# generated using pymatgen
data_Th3TcSn3Ir2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.55543981
_cell_length_b   7.55543944
_cell_length_c   4.15048891
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999733
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3TcSn3Ir2
_chemical_formula_sum   'Th3 Tc1 Sn3 Ir2'
_cell_volume   205.18678187
_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
  Th  Th0  1  0.41160120  0.41160120  0.50000000  1.0
  Th  Th1  1  0.58839880  1.00000000  0.50000000  1.0
  Th  Th2  1  1.00000000  0.58839880  0.50000000  1.0
  Tc  Tc3  1  0.00000000  0.00000000  0.50000000  1.0
  Sn  Sn4  1  0.75131872  0.75131872  0.00000000  1.0
  Sn  Sn5  1  0.24868128  0.00000000  0.00000000  1.0
  Sn  Sn6  1  0.00000000  0.24868128  0.00000000  1.0
  Ir  Ir7  1  0.66666700  0.33333300  0.00000000  1.0
  Ir  Ir8  1  0.33333300  0.66666700  0.00000000  1.0