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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/31/01/2310178.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_2310178
loop_
_publ_author_name
'Cromer, D.T.'
'Larson, A.C.'
_publ_section_title
;
 The crystal structure of Pu Ni4
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              909
_journal_page_last               912
_journal_volume                  13
_journal_year                    1960
_chemical_formula_sum            'Ni4 Pu'
_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                 100
_cell_angle_gamma                90
_cell_formula_units_Z            6
_cell_length_a                   4.87
_cell_length_b                   8.46
_cell_length_c                   10.27
_cell_volume                     416.698
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Cromer_ACCRA9_1960_1465.cif
_cod_data_source_block           Ni4Pu1
_cod_original_cell_volume        416.6978
_cod_original_formula_sum        'Ni4 Pu1'
_cod_database_code               2310178
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
Ni2 Ni 0.5712 0 0.1987 1 0.0
Ni3 Ni 0.3199 0.2507 0.1993 1 0.0
Pu2 Pu 0.1263 0 0.3552 1 0.0
Ni1 Ni 0 0.3331 0 1 0.0
Pu1 Pu 0 0 0 1 0.0
Ni4 Ni 0.1422 0.33 0.4066 1 0.0
