#------------------------------------------------------------------------------
#$Date: 2015-10-10 12:47:02 +0200 (Sat, 10 Oct 2015) $
#$Revision: 165407 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/73/1537324.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_1537324
loop_
_publ_author_name
'Ganglberger, E.'
_publ_section_title
;
 Die Kristallstruktur von Fe12 Zr2 P7
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              557
_journal_page_last               865
_journal_volume                  99
_journal_year                    1968
_chemical_formula_sum            'Fe12 P7 Zr2'
_chemical_name_systematic        'Fe12 Zr2 P7'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.0002
_cell_length_b                   9.0002
_cell_length_c                   3.592
_cell_volume                     251.983
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Ganglberger_MOCHAP_1968_954.cif
_cod_data_source_block           Fe12P7Zr2
_cod_database_code               1537324
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z
-y,x-y,z
x,y,-z
-x+y,-x,z
-y,x-y,-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
P1 P 0.4163 0.2959 0 1 0.0
P2 P 0.1207 0.4096 0.5 1 0.0
Fe3 Fe 0.3864 0.4359 0.5 1 0.0
Fe4 Fe 0.2232 0.0992 0.5 1 0.0
Zr2 Zr 0.6667 0.3333 0.5 1 0.0
Fe1 Fe 0.4309 0.059 0 1 0.0
P3 P 0 0 0 1 0.0
Zr1 Zr 0.3333 0.6667 0 1 0.0
Fe2 Fe 0.1583 0.2772 0 1 0.0
