# generated using pymatgen data_Tb5Ga6P6Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.87584241 _cell_length_b 12.87584272 _cell_length_c 3.96941381 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000172 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5Ga6P6Ir19 _chemical_formula_sum 'Tb5 Ga6 P6 Ir19' _cell_volume 569.91267483 _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 Tb Tb0 1 0.66666700 0.33333300 0.00000000 1.0 Tb Tb1 1 0.33333300 0.66666700 0.00000000 1.0 Tb Tb2 1 0.81652031 0.81223388 0.50000000 1.0 Tb Tb3 1 0.18776612 0.00428643 0.50000000 1.0 Tb Tb4 1 0.99571357 0.18347969 0.50000000 1.0 Ga Ga5 1 0.67741911 0.15859760 0.50000000 1.0 Ga Ga6 1 0.84140240 0.51882151 0.50000000 1.0 Ga Ga7 1 0.48117849 0.32258089 0.50000000 1.0 Ga Ga8 1 0.63525046 0.63591050 0.00000000 1.0 Ga Ga9 1 0.36408950 0.99934095 0.00000000 1.0 Ga Ga10 1 0.00065905 0.36474954 0.00000000 1.0 P P11 1 0.17963493 0.69758985 0.50000000 1.0 P P12 1 0.51795292 0.82036507 0.50000000 1.0 P P13 1 0.30241015 0.48204708 0.50000000 1.0 P P14 1 0.17698496 0.18189807 0.00000000 1.0 P P15 1 0.81810193 0.99508589 0.00000000 1.0 P P16 1 0.00491411 0.82301504 0.00000000 1.0 Ir Ir17 1 0.80745700 0.16965651 0.00000000 1.0 Ir Ir18 1 0.83034349 0.63780049 0.00000000 1.0 Ir Ir19 1 0.36219951 0.19254300 0.00000000 1.0 Ir Ir20 1 0.18251879 0.79495370 0.00000000 1.0 Ir Ir21 1 0.61243490 0.81748121 0.00000000 1.0 Ir Ir22 1 0.20504630 0.38756510 0.00000000 1.0 Ir Ir23 1 0.44656583 0.44132495 0.00000000 1.0 Ir Ir24 1 0.55867505 0.00524088 0.00000000 1.0 Ir Ir25 1 0.99475912 0.55343417 0.00000000 1.0 Ir Ir26 1 0.26960314 0.28247572 0.50000000 1.0 Ir Ir27 1 0.71752428 0.98712742 0.50000000 1.0 Ir Ir28 1 0.01287258 0.73039686 0.50000000 1.0 Ir Ir29 1 0.87322000 0.34928852 0.50000000 1.0 Ir Ir30 1 0.65071148 0.52393148 0.50000000 1.0 Ir Ir31 1 0.47606852 0.12678000 0.50000000 1.0 Ir Ir32 1 0.37115872 0.86927927 0.50000000 1.0 Ir Ir33 1 0.49812155 0.62884128 0.50000000 1.0 Ir Ir34 1 0.13072073 0.50187845 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.00000000 1.0