#------------------------------------------------------------------------------
#$Date: 2015-01-27 20:58:39 +0100 (Tue 27 de Jan de 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/1/00/89/1008999.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
loop_
_publ_author_name
'Fruchart, R'
'Michel, A'
_publ_section_title
;
Sur le borures de nickel, de cobalt et de fer isomorphes de la cementite
;
_journal_coden_ASTM              BSCFAS
_journal_name_full
;
Bulletin de la Societe Chimique de France (Vol=Year)
;
_journal_page_first              422
_journal_page_last               423
_journal_volume                  1959
_journal_year                    1959
_chemical_formula_structural     'Co3 B'
_chemical_formula_sum            'B Co3'
_chemical_name_systematic        'Cobat boride (3/1)'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.221(1)
_cell_length_b                   6.631(1)
_cell_length_c                   4.408(1)
_cell_volume                     152.6
_cod_database_code               1008999
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_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
loop_
_atom_type_symbol
_atom_type_oxidation_number
Co0 0.000
B0 0.000
