#------------------------------------------------------------------------------
#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/2000243.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_2000243
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  2252
_journal_page_last  2254
loop_
_publ_author_name
 'Ammon, H.L.'
_chemical_formula_sum  'C10 H6 N2 O4'
_chemical_formula_weight  218.2
_symmetry_cell_setting  triclinic
_symmetry_space_group_name_H-M  'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_cell_length_a  7.5552(8)
_cell_length_b  7.7630(10)
_cell_length_c  9.0730(10)
_cell_angle_alpha  110.742(9)
_cell_angle_beta  99.570(9)
_cell_angle_gamma  100.309(9)
_cell_volume  474.1(2)
_cell_formula_units_Z  2
_exptl_crystal_density_diffrn  1.528
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  224
_exptl_absorpt_coefficient_mu  1.05
_diffrn_radiation_type  Cu
_diffrn_radiation_wavelength  1.54178
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
 O1 .2694(6) -.3127(5) .2059(4)
 O2 .2778(6) -.0770(5) .4188(4)
 O3 .6779(4) .4995(4) .4419(3)
 O4 .6418(5) .5701(4) .2343(4)
 N1 .2788(5) -.1446(5) .2785(4)
 N2 .6059(4) .4647(4) .3022(3)
 C1 .3106(4) -.0181(4) .1931(4)
 C2 .4304(5) .1555(5) .2828(4)
 C3 .4699(4) .2791(4) .2062(3)
 C4A .2640(4) .0543(4) -.0463(3)
 C4 .3912(4) .2343(4) .0475(4)
 C5 .1809(5) .0048(5) -.2130(4)
 C6 .0585(5) -.1681(5) -.3032(4)
 C7 .0144(5) -.2977(5) -.2326(4)
 C8A .2212(4) -.0790(4) .0250(3)
 C8 .0917(5) -.2568(5) -.0731(4)
 H2 .483(5) .178(5) .371(5)
 H4 .424(5) .318(5) -.006(4)
 H5 .207(4) .099(4) -.260(3)
 H6 -.006(5) -.197(5) -.411(5)
 H7 -.067(5) -.401(5) -.300(4)
 H8 .062(5) -.348(5) -.038(4)