# generated using pymatgen
data_Ca2(LaPb)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.52208391
_cell_length_b   9.52208405
_cell_length_c   7.00658454
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000640
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2(LaPb)3
_chemical_formula_sum   'Ca4 La6 Pb6'
_cell_volume   550.17516877
_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
  Ca  Ca2  1  0.33333300  0.66666700  0.00000000  1.0
  Ca  Ca3  1  0.66666700  0.33333300  0.00000000  1.0
  La  La4  1  0.73719918  0.73719918  0.25000000  1.0
  La  La5  1  0.26280082  0.00000000  0.25000000  1.0
  La  La6  1  0.00000000  0.26280082  0.25000000  1.0
  La  La7  1  0.26280082  0.26280082  0.75000000  1.0
  La  La8  1  0.73719918  1.00000000  0.75000000  1.0
  La  La9  1  1.00000000  0.73719918  0.75000000  1.0
  Pb  Pb10  1  0.38423356  0.38423356  0.25000000  1.0
  Pb  Pb11  1  0.61576644  0.00000000  0.25000000  1.0
  Pb  Pb12  1  0.00000000  0.61576644  0.25000000  1.0
  Pb  Pb13  1  0.61576644  0.61576644  0.75000000  1.0
  Pb  Pb14  1  0.38423356  1.00000000  0.75000000  1.0
  Pb  Pb15  1  1.00000000  0.38423356  0.75000000  1.0