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#$Date: 2016-02-16 14:49:47 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176465 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/52/9015205.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9015205
loop_
_publ_author_name
'Rial, C.'
'Moran, E.'
'Alario-Franco M'
'Amador, U.'
'Martinez, J.'
'Rodriguez-Carvajal J'
'Andersen, N.'
_publ_section_title
;
 Effects of extra oxygen on the structure and superconductivity of
 La2-xCaxCuO4+y prepared by chemical oxidation
 _cod_database_code 1006187
;
_journal_name_full               'Physica C'
_journal_page_first              277
_journal_page_last               293
_journal_volume                  297
_journal_year                    1998
_chemical_formula_sum            'Ca0.12 Cu La1.88 O3.914'
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-B 2ab 2'
_symmetry_space_group_name_H-M   'B m a b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.34975
_cell_length_b                   5.34975
_cell_length_c                   13.1874
_cell_volume                     377.421
_database_code_amcsd             0015096
_exptl_crystal_density_diffrn    6.901
_cod_original_sg_symbol_H-M      'F 4/m m m'
_cod_original_formula_sum        '(La1.88 Ca.12) Cu O3.914'
_cod_database_code               9015205
_amcsd_formula_title             'Ca0.12 Cu La1.88 O4.058'
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 0.00000 0.36040 0.94000
Ca1 0.00000 0.00000 0.36040 0.06000
Cu1 0.00000 0.00000 0.00000 1.00000
O1 0.25000 0.25000 0.00000 1.00000
O2 0.00000 0.00000 0.18210 0.88500
O3 0.06400 0.06400 0.18400 0.02870
O4 0.25000 0.25000 0.23800 0.01450