# generated using pymatgen data_La2Sc3Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.30673834 _cell_length_b 7.63794264 _cell_length_c 14.33032556 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2Sc3Si4 _chemical_formula_sum 'La8 Sc12 Si16' _cell_volume 799.75323426 _cell_formula_units_Z 4 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 La La0 1 0.01139496 0.17147065 0.09788601 1.0 La La1 1 0.98860504 0.82852935 0.90211399 1.0 La La2 1 0.48860504 0.67147065 0.90211399 1.0 La La3 1 0.98860504 0.82852935 0.59788601 1.0 La La4 1 0.51139496 0.32852935 0.09788601 1.0 La La5 1 0.01139496 0.17147065 0.40211399 1.0 La La6 1 0.51139496 0.32852935 0.40211399 1.0 La La7 1 0.48860504 0.67147065 0.59788601 1.0 Sc Sc8 1 0.15991767 0.49600068 0.75000000 1.0 Sc Sc9 1 0.84008233 0.50399932 0.25000000 1.0 Sc Sc10 1 0.34008233 0.99600068 0.25000000 1.0 Sc Sc11 1 0.65991767 0.00399932 0.75000000 1.0 Sc Sc12 1 0.32927032 0.17523359 0.62585436 1.0 Sc Sc13 1 0.67072968 0.82476641 0.37414564 1.0 Sc Sc14 1 0.17072968 0.67523359 0.37414564 1.0 Sc Sc15 1 0.67072968 0.82476641 0.12585436 1.0 Sc Sc16 1 0.82927032 0.32476641 0.62585436 1.0 Sc Sc17 1 0.32927032 0.17523359 0.87414564 1.0 Sc Sc18 1 0.82927032 0.32476641 0.87414564 1.0 Sc Sc19 1 0.17072968 0.67523359 0.12585436 1.0 Si Si20 1 0.03342676 0.12879911 0.75000000 1.0 Si Si21 1 0.96657324 0.87120089 0.25000000 1.0 Si Si22 1 0.46657324 0.62879911 0.25000000 1.0 Si Si23 1 0.53342676 0.37120089 0.75000000 1.0 Si Si24 1 0.29001181 0.88624689 0.75000000 1.0 Si Si25 1 0.70998819 0.11375311 0.25000000 1.0 Si Si26 1 0.20998819 0.38624689 0.25000000 1.0 Si Si27 1 0.79001181 0.61375311 0.75000000 1.0 Si Si28 1 0.14960623 0.46315790 0.53967679 1.0 Si Si29 1 0.85039377 0.53684210 0.46032321 1.0 Si Si30 1 0.35039377 0.96315790 0.46032321 1.0 Si Si31 1 0.85039377 0.53684210 0.03967679 1.0 Si Si32 1 0.64960623 0.03684210 0.53967679 1.0 Si Si33 1 0.14960623 0.46315790 0.96032321 1.0 Si Si34 1 0.64960623 0.03684210 0.96032321 1.0 Si Si35 1 0.35039377 0.96315790 0.03967679 1.0