#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/24/1532421.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_1532421
loop_
_publ_author_name
'Yu, Ranbo'
'Wang, Dan'
'Takei, Takahiro'
'Koizumi, Hitoshi'
'Kumada, Nobuhiro'
'Kinomura, Nobukazu'
_publ_section_title
;
 Crystal Structure of a Novel Iron-Cobalt Phosphate Fluoride
;
_journal_coden_ASTM              JSIJFR
_journal_issue                   297
_journal_name_full
;
 Journal of the Society of Inorganic Materials, Japan
;
_journal_page_first              99
_journal_page_last               104
_journal_paper_doi               10.11451/mukimate2000.9.99
_journal_volume                  9
_journal_year                    2002
_chemical_formula_sum            'Co F Fe O4 P'
_chemical_name_systematic        'Fe Co (P O4) F'
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 118.27
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.968
_cell_length_b                   6.444
_cell_length_c                   9.818
_cell_volume                     722.590
_citation_journal_id_ASTM        JSIJFR
_cod_data_source_file            Yu_JSIJFR_2002_1183.cif
_cod_data_source_block           Co1F1Fe1O4P1
_cod_original_cell_volume        722.5903
_cod_original_formula_sum        'Co1 F1 Fe1 O4 P1'
_cod_database_code               1532421
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x,-y,z+1/2
x+1/2,y+1/2,z
x+1/2,-y+1/2,z+1/2
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
O7 O-2 0.1402 0.35 0.6657 1 0.0
F2 F-1 0.3761 0.4193 0.7937 1 0.0
O4 O-2 0.2761 -0.038 0.7205 1 0.0
P2 P+5 0.5245 -0.0954 0.6682 1 0.0
O3 O-2 0.4348 0.039 0.0046 1 0.0
O2 O-2 0.4825 0.715 0.724 1 0.0
Fe1 Fe+2 0.1909 0.3973 0.5019 1 0.0
O6 O-2 0.0459 0.417 0.2817 1 0.0
Co2 Co+2 0.4079 0.7736 0.8678 1 0.0
Co1 Co+2 0.5069 0.3964 0.7228 1 0.0
P1 P+5 0.1766 -0.0951 0.5563 1 0.0
O8 O-2 0.2193 0.283 0.9996 1 0.0
F1 F-1 0.3407 0.3642 0.5024 1 0.0
O5 O-2 0.1599 0.082 0.4436 1 0.0
Fe2 Fe+2 0.2895 0.2243 0.8564 1 0.0
O1 O-2 0.5632 0.355 0.5575 1 0.0
