#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/60/9016059.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_9016059
loop_
_publ_author_name
'Goldsztaub, M.'
_publ_section_title
;
 Etude de quelques derives de l'oxyde ferrique (Fe O . O H, Fe O2 Na, Fe
 O Cl) determination de leurs structures.
;
_journal_name_full
'Bulletin de la Societe Francaise de Mineralogie'
_journal_page_first              6
_journal_page_last               76
_journal_volume                  58
_journal_year                    1935
_chemical_formula_sum            'Fe O2'
_chemical_name_mineral           Goethite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.64
_cell_length_b                   10.
_cell_length_c                   3.03
_cell_formula_units_Z            4
_cell_volume                     140.592
_database_code_amcsd             0017983
_exptl_crystal_density_diffrn    4.150
_cod_duplicate_entry             1011087
_cod_original_formula_sum        'O2 Fe'
_cod_database_code               9016059
loop_
_space_group_symop_operation_xyz
x,y,z
x,y,1/2-z
-x,-y,1/2+z
1/2+x,1/2-y,1/2+z
1/2-x,1/2+y,1/2-z
1/2-x,1/2+y,z
1/2+x,1/2-y,-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
O1 0.25000 0.29170 0.25000
O2 0.75000 0.45830 0.25000
Fe1 0.53000 0.65000 0.25000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0017983
