#------------------------------------------------------------------------------
#$Date: 2011-09-28 16:24:46 +0200 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/01/2100121.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_2100121
_journal_name_full  'Acta Crystallographica, Section B'
_journal_year  2005
_journal_volume  61
_journal_page_first  359
_journal_page_last  359
loop_
_publ_author_name
  'Richard E. Marsh'
_publ_section_title
;
Space group P1: an update
;
_[local]_cod_chemical_formula_sum_orig 'not given'
_symmetry_space_group_name_H-M  'P n a 21'
_space_group_crystal_system  orthorhombic
_cell_length_a  29.2070
_cell_length_b  4.5240
_cell_length_c  7.3390
_cell_angle_alpha  90
_cell_angle_beta  90
_cell_angle_gamma  90
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_type_symbol
  Si1 0.06175 0.68930 0.48205 Si
  H1 0.09112 0.79225 0.35575 H
  H2 0.06442 0.39250 0.48875 H
  H3 0.07267 0.80250 0.64600 H
  O1 -0.02888 0.67567 0.54978 O
  C1 0.00191 0.80175 0.42020 C
  H4 -0.00083 1.02425 0.42155 H
  H5 -0.00580 0.72900 0.29400 H
  C2 -0.07445 0.76152 0.51512 C
  H6 -0.09408 0.68350 0.60875 H
  H7 -0.08390 0.68650 0.39850 H
  H8 -0.07648 0.97350 0.51475 H
  Si3 0.18843 0.22443 0.50998 Si
  H17 0.15792 0.32500 0.63925 H
  H18 0.18565 -0.07950 0.49825 H
  H19 0.17790 0.34750 0.34300 H
  O3 0.27906 0.23442 0.43957 O
  C5 0.24796 0.33330 0.57667 C
  H20 0.24985 0.54100 0.58880 H
  H21 0.25560 0.24725 0.68975 H
  C6 0.32425 0.33147 0.47745 C
  H22 0.34343 0.26950 0.38700 H
  H23 0.33365 0.25450 0.58625 H
  H24 0.32478 0.53300 0.48350 H
_cod_database_code 2100121