#------------------------------------------------------------------------------
#$Date: 2015-09-18 06:52:31 +0200 (Fri, 18 Sep 2015) $
#$Revision: 157717 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/20/1532094.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_1532094
loop_
_publ_author_name
'Rayaprol, S.'
'Mavani, K.'
'Kuberkar, D.G.'
'Thaker, C.M.'
'Rana, D.S.'
'Malik, S.K.'
'Thampi, R.S.'
'Kulkarni, R.G.'
_publ_section_title
;
 Structural investigations of La-2125 mixed oxide superconducting system
;
_journal_name_full               'Journal of Superconductivity'
_journal_page_first              211
_journal_page_last               215
_journal_volume                  15
_journal_year                    2002
_chemical_formula_sum            'Ba1.304 Ca0.39 Cu3 La1.109 Nd0.196 O7.136'
_chemical_name_systematic
;
(La0.414 Nd0.196 Ca0.39) (Ba1.304 La0.695) Cu3 O7.136
;
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.8735
_cell_length_b                   3.8735
_cell_length_c                   11.6686
_cell_volume                     175.076
_citation_journal_id_ASTM        JOUSEH
_cod_data_source_file            Rayaprol_JOUSEH_2002_1718.cif
_cod_data_source_block           Ba1.304Ca0.39Cu3La1.109Nd0.196O7.136
_cod_original_cell_volume        175.0757
_cod_database_code               1532094
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
O1 O-2 0 0.5 0 0.568 0.0
La1 La+3 0.5 0.5 0.5 0.414 0.0
Ca1 Ca+2 0.5 0.5 0.5 0.39 0.0
Cu1 Cu+2 0 0 0 1 0.0
O3 O-2 0 0 0.1579 1 0.0
Ba1 Ba+2 0.5 0.5 0.1864 0.652 0.0
Nd1 Nd+3 0.5 0.5 0.5 0.196 0.0
Cu2 Cu+2 0 0 0.3508 1 0.0
La2 La+3 0.5 0.5 0.1864 0.348 0.0
O2 O-2 0.5 0 0.3672 1 0.0
