#------------------------------------------------------------------------------
#$Date: 2024-05-09 11:47:05 +0300 (Thu, 09 May 2024) $
#$Revision: 291792 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/14/9011409.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9011409
loop_
_publ_author_name
'Buerger, M. J.'
_publ_section_title
;
 The symmetry and crystal structure of manganite, Mn(OH)O
 Locality: Ilfeld, Germany
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              163
_journal_page_last               174
_journal_volume                  95
_journal_year                    1936
_chemical_formula_sum            'Mn O2'
_chemical_name_mineral           Manganite
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc (x+1/2*z,y,1/2*z)'
_space_group_name_H-M_alt        'B 1 21/d 1'
_symmetry_space_group_name_H-M   'B 1 21/d 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.86
_cell_length_b                   5.24
_cell_length_c                   5.7
_cell_formula_units_Z            8
_cell_volume                     264.630
_exptl_crystal_density_diffrn    4.364
_cod_original_sg_symbol_H-M      'B 21/d'
_cod_database_code               9011409
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2+x,y,1/2+z
3/4-x,1/2+y,3/4-z
1/4-x,1/2+y,1/4-z
3/4+x,1/2-y,3/4+z
1/4+x,1/2-y,1/4+z
1/2-x,-y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Mn 0.00000 0.00000 0.25800
O1 0.11900 0.12200 0.00000
O2 0.11900 0.12200 0.50000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 ChemSpider 10609227
_database_code_amcsd 0010565