#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/85/1538558.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_1538558
loop_
_publ_author_name
'Schneider, A.'
'Gattow, G.'
_publ_section_title
;
 Beitrag zum System Aluminium-Selen
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              49
_journal_page_last               59
_journal_volume                  277
_journal_year                    1954
_chemical_formula_sum            'Al1.33 Se2'
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.89
_cell_length_b                   3.89
_cell_length_c                   6.3
_cell_volume                     82.560
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Schneider_ZAACAB_1954_885.cif
_cod_data_source_block           Al1.33Se2
_cod_original_cell_volume        82.56014
_cod_database_code               1538558
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
y,x,z+1/2
-x+y,y,z
-x,-x+y,z+1/2
-y,-x,z
x-y,-y,z+1/2
x,x-y,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
Se1 Se-2 0.3333 0.6667 0 1 0.0
Al1 Al+3 0.3333 0.6667 0.375 0.6667 0.0
