# generated using pymatgen
data_PmThCu4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61464463
_cell_length_b   5.61464514
_cell_length_c   5.61464426
_cell_angle_alpha   135.12844648
_cell_angle_beta   97.45615264
_cell_angle_gamma   99.29642197
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PmThCu4
_chemical_formula_sum   'Pm1 Th1 Cu4'
_cell_volume   115.40314605
_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
  Pm  Pm0  1  0.50000000  0.50000000  0.00000000  1.0
  Th  Th1  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu2  1  0.58659388  0.25352433  0.33307055  1.0
  Cu  Cu3  1  0.07954821  0.74647667  0.33307155  1.0
  Cu  Cu4  1  0.92045279  0.25352433  0.66693045  1.0
  Cu  Cu5  1  0.41340612  0.74647667  0.66692945  1.0