#------------------------------------------------------------------------------
#$Date: 2015-09-18 07:22:17 +0300 (Fri, 18 Sep 2015) $
#$Revision: 157639 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/20/1532024.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_1532024
loop_
_publ_author_name
'Prots', Yu.'
'Niewa, R.'
'Schnelle, W.'
'Kniep, R.'
_publ_section_title
;
 New ternary alkaline earth metal cerium(IV) nitrides: Ca Ce N2 and Sr Ce
 N2
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1590
_journal_page_last               1596
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'Ca1.04 Ce0.96 N2'
_chemical_name_systematic        'Ca (Ce N2)'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.9921
_cell_length_b                   4.9921
_cell_length_c                   4.9921
_cell_volume                     124.408
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Prots_ZAACAB_2002_1002.cif
_cod_data_source_block           Ca1.04Ce0.96N2
_cod_original_cell_volume        124.4084
_cod_database_code               1532024
loop_
_symmetry_equiv_pos_as_xyz
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-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
z,x,y
-x,z,y
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x,z,-y
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y,z,x
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z,y,-x
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y,x,z
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z,x,-y
-x,z,-y
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-x,-z,y
z,-x,y
x,z,y
-y,-z,-x
-y,z,x
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z,y,x
y,z,-x
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z+1/2,y,-x+1/2
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z+1/2,-x+1/2,y
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-z+1/2,-y+1/2,x
y+1/2,-z+1/2,x
z+1/2,y+1/2,x
y+1/2,z+1/2,-x
-z+1/2,y+1/2,-x
z+1/2,-y+1/2,-x
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
N1 N-3 0.5 0.5 0.5 1 0.0
Ca1 Ca+2 0 0 0 0.52 0.0
Ce1 Ce+4 0 0 0 0.48 0.0
