# generated using pymatgen
data_Th2Zr3(SiGe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.46092490
_cell_length_b   7.33964354
_cell_length_c   7.52699890
_cell_angle_alpha   70.35973636
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Zr3(SiGe)2
_chemical_formula_sum   'Th4 Zr6 Si4 Ge4'
_cell_volume   388.20228213
_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  0.67427408  0.93380039  0.69506397  1.0
  Th  Th1  1  0.32572592  0.06619961  0.30493603  1.0
  Th  Th2  1  0.17427408  0.56619961  0.30493603  1.0
  Th  Th3  1  0.82572592  0.43380039  0.69506397  1.0
  Zr  Zr4  1  0.67176776  0.74570537  0.24447778  1.0
  Zr  Zr5  1  0.32823224  0.25429463  0.75552222  1.0
  Zr  Zr6  1  0.17176776  0.75429463  0.75552222  1.0
  Zr  Zr7  1  0.82823224  0.24570537  0.24447778  1.0
  Zr  Zr8  1  0.00000000  0.00000000  0.00000000  1.0
  Zr  Zr9  1  0.50000000  0.50000000  0.00000000  1.0
  Si  Si10  1  0.87525523  0.62629671  0.99818143  1.0
  Si  Si11  1  0.12474477  0.37370329  0.00181857  1.0
  Si  Si12  1  0.37525523  0.87370329  0.00181857  1.0
  Si  Si13  1  0.62474477  0.12629671  0.99818143  1.0
  Ge  Ge14  1  0.95943899  0.85620546  0.41344568  1.0
  Ge  Ge15  1  0.04056101  0.14379454  0.58655432  1.0
  Ge  Ge16  1  0.45943899  0.64379454  0.58655432  1.0
  Ge  Ge17  1  0.54056101  0.35620546  0.41344568  1.0