# generated using pymatgen
data_CaLa4PPb3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.65498730
_cell_length_b   9.65498616
_cell_length_c   7.18868784
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000049
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaLa4PPb3
_chemical_formula_sum   'Ca2 La8 P2 Pb6'
_cell_volume   580.34148564
_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
  Ca  Ca0  1  0.66666700  0.33333300  0.50000000  1.0
  Ca  Ca1  1  0.33333300  0.66666700  0.50000000  1.0
  La  La2  1  0.76115271  0.76115271  0.25083836  1.0
  La  La3  1  0.23884729  0.00000000  0.25083836  1.0
  La  La4  1  1.00000000  0.23884729  0.25083836  1.0
  La  La5  1  0.23884729  0.23884729  0.74916164  1.0
  La  La6  1  0.76115271  1.00000000  0.74916164  1.0
  La  La7  1  0.00000000  0.76115271  0.74916164  1.0
  La  La8  1  0.33333300  0.66666700  0.00000000  1.0
  La  La9  1  0.66666700  0.33333300  0.00000000  1.0
  P  P10  1  0.00000000  0.00000000  0.50000000  1.0
  P  P11  1  0.00000000  0.00000000  0.00000000  1.0
  Pb  Pb12  1  0.40219877  0.40219877  0.24422120  1.0
  Pb  Pb13  1  0.59780123  1.00000000  0.24422120  1.0
  Pb  Pb14  1  0.00000000  0.59780123  0.24422120  1.0
  Pb  Pb15  1  0.59780123  0.59780123  0.75577880  1.0
  Pb  Pb16  1  0.40219877  0.00000000  0.75577880  1.0
  Pb  Pb17  1  1.00000000  0.40219877  0.75577880  1.0