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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/1/52/56/1525628.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_1525628
loop_
_publ_author_name
'Beitone, L.'
'Marrot, J.'
'Ferey, G.'
'Lorentz, C.'
'Loiseau, T.'
'Taulelle, F.'
_publ_section_title
;
 Hydrothermal synthesis and structure determination of the first
 three-dimensional oxyfluorinated gallium phosphate incorporating lithium
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              641
_journal_page_last               647
_journal_volume                  3
_journal_year                    2001
_chemical_formula_sum            'F3 Ga3 H5 Li O11 P2'
_chemical_name_systematic        'Li Ga3 F3 (O H) (P O4)2 (H2 O)2'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.351
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.6885
_cell_length_b                   8.2442
_cell_length_c                   7.1303
_cell_volume                     494.804
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Beitone_SSSCFJ_2001_1963.cif
_cod_data_source_block           H5F3Ga3Li1O11P2
_cod_original_formula_sum        'H5 F3 Ga3 Li1 O11 P2'
_cod_database_code               1525628
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-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
F2 F-1 0.1258 0.1937 0.0352 1 0.0
F1 F-1 0.3422 0.1589 0.821 0.5 0.0
O3 O-2 0.5813 0.2872 0.1205 1 0.0
P1 P+5 0.6815 0.4369 0.1962 1 0.0
O6 O-2 0.1571 0.8761 0.1794 1 0.0
O4 O-2 0.404 0.0394 0.1809 1 0.0
O1 O-2 0.3422 0.1589 0.821 0.5 0.0
O5 O-2 0.2887 0.4627 -0.0272 1 0.0
O2 O-2 -0.0918 0.0678 0.2236 1 0.0
Ga1 Ga+3 0 0 0 1 0.0
Li1 Li+1 0.3516 -0.0573 0.781 0.5 0.0
Ga2 Ga+3 0.3538 0.2519 0.0723 1 0.0
