#------------------------------------------------------------------------------
#$Date: 2015-07-12 18:25:18 +0200 (Sun, 12 Jul 2015) $
#$Revision: 147459 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/63/1526310.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_1526310
loop_
_publ_author_name
'Heerdmann, A.'
'Mewis, A.'
'Johrendt, D.'
_publ_section_title
;
 Palladiumpnictide des Zirconiums und Hafniums mit einem Metall:
 Nichtmetall-Verhaeltnis von 2:1
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1393
_journal_page_last               1399
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'P7 Pd9 Zr5'
_chemical_name_systematic        'Zr5 Pd9 P7'
_space_group_IT_number           38
_symmetry_space_group_name_Hall  'A 2 -2'
_symmetry_space_group_name_H-M   'A m m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.815
_cell_length_b                   26.3189
_cell_length_c                   6.511
_cell_volume                     653.747
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Heerdmann_ZAACAB_2000_731.cif
_cod_data_source_block           P7Pd9Zr5
_cod_original_cell_volume        653.7474
_cod_database_code               1526310
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
-x,y,z
x,-y,z
x,y+1/2,z+1/2
-x,-y+1/2,z+1/2
-x,y+1/2,z+1/2
x,-y+1/2,z+1/2
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
Pd5 Pd 0 0.136 0.3744 1 0.0
P4 P 0.5 0.1434 0.1148 1 0.0
Zr2 Zr 0 0 0.5187 1 0.0
P3 P 0.5 0.0696 0.6154 1 0.0
P2 P 0 0.2144 0.6099 1 0.0
Zr3 Zr 0.5 0.2719 0.8234 1 0.0
P1 P 0 0 0.1186 1 0.0
Pd4 Pd 0.5 0 0.8703 1 0.0
Pd2 Pd 0.5 0.1596 0.7078 1 0.0
Pd3 Pd 0 0.1966 0.9946 1 0.0
Zr1 Zr 0 0.0888 0.904 1 0.0
Pd1 Pd 0.5 0.0578 0.2493 1 0.0
