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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/62/1536280.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_1536280
loop_
_publ_author_name
'Davis, M.J.'
'Mugavero, S.J.'
'Glab, K.I.'
'Smith, M.D.'
'zur Loye, H.C.'
_publ_section_title
;
 The crystal growth and characterization of the lanthanide-containing
 double perovskites Ln2 Na Ir O6 (Ln= La, Pr, Nd).
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              413
_journal_page_last               417
_journal_volume                  6
_journal_year                    2004
_chemical_formula_sum            'Ir Na O6 Pr2'
_chemical_name_systematic        'Pr2 Na Ir O6'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.793
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.5322
_cell_length_b                   5.9341
_cell_length_c                   7.9412
_cell_volume                     260.674
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Davis_SSSCFJ_2004_1341.cif
_cod_data_source_block           Ir1Na1O6Pr2
_cod_original_cell_volume        260.6737
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Ir1 Na1 O6 Pr2'
_cod_database_code               1536280
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
x-1/2,-y-1/2,z-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
Pr1 Pr+3 0.48095 0.07043 0.25267 1 0.0
O3 O-2 0.3355 0.782 0.0664 1 0.0
O1 O-2 0.207 0.3264 0.051 1 0.0
Ir1 Ir+5 0.5 0.5 0 1 0.0
O2 O-2 0.6164 0.451 0.2324 1 0.0
Na1 Na+1 0 0 0 1 0.0
