data_1527655
_publ_section_title
;
 About the crystal structure of cesium cadmium tribromide and some
 observations on crystals of cesium cadmium trichloride
;
_journal_name_full
'Acta Chemica Scandinavica, Series A: (28,1974-)'
_journal_page_first              669
_journal_page_last               672
_journal_volume                  31
_journal_year                    1977
_chemical_formula_sum            'Br3 Cd Cs'
_chemical_name_systematic        'Cd Cs Br3'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.861
_cell_length_b                   7.861
_cell_length_c                   6.726
_cell_volume                     359.951
_citation_journal_id_ASTM        ACAPCT
_cod_data_source_file            KnakkergaardMoeller_ACAPCT_1977_789.cif
_cod_data_source_block           Br3Cd1Cs1
_cod_original_cell_volume        359.9507
_cod_chemical_formula_sum_orig   'Br3 Cd1 Cs1'
_cod_database_code               1527655
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
-y,-x,-z+1/2
x-y,-y,-z
x,x-y,-z+1/2
y,x,-z
-x+y,y,-z+1/2
-x,-x+y,-z
-x,-y,-z
-x+y,-x,-z-1/2
y,-x+y,-z
x,y,-z-1/2
x-y,x,-z
-y,x-y,-z-1/2
y,x,z-1/2
-x+y,y,z
-x,-x+y,z-1/2
-y,-x,z
x-y,-y,z-1/2
x,x-y,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
Cs1 Cs+1 0.6667 0.3333 0.25 1 0.0
Br1 Br-1 0.1667 -0.1667 0.25 1 0.0
Cd1 Cd+2 0 0 0 1 0.0
