# generated using pymatgen
data_LaTh3(MgSi2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.34375081
_cell_length_b   7.34375081
_cell_length_c   4.43411382
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.56548408
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTh3(MgSi2)2
_chemical_formula_sum   'La1 Th3 Mg2 Si4'
_cell_volume   239.12310900
_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
  La  La0  1  0.82082911  0.67917089  0.50000000  1.0
  Th  Th1  1  0.67711152  0.17906371  0.50000000  1.0
  Th  Th2  1  0.32093629  0.82288848  0.50000000  1.0
  Th  Th3  1  0.17935984  0.32064016  0.50000000  1.0
  Mg  Mg4  1  0.99953356  0.00004089  0.00000000  1.0
  Mg  Mg5  1  0.49995911  0.50046644  0.00000000  1.0
  Si  Si6  1  0.12305376  0.61400946  0.00000000  1.0
  Si  Si7  1  0.88599054  0.37694624  0.00000000  1.0
  Si  Si8  1  0.61227679  0.88772321  0.00000000  1.0
  Si  Si9  1  0.38094848  0.11905152  0.00000000  1.0