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#$Date: 2015-09-08 22:37:25 +0300 (Tue, 08 Sep 2015) $
#$Revision: 155313 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/02/1530245.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_1530245
loop_
_publ_author_name
'Lasocha, W.'
'Eick, H.A.'
_publ_section_title
;
 The Structure of Ca0.3 Sr0.7 Cl2 and Ca0.46 Sr0.54 Cl2 by the X-Ray
 Rietveld Refinement Procedure
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              175
_journal_page_last               182
_journal_volume                  75
_journal_year                    1988
_chemical_formula_sum            'Ca0.3 Cl2 Sr0.7'
_chemical_name_systematic        'Ca.3 Sr.7 Cl2'
_space_group_IT_number           85
_symmetry_space_group_name_Hall  'P 4ab -1ab'
_symmetry_space_group_name_H-M   'P 4/n :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            10
_cell_length_a                   10.898
_cell_length_b                   10.898
_cell_length_c                   6.744
_cell_volume                     800.961
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Lasocha_JSSCBI_1988_1631.cif
_cod_data_source_block           Ca0.3Cl2Sr0.7
_cod_cif_authors_sg_Hall         '-P 4a (x-1/4,y+1/4,z)'
_cod_original_cell_volume        800.9606
_cod_database_code               1530245
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x+1/2,z
-x,-y,z
y+1/2,-x+1/2,z
-x+1/2,-y+1/2,-z
y,-x,-z
x+1/2,y+1/2,-z
-y,x,-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
Cl1 Cl-1 -0.096 0.714 0.63 1 0.0
Cl4 Cl-1 0 0 0.5 1 0.0
Sr2 Sr+2 0 0.5 0.841 0.7 0.0
Cl3 Cl-1 0 0 0 1 0.0
Cl2 Cl-1 0.099 0.707 0.098 1 0.0
Ca2 Ca+2 0 0.5 0.841 0.3 0.0
Sr1 Sr+2 -0.142 0.831 0.252 0.7 0.0
Ca1 Ca+2 -0.142 0.831 0.252 0.3 0.0