#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/07/1530736.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_1530736
loop_
_publ_author_name
'Semiletov, S.A.'
'Pinsker, Z.G.'
_publ_section_title
;
 The electron diffraction analysis of the system of alloys Bi-Se
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1079
_journal_page_last               1082
_journal_volume                  100
_journal_year                    1955
_chemical_formula_sum            'Bi2 Se3'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                24.08
_cell_angle_beta                 24.08
_cell_angle_gamma                24.08
_cell_formula_units_Z            1
_cell_length_a                   9.42
_cell_length_b                   9.42
_cell_length_c                   9.42
_cell_volume                     122.284
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Semiletov_DANKAS_1955_1993.cif
_cod_data_source_block           Bi2Se3
_cod_original_cell_volume        122.2844
_cod_original_sg_symbol_Hall     '-R 3 2" (-y+z,x+z,-x+y+z)'
_cod_database_code               1530736
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
z,x,y
y,z,x
-y,-x,-z
-z,-y,-x
-x,-z,-y
-x,-y,-z
-z,-x,-y
-y,-z,-x
y,x,z
z,y,x
x,z,y
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
Se2 Se-2 0.206 0.206 0.206 1 0.0
Se1 Se-2 0 0 0 1 0.0
Bi1 Bi+3 0.399 0.399 0.399 1 0.0
