#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000151.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_2000151
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  2649
_journal_page_last  2651
loop_
_publ_author_name
 'Kociok-Kohn, G.'
 'Pickardt, J.'
 'Schumann, H.'
_chemical_formula_moiety  'C28 H42 O2,C8 H20 O2,Li1'
_chemical_formula_sum  'C36 H62 Li2 O4'
_chemical_formula_weight  572.77
_symmetry_cell_setting  triclinic
_symmetry_space_group_name_H-M  'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_cell_length_a  10.188(8)
_cell_length_b  11.202(9)
_cell_length_c  9.220(5)
_cell_angle_alpha  99.92(6)
_cell_angle_beta  113.39(5)
_cell_angle_gamma  68.31(7)
_cell_volume  897.02
_cell_formula_units_Z  1
_exptl_crystal_density_diffrn  1.06
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  316
_exptl_absorpt_coefficient_mu  0.035
_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
 Li .0457(8) .4178(6) .4111(8)
 O(1) -.0473(3) .5913(2) .3869(3)
 O(2) .1146(4) .2773(3) .2798(4)
 C(1) -.0865(4) .7044(3) .3237(4)
 C(2) -.2386(4) .7639(4) .2196(4)
 C(3) -.2784(5) .8868(4) .1729(5)
 C(4) -.1747(6) .9514(5) .2215(6)
 C(5) -.0283(6) .8908(4) .3119(5)
 C(6) .0217(4) .7665(4) .3604(4)
 C(7) -.3561(4) .6948(4) .1582(5)
 C(8) -.2972(7) .5675(5) .0771(7)
 C(9) -.3963(7) .6766(6) .2951(7)
 C(10) -.5039(6) .7738(6) .0350(7)
 C(11) .1910(5) .6985(4) .4525(5)
 C(12) .2519(7) .5745(5) .3657(8)
 C(13) .2884(7) .7811(6) .4682(8)
 C(14) .2185(7) .6716(6) .6208(6)
 C(15) .1961(8) .1500(5) .3350(8)
 C(16) .3425(9) .0950(7) .3081(10)
 C(17) .0565(8) .2809(6) .1074(7)
 C(18) -.0687(9) .2233(7) .0321(7)
 H(3) -.394(6)   .941(5)   .106(6)
 H(4) -.204(4)   1.034(4)   .185(5)
 H(5) .040(5)   .934(4)   .341(5)
 H(81) -.352(6)   .519(5)   .053(6)
 H(82) -.214(6)   .511(5)   .138(6)
 H(83) -.275(6)   .580(5)   -.015(7)
 H(91) .320(6)   .379(5)   .635(6)
 H(92) .465(5)   .358(4)   .739(5)
 H(93) -.445(6)   .765(5)   .338(6)
 H(101) -.559(6)   .862(5)   .086(6)
 H(102) -.410(8)   .800(6)   .059(9)
 H(103) -.568(7)   .731(5)   .003(7)
 H(121) .193(6)   .518(5)   .340(6)
 H(122) .340(7)   .531(6)   .420(7)
 H(123) .237(7)   .600(6)   .261(8)
 H(131) .263(6)   .858(5)   .526(7)
 H(132) .265(6)   .809(5)   .360(7)
 H(133) .394(7)   .729(5)   .527(6)
 H(141) .322(6)   .650(4)   .678(5)
 H(142) .179(6)   .751(5)   .665(6)
 H(143) -.187(5)   .399(4)   .377(5)
 H(151) .221(7)   .154(6)   .442(8)
 H(152) .124(7)   .098(6)   .244(8)
 H(161) .3227 .0892 .1978
 H(162) .3958 .0117 .3506
 H(163) .4022 .1490 .3585
 H(171) .032(7)   .372(7)   .090(8)
 H(172) .182(9)   .250(6)   .152(8)
 H(181) -.0303 .1354 .0582
 H(182) -.1061 .2298 -.0795
 H(183) -.1486 .2684 .0701