#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000742.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_2000742
_journal_name_full  'Acta Cryst.'
_journal_year  1992
_journal_volume  C48
_journal_page_first  1207
_journal_page_last  1209
loop_
_publ_author_name
 'Tyrselova, J.'
 'Pavelcik, F.'
_chemical_formula_moiety  'C6 H18 N2,O6 V2'
_chemical_formula_sum  'C6 H18 N2 O6 V2'
_chemical_formula_weight  316.10
_symmetry_cell_setting  orthorhombic
_symmetry_space_group_name_H-M  'P b c a'
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_cell_length_a  5.379(4)
_cell_length_b  11.074(9)
_cell_length_c  19.582(17)
_cell_angle_alpha  90.
_cell_angle_beta  90.
_cell_angle_gamma  90.
_cell_volume  1166.4(17)
_cell_formula_units_Z  4
_exptl_crystal_density_diffrn  1.800
_exptl_crystal_density_meas  1.760(10)
_exptl_crystal_F_000  648
_exptl_absorpt_coefficient_mu  1.565
_diffrn_radiation_type  Mo
_diffrn_radiation_wavelength  0.71069
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
 V(1) .20980(10)
      .15430(10)
         .20610(10)
 O(1) .02030(10)
      .10570(10)
         .27600(10)
 O(2) .19810(10)
      .30140(10)
         .20100(10)
 O(3) .1058(2) .09720(10)
         .13590(10)
 N(1) .2195(2) .10300(10)
         .83900(10)
 C(1) .4059(2) .01070(10)
         .97240(10)
 C(2) .3735(3) .14040(10)
         .95490(10)
 C(3) .1735(2) .16570(10)
         .90400(10)
 H(1) .237(3)   -.0110(16) .9900(8)
 H(2) .473(3)   -.0256(11) .9295(7)
 H(3) .315(4)   .1727(16) 1.0002(9)
 H(4) .563(3)   .1690(12) .9391(6)
 H(5) -.001(3)   .1407(10) .9217(6)
 H(6) .173(2)   .2444(11) .8943(6)
 H(7) .129(3)   .1348(11) .8041(6)
 H(8) .386(3)   .1097(11) .8227(6)
 H(9) .185(2)   .0314(11) .8414(6)