# generated using pymatgen
data_Th3Mg2SiPb3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.40322225
_cell_length_b   9.40322379
_cell_length_c   6.53594749
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000498
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Mg2SiPb3
_chemical_formula_sum   'Th6 Mg4 Si2 Pb6'
_cell_volume   500.48681074
_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  0.74264745  0.74264745  0.25000000  1.0
  Th  Th1  1  0.25735255  1.00000000  0.25000000  1.0
  Th  Th2  1  0.00000000  0.25735255  0.25000000  1.0
  Th  Th3  1  0.25735255  0.25735255  0.75000000  1.0
  Th  Th4  1  0.74264745  0.00000000  0.75000000  1.0
  Th  Th5  1  0.00000000  0.74264745  0.75000000  1.0
  Mg  Mg6  1  0.66666700  0.33333300  0.50000000  1.0
  Mg  Mg7  1  0.33333300  0.66666700  0.50000000  1.0
  Mg  Mg8  1  0.33333300  0.66666700  0.00000000  1.0
  Mg  Mg9  1  0.66666700  0.33333300  0.00000000  1.0
  Si  Si10  1  0.00000000  0.00000000  0.50000000  1.0
  Si  Si11  1  0.00000000  0.00000000  0.00000000  1.0
  Pb  Pb12  1  0.39485081  0.39485081  0.25000000  1.0
  Pb  Pb13  1  0.60514919  0.00000000  0.25000000  1.0
  Pb  Pb14  1  0.00000000  0.60514919  0.25000000  1.0
  Pb  Pb15  1  0.60514919  0.60514919  0.75000000  1.0
  Pb  Pb16  1  0.39485081  1.00000000  0.75000000  1.0
  Pb  Pb17  1  0.00000000  0.39485081  0.75000000  1.0