# generated using pymatgen data_Tm3ZrIn3Ir2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.82920873 _cell_length_b 7.62423461 _cell_length_c 3.95920714 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 121.38281629 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3ZrIn3Ir2 _chemical_formula_sum 'Tm3 Zr1 In3 Ir2' _cell_volume 201.75820130 _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 0.31053653 0.24775393 0.50000000 1.0 Tm Tm1 1 0.73405401 0.03538243 0.50000000 1.0 Tm Tm2 1 0.94803059 0.71090304 0.50000000 1.0 Zr Zr3 1 0.09717737 0.42422831 0.00000000 1.0 In In4 1 0.58535031 0.65858370 0.00000000 1.0 In In5 1 0.32544148 0.91667356 0.00000000 1.0 In In6 1 0.67776075 0.33618549 0.00000000 1.0 Ir Ir7 1 0.31846024 0.64658461 0.50000000 1.0 Ir Ir8 1 0.00318773 0.02370494 0.00000000 1.0