#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/31/02/2310222.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_2310222
loop_
_publ_author_name
'Kirkpatrick, M.E.'
'Smith, J.F.'
'Larsen, W.L.'
_publ_section_title
;
 Structures of the intermediate phases Ni10 Zr7 and Ni10 Hf7
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              894
_journal_page_last               903
_journal_volume                  15
_journal_year                    1962
_chemical_formula_sum            'Ni10 Zr7'
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.497
_cell_length_b                   9.21
_cell_length_c                   9.325
_cell_volume                     1073.283
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Kirkpatrick_ACCRA9_1962_1594.cif
_cod_data_source_block           Ni10Zr7
_cod_database_code               2310222
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z
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
Zr3 Zr 0.2378 0.2592 0.244 1 0.0
Zr4 Zr 0.4958 0.3156 0.3175 1 0.0
Ni1 Ni 0.195 0.0062 0.208 1 0.0
Ni2 Ni 0.3578 0.0196 0.2964 1 0.0
Ni3 Ni 0.3557 0.2941 0.0042 1 0.0
Ni5 Ni 0.5083 0.1078 0.1023 1 0.0
Zr1 Zr 0 0 0 1 0.0
Zr2 Zr 0.3356 0.9983 0.9897 1 0.0
Ni4 Ni 0.6406 0.2917 0.0145 1 0.0
