#------------------------------------------------------------------------------
#$Date: 2008-11-20 19:58:43 +0000 (Thu, 20 Nov 2008) $
#$Revision: 481 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000554.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_2000554
_journal_name_full 'Acta Crystallographica Section C'
_journal_year  1992
_journal_volume 48
_journal_page_first  1866
_journal_page_last  1868
loop_
_publ_author_name
 'Hua, H.'
 'Roche, D.'
 'Bharathi, S.N.'
 'Wu, X.'
 'Robinson, P.D.'
_chemical_formula_sum  'C18 H19 O3 P1'
_chemical_formula_weight  314.32
_symmetry_cell_setting  monoclinic
_symmetry_space_group_name_H-M  'P 21/n'
_symmetry_space_group_name_Hall  ?
_cell_length_a  5.726(6)
_cell_length_b  14.234(7)
_cell_length_c  20.080(10)
_cell_angle_alpha  90.
_cell_angle_beta  92.54(7)
_cell_angle_gamma  90.
_cell_volume  1635(4)
_cell_formula_units_Z  4
_exptl_crystal_density_diffrn  1.277
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  664
_exptl_absorpt_coefficient_mu  0.171
_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) .0949(4) .6692(2) .67460(10)
 P(2) .16970(10)
      .63227(6) .74656(4)
 O(3) .0947(3) .71210(10)
         .79560(10)
 C(4) -.1395(6) .7525(2) .7857(2)
 C(5) -.1667(6) .7892(2) .7149(2)
 C(6) -.1336(6) .7131(3) .6625(2)
 O(7) .4203(4) .6129(2) .75360(10)
 C(8) -.1670(6) .8280(2) .8368(2)
 C(9) -.0074(6) .8988(3) .8457(2)
 C(10) -.0365(8) .9689(3) .8910(2)
 C(11) -.2307(8) .9678(3) .9290(2)
 C(12) -.3909(7) .8978(4) .9205(2)
 C(13) -.3602(6) .8277(3) .8745(2)
 C(14) -.1427(6) .7544(3) .5933(2)
 C(15) .0337(7) .8100(3) .5717(2)
 C(16) .0170(10)
      .8518(4) .5108(2)
 C(17) -.1760(10)
       .8394(4) .4702(2)
 C(18) -.3530(10)
       .7840(4) .4894(2)
 C(19) -.3404(7) .7402(3) .5518(2)
 C(20) -.0089(6) .5325(2) .7625(2)
 C(21) .0330(7) .4966(3) .8313(2)
 C(22) -.1180(10)
       .4973(3) .8768(2)
 H(4) -.2527 .7049 .7919
 H(5a) -.3191 .8149 .7083
 H(5b) -.0537 .8370 .7091
 H(6) -.2526 .6670 .6656
 H(9) .1272 .8992 .8197
 H(10) .0758 1.0178 .8963
 H(11) -.2528 1.0158 .9611
 H(12) -.5253 .8972 .9466
 H(13) -.4733 .7792 .8688
 H(15) .1700 .8194 .5996
 H(16) .1409 .8901 .4966
 H(17) -.1871 .8697 .4281
 H(18) -.4869 .7748 .4604
 H(19) -.4645 .7015 .5656
 H(20a) -.1686 .5500 .7565
 H(20b) .0253 .4841 .7318
 H(21) .1829 .4711 .8426
 H(22a) -.0780 .4730 .9198
 H(22b) -.2700 .5222 .8674