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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/22/1532264.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_1532264
loop_
_publ_author_name
'Weber, F.A.'
'Schleid, T.'
_publ_section_title
;
 Vier Oxidselenide des Praseodyms: Pr10 O Se14, Pr2 O Se2, Pr2 O2 Se und
 Pr4 O4 Se3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1383
_journal_page_last               1388
_journal_volume                  627
_journal_year                    2001
_chemical_formula_sum            'O2 Pr2 Se'
_chemical_name_systematic        'Pr2 O2 Se'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   4.0112
_cell_length_b                   4.0112
_cell_length_c                   7.0551
_cell_volume                     98.307
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Weber_ZAACAB_2001_9.cif
_cod_data_source_block           O2Pr2Se1
_cod_original_cell_volume        98.30654
_cod_original_formula_sum        'O2 Pr2 Se1'
_cod_database_code               1532264
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,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
Se1 Se-2 0 0 0 1 0.0
Pr1 Pr+3 0.3333 0.6667 0.28799 1 0.0
O1 O-2 0.3333 0.6667 0.6253 1 0.0
