# generated using pymatgen
data_La3Th(CuP)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.90779917
_cell_length_b   8.93479718
_cell_length_c   9.98569660
_cell_angle_alpha   89.77836587
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3Th(CuP)8
_chemical_formula_sum   'La3 Th1 Cu8 P8'
_cell_volume   348.65191271
_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
  La  La0  1  0.25000000  0.25833510  0.67912675  1.0
  La  La1  1  0.75000000  0.74321841  0.32162124  1.0
  La  La2  1  0.25000000  0.75729634  0.82099008  1.0
  Th  Th3  1  0.75000000  0.24193385  0.17929396  1.0
  Cu  Cu4  1  0.75000000  0.08078006  0.45194441  1.0
  Cu  Cu5  1  0.25000000  0.92468952  0.54563164  1.0
  Cu  Cu6  1  0.75000000  0.57427529  0.04935400  1.0
  Cu  Cu7  1  0.25000000  0.41997749  0.94971041  1.0
  Cu  Cu8  1  0.25000000  0.94432536  0.11123205  1.0
  Cu  Cu9  1  0.75000000  0.04919108  0.89377834  1.0
  Cu  Cu10  1  0.25000000  0.45467880  0.39333306  1.0
  Cu  Cu11  1  0.75000000  0.55063732  0.60678134  1.0
  P  P12  1  0.25000000  0.16066805  0.96720101  1.0
  P  P13  1  0.75000000  0.83521994  0.03961007  1.0
  P  P14  1  0.25000000  0.66312915  0.53784242  1.0
  P  P15  1  0.75000000  0.34110545  0.45719438  1.0
  P  P16  1  0.25000000  0.50880482  0.16967247  1.0
  P  P17  1  0.75000000  0.47982335  0.82809762  1.0
  P  P18  1  0.25000000  0.02876230  0.32707040  1.0
  P  P19  1  0.75000000  0.98314732  0.67051235  1.0