#------------------------------------------------------------------------------
#$Date: 2012-02-28 12:14:52 +0000 (Tue, 28 Feb 2012) $
#$Revision: 35911 $
#$URL: svn://www.crystallography.net/cod/cif/1/01/08/1010891.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1010891
_chemical_name_systematic          'Manganese silicide (5/3)'
_chemical_formula_structural       'Mn5 Si3'
_chemical_formula_sum              'Mn5 Si3'
_publ_section_title                'On the crystal structure of $= Mn5Si3'
loop_
_publ_author_name
  'Amark, K'
  'Boren, B'
  'Westgren, A'
_journal_name_full                 'Svensk Kemisk Tidskrift'
_journal_coden_ASTM                SKTIAF
_journal_volume                    48
_journal_year                      1936
_journal_page_first                273
_journal_page_last                 276
_cell_length_a                     6.898(5)
_cell_length_b                     6.898(5)
_cell_length_c                     4.802(5)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  120
_cell_volume                       197.9
_cell_formula_units_Z              2
_symmetry_space_group_name_H-M     'P 63/m c m'
_symmetry_Int_Tables_number        193
_symmetry_cell_setting             hexagonal
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '-y,x-y,z'
  'y-x,-x,z'
  'y,x,z'
  'x-y,-y,z'
  '-x,y-x,z'
  '-x,-y,-z'
  'y,y-x,-z'
  'x-y,x,-z'
  '-y,-x,-z'
  'y-x,y,-z'
  'x,x-y,-z'
  '-x,-y,1/2+z'
  'y,y-x,1/2+z'
  'x-y,x,1/2+z'
  '-y,-x,1/2+z'
  'y-x,y,1/2+z'
  'x,x-y,1/2+z'
  'x,y,1/2-z'
  '-y,x-y,1/2-z'
  'y-x,-x,1/2-z'
  'y,x,1/2-z'
  'x-y,-y,1/2-z'
  '-x,y-x,1/2-z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Mn2+   2.400
  Si4-  -4.000
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
  Mn1   Mn2+   4 d 0.3333 0.6667 0. 1.  0 d
  Mn2   Mn2+   6 g 0.23 0.23 0.75 1.  0 d
  Si1   Si4-   6 g 0.6 0.6 0.75 1.  0 d
_cod_database_code 1010891