#------------------------------------------------------------------------------
#$Date: 2010-01-30 13:59:17 +0000 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: svn://www.crystallography.net/cod/cif/1/1005044.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_1005044
_chemical_name_systematic          'Dicerium nonapalladium triantimonide'
_chemical_formula_structural       'Ce2 Pd9 Sb3'
_chemical_formula_sum              'Ce2 Pd9 Sb3'
_publ_section_title
;
Crystal structure, electric and magnetic behaviour of Ce2 Pd9 Sb3
;
loop_
_publ_author_name
  'Gordon, R A'
  'DiSalvo, F J'
  'Poettgen, R'
  'Brese, N E'
_journal_name_full
;
Journal of the Chemical Society. Faraday Transactions
;
_journal_coden_ASTM                JCFTEV
_journal_volume                    92
_journal_year                      1996
_journal_page_first                2167
_journal_page_last                 2171
_journal_issue                     12
_cell_length_a                     13.769(2)
_cell_length_b                     8.0412(8)
_cell_length_c                     9.3482(10)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       1035.0
_cell_formula_units_Z              4
_symmetry_space_group_name_H-M     'C m c m'
_symmetry_Int_Tables_number        63
_symmetry_cell_setting             orthorhombic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'x,-y,-z'
  'x,y,1/2-z'
  'x,-y,1/2+z'
  '-x,-y,-z'
  '-x,y,z'
  '-x,-y,1/2+z'
  '-x,y,1/2-z'
  '1/2+x,1/2+y,z'
  '1/2+x,1/2-y,-z'
  '1/2+x,1/2+y,1/2-z'
  '1/2+x,1/2-y,1/2+z'
  '1/2-x,1/2-y,-z'
  '1/2-x,1/2+y,z'
  '1/2-x,1/2-y,1/2+z'
  '1/2-x,1/2+y,1/2-z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Ce0    0.000
  Pd0    0.000
  Sb0    0.000
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
  Ce1   Ce0    8 g 0.34547(6) 0.32828(8) 0.25 1.  0 d
  Pd1   Pd0   16 h 0.17109(5) 0.17061(8) 0.08478(8) 1.  0 d
  Pd2   Pd0    8 f 0. 0.3323(1) 0.5268(1) 1.  0 d
  Pd3   Pd0    4 c 0. 0.1457(2) 0.25 1.  0 d
  Pd4   Pd0    8 g 0.09840(8) 0.4582(1) 0.25 1.  0 d
  Sb1   Sb0    4 a 0. 0. 0. 1.  0 d
  Sb2   Sb0    8 e 0.32369(6) 0. 0. 1.  0 d
_refine_ls_R_factor_all            0.03
_cod_database_code 1005044