data_global _amcsd_formula_title 'O15 Ti8' loop_ _publ_author_name 'le Page Y' 'Strobel P' _journal_name_full 'Journal of Solid State Chemistry' _journal_volume 44 _journal_year 1982 _journal_page_first 273 _journal_page_last 281 _publ_section_title ; Structural chemistry of the Magneli phases Tin O(2n-1), 4<=n<=9 _cod_database_code 1008197 ; _database_code_amcsd 0016133 _chemical_formula_sum 'Ti8 O15' _cell_length_a 5.526 _cell_length_b 7.133 _cell_length_c 44.059 _cell_angle_alpha 66.54 _cell_angle_beta 57.18 _cell_angle_gamma 108.51 _cell_volume 966.863 _exptl_crystal_density_diffrn 4.280 _symmetry_space_group_name_H-M 'I -1' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,1/2+z' '-x,-y,-z' '1/2-x,1/2-y,1/2-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ti1 0.00490 0.00533 0.03234 Ti2 0.03156 0.02307 0.09580 Ti3 0.05726 0.05485 0.15976 Ti4 0.09216 0.04119 0.22722 Ti5 0.01200 0.50575 0.03236 Ti6 0.03377 0.52580 0.09657 Ti7 0.05330 0.54622 0.16141 Ti8 0.09541 0.54753 0.22520 O1 0.99210 0.69460 0.05492 O2 0.99600 0.70470 0.12063 O3 0.92710 0.67590 0.19678 O4 0.01280 0.31200 0.01151 O5 0.03280 0.32630 0.07661 O6 0.06270 0.34300 0.14043 O7 0.03460 0.31470 0.21074 O8 0.61080 0.81550 0.03858 O9 0.62310 0.83050 0.10511 O10 0.64300 0.84590 0.16930 O11 0.62150 0.84290 0.23719 O12 0.40160 0.19700 0.02702 O13 0.41080 0.19770 0.09383 O14 0.41990 0.19600 0.16018 O15 0.44580 0.18260 0.22525