#------------------------------------------------------------------------------
#$Date: 2012-02-28 14:14:52 +0200 (Tue, 28 Feb 2012) $
#$Revision: 35911 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/00/84/1008461.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_1008461
_chemical_name_systematic          'Pentarubidium triphosphidogermanate'
_chemical_formula_structural       'Rb5 Ge P3'
_chemical_formula_sum              'Ge P3 Rb5'
_publ_section_title
;
Crystal structure of pentarubidium triphosphidogermanate
;
loop_
_publ_author_name
  'Eisenmann, B'
  'Klein, J'
  'Somer, M'
_journal_name_full
;
Zeitschrift fuer Kristallographie (149,1979-)
;
_journal_coden_ASTM                ZEKRDZ
_journal_volume                    197
_journal_year                      1991
_journal_page_first                263
_journal_page_last                 264
_cell_length_a                     13.966(4)
_cell_length_b                     5.582(2)
_cell_length_c                     15.256(4)
_cell_angle_alpha                  90.(0)
_cell_angle_beta                   90.(0)
_cell_angle_gamma                  90.(0)
_cell_volume                       1189.3
_cell_formula_units_Z              4
_symmetry_space_group_name_H-M     'P n m a'
_symmetry_Int_Tables_number        62
_symmetry_cell_setting             orthorhombic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '1/2+x,1/2-y,1/2-z'
  '-x,1/2+y,-z'
  '1/2-x,-y,1/2+z'
  '-x,-y,-z'
  '1/2-x,1/2+y,1/2+z'
  'x,1/2-y,z'
  '1/2+x,y,1/2-z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Rb1+   1.000
  Ge4+   4.000
  P3-   -3.000
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
  Rb1   Rb1+   4 c 0.56528(20) 0.25 0.44511(20) 1.  0 d
  Rb2   Rb1+   4 c 0.61524(20) 0.25 0.68291(20) 1.  0 d
  Rb3   Rb1+   4 c 0.85459(20) 0.25 0.54612(20) 1.  0 d
  Rb4   Rb1+   4 c 0.27831(20) 0.25 0.2138(2) 1.  0 d
  Rb5   Rb1+   4 c 0.05121(20) 0.25 0.34989(20) 1.  0 d
  Ge1   Ge4+   4 c 0.26209(20) 0.25 0.57328(10) 1.  0 d
  P1    P3-    4 c 0.10345(40) 0.25 0.59495(40) 1.  0 d
  P2    P3-    4 c 0.31405(50) 0.25 0.43337(40) 1.  0 d
  P3    P3-    4 c 0.36685(40) 0.25 0.68798(40) 1.  0 d
_refine_ls_R_factor_all            0.059
_cod_database_code 1008461