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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/2/10/63/2106387.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106387
loop_
_publ_author_name
'Mascherpa-Corral, D.'
'Vitse, P.'
'Potier, A.'
'Darriet, J.'
_publ_section_title
;
 Structure cristalline d un chlorocomplexe de gallium: K Ga2 Cl7
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              247
_journal_page_last               250
_journal_volume                  32
_journal_year                    1976
_chemical_formula_sum            'Cl7 Ga2 K'
_chemical_name_systematic        'K (Ga2 Cl7)'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.8216
_cell_length_b                   8.944
_cell_length_c                   10.708
_cell_volume                     1132.182
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Mascherpa-Corral_ACBCAR_1976_642.cif
_cod_data_source_block           Cl7Ga2K1
_cod_original_formula_sum        'Cl7 Ga2 K1'
_cod_database_code               2106387
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y+1/2,z+1/2
x+1/2,-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
Cl2 Cl-1 0.2861 0.4511 0.6585 1 0.0
Cl7 Cl-1 0.4917 0.1971 0.1908 1 0.0
K1 K+1 0.1168 0.3701 0.8878 1 0.0
Ga2 Ga+3 0.175 0.4317 0.5 1 0.0
Ga1 Ga+3 0.3874 0.3814 0.2443 1 0.0
Cl1 Cl-1 0.2561 0.26 0.3706 1 0.0
Cl4 Cl-1 0.0144 0.3379 0.5524 1 0.0
Cl5 Cl-1 0.4708 0.5363 0.6372 1 0.0
Cl3 Cl-1 0.2929 0.4842 0.0997 1 0.0
Cl6 Cl-1 0.1582 0.6298 0.3906 1 0.0
