# generated using pymatgen data_Ti5O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.46606644 _cell_length_b 9.01539977 _cell_length_c 9.00719503 _cell_angle_alpha 68.33839465 _cell_angle_beta 94.88058384 _cell_angle_gamma 94.83147245 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti5O8 _chemical_formula_sum 'Ti15 O24' _cell_volume 410.35302618 _cell_formula_units_Z 3 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ti Ti0 1 0.67633023 0.06814801 0.07165091 1.0 Ti Ti1 1 0.20015508 0.06923327 0.59376714 1.0 Ti Ti2 1 0.30323774 0.17387469 0.17368453 1.0 Ti Ti3 1 0.81161854 0.17328797 0.67236437 1.0 Ti Ti4 1 0.30630069 0.42192321 0.42041440 1.0 Ti Ti5 1 0.19509994 0.59302410 0.06676139 1.0 Ti Ti6 1 0.18950672 0.32095701 0.82663700 1.0 Ti Ti7 1 0.69269623 0.32745143 0.32485004 1.0 Ti Ti8 1 0.81069941 0.67312152 0.17344066 1.0 Ti Ti9 1 0.19705115 0.83166146 0.32341573 1.0 Ti Ti10 1 0.30501063 0.67338548 0.67311030 1.0 Ti Ti11 1 0.80641571 0.42207017 0.92582873 1.0 Ti Ti12 1 0.69047175 0.57778366 0.57782142 1.0 Ti Ti13 1 0.68193661 0.82960822 0.83749765 1.0 Ti Ti14 1 0.80796040 0.92630996 0.42367433 1.0 O O15 1 0.15753815 0.03328623 0.37822612 1.0 O O16 1 0.99634273 0.21552262 0.03241189 1.0 O O17 1 0.65728974 0.12737661 0.27912680 1.0 O O18 1 0.16322339 0.14168374 0.76643147 1.0 O O19 1 0.99910272 0.27980038 0.46575091 1.0 O O20 1 0.67622508 0.03363693 0.87207303 1.0 O O21 1 0.34352001 0.37965012 0.21333148 1.0 O O22 1 0.50004603 0.21882763 0.52878284 1.0 O O23 1 0.16022313 0.62781938 0.28154360 1.0 O O24 1 0.49801089 0.28048235 0.96755260 1.0 O O25 1 0.34041776 0.46938730 0.62358240 1.0 O O26 1 0.85143296 0.46687690 0.12756702 1.0 O O27 1 0.15208553 0.53032090 0.87399467 1.0 O O28 1 0.65645506 0.53040323 0.37620426 1.0 O O29 1 0.99808012 0.72000791 0.53268715 1.0 O O30 1 0.50918439 0.70985639 0.03616518 1.0 O O31 1 0.84044311 0.37496429 0.71965246 1.0 O O32 1 0.64856871 0.62463847 0.78463173 1.0 O O33 1 0.50151900 0.78089800 0.46830656 1.0 O O34 1 0.97563027 0.76841091 0.96483138 1.0 O O35 1 0.35516579 0.96894398 0.14005968 1.0 O O36 1 0.34993858 0.87103477 0.70934963 1.0 O O37 1 0.84635216 0.87488834 0.22055115 1.0 O O38 1 0.84062287 0.96646645 0.62928941 1.0