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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/1/52/61/1526124.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_1526124
loop_
_publ_author_name
'Goni, A.'
'Rojo, T.'
'Lezama, L.'
'Pujana, A.'
'Arriortua, M.I.'
_publ_section_title
;
 Clustering of Fe(3+) in the Li1-3x Fex Mg P O4 (0< x <0.1) solid solution
;
_journal_name_full
'International Journal of Inorganic Materials'
_journal_page_first              937
_journal_page_last               942
_journal_volume                  3
_journal_year                    2001
_chemical_formula_sum            'Fe0.081 Li0.758 Mg O4 P'
_chemical_name_systematic        '(Li0.758 Fe0.081) Mg (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                   10.1171
_cell_length_b                   5.8803
_cell_length_c                   4.7012
_cell_volume                     279.682
_citation_journal_id_ASTM        IJIMCR
_cod_data_source_file            Goni_IJIMCR_2001_1068.cif
_cod_data_source_block           Fe0.081Li0.758Mg1O4P1
_cod_original_cell_volume        279.6818
_cod_original_formula_sum        'Fe0.081 Li0.758 Mg1 O4 P1'
_cod_database_code               1526124
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
Mg1 Mg+2 0.279 0.25 0.987 1 0.0
O2 O-2 0.45 0.25 0.195 1 0.0
P1 P+5 0.093 0.25 0.414 1 0.0
Fe1 Fe+3 0 0 0 0.081 0.0
O3 O-2 0.172 0.039 0.282 1 0.0
Li1 Li+1 0 0 0 0.758 0.0
O1 O-2 0.108 0.25 0.744 1 0.0
