# generated using pymatgen
data_Th4MgScSi4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.36559219
_cell_length_b   7.36559219
_cell_length_c   4.38517656
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th4MgScSi4
_chemical_formula_sum   'Th4 Mg1 Sc1 Si4'
_cell_volume   237.90437200
_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  0.67396861  0.18509171  0.50000000  1.0
  Th  Th1  1  0.32603139  0.81490829  0.50000000  1.0
  Th  Th2  1  0.18509171  0.32603139  0.50000000  1.0
  Th  Th3  1  0.81490829  0.67396861  0.50000000  1.0
  Mg  Mg4  1  0.50000000  0.50000000  0.00000000  1.0
  Sc  Sc5  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si6  1  0.10805978  0.62757169  0.00000000  1.0
  Si  Si7  1  0.89194022  0.37242831  0.00000000  1.0
  Si  Si8  1  0.62757169  0.89194022  0.00000000  1.0
  Si  Si9  1  0.37242831  0.10805978  0.00000000  1.0