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#$Date: 2018-09-27 06:13:35 +0200 (Thu 27 de Sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/97/1539705.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_1539705
loop_
_publ_author_name
'Dascoulidou, A.'
'Bronger, W.'
'Mueller, P.'
_publ_section_title
;
 Ternaere Mangan-Verbindungen A Mn X (A= Mg, Ca, Sr, oder Ba; X= Si, Ge
 oder Sn): Neutronenbeugungsuntersuchungen zur Charakterisierung der
 magnetischen Eigenschaften
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              124
_journal_page_last               128
_journal_volume                  624
_journal_year                    1998
_chemical_formula_sum            'Ca Mn Si'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  'P 4ab 2ab -1ab'
_symmetry_space_group_name_H-M   'P 4/n m m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.178
_cell_length_b                   4.178
_cell_length_c                   7.158
_cell_volume                     124.948
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Dascoulidou_ZAACAB_1998_1810.cif
_cod_data_source_block           Ca1Mn1Si1
_cod_original_cell_volume        124.9478
_cod_original_sg_symbol_Hall     '-P 4a 2a (x-1/4,y+1/4,z)'
_cod_original_formula_sum        'Ca1 Mn1 Si1'
_cod_database_code               1539705
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
-x+1/2,-y+1/2,-z
y,-x,-z
x+1/2,y+1/2,-z
-y,x,-z
-x,y,z
-y+1/2,-x+1/2,z
x,-y,z
y+1/2,x+1/2,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
Si1 Si-4 0 0.5 0.706 1 0.0
Ca1 Ca+2 0 0.5 0.169 1 0.0
Mn1 Mn+2 0 0 0 1 0.0
