# generated using pymatgen
data_Tm3(SiIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.48117451
_cell_length_b   5.48117483
_cell_length_c   13.10571553
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   136.98622394
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3(SiIr)2
_chemical_formula_sum   'Tm6 Si4 Ir4'
_cell_volume   268.59832604
_cell_formula_units_Z   2
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  0.77868937  0.22131063  0.60475319  1.0
  Tm  Tm1  1  0.51239566  0.48760434  0.25000000  1.0
  Tm  Tm2  1  0.22131063  0.77868937  0.39524681  1.0
  Tm  Tm3  1  0.77868937  0.22131063  0.89524681  1.0
  Tm  Tm4  1  0.48760434  0.51239566  0.75000000  1.0
  Tm  Tm5  1  0.22131063  0.77868937  0.10475319  1.0
  Si  Si6  1  0.06610134  0.93389866  0.59018569  1.0
  Si  Si7  1  0.06610134  0.93389866  0.90981431  1.0
  Si  Si8  1  0.93389866  0.06610134  0.40981431  1.0
  Si  Si9  1  0.93389866  0.06610134  0.09018569  1.0
  Ir  Ir10  1  0.80550467  0.19449533  0.25000000  1.0
  Ir  Ir11  1  0.19449533  0.80550467  0.75000000  1.0
  Ir  Ir12  1  0.50000000  0.50000000  0.00000000  1.0
  Ir  Ir13  1  0.50000000  0.50000000  0.50000000  1.0