#------------------------------------------------------------------------------ #$Date: 2008-01-26 13:05:32 +0000 (Sat, 26 Jan 2008) $ #$Revision: 19 $ #$URL: svn://www.crystallography.net/cod/cif/2/2000736.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_2000736 _journal_name_full 'Acta Cryst.' _journal_year 1992 _journal_volume C48 _journal_page_first 1179 _journal_page_last 1182 loop_ _publ_author_name 'Le Lay, L.' 'Powell, D.R.' 'Willis, T.C.' _chemical_formula_sum 'Mo6 S8 Sn0.854' _chemical_formula_weight 933.5 _symmetry_cell_setting trigonal _symmetry_space_group_name_H-M 'R -3 {rhombohedral axes}' _symmetry_space_group_name_Hall '-P 3*' _cell_length_a 6.5100(10) _cell_length_b 6.5100(10) _cell_length_c 6.5100(10) _cell_angle_alpha 89.47(2) _cell_angle_beta 89.47(2) _cell_angle_gamma 89.47(2) _cell_volume 275.86(7) _cell_formula_units_Z 1 _exptl_crystal_density_diffrn 5.619 _exptl_crystal_density_meas ? _exptl_crystal_F_000 422.70 _exptl_absorpt_coefficient_mu 9.777 _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 Sn(1) .0 .0 .0 .0318(4) Mo(1) .22508(8) .41614(7) .56111(8) .0067(2) S(1) .3791(2) .1262(2) .7443(2) .0095(4) S(2) .2408(2) .2408(2) .2408(2) .0107(3)