#------------------------------------------------------------------------------ #$Date: 2008-11-24 12:28:37 +0200 (Mon, 24 Nov 2008) $ #$Revision: 490 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/2000245.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_2000245 _journal_name_full 'Acta Cryst. C' _journal_year 1991 _journal_volume 47 _journal_page_first 1791 _journal_page_last 1794 loop_ _publ_author_name 'Gougeon, P.' 'Potel, M.' 'Sergent, M.' _chemical_formula_sum 'Mo15 Se19' _chemical_formula_weight 2939.34 _symmetry_cell_setting trigonal _symmetry_space_group_name_H-M 'R -3 c {rhombohedral axes}' _symmetry_space_group_name_Hall '-P 3* 2n' _cell_length_a 20.3600(10) _cell_length_b ? _cell_length_c ? _cell_angle_alpha 26.9810(10) _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 1532.20(10) _cell_formula_units_Z 2 _exptl_crystal_density_diffrn 6.371 _exptl_crystal_density_meas ? _exptl_crystal_F_000 2552 _exptl_absorpt_coefficient_mu 281.28 _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 _atom_site_U_iso_or_equiv Mo1 0.49818(4) 0.69255(4) 0.36968(4) ? Mo2 0.22468(4) 0.04038(4) 0.36761(4) ? Mo3 0.41300(10) 0.0870(10) 0.250 ? Se1 0.18482(4) 0.80685(4) 0.55594(4) ? Se2 0.54368(5) 0.91827(5) 0.18296(5) ? Se3 0.0641(2) 0.43590(10) 0.75 ? Se4 0.44577(3) 0.44577(3) 0.44577(3) ? Se5 0.17689(3) 0.17689(3) 0.17689(3) ?