# generated using pymatgen
data_TiPb3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.52869373
_cell_length_b   6.53834477
_cell_length_c   5.84271978
_cell_angle_alpha   90.09554625
_cell_angle_beta   90.05229692
_cell_angle_gamma   119.95115798
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiPb3
_chemical_formula_sum   'Ti2 Pb6'
_cell_volume   216.09854911
_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
  Ti  Ti0  1  0.33334900  0.66660100  0.74550500  1.0
  Ti  Ti1  1  0.66681800  0.33338700  0.25414300  1.0
  Pb  Pb2  1  0.17127200  0.34253900  0.24944000  1.0
  Pb  Pb3  1  0.65729500  0.82902400  0.24979600  1.0
  Pb  Pb4  1  0.17166800  0.82950300  0.24921600  1.0
  Pb  Pb5  1  0.82875200  0.65725600  0.75048000  1.0
  Pb  Pb6  1  0.34289300  0.17090400  0.75095900  1.0
  Pb  Pb7  1  0.82795000  0.17078000  0.75045800  1.0