# generated using pymatgen data_Tm3Mg(P3Rh4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.90661842 _cell_length_b 11.13665917 _cell_length_c 12.64212199 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Mg(P3Rh4)2 _chemical_formula_sum 'Tm6 Mg2 P12 Rh16' _cell_volume 550.01672856 _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 0.00000000 0.50000000 0.52212750 1.0 Tm Tm1 1 0.50000000 0.00000000 0.47787250 1.0 Tm Tm2 1 0.50000000 0.82127211 0.20614532 1.0 Tm Tm3 1 0.50000000 0.17872789 0.20614532 1.0 Tm Tm4 1 0.00000000 0.67872789 0.79385468 1.0 Tm Tm5 1 0.00000000 0.32127211 0.79385468 1.0 Mg Mg6 1 0.50000000 0.50000000 0.16052453 1.0 Mg Mg7 1 0.00000000 0.00000000 0.83947547 1.0 P P8 1 0.50000000 0.50000000 0.88057649 1.0 P P9 1 0.00000000 0.00000000 0.11942351 1.0 P P10 1 0.50000000 0.50000000 0.35840567 1.0 P P11 1 0.00000000 0.00000000 0.64159433 1.0 P P12 1 0.50000000 0.31376656 0.61830048 1.0 P P13 1 0.50000000 0.68623344 0.61830048 1.0 P P14 1 0.00000000 0.18623344 0.38169952 1.0 P P15 1 0.00000000 0.81376656 0.38169952 1.0 P P16 1 0.50000000 0.83857373 0.88951264 1.0 P P17 1 0.50000000 0.16142627 0.88951264 1.0 P P18 1 0.00000000 0.66142627 0.11048736 1.0 P P19 1 0.00000000 0.33857373 0.11048736 1.0 Rh Rh20 1 0.50000000 0.50000000 0.70215449 1.0 Rh Rh21 1 0.00000000 0.00000000 0.29784551 1.0 Rh Rh22 1 0.00000000 0.50000000 0.98701938 1.0 Rh Rh23 1 0.50000000 0.00000000 0.01298062 1.0 Rh Rh24 1 0.50000000 0.33275128 0.99460136 1.0 Rh Rh25 1 0.50000000 0.66724872 0.99460136 1.0 Rh Rh26 1 0.00000000 0.16724872 0.00539864 1.0 Rh Rh27 1 0.00000000 0.83275128 0.00539864 1.0 Rh Rh28 1 0.50000000 0.29532181 0.43245814 1.0 Rh Rh29 1 0.50000000 0.70467819 0.43245814 1.0 Rh Rh30 1 0.00000000 0.20467819 0.56754186 1.0 Rh Rh31 1 0.00000000 0.79532181 0.56754186 1.0 Rh Rh32 1 0.50000000 0.87261009 0.70983064 1.0 Rh Rh33 1 0.50000000 0.12738991 0.70983064 1.0 Rh Rh34 1 0.00000000 0.62738991 0.29016936 1.0 Rh Rh35 1 0.00000000 0.37261009 0.29016936 1.0