# generated using pymatgen
data_TmPa(SiIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11262466
_cell_length_b   6.88419303
_cell_length_c   7.48324424
_cell_angle_alpha   88.76489830
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmPa(SiIr)2
_chemical_formula_sum   'Tm2 Pa2 Si4 Ir4'
_cell_volume   211.81715045
_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  0.75000000  0.99348939  0.68445261  1.0
  Tm  Tm1  1  0.25000000  0.00651061  0.31554739  1.0
  Pa  Pa2  1  0.25000000  0.50398164  0.17827106  1.0
  Pa  Pa3  1  0.75000000  0.49601836  0.82172894  1.0
  Si  Si4  1  0.25000000  0.80036934  0.88879722  1.0
  Si  Si5  1  0.75000000  0.19963066  0.11120278  1.0
  Si  Si6  1  0.75000000  0.71436059  0.39409943  1.0
  Si  Si7  1  0.25000000  0.28563941  0.60590057  1.0
  Ir  Ir8  1  0.25000000  0.65280593  0.57914368  1.0
  Ir  Ir9  1  0.75000000  0.34719407  0.42085632  1.0
  Ir  Ir10  1  0.75000000  0.83929277  0.06900090  1.0
  Ir  Ir11  1  0.25000000  0.16070723  0.93099910  1.0