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#$Date: 2015-07-11 23:57:33 +0300 (Sat, 11 Jul 2015) $
#$Revision: 146423 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/12/7221261.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_7221261
loop_
_publ_author_name
'Welk, E.'
'Schuster, H.U.'
_publ_section_title
;
 Li Fe6 Ge5 und Li Fe6 Ge4. Zwei Phasen mit enger Strukturbeziehung zu der
 Verbindung Li Fe6 Ge6
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (2,1947-32,1977)
;
_journal_page_first              749
_journal_page_last               752
_journal_volume                  32
_journal_year                    1977
_chemical_formula_sum            'Fe6 Ge4 Li'
_chemical_name_systematic        'Li Fe6 Ge4'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.94
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.739
_cell_length_b                   5.045
_cell_length_c                   7.17
_cell_volume                     288.918
_citation_journal_id_ASTM        ZENBAX
_cod_data_source_file            Welk_ZENBAX_1977_155.cif
_cod_data_source_block           Fe6Ge4Li1
_cod_original_cell_volume        288.9179
_cod_chemical_formula_sum_orig   'Fe6 Ge4 Li1'
_cod_database_code               7221261
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,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
Ge2 Ge 0.333 0 0.5 1 0.0
Ge1 Ge 0.126 0 0.122 1 0.0
Fe1 Fe 0.401 0 0.809 1 0.0
Li1 Li 0 0 0.5 1 0.0
Fe2 Fe 0.355 0.25 0.19 1 0.0