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#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9002809.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_9002809
_chemical_name 'Allabogdanite'
loop_
_publ_author_name
'Britvin S N'
'Rudashevsky N S'
'Krivovichev S V'
'Burns P C'
'Polekhovsky Y S'
_journal_name_full "American Mineralogist"
_journal_volume 87
_journal_year 2002
_journal_page_first 1245
_journal_page_last 1249
_publ_section_title
;
 Allabogdanite, (Fe,Ni)2P, a new mineral from the Onello meteorite:
 The occurence and crystal structure
;
_chemical_formula_sum '(Fe1.5 Ni.5) P'
_cell_length_a 5.792
_cell_length_b 3.564
_cell_length_c 6.691
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 138.120
_symmetry_space_group_name_H-M 'P n m a'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'x,1/2-y,z'
  '-x,1/2+y,-z'
  '1/2-x,1/2+y,1/2+z'
  '1/2+x,1/2-y,1/2-z'
  '1/2+x,y,1/2-z'
  '1/2-x,-y,1/2+z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_Uiso_or_equiv
Fe1   0.35770   0.25000   0.93570   0.75000   0.00950
Ni1   0.35770   0.25000   0.93570   0.25000   0.00950
Fe2   0.46930   0.25000   0.33240   0.75000   0.01110
Ni2   0.46930   0.25000   0.33240   0.25000   0.01110
P   0.24430   0.25000   0.62250   1.00000   0.00710