#------------------------------------------------------------------------------
#$Date: 2015-09-17 22:03:06 +0200 (jue 17 de sep de 2015) $
#$Revision: 156828 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/13/1531375.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_1531375
loop_
_publ_author_name
'Esmaeilzadeh, S.'
'Grins, J.'
_publ_section_title
;
 Meta-stable phases in the Mn - Ta - O system
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              117
_journal_page_last               123
_journal_volume                  4
_journal_year                    2002
_chemical_formula_sum            'Mn0.666 O4 Ta1.334'
_chemical_name_systematic        '(Mn0.333 Ta0.667)2 O4'
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.355
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.7565
_cell_length_b                   5.7281
_cell_length_c                   5.1358
_cell_volume                     139.926
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Esmaeilzadeh_SSSCFJ_2002_895.cif
_cod_data_source_block           Mn0.666O4Ta1.334
_cod_original_cell_volume        139.9258
_cod_database_code               1531375
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
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
Ta2 Ta+5 0 0.168 0.25 0.667 0.0
Ta1 Ta+5 0.5 0.669 0.25 0.667 0.0
Mn1 Mn+2 0.5 0.669 0.25 0.333 0.0
Mn2 Mn+2 0 0.168 0.25 0.333 0.0
O2 O-2 0.281 0.405 0.438 1 0.0
O1 O-2 0.205 0.135 0.906 1 0.0
