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#$Date: 2016-01-03 12:47:11 +0200 (Sun, 03 Jan 2016) $
#$Revision: 172857 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/15/1541513.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_1541513
loop_
_publ_author_name
'Brauer, G.'
'Mueller, O.'
_publ_section_title
;
 Zur Kristallchemie des Strontiumchlorids
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              218
_journal_page_last               226
_journal_volume                  295
_journal_year                    1958
_chemical_formula_sum            'Ca0.15 Cl2 Sr0.85'
_chemical_name_systematic        'Ca.15 Sr.85 Cl2'
_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            4
_cell_length_a                   6.939
_cell_length_b                   6.939
_cell_length_c                   6.939
_cell_volume                     334.111
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Brauer_ZAACAB_1958_1055.cif
_cod_data_source_block           Ca0.15Cl2Sr0.85
_cod_original_cell_volume        334.1109
_cod_database_code               1541513
loop_
_symmetry_equiv_pos_as_xyz
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-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
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-x,y,-z
-y,-x,-z
z,x,y
-x,z,y
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x,-z,y
z,-x,-y
x,z,-y
-z,x,-y
-x,-z,-y
y,z,x
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z,y,-x
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z,x,-y
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x,z,y
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z,x+1/2,y+1/2
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z+1/2,x,y+1/2
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z+1/2,y+1/2,x
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-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
Sr1 Sr+2 0 0 0 0.85 0.0
Cl1 Cl-1 0.25 0.25 0.25 1 0.0
Ca1 Ca+2 0 0 0 0.15 0.0
