# generated using pymatgen
data_LaMo12PbSe16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.80043961
_cell_length_b   9.80043961
_cell_length_c   9.80043951
_cell_angle_alpha   58.86237697
_cell_angle_beta   58.86237697
_cell_angle_gamma   58.86238205
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMo12PbSe16
_chemical_formula_sum   'La1 Mo12 Pb1 Se16'
_cell_volume   648.32655953
_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  0.50000000  0.50000000  0.50000000  1.0
  Mo  Mo1  1  0.87181000  0.55040000  0.68881400  1.0
  Mo  Mo2  1  0.37248400  0.04972100  0.18905300  1.0
  Mo  Mo3  1  0.55040000  0.68881400  0.87181000  1.0
  Mo  Mo4  1  0.04972100  0.18905300  0.37248400  1.0
  Mo  Mo5  1  0.68881400  0.87181000  0.55040000  1.0
  Mo  Mo6  1  0.18905300  0.37248400  0.04972100  1.0
  Mo  Mo7  1  0.62751600  0.95027900  0.81094700  1.0
  Mo  Mo8  1  0.12819000  0.44960000  0.31118600  1.0
  Mo  Mo9  1  0.95027900  0.81094700  0.62751600  1.0
  Mo  Mo10  1  0.44960000  0.31118600  0.12819000  1.0
  Mo  Mo11  1  0.81094700  0.62751600  0.95027900  1.0
  Mo  Mo12  1  0.31118600  0.12819000  0.44960000  1.0
  Pb  Pb13  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se14  1  0.37720100  0.00272000  0.74366600  1.0
  Se  Se15  1  0.87565700  0.50420200  0.24555700  1.0
  Se  Se16  1  0.00272000  0.74366600  0.37720100  1.0
  Se  Se17  1  0.50420200  0.24555700  0.87565700  1.0
  Se  Se18  1  0.74366600  0.37720100  0.00272000  1.0
  Se  Se19  1  0.24555700  0.87565700  0.50420200  1.0
  Se  Se20  1  0.12434300  0.49579800  0.75444300  1.0
  Se  Se21  1  0.62279900  0.99728000  0.25633400  1.0
  Se  Se22  1  0.49579800  0.75444300  0.12434300  1.0
  Se  Se23  1  0.99728000  0.25633400  0.62279900  1.0
  Se  Se24  1  0.75444300  0.12434300  0.49579800  1.0
  Se  Se25  1  0.25633400  0.62279900  0.99728000  1.0
  Se  Se26  1  0.62096200  0.62096200  0.62096200  1.0
  Se  Se27  1  0.12170300  0.12170300  0.12170300  1.0
  Se  Se28  1  0.87829700  0.87829700  0.87829700  1.0
  Se  Se29  1  0.37903800  0.37903800  0.37903800  1.0