# generated using pymatgen data_Tm8Sc2Ir5Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.71468715 _cell_length_b 10.67329971 _cell_length_c 6.17589093 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.92319535 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Sc2Ir5Au _chemical_formula_sum 'Tm16 Sc4 Ir10 Au2' _cell_volume 706.28084360 _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 Tm Tm0 1 0.28913175 0.08653725 0.37202734 1.0 Tm Tm1 1 0.28913175 0.91346275 0.87202734 1.0 Tm Tm2 1 0.70088965 0.09085311 0.86945632 1.0 Tm Tm3 1 0.70088965 0.90914689 0.36945632 1.0 Tm Tm4 1 0.57763047 0.78598989 0.87744796 1.0 Tm Tm5 1 0.57763047 0.21401011 0.37744796 1.0 Tm Tm6 1 0.41098143 0.78735747 0.37732727 1.0 Tm Tm7 1 0.41098143 0.21264253 0.87732727 1.0 Tm Tm8 1 0.21324339 0.41437284 0.62085337 1.0 Tm Tm9 1 0.21324339 0.58562716 0.12085337 1.0 Tm Tm10 1 0.78692605 0.41971264 0.12214348 1.0 Tm Tm11 1 0.78692605 0.58028736 0.62214348 1.0 Tm Tm12 1 0.91869548 0.70801254 0.13488400 1.0 Tm Tm13 1 0.91869548 0.29198746 0.63488400 1.0 Tm Tm14 1 0.09356487 0.70603190 0.62307933 1.0 Tm Tm15 1 0.09356487 0.29396810 0.12307933 1.0 Sc Sc16 1 0.01093957 0.99758966 0.50099468 1.0 Sc Sc17 1 0.01093957 0.00241034 0.00099468 1.0 Sc Sc18 1 0.49982294 0.49876849 0.00045660 1.0 Sc Sc19 1 0.49982294 0.50123151 0.50045660 1.0 Ir Ir20 1 0.14961606 0.14974589 0.74966900 1.0 Ir Ir21 1 0.14961606 0.85025411 0.24966900 1.0 Ir Ir22 1 0.65036737 0.34927656 0.74980891 1.0 Ir Ir23 1 0.65036737 0.65072344 0.24980891 1.0 Ir Ir24 1 0.35019702 0.35116689 0.24979355 1.0 Ir Ir25 1 0.35019702 0.64883311 0.74979355 1.0 Ir Ir26 1 0.49893545 0.99970127 0.12044440 1.0 Ir Ir27 1 0.49893545 0.00029873 0.62044440 1.0 Ir Ir28 1 0.00041939 0.50049769 0.87951864 1.0 Ir Ir29 1 0.00041939 0.49950231 0.37951864 1.0 Au Au30 1 0.84863812 0.14985359 0.25209515 1.0 Au Au31 1 0.84863812 0.85014641 0.75209515 1.0