# generated using pymatgen data_Ge3Te3Ir2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.87825221 _cell_length_b 7.87825221 _cell_length_c 9.09613592 _cell_angle_alpha 55.00757063 _cell_angle_beta 55.00757063 _cell_angle_gamma 69.83828533 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ge3Te3Ir2 _chemical_formula_sum 'Ge6 Te6 Ir4' _cell_volume 378.79621125 _cell_formula_units_Z 2 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 Ge Ge0 1 0.49406600 0.20915100 0.64799500 1.0 Ge Ge1 1 0.50593400 0.79084900 0.35200500 1.0 Ge Ge2 1 0.79084900 0.50593400 0.35200500 1.0 Ge Ge3 1 0.20915100 0.49406600 0.64799500 1.0 Ge Ge4 1 0.83835000 0.83835000 0.48957200 1.0 Ge Ge5 1 0.16165000 0.16165000 0.51042800 1.0 Te Te6 1 0.85770900 0.85770900 0.78731000 1.0 Te Te7 1 0.14229100 0.14229100 0.21269000 1.0 Te Te8 1 0.67507200 0.32826900 0.83833800 1.0 Te Te9 1 0.32492800 0.67173100 0.16166200 1.0 Te Te10 1 0.32826900 0.67507200 0.83833800 1.0 Te Te11 1 0.67173100 0.32492800 0.16166200 1.0 Ir Ir12 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir13 1 0.50000000 0.00000000 0.00000000 1.0 Ir Ir14 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir15 1 0.00000000 0.50000000 0.00000000 1.0