#------------------------------------------------------------------------------
#$Date: 2009-11-18 15:56:34 +0100 (Wed, 18 Nov 2009) $
#$Revision: 858 $
#$URL: svn://www.crystallography.net/cod/cif/2/2100064.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_2100064
_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
;
_chemical_formula_sum            'gi n no t ve'
_[local]_cod_chemical_formula_sum_orig 'not given'
_symmetry_space_group_name_H-M 'P -1'
_space_group_crystal_system  triclinic
_cell_length_a  8.7240
_cell_length_b  8.3410
_cell_length_c  6.3350
_cell_angle_alpha  98.15
_cell_angle_beta  85.60
_cell_angle_gamma  105.51
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_type_symbol
  P1 0.23864 0.18644 0.57684 P
  N1 0.30353 0.07723 0.72807 N
  N2 0.26409 0.37701 0.70588 N
  O1 0.31885 0.19533 0.36358 O
  C1 0.02761 0.08743 0.55767 C
  C2 0.20801 -0.03156 0.87514 C
  C3 0.47377 0.12324 0.76371 C
  C4 0.28119 0.51989 0.59005 C
  C5 0.24502 0.41042 0.93767 C
  C6 -0.07464 0.17752 0.63183 C
  H1 0.09781 -0.05626 0.84246 H
  H2 0.23872 -0.13296 0.86308 H
  H3 0.22023 0.02310 1.01771 H
  H4 0.52949 0.19414 0.66438 H
  H5 0.49213 0.18078 0.90560 H
  H6 0.51062 0.02472 0.75097 H
  H7 0.29244 0.48531 0.44069 H
  H8 0.18909 0.56111 0.61667 H
  H9 0.37242 0.60558 0.63436 H
  H10 0.23542 0.31058 0.99949 H
  H11 0.33593 0.49392 0.99208 H
  H12 0.15259 0.44944 0.97439 H
  H13 -0.18639 0.12896 0.62368 H
  H14 -0.03669 0.29146 0.69292 H