# generated using pymatgen
data_Tm3In4IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.96924174
_cell_length_b   7.96924216
_cell_length_c   3.54193465
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000636
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3In4IrRu
_chemical_formula_sum   'Tm3 In4 Ir1 Ru1'
_cell_volume   194.80727526
_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  0.29482445  0.25817203  0.50000000  1.0
  Tm  Tm1  1  0.74182797  0.03665241  0.50000000  1.0
  Tm  Tm2  1  0.96334759  0.70517555  0.50000000  1.0
  In  In3  1  0.06382420  0.40385730  0.00000000  1.0
  In  In4  1  0.59614270  0.65996690  0.00000000  1.0
  In  In5  1  0.34003310  0.93617580  0.00000000  1.0
  In  In6  1  0.66666700  0.33333300  0.00000000  1.0
  Ir  Ir7  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru8  1  0.33333300  0.66666700  0.50000000  1.0