# generated using pymatgen data_Ti8V11Si16W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.30215911 _cell_length_b 6.43133378 _cell_length_c 12.25189208 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.01445204 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti8V11Si16W _chemical_formula_sum 'Ti8 V11 Si16 W1' _cell_volume 496.58495940 _cell_formula_units_Z 1 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 0.49263697 0.67177482 0.59261359 1.0 Ti Ti1 1 0.99368168 0.82702248 0.90706868 1.0 Ti Ti2 1 0.50750172 0.32744106 0.09103917 1.0 Ti Ti3 1 0.00740598 0.17217051 0.40901075 1.0 Ti Ti4 1 0.50750172 0.32744106 0.40896083 1.0 Ti Ti5 1 0.00740598 0.17217051 0.09098925 1.0 Ti Ti6 1 0.49263697 0.67177482 0.90738641 1.0 Ti Ti7 1 0.99368168 0.82702248 0.59293132 1.0 V V8 1 0.66157004 0.16834590 0.62544053 1.0 V V9 1 0.16188001 0.33208550 0.87467649 1.0 V V10 1 0.33653754 0.83236594 0.12413746 1.0 V V11 1 0.83828943 0.66717053 0.37549031 1.0 V V12 1 0.33653754 0.83236594 0.37586254 1.0 V V13 1 0.83828943 0.66717053 0.12450969 1.0 V V14 1 0.66157004 0.16834590 0.87455947 1.0 V V15 1 0.16188001 0.33208550 0.62532351 1.0 V V16 1 0.83821859 0.49120967 0.75000000 1.0 V V17 1 0.33821678 0.00853693 0.75000000 1.0 V V18 1 0.16202784 0.50831499 0.25000000 1.0 Si Si19 1 0.67381766 0.95915687 0.46305417 1.0 Si Si20 1 0.17359353 0.53909438 0.03851949 1.0 Si Si21 1 0.32598786 0.03959503 0.96038084 1.0 Si Si22 1 0.82631820 0.46008640 0.53938416 1.0 Si Si23 1 0.32598786 0.03959503 0.53961916 1.0 Si Si24 1 0.82631820 0.46008640 0.96061584 1.0 Si Si25 1 0.67381766 0.95915687 0.03694583 1.0 Si Si26 1 0.17359353 0.53909438 0.46148051 1.0 Si Si27 1 0.46327990 0.38564867 0.75000000 1.0 Si Si28 1 0.96341574 0.11428669 0.75000000 1.0 Si Si29 1 0.53426801 0.61244156 0.25000000 1.0 Si Si30 1 0.04054329 0.88267027 0.25000000 1.0 Si Si31 1 0.69835450 0.85413114 0.75000000 1.0 Si Si32 1 0.19854777 0.64541709 0.75000000 1.0 Si Si33 1 0.29678403 0.14974568 0.25000000 1.0 Si Si34 1 0.80529616 0.35928164 0.25000000 1.0 W W35 1 0.66260313 0.99569782 0.25000000 1.0