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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/08/1530861.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_1530861
loop_
_publ_author_name
'Tamada, O.'
'Yamamoto, N.'
'Oka, Y.'
_publ_section_title
;
 Hydrothermal Synthesis and Structure Determination of a New Manganese
 (III) Oxide, Ba Mn2 O3 (O H)2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              401
_journal_page_last               408
_journal_volume                  74
_journal_year                    1988
_chemical_formula_sum            'Ba H2 Mn2 O5'
_chemical_name_systematic        'Ba Mn2 O3 (O H)2'
_space_group_IT_number           38
_symmetry_space_group_name_Hall  'C -2 -2'
_symmetry_space_group_name_H-M   'C m 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   11.585
_cell_length_b                   4.12
_cell_length_c                   4.39
_cell_volume                     209.536
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Tamada_JSSCBI_1988_1621.cif
_cod_data_source_block           H2Ba1Mn2O5
_cod_original_cell_volume        209.5356
_cod_original_sg_symbol_Hall     'A 2 -2 (y,z,x)'
_cod_original_formula_sum        'H2 Ba1 Mn2 O5'
_cod_database_code               1530861
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
x,y,-z
-x,y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
x+1/2,y+1/2,-z
-x+1/2,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
O2 O-2 0.1738 -0.021 0.5 1 0.0
O3 O-2 0.3354 -0.001 0 1 0.0
Mn1 Mn+3 0.33887 -0.008 0.5 1 0.0
Ba1 Ba+2 0 0 0 1 0.0
O1 O-2 0.5 0 0.5 1 0.0
