#------------------------------------------------------------------------------
#$Date: 2017-10-06 19:24:22 +0300 (Fri, 06 Oct 2017) $
#$Revision: 201816 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/52/9015219.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_9015219
loop_
_publ_author_name
'Bjorling, C. O.'
'Westgren, A.'
_publ_section_title
;
 Minerals of the Varustrask Pegmatite. IX. X-ray studies of triphylite,
 varulite and their oxidation products
;
_journal_name_full
'Geologiska Foreningens i Stockholm Forhandlingar'
_journal_page_first              67
_journal_page_last               72
_journal_paper_doi               10.1080/11035893809443985
_journal_volume                  60
_journal_year                    1938
_chemical_compound_source        'Varustrask pegmatite, Sweden'
_chemical_formula_sum            'Fe O4 P'
_chemical_name_mineral           Heterosite
_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                   4.760
_cell_length_b                   9.680
_cell_length_c                   5.819
_cell_volume                     268.121
_database_code_amcsd             0018613
_exptl_crystal_density_diffrn    3.736
_cod_original_formula_sum        'Fe P O4'
_cod_database_code               9015219
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
Fe -0.02800 0.27800 0.25000
P 0.41700 0.09700 0.25000
O1 -0.25000 0.05600 0.25000
O2 0.25000 0.44400 0.25000
O3 0.19400 0.16700 0.02800
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0018613
