# generated using pymatgen
data_Tm2Si3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.08772655
_cell_length_b   8.08772621
_cell_length_c   7.77036634
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2Si3Ir
_chemical_formula_sum   'Tm8 Si12 Ir4'
_cell_volume   440.17466049
_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  0.51047241  0.02094282  0.25000000  1.0
  Tm  Tm1  1  0.48952759  0.97905718  0.75000000  1.0
  Tm  Tm2  1  0.97905718  0.48952759  0.25000000  1.0
  Tm  Tm3  1  0.02094282  0.51047241  0.75000000  1.0
  Tm  Tm4  1  0.51047241  0.48952759  0.25000000  1.0
  Tm  Tm5  1  0.48952759  0.51047241  0.75000000  1.0
  Tm  Tm6  1  0.00000000  0.00000000  0.25000000  1.0
  Tm  Tm7  1  0.00000000  0.00000000  0.75000000  1.0
  Si  Si8  1  0.16650178  0.33300456  0.00245029  1.0
  Si  Si9  1  0.83349822  0.66699544  0.99754971  1.0
  Si  Si10  1  0.66699544  0.83349822  0.00245029  1.0
  Si  Si11  1  0.83349822  0.66699544  0.50245029  1.0
  Si  Si12  1  0.33300456  0.16650178  0.99754971  1.0
  Si  Si13  1  0.16650178  0.33300456  0.49754971  1.0
  Si  Si14  1  0.16650178  0.83349822  0.00245029  1.0
  Si  Si15  1  0.33300456  0.16650178  0.50245029  1.0
  Si  Si16  1  0.83349822  0.16650178  0.99754971  1.0
  Si  Si17  1  0.66699544  0.83349822  0.49754971  1.0
  Si  Si18  1  0.83349822  0.16650178  0.50245029  1.0
  Si  Si19  1  0.16650178  0.83349822  0.49754971  1.0
  Ir  Ir20  1  0.33333300  0.66666700  0.03374354  1.0
  Ir  Ir21  1  0.66666700  0.33333300  0.96625646  1.0
  Ir  Ir22  1  0.66666700  0.33333300  0.53374354  1.0
  Ir  Ir23  1  0.33333300  0.66666700  0.46625646  1.0