#------------------------------------------------------------------------------
#$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/1011006.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
_chemical_name_systematic          'Iron telluride (1/2)'
_chemical_name_mineral             'Frohbergite'
_chemical_compound_source          'synthetic at 523 K'
_chemical_formula_structural       'Fe Te2'
_chemical_formula_sum              'Fe Te2'
_publ_section_title
;
Ueber Diselenide und Ditelluride von Eisen, Kobalt und Nickel
;
loop_
_publ_author_name                  'Tengner, S'
_journal_name_full
;
Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_coden_ASTM                ZAACAB
_journal_volume                    239
_journal_year                      1938
_journal_page_first                126
_journal_page_last                 132
_cell_length_a                     3.849
_cell_length_b                     5.34
_cell_length_c                     6.26
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       128.7
_cell_formula_units_Z              2
_symmetry_space_group_name_H-M     'P m n n'
_symmetry_Int_Tables_number        58
_symmetry_cell_setting             orthorhombic
loop_
_symmetry_equiv_pos_as_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_type_symbol
_atom_type_oxidation_number
  Fe0    0.000
  Te0    0.000
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
_cod_database_code 1011006