#------------------------------------------------------------------------------
#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9008294.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_9008294
_chemical_name 'Cattiite'
loop_
_publ_author_name
'Catti M'
'Franchini-Angela M'
'Ivaldi G'
_journal_name_full "Zeitschrift fur Kristallographie"
_journal_volume 155
_journal_year 1981
_journal_page_first 53
_journal_page_last 64
_publ_section_title
;
 A case of polytypism in hydrated oxysalts:
 the crystal structure of Mg3(PO4)2*22H2O-II
 Locality: synthetic
;
_chemical_formula_sum 'Mg3 P2 O30 H44'
_cell_length_a 6.937
_cell_length_b 6.932
_cell_length_c 16.132
_cell_angle_alpha 82.15
_cell_angle_beta 89.72
_cell_angle_gamma 119.49
_cell_volume 666.568
_symmetry_space_group_name_H-M 'P -1'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Mg1   0.00000   0.50000   0.00000
Mg2   0.64830   0.25100   0.34371
P   0.00310   0.96320   0.24028
O1   0.97390   0.92930   0.33690
O2   0.14700   0.21650   0.20770
O3   0.11730   0.83720   0.21370
O4   0.77370   0.87350   0.20560
Ow1   0.77650   0.31620   0.10550
Ow2   0.17030   0.77710   0.05820
Ow3   0.20450   0.38620   0.04720
Ow4   0.74730   0.06840   0.42540
Ow5   0.76130   0.50820   0.41160
Ow6   0.96860   0.41240   0.28550
Ow7   0.57210   0.41650   0.24040
Ow8   0.34080   0.14840   0.40780
Ow9   0.50200   0.96720   0.28550
Ow10   0.64500   0.81680   0.04880
Ow11   0.27860   0.52800   0.41500
H1   0.72200   0.35100   0.13400
H2   0.75600   0.19500   0.13000
H3   0.13000   0.79000   0.10700
H4   0.23700   0.89500   0.03300
H5   0.19000   0.32800   0.09800
H6   0.24900   0.32400   0.02200
H7   0.82000   0.01800   0.40200
H8   0.71700   0.02100   0.47000
H9   0.85000   0.65500   0.38800
H10   0.76200   0.50400   0.45900
H11   0.00000   0.52400   0.26400
H12   0.03800   0.35200   0.25700
H13   0.43200   0.35600   0.23200
H14   0.62900   0.55200   0.23700
H15   0.20700   0.05900   0.38400
H16   0.33200   0.26000   0.41200
H17   0.58800   0.93300   0.25600
H18   0.38400   0.93200   0.25900
H19   0.51900   0.74700   0.05500
H20   0.69200   0.84300   0.09500
H21   0.36100   0.65500   0.39300
H22   0.17400   0.48900   0.39000