# generated using pymatgen
data_ThAl2ZnCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.21352590
_cell_length_b   4.21352590
_cell_length_c   10.38691334
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThAl2ZnCu
_chemical_formula_sum   'Th2 Al4 Zn2 Cu2'
_cell_volume   184.40718769
_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  0.00000000  0.50000000  0.25291636  1.0
  Th  Th1  1  0.50000000  0.00000000  0.74708364  1.0
  Al  Al2  1  0.00000000  0.00000000  0.50000000  1.0
  Al  Al3  1  0.50000000  0.50000000  0.50000000  1.0
  Al  Al4  1  0.00000000  0.50000000  0.85989963  1.0
  Al  Al5  1  0.50000000  0.00000000  0.14010037  1.0
  Zn  Zn6  1  0.00000000  0.00000000  0.00000000  1.0
  Zn  Zn7  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu8  1  0.00000000  0.50000000  0.62835497  1.0
  Cu  Cu9  1  0.50000000  0.00000000  0.37164503  1.0