# generated using pymatgen data_Tm3Al12Ru3Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.71781812 _cell_length_b 8.71781793 _cell_length_c 9.44035502 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.81200138 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Al12Ru3Rh _chemical_formula_sum 'Tm6 Al24 Ru6 Rh2' _cell_volume 622.52123619 _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 0.80514358 0.19485642 0.75000000 1.0 Tm Tm1 1 0.19485642 0.80514358 0.25000000 1.0 Tm Tm2 1 0.38621468 0.18948513 0.75000000 1.0 Tm Tm3 1 0.61378532 0.81051487 0.25000000 1.0 Tm Tm4 1 0.81051487 0.61378532 0.75000000 1.0 Tm Tm5 1 0.18948513 0.38621468 0.25000000 1.0 Al Al6 1 0.66728471 0.33271529 0.98551004 1.0 Al Al7 1 0.33271529 0.66728471 0.01448996 1.0 Al Al8 1 0.33271529 0.66728471 0.48551004 1.0 Al Al9 1 0.66728471 0.33271529 0.51448996 1.0 Al Al10 1 0.83718922 0.16281078 0.42155048 1.0 Al Al11 1 0.16281078 0.83718922 0.57844952 1.0 Al Al12 1 0.32437180 0.16148993 0.42122559 1.0 Al Al13 1 0.16281078 0.83718922 0.92155048 1.0 Al Al14 1 0.67562820 0.83851007 0.57877441 1.0 Al Al15 1 0.83718922 0.16281078 0.07844952 1.0 Al Al16 1 0.83851007 0.67562820 0.42122559 1.0 Al Al17 1 0.67562820 0.83851007 0.92122559 1.0 Al Al18 1 0.16148993 0.32437180 0.57877441 1.0 Al Al19 1 0.32437180 0.16148993 0.07877441 1.0 Al Al20 1 0.16148993 0.32437180 0.92122559 1.0 Al Al21 1 0.83851007 0.67562820 0.07877441 1.0 Al Al22 1 0.43968698 0.56031302 0.75000000 1.0 Al Al23 1 0.56031302 0.43968698 0.25000000 1.0 Al Al24 1 0.12306433 0.56074090 0.75000000 1.0 Al Al25 1 0.87693567 0.43925910 0.25000000 1.0 Al Al26 1 0.43925910 0.87693567 0.75000000 1.0 Al Al27 1 0.56074090 0.12306433 0.25000000 1.0 Al Al28 1 0.00016088 0.99983912 0.75000000 1.0 Al Al29 1 0.99983912 0.00016088 0.25000000 1.0 Ru Ru30 1 0.00000000 0.50000000 0.00000000 1.0 Ru Ru31 1 0.50000000 0.00000000 0.00000000 1.0 Ru Ru32 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru33 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru34 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru35 1 0.00000000 0.00000000 0.50000000 1.0 Rh Rh36 1 0.50000000 0.50000000 0.00000000 1.0 Rh Rh37 1 0.50000000 0.50000000 0.50000000 1.0