# generated using pymatgen
data_ThURe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45030647
_cell_length_b   5.45030647
_cell_length_c   8.86893700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000574
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThURe4
_chemical_formula_sum   'Th2 U2 Re8'
_cell_volume   228.16237217
_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
  Th  Th0  1  0.66666700  0.33333300  0.43316100  1.0
  Th  Th1  1  0.33333300  0.66666700  0.56683900  1.0
  U  U2  1  0.33333300  0.66666700  0.93869700  1.0
  U  U3  1  0.66666700  0.33333300  0.06130300  1.0
  Re  Re4  1  0.00000000  0.00000000  0.50000000  1.0
  Re  Re5  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re6  1  0.65910900  0.82955500  0.24508800  1.0
  Re  Re7  1  0.17044500  0.82955500  0.24508800  1.0
  Re  Re8  1  0.17044500  0.34089100  0.24508800  1.0
  Re  Re9  1  0.34089100  0.17044500  0.75491200  1.0
  Re  Re10  1  0.82955500  0.17044500  0.75491200  1.0
  Re  Re11  1  0.82955500  0.65910900  0.75491200  1.0