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#$Date: 2015-10-10 03:30:50 +0200 (Sat, 10 Oct 2015) $
#$Revision: 164264 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/65/1536525.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_1536525
loop_
_publ_author_name
'Khaenko, B.V.'
'Gnitetskii, O.A.'
'Kublii, V.Z.'
_publ_section_title
;
 Structure of ordered carbide beta'-Mo2 C: results of single crystal
 diffraction study.
;
_journal_name_full
;
Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta 
Matematichni Nauki
;
_journal_page_first              78
_journal_page_last               82
_journal_volume                  1991
_journal_year                    1991
_chemical_formula_sum            'C0.96 Mo1.93'
_chemical_name_systematic        'Mo1.93 C0.96'
_space_group_IT_number           29
_symmetry_space_group_name_Hall  'P 2c -2ac'
_symmetry_space_group_name_H-M   'P c a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.022
_cell_length_b                   4.725
_cell_length_c                   5.195
_cell_volume                     147.818
_citation_journal_id_ASTM        DUKABM
_cod_data_source_file            Khaenko_DUKABM_1991_1168.cif
_cod_data_source_block           C0.96Mo1.93
_cod_original_cell_volume        147.8183
_cod_database_code               1536525
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y,z+1/2
x+1/2,-y,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
C1 C 0.1258 0.253 0.3036 0.96 0.0
Mo2 Mo 0.1275 0.5032 0.6642 1 0.0
Mo1 Mo 0.1306 -0.0091 0.0038 0.93 0.0
