#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/1/01/05/1010567.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_1010567
loop_
_publ_author_name
'MacGillavry, C H'
'Nijveld, H'
'Dierdorp, S'
'Karsten, J'
_publ_section_title
;
Die Krystallstruktur von NH₄CdCl₃ und RbCdCl₃
;
_journal_coden_ASTM              RTCPA3
_journal_name_full
;
Recueil des Travaux Chimiques des Pays-Bas et de la Belgique
;
_journal_page_first              193
_journal_page_last               200
_journal_volume                  58
_journal_year                    1939
_chemical_formula_structural     'Rb Cd Cl3'
_chemical_formula_sum            'Cd Cl3 Rb'
_chemical_name_systematic        'Rubidium trichlorocadmate'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.01
_cell_length_b                   14.93
_cell_length_c                   4.01
_cell_volume                     539.4
_cod_database_code               1010567
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2+x,1/2-y,1/2-z
-x,-y,1/2+z
1/2-x,1/2+y,-z
-x,-y,-z
1/2-x,1/2+y,1/2+z
x,y,1/2-z
1/2+x,1/2-y,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
Cd1 Cd2+ 4 c 0.1639 0.0569 0.75 1. 0 d
Cl1 Cl1- 4 c 0.2861 0.2153 0.75 1. 0 d
Cl2 Cl1- 4 c -0.0208 0.1014 0.25 1. 0 d
Cl3 Cl1- 4 c 0.3278 -0.0056 0.25 1. 0 d
Rb1 Rb1+ 4 c 0.075 0.3278 0.25 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Cd2+ 2.000
Cl1- -1.000
Rb1+ 1.000
