#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/9/9009825.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_9009825
_chemical_name 'Cyrilovite'
loop_
_publ_author_name
'Cozzupoli D'
'Grubessi O'
'Mottana A'
'Zanazzi P F'
_journal_name_full "Mineralogy and Petrology"
_journal_volume 37
_journal_year 1987
_journal_page_first 1
_journal_page_last 14
_publ_section_title
;
 Cyrilovite from Italy: structure and crystal chemistry
 Locality: Bosa, Sardinia, Italy
;
_chemical_formula_sum 'Na Fe3 P2 O14 H8'
_cell_length_a 7.313
_cell_length_b 7.313
_cell_length_c 19.3150
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 1032.966
_symmetry_space_group_name_H-M 'P 41 21 2'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'y,x,-z'
  '1/2-y,1/2+x,1/4+z'
  '1/2-x,1/2+y,1/4-z'
  '-x,-y,1/2+z'
  '-y,-x,1/2-z'
  '1/2+y,1/2-x,3/4+z'
  '1/2+x,1/2-y,3/4-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Na   0.37550   0.37550   0.50000
Fe1   0.39530   0.10820   0.25770
Fe2   0.10350   0.10350   0.00000
P   0.14110   0.36600   0.35020
O2   0.29500   0.50650   0.33870
O3   0.19810   0.18010   0.31970
O4   0.10580   0.34870   0.42850
O-H5   0.13790   0.35290  -0.04310
O6   0.17540   0.02530   0.18880
O-H7   0.41060   0.34920   0.21090
Wat1  -0.03310   0.42520   0.31390