# generated using pymatgen data_Ca4Sn4IrPd3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.59630912 _cell_length_b 7.36784497 _cell_length_c 7.97390100 _cell_angle_alpha 90.49798831 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca4Sn4IrPd3 _chemical_formula_sum 'Ca4 Sn4 Ir1 Pd3' _cell_volume 270.02510493 _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 Ca Ca0 1 0.75000000 0.47696600 0.81710147 1.0 Ca Ca1 1 0.25000000 0.51677215 0.18429485 1.0 Ca Ca2 1 0.25000000 0.02061920 0.31217360 1.0 Ca Ca3 1 0.75000000 0.98089149 0.68650924 1.0 Sn Sn4 1 0.75000000 0.33017113 0.42328360 1.0 Sn Sn5 1 0.25000000 0.66704229 0.57098780 1.0 Sn Sn6 1 0.75000000 0.83902043 0.07297080 1.0 Sn Sn7 1 0.25000000 0.16711540 0.93155395 1.0 Ir Ir8 1 0.75000000 0.20956769 0.10798750 1.0 Pd Pd9 1 0.75000000 0.70744110 0.39148546 1.0 Pd Pd10 1 0.25000000 0.79023658 0.89123228 1.0 Pd Pd11 1 0.25000000 0.29415654 0.61041845 1.0