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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/1/53/00/1530097.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_1530097
loop_
_publ_author_name
'Hoenle, W.'
'Simon, A.'
'Miller, G.'
_publ_section_title
;
 Preparation, Crystal Structures, and Electronic Properties of Li Ga Cl3
 and Li Ga I3
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              147
_journal_page_last               155
_journal_volume                  75
_journal_year                    1988
_chemical_formula_sum            'Ga I3 Li'
_chemical_name_systematic        'Li Ga I3'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.77
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.467
_cell_length_b                   11.372
_cell_length_c                   7.132
_cell_volume                     686.389
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Hoenle_JSSCBI_1988_1642.cif
_cod_data_source_block           Ga1I3Li1
_cod_original_cell_volume        686.3892
_cod_original_formula_sum        'Ga1 I3 Li1'
_cod_database_code               1530097
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
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
Ga1 Ga+2 0.2434 0.25 0.8674 1 0.0
I1 I-1 0.4521 0.25 0.142 1 0.0
I3 I-1 0.32075 0.0709 0.6609 1 0.0
I2 I-1 0.9337 0.25 0.3264 1 0.0
Li2 Li+1 0.5 0 0 1 0.0
Li1 Li+1 0 0 0.5 1 0.0
I4 I-1 0.81678 0.06975 0.8251 1 0.0
Ga2 Ga+2 0.9716 0.25 0.9664 1 0.0
