#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/65/2106552.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106552
loop_
_publ_author_name
'Likforman, A.'
'Carre, D.'
'Bachet, J.E.'
'Bachet, B.'
_publ_section_title
;
 Structure cristalline du monoseleniure d'indium In Se
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1252
_journal_page_last               1254
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'In Se'
_space_group_IT_number           160
_symmetry_space_group_name_Hall  'R 3 -2"'
_symmetry_space_group_name_H-M   'R 3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   4
_cell_length_b                   4
_cell_length_c                   25.32
_cell_volume                     350.844
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Likforman_ACBCAR_1975_1968.cif
_cod_data_source_block           In1Se1
_cod_original_cell_volume        350.8442
_cod_original_formula_sum        'In1 Se1'
_cod_database_code               2106552
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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 0 0 0.6165 1 0.0
Se1 Se 0 0 0.8281 1 0.0
In1 In 0 0 0 1 0.0
In2 In 0 0 0.1114 1 0.0
