'Durif, A'
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences
(1884 - 1965)
;
_journal_coden_ASTM                COREAF
_journal_volume                    258
_journal_year                      1964
_journal_page_first                4482
_journal_page_last                 4485
_cell_length_a                     8.193(3)
_cell_length_b                     8.193(3)
_cell_length_c                     8.193(3)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       550.0
_cell_formula_units_Z              4
_symmetry_space_group_name_H-M     'P 43 3 2'
_symmetry_Int_Tables_number        212
_symmetry_cell_setting             cubic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '1/2+x,1/2-y,-z'
  '-x,1/2+y,1/2-z'
  '1/2-x,-y,1/2+z'
  'z,x,y'
  '-z,1/2+x,1/2-y'
  '1/2-z,-x,1/2+y'
  '1/2+z,1/2-x,-y'
  'y,z,x'
  '1/2+y,1/2-z,-x'
  '-y,1/2+z,1/2-x'
  '1/2-y,-z,1/2+x'
  '1/4-x,1/4-z,1/4-y'
  '3/4+x,3/4-z,1/4+y'
  '1/4-y,1/4-x,1/4-z'
  '3/4+y,3/4-x,1/4+z'
  '1/4-z,1/4-y,1/4-x'
  '3/4+z,3/4-y,1/4+x'
  '3/4-x,1/4+z,3/4+y'
  '1/4+x,3/4+z,3/4-y'
  '3/4-y,1/4+x,3/4+z'
  '1/4+y,3/4+x,3/4-z'
  '3/4-z,1/4+y,3/4+x'
  '1/4+z,3/4+y,3/4-x'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Li1+   1.000
  Mn4+   4.000
  Zn2+   2.000
  O2-   -2.000
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
  Li1   Li1+   4 b 0.125 0.125 0.125 1.  0 d
  Mn1   Mn4+  12 d 0.125 0.375 -0.125 1.  0 d
  Zn1   Zn2+   8 c 0. 0. 0. 0.5  0 d
  Li2   Li1+   8 c 0. 0. 0. 0.5  0 d
  O1    O2-   24 e 0.125 0.125 0.375 1.  0 d
  O2    O2-    8 c 0.375 0.375 0.375 1.  0 d