# generated using pymatgen data_LaPr3NdIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.33862774 _cell_length_b 11.33862774 _cell_length_c 6.58117666 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaPr3NdIr3 _chemical_formula_sum 'La4 Pr12 Nd4 Ir12' _cell_volume 846.10554885 _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 0.09400399 0.29086837 0.10946443 1.0 La La1 1 0.79086837 0.40599601 0.10946443 1.0 La La2 1 0.20913163 0.59400399 0.10946443 1.0 La La3 1 0.90599601 0.70913163 0.10946443 1.0 Pr Pr4 1 0.40962470 0.79306568 0.38952858 1.0 Pr Pr5 1 0.59037530 0.20693432 0.38952858 1.0 Pr Pr6 1 0.29306568 0.09037530 0.38952858 1.0 Pr Pr7 1 0.70693432 0.90962470 0.38952858 1.0 Pr Pr8 1 0.41069432 0.20845382 0.88738701 1.0 Pr Pr9 1 0.70845382 0.08930568 0.88738701 1.0 Pr Pr10 1 0.29154618 0.91069432 0.88738701 1.0 Pr Pr11 1 0.58930568 0.79154618 0.88738701 1.0 Pr Pr12 1 0.08955713 0.70809225 0.61009687 1.0 Pr Pr13 1 0.91044287 0.29190775 0.61009687 1.0 Pr Pr14 1 0.20809225 0.41044287 0.61009687 1.0 Pr Pr15 1 0.79190775 0.58955713 0.61009687 1.0 Nd Nd16 1 0.00000000 0.00000000 0.00007622 1.0 Nd Nd17 1 0.50000000 0.50000000 0.00007622 1.0 Nd Nd18 1 0.50000000 0.50000000 0.50178604 1.0 Nd Nd19 1 0.00000000 0.00000000 0.50178604 1.0 Ir Ir20 1 0.15333690 0.84952111 0.25221230 1.0 Ir Ir21 1 0.34952111 0.34666310 0.25221230 1.0 Ir Ir22 1 0.65047889 0.65333690 0.25221230 1.0 Ir Ir23 1 0.84666310 0.15047889 0.25221230 1.0 Ir Ir24 1 0.34491553 0.65189434 0.75149755 1.0 Ir Ir25 1 0.15189434 0.15508447 0.75149755 1.0 Ir Ir26 1 0.84810566 0.84491553 0.75149755 1.0 Ir Ir27 1 0.65508447 0.34810566 0.75149755 1.0 Ir Ir28 1 0.00000000 0.50000000 0.36771205 1.0 Ir Ir29 1 0.50000000 0.00000000 0.12182928 1.0 Ir Ir30 1 0.50000000 0.00000000 0.62425276 1.0 Ir Ir31 1 0.00000000 0.50000000 0.88173841 1.0