#------------------------------------------------------------------------------
#$Date: 2012-02-28 14:14:52 +0200 (Tue, 28 Feb 2012) $
#$Revision: 35911 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/00/15/1001571.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_1001571
_chemical_name_systematic
;
Dibismuth pentastrontium tricopper bis(carbonate) decaoxide
;
_chemical_formula_structural       'Bi2 Sr5 Cu3 (C O3)2 O10'
_chemical_formula_sum              'Bi2 Cu3 O16 Sr5'
_publ_section_title
;
The bismuth oxycarbonate Bi~2~Sr~6-x~Cu~3~O~10~(CO~3~)~2~. A new 40K
superconductor, second member of the series
(Bi~2~Sr~2~CuO~6~)~n~(Sr~2~CuO~2~CO~3~)~n~'
;
loop_
_publ_author_name
  'Pelloquin, D'
  'Maignan, A'
  'Caldes, M'
  'Hervieu, M'
  'Michel, C'
  'Raveau, B'
_journal_name_full                 'Physica C (Amsterdam) (152,1988-)'
_journal_coden_ASTM                PHYCE6
_journal_volume                    212
_journal_year                      1993
_journal_page_first                199
_journal_page_last                 205
_cell_length_a                     5.469(2)
_cell_length_b                     5.483(2)
_cell_length_c                     54.26(1)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       1627.1
_cell_formula_units_Z              4
_symmetry_space_group_name_H-M     'F m m m'
_symmetry_Int_Tables_number        69
_symmetry_cell_setting             orthorhombic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'x,-y,-z'
  '-x,y,-z'
  '-x,-y,z'
  '-x,-y,-z'
  '-x,y,z'
  'x,-y,z'
  'x,y,-z'
  'x,1/2+y,1/2+z'
  '1/2+x,y,1/2+z'
  '1/2+x,1/2+y,z'
  'x,1/2-y,1/2-z'
  '1/2+x,-y,1/2-z'
  '1/2+x,1/2-y,-z'
  '-x,1/2+y,1/2-z'
  '1/2-x,y,1/2-z'
  '1/2-x,1/2+y,-z'
  '-x,1/2-y,1/2+z'
  '1/2-x,-y,1/2+z'
  '1/2-x,1/2-y,z'
  '-x,1/2-y,1/2-z'
  '1/2-x,-y,1/2-z'
  '1/2-x,1/2-y,-z'
  '-x,1/2+y,1/2+z'
  '1/2-x,y,1/2+z'
  '1/2-x,1/2+y,z'
  'x,1/2-y,1/2+z'
  '1/2+x,-y,1/2+z'
  '1/2+x,1/2-y,z'
  'x,1/2+y,1/2-z'
  '1/2+x,y,1/2-z'
  '1/2+x,1/2+y,-z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Bi3+   3.000
  Sr2+   2.000
  Cu3+   2.670
  C4+    4.000
  O2-   -2.000
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
  Bi1   Bi3+   8 i 0. 0. 0.221 1.  0 d
  Sr1   Sr2+   8 i 0. 0. 0.671 0.833  0 d
  Sr2   Sr2+   8 i 0. 0. 0.604 0.833  0 d
  Sr3   Sr2+   8 i 0. 0. 0.534 0.833  0 d
  Cu1   Cu3+   8 i 0. 0. 0.137 1.  0 d
  Cu2   Cu3+   4 a 0. 0. 0. 1.  0 d
  C1    C4+    8 i 0. 0. 0.069 1.  0 d
  O1    O2-    8 i 0. 0. 0.721 1.  0 d
  O2    O2-    8 i 0. 0. 0.171 1.  0 d
  O3    O2-    8 i 0. 0. 0.104 1.  0 d
  O4    O2-    8 i 0. 0. 0.034 1.  0 d
  O5    O2-   16 j 0.25 0.25 0.137 1.  0 d
  O6    O2-    8 e 0.25 0.25 0. 1.  0 d
  O7    O2-   32 p 0.17 0.17 0.069 0.25  0 d
_cod_database_code 1001571