# generated using pymatgen data_Tm5Ge9P3Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.93941554 _cell_length_b 12.93941527 _cell_length_c 3.95064628 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999822 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Ge9P3Ir19 _chemical_formula_sum 'Tm5 Ge9 P3 Ir19' _cell_volume 572.83309126 _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 Tm Tm0 1 0.33333300 0.66666700 0.50000000 1.0 Tm Tm1 1 0.66666700 0.33333300 0.50000000 1.0 Tm Tm2 1 0.00000000 0.81771654 0.00000000 1.0 Tm Tm3 1 0.18228346 0.18228346 0.00000000 1.0 Tm Tm4 1 0.81771654 0.00000000 0.00000000 1.0 Ge Ge5 1 0.00000000 0.63764471 0.50000000 1.0 Ge Ge6 1 0.36235529 0.36235529 0.50000000 1.0 Ge Ge7 1 0.63764471 0.00000000 0.50000000 1.0 Ge Ge8 1 0.51868469 0.68248744 0.00000000 1.0 Ge Ge9 1 0.31751256 0.83619725 0.00000000 1.0 Ge Ge10 1 0.16380275 0.48131531 0.00000000 1.0 Ge Ge11 1 0.48131531 0.16380275 0.00000000 1.0 Ge Ge12 1 0.68248744 0.51868469 0.00000000 1.0 Ge Ge13 1 0.83619725 0.31751256 0.00000000 1.0 P P14 1 0.00000000 0.17605826 0.50000000 1.0 P P15 1 0.82394174 0.82394174 0.50000000 1.0 P P16 1 0.17605826 0.00000000 0.50000000 1.0 Ir Ir17 1 0.51582370 0.87084481 0.00000000 1.0 Ir Ir18 1 0.12915519 0.64497889 0.00000000 1.0 Ir Ir19 1 0.35502111 0.48417630 0.00000000 1.0 Ir Ir20 1 0.48417630 0.35502111 0.00000000 1.0 Ir Ir21 1 0.87084481 0.51582370 0.00000000 1.0 Ir Ir22 1 0.64497889 0.12915519 0.00000000 1.0 Ir Ir23 1 1.00000000 0.44734950 0.50000000 1.0 Ir Ir24 1 0.55265050 0.55265050 0.50000000 1.0 Ir Ir25 1 0.44734950 1.00000000 0.50000000 1.0 Ir Ir26 1 0.00000000 0.26990213 0.00000000 1.0 Ir Ir27 1 0.73009787 0.73009787 0.00000000 1.0 Ir Ir28 1 0.26990213 0.00000000 0.00000000 1.0 Ir Ir29 1 0.63342524 0.80857513 0.50000000 1.0 Ir Ir30 1 0.19142487 0.82485012 0.50000000 1.0 Ir Ir31 1 0.17514988 0.36657476 0.50000000 1.0 Ir Ir32 1 0.36657476 0.17514988 0.50000000 1.0 Ir Ir33 1 0.80857513 0.63342524 0.50000000 1.0 Ir Ir34 1 0.82485012 0.19142487 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0