# generated using pymatgen
data_Tm2NbIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.58348700
_cell_length_b   5.21438208
_cell_length_c   5.58348759
_cell_angle_alpha   57.62943067
_cell_angle_beta   59.99999648
_cell_angle_gamma   57.62942457
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2NbIr3
_chemical_formula_sum   'Tm2 Nb1 Ir3'
_cell_volume   110.65485795
_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  0.75264775  0.74205775  0.75264775  1.0
  Tm  Tm1  1  0.49735225  0.50794225  0.49735225  1.0
  Nb  Nb2  1  0.12500000  0.62500000  0.12500000  1.0
  Ir  Ir3  1  0.12500000  0.12500000  0.62500000  1.0
  Ir  Ir4  1  0.62500000  0.12500000  0.12500000  1.0
  Ir  Ir5  1  0.12500000  0.12500000  0.12500000  1.0