#------------------------------------------------------------------------------ #$Date: 2015-09-05 11:20:39 +0300 (Sat, 05 Sep 2015) $ #$Revision: 154371 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/97/1529760.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_1529760 loop_ _publ_author_name 'Chevrel, R.' 'Rossel, C.' 'Sergent, M.' _publ_section_title ; The structure of Sn Mo6 S8 and the superconducting properties of the series Snx Mo6 S8 and My Snx Mo6 S8 (M = La, Ce, Pr, Eu, Gd, Ho, Lu, Y, In, U) ; _journal_name_full 'Journal of the Less-Common Metals' _journal_page_first 31 _journal_page_last 43 _journal_volume 72 _journal_year 1980 _chemical_formula_sum 'Mo6 S8 Sn' _chemical_name_systematic 'Sn Mo6 S8' _space_group_IT_number 148 _symmetry_space_group_name_Hall '-P 3*' _symmetry_space_group_name_H-M 'R -3 :R' _cell_angle_alpha 89.7 _cell_angle_beta 89.7 _cell_angle_gamma 89.7 _cell_formula_units_Z 1 _cell_length_a 6.527 _cell_length_b 6.527 _cell_length_c 6.527 _cell_volume 278.050 _citation_journal_id_ASTM JCOMAH _cod_data_source_file Chevrel_JCOMAH_1980_576.cif _cod_data_source_block Mo6S8Sn1 _cod_cif_authors_sg_Hall '-R 3 (-y+z,x+z,-x+y+z)' _cod_original_cell_volume 278.0501 _cod_chemical_formula_sum_orig 'Mo6 S8 Sn1' _cod_database_code 1529760 loop_ _symmetry_equiv_pos_as_xyz x,y,z z,x,y y,z,x -x,-y,-z -z,-x,-y -y,-z,-x loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv S1 S 0.37939 0.12593 0.74358 1 0.0 S2 S 0.24117 0.24117 0.24117 1 0.0 Sn1 Sn 0 0 0 1 0.0 Mo1 Mo 0.22509 0.41632 0.56109 1 0.0