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#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9000767.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_9000767
_chemical_name 'Paradamite'
loop_
_publ_author_name
'Bennett T J'
_journal_name_full "American Mineralogist"
_journal_volume 65
_journal_year 1980
_journal_page_first 353
_journal_page_last 354
_publ_section_title
;
 Crystal structure of paradamite
;
_chemical_formula_sum 'Zn2 As O5'
_cell_length_a 5.830
_cell_length_b 6.711
_cell_length_c 5.648
_cell_angle_alpha 104.7
_cell_angle_beta 92.3
_cell_angle_gamma 76.8
_cell_volume 208.061
_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
_atom_site_Uiso_or_equiv
Zn1   0.74990   0.50080   0.39250 ?
Zn2   0.26470   0.18690   0.02140 ?
As   0.75180   0.27600   0.83160 ?
O1   0.03200   0.14000   0.76400   0.02913
O2   0.61200   0.12500   0.94200   0.03040
O3   0.61400   0.33300   0.58100   0.02913
O4   0.25300   0.49800   0.95600   0.02533
O5   0.11200   0.30200   0.35300   0.02153