data_global
_amcsd_formula_title 'Ca0.12 Cu La1.88 O4.05'
loop_
_publ_author_name
'Rial C'
'Moran E'
'Alario-Franco M'
'Amador U'
'Martinez J'
'Rodriguez-Carvajal J'
'Andersen N'
_journal_name_full 'Physica C'
_journal_volume 297 
_journal_year 1998
_journal_page_first 277
_journal_page_last 293
_publ_section_title
;
 Effects of extra oxygen on the structure and superconductivity of
 La2-xCaxCuO4+y prepared by chemical oxidation
 _cod_database_code 1006192
;
_database_code_amcsd 0015101
_chemical_formula_sum '(La1.88 Ca.12) Cu O4.05'
_cell_length_a 5.3313
_cell_length_b 5.3666
_cell_length_c 13.1531
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 376.323
_exptl_crystal_density_diffrn      6.959
_symmetry_space_group_name_H-M 'B m a b'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,y,1/2+z'
  'x,1/2+y,1/2-z'
  '1/2+x,1/2+y,-z'
  '-x,1/2-y,1/2+z'
  '1/2-x,1/2-y,+z'
  '-x,y,z'
  '1/2-x,y,1/2+z'
  'x,-y,-z'
  '1/2+x,-y,1/2-z'
  'x,1/2-y,1/2+z'
  '1/2+x,1/2-y,+z'
  '-x,1/2+y,1/2-z'
  '1/2-x,1/2+y,-z'
  '-x,-y,-z'
  '1/2-x,-y,1/2-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
La1   0.00000   0.00240   0.36080   0.94000
Ca1   0.00000   0.00240   0.36080   0.06000
Cu1   0.00000   0.00000   0.00000   1.00000
O1   0.25000   0.25000   0.00520   1.00000
O2   0.00000  -0.02710   0.18230   0.92000
O3   0.03900   0.08500   0.18400   0.04000
O4   0.25000   0.25000   0.24300   0.02500