#------------------------------------------------------------------------------
#$Date: 2023-03-26 10:09:57 +0200 (Sun 26 de Mar de 2023) $
#$Revision: 282068 $
#$URL: svn://www.crystallography.net/cod/cif/1/01/10/1011006.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_1011006
loop_
_publ_author_name
'Tengner, S'
_publ_section_title
;
Ueber Diselenide und Ditelluride von Eisen, Kobalt und Nickel
;
_journal_coden_ASTM              ZAACAB
_journal_name_full
;
Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              126
_journal_page_last               132
_journal_paper_doi               10.1002/zaac.19382390203
_journal_volume                  239
_journal_year                    1938
_chemical_compound_source        'synthetic at 523 K'
_chemical_formula_structural     'Fe Te2'
_chemical_formula_sum            'Fe Te2'
_chemical_name_mineral           Frohbergite
_chemical_name_systematic        'Iron telluride (1/2)'
_space_group_IT_number           58
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      58
_symmetry_space_group_name_Hall  '-P 2n 2'
_symmetry_space_group_name_H-M   'P m n n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.849
_cell_length_b                   5.34
_cell_length_c                   6.26
_cell_volume                     128.7
_database_code_amcsd             0015753
_exptl_crystal_density_diffrn    8.029
_cod_database_code               1011006
loop_
_space_group_symop_operation_xyz
x,y,z
x,-y,-z
1/2-x,1/2-y,1/2+z
1/2-x,1/2+y,1/2-z
-x,-y,-z
-x,y,z
1/2+x,1/2+y,1/2-z
1/2+x,1/2-y,1/2+z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
Fe1 Fe0 2 a 0. 0. 0. 1. 0 d
Te1 Te0 4 g 0. 0.22 0.36 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Fe0 0.000
Te0 0.000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0015753
