#------------------------------------------------------------------------------ #$Date: 2008-11-20 19:58:43 +0000 (Thu, 20 Nov 2008) $ #$Revision: 481 $ #$URL: svn://www.crystallography.net/cod/cif/2/2002030.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_2002030 _journal_name_full 'Acta Crystallographica Section C' _journal_year 1993 _journal_volume 49 _journal_page_first 16 _journal_page_last 19 loop_ _publ_author_name 'Deshayes, L.' 'Keller, N.' 'Lance, M.' 'Nierlich, M.' 'Vigner, D.' _chemical_formula_moiety ? _chemical_formula_sum 'C28 H44 N2 O20 U1' _chemical_formula_weight 966.69 _symmetry_cell_setting monoclinic _symmetry_space_group_name_H-M 'P 21/n' _symmetry_space_group_name_Hall ? _cell_length_a 10.891(3) _cell_length_b 8.312(2) _cell_length_c 20.507(6) _cell_angle_alpha 90 _cell_angle_beta 97.21(2) _cell_angle_gamma 90 _cell_volume 1842.0(10) _cell_formula_units_Z 2 _exptl_crystal_density_diffrn 1.74 _exptl_crystal_density_meas ? _exptl_crystal_F_000 956 _exptl_absorpt_coefficient_mu 4.256 _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 U .0 .0 .0 O(21) -.0572(4) .1673(6) -.0464(2) O(22) .1244(4) -.0827(7) -.0843(2) O(23) .2140(4) .1181(7) .0094(3) O(24) .1076(4) .1800(8) .0861(3) O(25) .2894(5) .2841(8) .0861(3) N .2929(5) .6972(8) .4378(3) O(3) .9642(4) .3305(6) .1794(2) O(6) .7639(5) .4414(7) .0972(3) O(9) .6312(4) .1533(7) .0682(3) O(12) .6967(5) -.0299(7) .1825(3) O(15) .9448(5) .0446(6) .2220(2) C(1) 1.0329(7) .1380(9) .2577(4) C(2) 1.0458(6) .2929(9) .2339(3) C(4) .9631(7) .4920(10) .1563(4) C(5) .8843(6) .496(2) .0902(4) C(7) .6910(8) .4110(10) .0360(4) C(8) .5847(8) .3080(10) .0484(4) C(10) .5464(7) .0540(10) .0982(4) C(11) .6136(8) -.0860(10) .1292(4) C(13) .7827(8) -.1490(10) .2077(4) C(14) .8825(8) -.0750(10) .2562(4) C(16) 1.1077(7) .0840(10) .3132(4) C(17) 1.1968(8) .1880(10) .3432(4) C(18) 1.2112(8) .3390(10) .3205(4) C(19) 1.1350(7) .3930(10) .2651(4)