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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/04/1530478.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_1530478
loop_
_publ_author_name
'Natarajan-Iyer, M.'
'Brown, I.D.'
'Howard-Lock, H.E.'
_publ_section_title
;
 The crystal structure of Rb Cd Cl3 and the polarized Raman spectra of Rb
 Cd X3 (X = Cl, Br)
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              1192
_journal_page_last               1195
_journal_volume                  56
_journal_year                    1978
_chemical_formula_sum            'Cd Cl3 Rb'
_chemical_name_systematic        'Rb Cd Cl3'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.949
_cell_length_b                   4.026
_cell_length_c                   14.93
_cell_volume                     537.908
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Natarajan-Iyer_CJCHAG_1978_234.cif
_cod_data_source_block           Cd1Cl3Rb1
_cod_original_cell_volume        537.9081
_cod_original_formula_sum        'Cd1 Cl3 Rb1'
_cod_database_code               1530478
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
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
Cl1 Cl-1 0.284 0.25 0.2067 1 0.0
Cd1 Cd+2 0.16674 0.25 0.05571 1 0.0
Cl2 Cl-1 0.171 0.25 0.4951 1 0.0
Cl3 Cl-1 0.0256 0.25 0.9005 1 0.0
Rb1 Rb+1 0.42731 0.25 0.82536 1 0.0
