#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000232.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_2000232
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  2216
_journal_page_last  2218
loop_
_publ_author_name
 'Kirschbaum, K.'
 'Giolando, D.M.'
_chemical_formula_sum  'C6 H7 Cl3 Ti1'
_chemical_formula_weight  233.38
_symmetry_cell_setting  triclinic
_symmetry_space_group_name_H-M  'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_cell_length_a  6.8620(10)
_cell_length_b  6.923(2)
_cell_length_c  11.215(2)
_cell_angle_alpha  82.650(10)
_cell_angle_beta  83.270(10)
_cell_angle_gamma  61.300(10)
_cell_volume  462(3)
_cell_formula_units_Z  2
_exptl_crystal_density_diffrn  1.68
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  232
_exptl_absorpt_coefficient_mu  1.72
_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
 Ti .35273(7) .04280(7) .27021(4)
 Cl(1) .63000(10)
    .12680(10)
    .25409(9)
 Cl(2) .15990(10)
    .22720(10)
    .11044(7)
 Cl(3) .1339(2) .2384(2) .42028(8)
 C(1) .2559(5) -.2369(5) .3190(3)
 C(2) .4163(6) -.2689(5) .3959(3)
 C(3) .6080(5) -.3152(5) .3264(4)
 C(4) .5710(5) -.3103(5) .2084(4)
 C(5) .3505(4) -.2683(4) .2031(3)
 C(6) .2419(7) -.2644(6) .0959(4)
 H(1) .103(4) -.196(5) .345(3)
 H(2) .408(5) -.254(6) .479(3)
 H(3) .737(5) -.345(5) .354(3)
 H(4) .636(4) -.314(5) .149(3)
 H(5) .253(6) -.428(7) .086(4)
 H(6) .277(7) -.218(8) .020(5)
 H(7) .034(6) -.140(8) .120(4)
 C* .4403 -.2799 .2906