# generated using pymatgen data_Ba2CdSi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.71593886 _cell_length_b 11.15206279 _cell_length_c 8.63934644 _cell_angle_alpha 78.83513173 _cell_angle_beta 59.36334315 _cell_angle_gamma 41.80153131 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2CdSi3 _chemical_formula_sum 'Ba8 Cd4 Si12' _cell_volume 664.54906447 _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 Ba Ba0 1 0.12582638 0.12582638 0.37417362 1.0 Ba Ba1 1 0.87582638 0.87582638 0.12417362 1.0 Ba Ba2 1 0.12417362 0.12417362 0.87582638 1.0 Ba Ba3 1 0.37417362 0.37417362 0.12582638 1.0 Ba Ba4 1 0.62232078 0.62232078 0.37767922 1.0 Ba Ba5 1 0.37767922 0.37767922 0.62232078 1.0 Ba Ba6 1 0.62767922 0.62767922 0.87232078 1.0 Ba Ba7 1 0.87232078 0.87232078 0.62767922 1.0 Cd Cd8 1 0.08259992 0.41740008 0.08259992 1.0 Cd Cd9 1 0.16740008 0.83259992 0.16740008 1.0 Cd Cd10 1 0.41740008 0.08259992 0.41740008 1.0 Cd Cd11 1 0.83259992 0.16740008 0.83259992 1.0 Si Si12 1 0.33703440 0.65546786 0.82219003 1.0 Si Si13 1 0.18530671 0.82219003 0.65546786 1.0 Si Si14 1 0.82219003 0.18530671 0.33703440 1.0 Si Si15 1 0.65546786 0.33703440 0.18530671 1.0 Si Si16 1 0.91296560 0.59453214 0.42780997 1.0 Si Si17 1 0.06469329 0.42780997 0.59453214 1.0 Si Si18 1 0.42780997 0.06469329 0.91296560 1.0 Si Si19 1 0.90934893 0.59065107 0.90934893 1.0 Si Si20 1 0.65934893 0.34065107 0.65934893 1.0 Si Si21 1 0.34065107 0.65934893 0.34065107 1.0 Si Si22 1 0.59065107 0.90934893 0.59065107 1.0 Si Si23 1 0.59453214 0.91296560 0.06469329 1.0