# generated using pymatgen
data_ThGa3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50158061
_cell_length_b   6.50158210
_cell_length_c   4.49649011
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001358
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThGa3
_chemical_formula_sum   'Th2 Ga6'
_cell_volume   164.60469468
_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  0.33333300  0.66666600  0.74999900  1.0
  Th  Th1  1  0.66666700  0.33333300  0.24999900  1.0
  Ga  Ga2  1  0.14031183  0.28062467  0.24999900  1.0
  Ga  Ga3  1  0.71937533  0.85968817  0.24999900  1.0
  Ga  Ga4  1  0.14031283  0.85968817  0.24999900  1.0
  Ga  Ga5  1  0.85968717  0.71937433  0.74999900  1.0
  Ga  Ga6  1  0.28062367  0.14031183  0.74999900  1.0
  Ga  Ga7  1  0.85968817  0.14031183  0.74999900  1.0