data_global
_amcsd_formula_title 'Al0.58 Ba1.47 Ca0.53 Cu2.42 La O6.68'
loop_
_publ_author_name
'Amador U'
'Senaris M'
'Moran E'
'Alario-Franco M'
'Vegas A'
'Martinez-Ripoll M'
'Ibanez J'
_journal_name_full 'European Journal of Solid State and Inorganic Chemistry'
_journal_volume 28 
_journal_year 1991
_journal_page_first 611
_journal_page_last 624
_publ_section_title
;
 (CaBaLa)3(Cu3-yMy)O7-x (M=Al, Pt) single crystals
 _cod_database_code 1008554
;
_database_code_amcsd 0016445
_chemical_formula_sum 'Cu2.42 Al.58 Ca.53 La Ba1.47 O6.676'
_cell_length_a 3.8970
_cell_length_b 3.8970
_cell_length_c 11.573
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 175.755
_exptl_crystal_density_diffrn      6.030
_symmetry_space_group_name_H-M 'P 4/m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-y,-x,z'
  'y,x,-z'
  'y,-x,-z'
  '-y,x,z'
  'x,-y,z'
  '-x,y,-z'
  'x,y,-z'
  '-x,-y,z'
  'y,x,z'
  '-y,-x,-z'
  '-y,x,-z'
  'y,-x,z'
  '-x,y,z'
  'x,-y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Cu1   0.00000   0.00000   0.00000   0.42000
Al1   0.00000   0.00000   0.00000   0.58000
Cu2   0.00000   0.00000   0.35300   1.00000
Ca1   0.50000   0.50000   0.50000   0.53000
La1   0.50000   0.50000   0.50000   0.47000
Ba1   0.50000   0.50000   0.19100   0.73500
La2   0.50000   0.50000   0.19100   0.26500
O1   0.00000   0.00000   0.15400   0.99000
O2   0.00000   0.50000   0.36200   1.00000
O3   0.00000   0.50000   0.00000   0.34800