#------------------------------------------------------------------------------
#$Date: 2024-05-16 08:36:09 +0200 (Thu 16 de May de 2024) $
#$Revision: 291877 $
#$URL: svn://www.crystallography.net/cod/cif/9/01/23/9012387.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9012387
loop_
_publ_author_name
'Matkovic, P.'
'Schubert, K.'
_publ_section_title
;
 Kristallstruktur von Pt5Se4
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              185
_journal_page_last               190
_journal_paper_doi               10.1016/0022-5088(77)90191-6
_journal_volume                  55
_journal_year                    1977
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Pt5 Se4'
_chemical_name_mineral           Luberoite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 101.59
_cell_angle_gamma                90
_cell_length_a                   6.577
_cell_length_b                   4.610
_cell_length_c                   11.122
_cell_formula_units_Z            2
_cell_volume                     330.343
_database_code_amcsd             0014140
_exptl_crystal_density_diffrn    12.981
_cod_database_code               9012387
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2-y,1/2+z
-x,1/2+y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Pt1 0.33100 0.33000 0.00300 0.00633
Pt2 0.22300 0.66300 0.17400 0.00633
Pt3 0.00000 0.00000 0.00000 0.00507
Se1 0.91100 0.36800 0.13600 0.00507
Se2 0.50900 0.96800 0.14100 0.00760
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0014140
