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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/4/34/38/4343868.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_4343868
loop_
_publ_author_name
'Krahl, T.'
'Heidemann, D.'
'Ahrens, M.'
'Scholz, G.'
'Kemnitz, E.'
_publ_section_title
;
 Structure of (N H4)3 Ga F6 investigated by multinuclear magic-angle
 spinning NMR spectroscopy in comparison with Rietveld refinement
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              663
_journal_page_last               670
_journal_volume                  47
_journal_year                    2008
_chemical_formula_sum            'F6 Ga H12 N3'
_chemical_name_systematic        '(N H4)3 Ga F6'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.0449
_cell_length_b                   9.0449
_cell_length_c                   9.0449
_cell_volume                     739.965
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Krahl_INOCAJ_2008_1426.cif
_cod_data_source_block           H12F6Ga1N3
_cod_original_cell_volume        739.9652
_cod_original_formula_sum        'H12 F6 Ga1 N3'
_cod_database_code               4343868
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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
H1 H+1 0.5564 0.5564 0.5564 0.5 0.0
Ga1 Ga+3 0 0 0 1 0.0
N1 N-3 0.5 0.5 0.5 1 0.0
N2 N-3 0.25 0.25 0.25 1 0.0
F1 F-1 0.01606 0.05456 0.20416 0.125 0.0
H2 H+1 0.3064 0.3064 0.3064 1 0.0
