# generated using pymatgen data_Sc8Nb11Si16W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.68140784 _cell_length_b 6.89580138 _cell_length_c 13.10063971 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00576068 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Nb11Si16W _chemical_formula_sum 'Sc8 Nb11 Si16 W1' _cell_volume 603.59443494 _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 Sc Sc0 1 0.50220984 0.67426607 0.59560427 1.0 Sc Sc1 1 0.00233219 0.82644455 0.90452196 1.0 Sc Sc2 1 0.49815734 0.32555761 0.09592166 1.0 Sc Sc3 1 0.99851574 0.17395142 0.40416832 1.0 Sc Sc4 1 0.49815734 0.32555761 0.40407834 1.0 Sc Sc5 1 0.99851574 0.17395142 0.09583168 1.0 Sc Sc6 1 0.50220984 0.67426607 0.90439573 1.0 Sc Sc7 1 0.00233219 0.82644455 0.59547804 1.0 Nb Nb8 1 0.66382643 0.17550568 0.62421111 1.0 Nb Nb9 1 0.16381904 0.32441752 0.87525690 1.0 Nb Nb10 1 0.33581445 0.82602359 0.12578120 1.0 Nb Nb11 1 0.83539215 0.67525787 0.37424640 1.0 Nb Nb12 1 0.33581445 0.82602359 0.37421880 1.0 Nb Nb13 1 0.83539215 0.67525787 0.12575360 1.0 Nb Nb14 1 0.66382643 0.17550568 0.87578889 1.0 Nb Nb15 1 0.16381904 0.32441752 0.62474310 1.0 Nb Nb16 1 0.83797860 0.49498658 0.75000000 1.0 Nb Nb17 1 0.33829623 0.00486879 0.75000000 1.0 Nb Nb18 1 0.16157328 0.50474246 0.25000000 1.0 Si Si19 1 0.66725964 0.96733859 0.45883755 1.0 Si Si20 1 0.16754936 0.53301194 0.03921109 1.0 Si Si21 1 0.33252385 0.03290802 0.96120750 1.0 Si Si22 1 0.83280371 0.46769544 0.53906944 1.0 Si Si23 1 0.33252385 0.03290802 0.53879250 1.0 Si Si24 1 0.83280371 0.46769544 0.96093056 1.0 Si Si25 1 0.66725964 0.96733859 0.04116245 1.0 Si Si26 1 0.16754936 0.53301194 0.46078891 1.0 Si Si27 1 0.46077903 0.38721414 0.75000000 1.0 Si Si28 1 0.96040439 0.11287607 0.75000000 1.0 Si Si29 1 0.53930781 0.61272707 0.25000000 1.0 Si Si30 1 0.03538856 0.88976410 0.25000000 1.0 Si Si31 1 0.70640251 0.86440362 0.75000000 1.0 Si Si32 1 0.20625511 0.63575219 0.75000000 1.0 Si Si33 1 0.29868864 0.13501714 0.25000000 1.0 Si Si34 1 0.79316128 0.35879986 0.25000000 1.0 W W35 1 0.66135908 0.99408838 0.25000000 1.0