# generated using pymatgen
data_Th2CuTe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.39622640
_cell_length_b   6.23681213
_cell_length_c   10.54199947
_cell_angle_alpha   81.24994935
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2CuTe6
_chemical_formula_sum   'Th2 Cu1 Te6'
_cell_volume   285.68107256
_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  0.50000000  0.29560942  0.33489574  1.0
  Th  Th1  1  0.00000000  0.71035065  0.66608037  1.0
  Cu  Cu2  1  0.00000000  0.40609982  0.96380964  1.0
  Te  Te3  1  -0.00000000  0.23670798  0.55774772  1.0
  Te  Te4  1  0.50000000  0.76755351  0.44282450  1.0
  Te  Te5  1  -0.00000000  0.09534014  0.16108485  1.0
  Te  Te6  1  0.50000000  0.90053437  0.83837680  1.0
  Te  Te7  1  -0.00000000  0.59066406  0.16678068  1.0
  Te  Te8  1  0.50000000  0.39293904  0.83469971  1.0