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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/28/7222878.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_7222878
loop_
_publ_author_name
'Mueller, W.'
'Schaefer, H.'
'Weiss, A.'
_publ_section_title
;
 Zur Kenntnis der Phasen Ca Li Si2 und Ca Li Ge2
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (2,1947-32,1977)
;
_journal_page_first              534
_journal_page_last               536
_journal_volume                  26
_journal_year                    1971
_chemical_formula_sum            'Ca Li Si2'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.98
_cell_length_b                   3.8
_cell_length_c                   10.69
_cell_volume                     324.164
_citation_journal_id_ASTM        ZENBAX
_cod_data_source_file            Mueller_ZENBAX_1971_675.cif
_cod_data_source_block           Ca1Li1Si2
_cod_original_cell_volume        324.1635
_cod_original_formula_sum        'Ca1 Li1 Si2'
_cod_database_code               7222878
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-y-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 0.23 0.25 0.431 1 0.0
Li1 Li 0.998 0.25 0.613 1 0.0
Si2 Si 0.664 0.25 0.674 1 0.0
Ca1 Ca 0.135 0.25 0.136 1 0.0
