#------------------------------------------------------------------------------
#$Date: 2016-04-12 21:24:15 +0300 (Tue, 12 Apr 2016) $
#$Revision: 182026 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/34/1523424.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_1523424
loop_
_publ_author_name
'Cybulski, Z. A.'
_publ_section_title
;
 Ternary and quaternary selenide compounds MITiZrSe₄ (MI = Li, Ag)
;
_journal_coden_ASTM              MSFOEP
_journal_name_full               'Materials Science Forum'
_journal_page_first              159
_journal_page_last               164
_journal_paper_doi               10.4028/www.scientific.net/MSF.91-93.159
_journal_volume                  91-93
_journal_year                    1992
_chemical_formula_sum            'Se4 Ti Zr'
_chemical_name_systematic        'Ti Zr Se4'
_space_group_IT_number           10
_symmetry_space_group_name_Hall  '-P 2y'
_symmetry_space_group_name_H-M   'P 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   6.1
_cell_length_b                   3.669
_cell_length_c                   6.2
_cell_volume                     138.762
_citation_journal_id_ASTM        MSFOEP
_cod_data_source_file            Cybulski_MSFOEP_1992_517.cif
_cod_data_source_block           Se4Ti1Zr1
_cod_original_cell_volume        138.7616
_cod_original_formula_sum        'Se4 Ti1 Zr1'
_cod_database_code               1523424
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
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
Se2 Se-2 0.25 0 0.33 1 0.0
Ti1 Ti+4 0 0 0 1 0.0
Se1 Se-2 0.25 0.5 0.83 1 0.0
Zr1 Zr+4 0 0.5 0.5 1 0.0
