#------------------------------------------------------------------------------
#$Date: 2008-01-26 13:05:32 +0000 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000152.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_2000152
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  2653
_journal_page_last  2654
loop_
_publ_author_name
 'Yu, K.-B.'
 'Gou, S.-H.'
 'You, X.-Z.'
 'Xu, Z.'
_chemical_formula_moiety  '2(C5 H4 F3 O2),C10 H8 N2,Cu1'
_chemical_formula_sum  'C20 H16 Cu1 F6 N2 O4'
_chemical_formula_weight  525.55
_symmetry_cell_setting  orthorhombic
_symmetry_space_group_name_H-M  'P n n m'
_symmetry_space_group_name_Hall  '-P 2 2n'
_cell_length_a  8.3790(10)
_cell_length_b  8.3790(10)
_cell_length_c  15.832(4)
_cell_angle_alpha  90
_cell_angle_beta  90
_cell_angle_gamma  90
_cell_volume  1111.6(4)
_cell_formula_units_Z  1
_exptl_crystal_density_diffrn  1.568
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  530
_exptl_absorpt_coefficient_mu  1.059
_diffrn_radiation_type  Mo
_diffrn_radiation_wavelength  0.71073
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
 Cu .0 .0 .0 .0550(10)
 N .2009(5) .2013(5) .0 .072(2)
 O -.1207(3) .1205(3) .0854(2) .0660(10)
 C1 .3525(7) .1671(7) .0 .106(3)
 C2 .4728(6) .2776(7) .0 .099(3)
 C3 .4371(6) .4373(6) .0 .055(2)
 C4 .2778(7) .4731(6) .0 .100(3)
 C5 .1674(7) .3516(7) .0 .105(3)
 C6 -.1028(4) .1030(4) .1641(3) .066(3)
 C7 .0 .0 .2040(4) .069(2)
 C8 -.2102(7) .2096(7) .2173(4) .099(2)
 F1 -.3520(8) .1855(12) .1949(5) .161(4)
 F2 -.1948(10) .1958(10) .2943(4) .147(4)
 F3 -.1849(12) .3523(8) .1953(5) .159(4)