#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/96/1529692.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_1529692
loop_
_publ_author_name
'Bronger, W.'
'Mueller, P.'
_publ_section_title
;
 Low-spin-Anordnungen in Tetraederstrukturen von Eisensulfiden:
 Untersuchungen zum System Cs Ga1-x Fex S2
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              253
_journal_page_last               262
_journal_volume                  70
_journal_year                    1980
_chemical_formula_sum            'Cs Ga S2'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 113
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.428
_cell_length_b                   12.217
_cell_length_c                   5.905
_cell_volume                     493.267
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Bronger_JCOMAH_1980_752.cif
_cod_data_source_block           Cs1Ga1S2
_cod_original_cell_volume        493.2675
_cod_original_formula_sum        'Cs1 Ga1 S2'
_cod_database_code               1529692
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-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
Ga1 Ga+3 0 -0.0033 0.25 1 0.0
Cs1 Cs+1 0 0.3547 0.25 1 0.0
S1 S-2 0.18 0.1 0.092 1 0.0
