#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/2/31/01/2310172.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2310172
loop_
_publ_author_name
'Brown, P.J.'
_publ_section_title
;
 The structure of the zeta-phase in the transition metal-zinc alloy
 systems
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              608
_journal_page_last               612
_journal_volume                  15
_journal_year                    1962
_chemical_formula_sum            'Fe Zn13'
_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                 127.3
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   13.424
_cell_length_b                   7.608
_cell_length_c                   5.061
_cell_volume                     411.163
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Brown_ACCRA9_1962_128.cif
_cod_data_source_block           Fe1Zn13
_cod_original_cell_volume        411.1634
_cod_original_formula_sum        'Fe1 Zn13'
_cod_database_code               2310172
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
Fe1 Fe 0 0 0 0.5 0.0
Fe2 Fe 0 0 0.5 0.5 0.0
Zn2 Zn 0 0 0.5 0.5 0.0
Zn6 Zn 0.176 0.178 0.545 1 0.0
Zn3 Zn 0.612 0 0.292 1 0.0
Zn4 Zn 0.2195 0 0.073 1 0.0
Zn1 Zn 0 0 0 0.5 0.0
Zn5 Zn 0.077 0.292 0.835 1 0.0
