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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/1/53/46/1534667.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_1534667
loop_
_publ_author_name
'Assoud, A.'
'Meyer, G.'
_publ_section_title
;
 Ein neues Chloropalladat(II): Ba Pd Cl4
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1246
_journal_page_last               1247
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'Ba Cl4 Pd'
_chemical_name_systematic        'Ba (Pd Cl4)'
_space_group_IT_number           60
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.867
_cell_length_b                   12.588
_cell_length_c                   7.5015
_cell_volume                     648.443
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Assoud_ZAACAB_2002_197.cif
_cod_data_source_block           Ba1Cl4Pd1
_cod_original_cell_volume        648.4432
_cod_original_formula_sum        'Ba1 Cl4 Pd1'
_cod_database_code               1534667
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x,y,-z+1/2
-x,-y,-z
x-1/2,y-1/2,-z-1/2
-x-1/2,y-1/2,z
x,-y,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
Cl1 Cl-1 0.2064 0.43682 0.1055 1 0.0
Pd1 Pd+2 0 0 0 1 0.0
Ba1 Ba+2 0 0.65004 0.25 1 0.0
Cl2 Cl-1 0.1086 0.17253 0.0317 1 0.0
