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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/9/9004266.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_9004266
_chemical_name 'Mozartite'
loop_
_publ_author_name
'Basso R'
'Lucchetti G'
'Zefiro L'
'Palenzona A'
_journal_name_full "The Canadian Mineralogist"
_journal_volume 31
_journal_year 1993
_journal_page_first 331
_journal_page_last 336
_publ_section_title
;
 Mozartite, CaMn(OH)SiO4, a new mineral species from the Cerchiara Mine,
 Northern Apennines, Italy
 Locality: Cerchiara Mine, Northern Apennines, Italy
;
_chemical_formula_sum 'Ca (Mn.94 Al.06) Si O5'
_cell_length_a 5.838
_cell_length_b 7.224
_cell_length_c 8.690
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 366.490
_symmetry_space_group_name_H-M 'P 21 21 21'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '-x,1/2+y,1/2-z'
  '1/2+x,1/2-y,-z'
  '1/2-x,-y,1/2+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
Ca   0.02160   0.37480   0.67410   1.00000   0.00720
Mn   0.74680   0.25700   0.99640   0.94000   0.00430
Al   0.74680   0.25700   0.99640   0.06000   0.00430
Si   0.51030   0.63070   0.81640   1.00000   0.00540
O1   0.49130   0.45340   0.93360   1.00000   0.00600
O2   0.57160   0.79950   0.93970   1.00000   0.00850
O3   0.27290   0.65860   0.72180   1.00000   0.00620
O4   0.73880   0.62340   0.70680   1.00000   0.00700
O5   0.00330   0.39430   0.94140   1.00000   0.00560