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#$Date: 2015-10-14 19:37:30 +0300 (Wed, 14 Oct 2015) $
#$Revision: 168993 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/99/1539909.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_1539909
loop_
_publ_author_name
'Bruskov, V.A.'
'Lomnitskaya, Ya.F.'
'Kuz'ma, Yu.B.'
_publ_section_title
;
 Crystal structure of the compound Zr2 Ni1-x P
;
_journal_name_full
'Soviet Physics, Crystallography (= Kristallografiya)'
_journal_page_first              199
_journal_page_last               201
_journal_volume                  33
_journal_year                    1988
_chemical_formula_sum            'Ni0.95 P2 Zr4'
_chemical_name_systematic        'Ni0.95 Zr4 P2'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.852
_cell_length_b                   3.657
_cell_length_c                   10.213
_cell_volume                     517.358
_citation_journal_id_ASTM        SPHCA6
_cod_data_source_file            Bruskov_SPHCA6_1988_566.cif
_cod_data_source_block           Ni0.95P2Zr4
_cod_original_cell_volume        517.3575
_cod_database_code               1539909
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-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
Zr2 Zr 0.8981 0.25 0.5312 1 0.0
Zr4 Zr 0.6491 0.25 0.5935 1 0.0
Zr3 Zr 0.0376 0.25 0.2208 1 0.0
Ni1 Ni 0.4526 0.25 0.5262 0.76 0.0
P1 P 0.0725 0.25 0.6588 1 0.0
P2 P 0.2114 0.25 0.347 1 0.0
Ni2 Ni 0.3456 0.25 0.2233 0.19 0.0
Zr1 Zr 0.7736 0.25 0.8593 1 0.0
