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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/55/1525576.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_1525576
loop_
_publ_author_name
'Andersson, A.S.'
'Kalska, B.'
'Haeggstroem, L.'
'Thomas, J.O.'
_publ_section_title
;
 Lithium extraction/insertion in Li Fe P O4: an X-ray diffraction and
 Mossbauer spectroscopy study
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              41
_journal_page_last               52
_journal_volume                  130
_journal_year                    2000
_chemical_formula_sum            'Fe O4 P'
_chemical_name_systematic        'Fe (P O4)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.8142
_cell_length_b                   5.7893
_cell_length_c                   4.782
_cell_volume                     271.701
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Andersson_SSIOD3_2000_564.cif
_cod_data_source_block           Fe1O4P1
_cod_original_cell_volume        271.7006
_cod_original_formula_sum        'Fe1 O4 P1'
_cod_database_code               1525576
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-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
P1 P+5 0.093 0.25 0.3989 1 0.0
O1 O-2 0.1153 0.25 0.7107 1 0.0
O2 O-2 0.445 0.25 0.1511 1 0.0
O3 O-2 0.1649 0.0465 0.252 1 0.0
Fe1 Fe+3 0.2753 0.25 0.9504 1 0.0
