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#$Date: 2015-10-10 06:19:44 +0300 (Sat, 10 Oct 2015) $
#$Revision: 164657 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/67/1536790.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_1536790
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            'Mn1.333 O8 Ta2.667'
_chemical_name_systematic        'Mn1.333 Ta2.667 O8'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.16
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.562
_cell_length_b                   11.509
_cell_length_c                   5.138
_cell_volume                     565.316
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Esmaeilzadeh_SSSCFJ_2002_268.cif
_cod_data_source_block           Mn1.333O8Ta2.667
_cod_original_cell_volume        565.3162
_cod_database_code               1536790
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,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
O1 O-2 0.1336 0.0599 0.079 1 0.0
O3 O-2 0.1209 0.3049 0.106 1 0.0
O4 O-2 0.3841 0.3137 0.416 1 0.0
Mn1 Mn+2 0 0.6586 0.25 1 0.0
O2 O-2 0.1466 0.4509 0.561 1 0.0
Mn2 Mn+2 0 0.16908 0.25 0.333 0.0
Ta1 Ta+5 0.24903 0.41389 0.24733 1 0.0
Ta2 Ta+5 0 0.16908 0.25 0.667 0.0
