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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/1/52/24/1522454.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_1522454
loop_
_publ_author_name
'Markiv, V.Ya.'
'Belyavina, N.N.'
_publ_section_title
;
 Crystal structure of the Sc3 Mn2 Ga6 and Sc3 Fe2 Ga6 compounds
;
_journal_name_full
;
Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya B: Geologichni, Khimichni ta 
Biologichni Nauki
;
_journal_page_first              55
_journal_page_last               58
_journal_volume                  1987
_journal_year                    1987
_chemical_formula_sum            'Ga6 Mn2 Sc3'
_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                   8.051
_cell_length_b                   8.533
_cell_length_c                   10.607
_cell_volume                     728.692
_citation_journal_id_ASTM        DANND6
_cod_data_source_file            Markiv_DANND6_1987_218.cif
_cod_data_source_block           Ga6Mn2Sc3
_cod_original_cell_volume        728.6922
_cod_database_code               1522454
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
Mn2 Mn 0.137 0.25 0.227 1 0.0
Ga3 Ga 0.387 0.414 0.343 1 0.0
Ga1 Ga 0.721 0.25 0.776 1 0.0
Sc2 Sc 0.067 0.938 0.364 1 0.0
Sc1 Sc 0.555 0.25 0.564 1 0.0
Ga4 Ga 0.3 0.515 0.587 1 0.0
Mn1 Mn 0.177 0.25 0.489 1 0.0
Ga2 Ga 0.399 0.25 0.084 1 0.0
