#------------------------------------------------------------------------------
#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/1008999.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_1008999
_chemical_name_systematic          'Cobat boride (3/1)'
_chemical_formula_structural       'Co3 B'
_chemical_formula_sum              'B Co3'
_publ_section_title
;
Sur le borures de nickel, de cobalt et de fer isomorphes de la cementite
;
loop_
_publ_author_name
  'Fruchart, R'
  'Michel, A'
_journal_name_full
;
Bulletin de la Societe Chimique de France (Vol=Year)
;
_journal_coden_ASTM                BSCFAS
_journal_volume                    1959
_journal_year                      1959
_journal_page_first                422
_journal_page_last                 423
_cell_length_a                     5.221(1)
_cell_length_b                     6.631(1)
_cell_length_c                     4.408(1)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       152.6
_cell_formula_units_Z              4
_symmetry_space_group_name_H-M     'P n m a'
_symmetry_Int_Tables_number        62
_symmetry_cell_setting             orthorhombic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '1/2+x,1/2-y,1/2-z'
  '-x,1/2+y,-z'
  '1/2-x,-y,1/2+z'
  '-x,-y,-z'
  '1/2-x,1/2+y,1/2+z'
  'x,1/2-y,z'
  '1/2+x,y,1/2-z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Co0    0.000
  B0     0.000
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
  Co1   Co0    8 d 0.186 0.063 0.328 1.  0 d
  Co2   Co0    4 c 0.036 0.25 0.852 1.  0 d
  B1    B0     4 c 0.89 0.25 0.45 1.  0 d