#------------------------------------------------------------------------------
#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/2000257.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_2000257
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  1968
_journal_page_last  1969
loop_
_publ_author_name
 'Sachleben, R.A.'
 'Burns, J.H.'
_chemical_formula_moiety  'LiC20H21O6.0.5(C2H5OH)'
_chemical_formula_sum  'Li2 C42 H47 O13'
_symmetry_cell_setting  monoclinic
_symmetry_space_group_name_H-M  'P21/n'
_symmetry_space_group_name_Hall  ?
_cell_length_a  9.970(4)
_cell_length_b  9.900(2)
_cell_length_c  19.790(10)
_cell_angle_alpha  90
_cell_angle_beta  102.09000
_cell_angle_gamma  90
_cell_volume  1910(2)
_cell_formula_units_Z  4
_exptl_crystal_density_diffrn  1.35
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  820
_exptl_absorpt_coefficient_mu  0.093
_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
 O(1) .8104(2) -.1579(2) .34320(10)
 O(2) .5403(2) -.1447(2) .27290(10)
 O(3) .5024(2) .0655(2) .33990(10)
 O(4) .7727(2) .0547(2) .40730(10)
 O(5) .9489(3) .3235(3) .06390(10)
 O(6A) .3504(4) .3537(4) .5071(2)
 O(6B) .5930(10)
   .6230(10)
  .4472(6)
 O(7B) .6540(10)
   .0120(10)
  .0632(6)
 O(7A) .6030(10)
   .1260(10)
  .0322(6)
 C(1) .8213(4) -.2760(4) .3022(2)
 C(2) .6824(4) -.3419(4) .2843(2)
 C(3) .5735(4) -.2614(4) .2362(2)
 C(4) .4350(3) -.0631(3) .2399(2)
 C(5) .3543(4) -.0863(3) .1754(2)
 C(6) .2488(4) .0025(4) .1489(2)
 C(7) .2256(4) .1126(4) .1858(2)
 C(8) .3086(3) .1397(3) .2503(2)
 C(9) .4129(3) .0510(3) .2772(2)
 C(10) .4925(3) .1846(3) .3795(2)
 C(11) .5948(3) .1757(3) .4477(2)
 C(12) .7433(3) .1772(3) .4398(2)
 C(13) .9070(3) .0303(3) .40440(10)
 C(14) 1.0170(3) .1095(3) .4341(2)
 C(15) 1.1485(3) .0725(4) .4272(2)
 C(16) 1.1684(4) -.0397(4) .3908(2)
 C(17) 1.0581(3) -.1197(4) .3610(2)
 C(18) .9277(3) -.0850(3) .3690(2)
 C(19) .5719(3) .2953(3) .4938(2)
 C(20) .4507(3) .2765(3) .5280(2)
 C(21) .4240(10)
   -.0050(10)
   -.0078(6)
 C(22) .5310(10)
   .0240(10)
  .0371(5)
 Li .6329(5) -.0935(6) .3731(3)
 H1 .886 -.337 .328
 H2 .850 -.251 .261
 H3 .652 -.357 .326
 H4 .692 -.426 .263
 H5 .607 -.233 .197
 H6 .494 -.315 .222
 H7 .371 -.162 .149
 H8 .193 -.014 .105
 H9 .152 .171 .168
 H10 .294 .218 .275
 H11 .402 .192 .388
 H12 .512 .262 .355
 H13 .580 .091 .468
 H14 .758 .252 .412
 H15 .802 .184 .484
 H16 1.004 .189 .459
 H17 1.225 .126 .448
 H18 1.258 -.063 .386
 H19 1.072 -.197 .335
 H20 .557 .374 .466
 H21 .652 .306 .529