#------------------------------------------------------------------------------
#$Date: 2016-02-14 15:26:36 +0100 (dom 14 de feb de 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/54/2105413.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2105413
loop_
_publ_author_name
'Jeitschko, W.'
_publ_section_title
;
 The crystal structure of Mo Co B and related compounds
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              930
_journal_page_last               934
_journal_paper_doi               10.1107/S0567740868003432
_journal_volume                  24
_journal_year                    1968
_chemical_formula_sum            'B Co Mo'
_chemical_name_systematic        'Mo Co B'
_space_group_IT_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                   5.741
_cell_length_b                   3.232
_cell_length_c                   6.634
_cell_volume                     123.093
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            boron0-1_144.cif
_cod_data_source_block           B1Co1Mo1
_cod_original_cell_volume        123.0933
_cod_original_formula_sum        'B1 Co1 Mo1'
_cod_database_code               2105413
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-y-1/2,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Mo1 Mo 0.0271 0.25 0.1733 1 0.0
B1 B 0.2705 0.25 0.8614 1 0.0
Co1 Co 0.1478 0.25 0.5556 1 0.0
