#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/10/1521086.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_1521086
loop_
_publ_author_name
'Guenther, W.'
'Paulus, W.'
'Schoellhorn, R.'
_publ_section_title
;
 Stacking disorder in a layered carbonate phase: the structure of La K O C
 O3
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1945
_journal_page_last               1953
_journal_volume                  61
_journal_year                    2000
_chemical_formula_sum            'C K La O4'
_chemical_name_systematic        'La K O (C O3)'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.0154
_cell_length_b                   4.0154
_cell_length_c                   12.3843
_cell_volume                     199.677
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Guenther_JPCSAW_2000_1625.cif
_cod_data_source_block           C1K1La1O4
_cod_original_cell_volume        199.6775
_cod_original_formula_sum        'C1 K1 La1 O4'
_cod_database_code               1521086
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x,z
-x+1/2,-y+1/2,z
y,-x+1/2,z
x+1/2,-y,-z
y+1/2,x+1/2,-z
-x,y+1/2,-z
-y,-x,-z
-x,-y,-z
y-1/2,-x,-z
x-1/2,y-1/2,-z
-y,x-1/2,-z
-x-1/2,y,z
-y-1/2,-x-1/2,z
x,-y-1/2,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
O3 O-2 0.25 0.25 0.6098 1 0.0
La1 La+3 0.25 0.25 0.1013 1 0.0
O1 O-2 0.25 0.528 0.765 0.5 0.0
C1 C+4 0.25 0.25 0.7123 1 0.0
O2 O-2 0.75 0.25 0 1 0.0
K1 K+1 0.25 0.25 0.3953 1 0.0
