# generated using pymatgen data_Tm2HfGa5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.87060034 _cell_length_b 9.27256368 _cell_length_c 11.13195574 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2HfGa5 _chemical_formula_sum 'Tm8 Hf4 Ga20' _cell_volume 605.97374904 _cell_formula_units_Z 4 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 0.88634294 0.50699747 0.35249406 1.0 Tm Tm1 1 0.61365706 0.99300253 0.85249406 1.0 Tm Tm2 1 0.11365706 0.00699747 0.64750594 1.0 Tm Tm3 1 0.38634294 0.49300253 0.14750594 1.0 Tm Tm4 1 0.11365706 0.49300253 0.64750594 1.0 Tm Tm5 1 0.38634294 0.00699747 0.14750594 1.0 Tm Tm6 1 0.88634294 0.99300253 0.35249406 1.0 Tm Tm7 1 0.61365706 0.50699747 0.85249406 1.0 Hf Hf8 1 0.85769097 0.75000000 0.07542188 1.0 Hf Hf9 1 0.64230903 0.75000000 0.57542188 1.0 Hf Hf10 1 0.14230903 0.25000000 0.92457812 1.0 Hf Hf11 1 0.35769097 0.25000000 0.42457812 1.0 Ga Ga12 1 0.87510680 0.05317967 0.08914365 1.0 Ga Ga13 1 0.62489320 0.44682033 0.58914365 1.0 Ga Ga14 1 0.12489320 0.55317967 0.91085635 1.0 Ga Ga15 1 0.37510680 0.94682033 0.41085635 1.0 Ga Ga16 1 0.12489320 0.94682033 0.91085635 1.0 Ga Ga17 1 0.37510680 0.55317967 0.41085635 1.0 Ga Ga18 1 0.87510680 0.44682033 0.08914365 1.0 Ga Ga19 1 0.62489320 0.05317967 0.58914365 1.0 Ga Ga20 1 0.16241495 0.75000000 0.25459243 1.0 Ga Ga21 1 0.33758505 0.75000000 0.75459243 1.0 Ga Ga22 1 0.83758505 0.25000000 0.74540757 1.0 Ga Ga23 1 0.66241495 0.25000000 0.24540757 1.0 Ga Ga24 1 0.39219789 0.75000000 0.00100360 1.0 Ga Ga25 1 0.10780211 0.75000000 0.50100360 1.0 Ga Ga26 1 0.60780211 0.25000000 0.99899640 1.0 Ga Ga27 1 0.89219789 0.25000000 0.49899640 1.0 Ga Ga28 1 0.60466812 0.75000000 0.29330385 1.0 Ga Ga29 1 0.89533188 0.75000000 0.79330385 1.0 Ga Ga30 1 0.39533188 0.25000000 0.70669615 1.0 Ga Ga31 1 0.10466812 0.25000000 0.20669615 1.0