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#$Date: 2015-09-05 14:35:51 +0300 (Sat, 05 Sep 2015) $
#$Revision: 154447 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/98/1529811.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_1529811
loop_
_publ_author_name
'Doenni, A.'
'Furrer, A.'
'Guedel, H.U.'
_publ_section_title
;
 Structure of the Dimer Compounds Cs3 R2 Br9 (R= Tb, Dy, Ho, Er, Yb) at 8
 and 295 K Studied by Neutron Diffraction
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              278
_journal_page_last               284
_journal_volume                  81
_journal_year                    1989
_chemical_formula_sum            'Br9 Cs3 Ho2'
_chemical_name_systematic        'Cs3 Ho2 Br9'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   13.467
_cell_length_b                   13.467
_cell_length_c                   19.09
_cell_volume                     2998.322
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Doenni_JSSCBI_1989_1886.cif
_cod_data_source_block           Br9Cs3Ho2
_cod_database_code               1529811
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z+1/2
-x,-x+y,-z+1/2
x-y,-y,-z+1/2
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z-1/2
x,x-y,z-1/2
-x+y,y,z-1/2
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+5/6
-x+2/3,-x+y+1/3,-z+5/6
x-y+2/3,-y+1/3,-z+5/6
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z-1/6
x+2/3,x-y+1/3,z-1/6
-x+y+2/3,y+1/3,z-1/6
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+7/6
-x+1/3,-x+y+2/3,-z+7/6
x-y+1/3,-y+2/3,-z+7/6
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+1/6
x+1/3,x-y+2/3,z+1/6
-x+y+1/3,y+2/3,z+1/6
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
Br2 Br-1 0.1809 0.1742 0.0849 1 0.0
Br1 Br-1 0.1578 0 0.25 1 0.0
Cs1 Cs+1 0.6618 0 0.25 1 0.0
Ho1 Ho+3 0 0 0.649 1 0.0
