#------------------------------------------------------------------------------
#$Date: 2015-10-05 10:42:43 +0200 (lun 05 de oct de 2015) $
#$Revision: 159633 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/33/1533395.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_1533395
loop_
_publ_author_name
'Georges, S.'
'Goutenoire, F.'
'Sheptyakov, D.'
'Altorfer, F.'
'Lacorre, P.'
'Fauth, F.'
'Suard, E.'
_publ_section_title
;
 Thermal, structural and transport properties of the fast oxide-ion
 conductors La2-x Rx Mo2 O9 (R = Nd, Gd, Y)
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              231
_journal_page_last               241
_journal_volume                  161
_journal_year                    2003
_chemical_formula_sum            'La1.9 Mo2 O9 Y0.1'
_chemical_name_systematic        '(La1.9 Y0.1) (Mo2 O9)'
_space_group_IT_number           198
_symmetry_space_group_name_Hall  'P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.1491
_cell_length_b                   7.1491
_cell_length_c                   7.1491
_cell_volume                     365.388
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Georges_SSIOD3_2003_921.cif
_cod_data_source_block           La1.9Mo2O9Y0.1
_cod_original_cell_volume        365.3878
_cod_database_code               1533395
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
z,x,y
-z+1/2,-x,y+1/2
z+1/2,-x+1/2,-y
-z,x+1/2,-y+1/2
y,z,x
y+1/2,-z+1/2,-x
-y,z+1/2,-x+1/2
-y+1/2,-z,x+1/2
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
O2 O-2 0.9957 0.174 0.3454 0.71 0.0
O3 O-2 0.878 0.615 0.557 0.45 0.0
Y1 Y+3 0.8548 0.8548 0.8548 0.05 0.0
Mo1 Mo+6 0.167 0.167 0.167 1 0.0
O1 O-2 0.3098 0.3098 0.3098 1 0.0
La1 La+3 0.8548 0.8548 0.8548 0.95 0.0
