# generated using pymatgen
data_Lu3Tl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66792432
_cell_length_b   6.66792540
_cell_length_c   5.51261170
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999464
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3Tl
_chemical_formula_sum   'Lu6 Tl2'
_cell_volume   212.26063156
_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
  Lu  Lu0  1  0.16830924  0.33661847  0.25000000  1.0
  Lu  Lu1  1  0.66338253  0.83169176  0.25000000  1.0
  Lu  Lu2  1  0.16831024  0.83169176  0.25000000  1.0
  Lu  Lu3  1  0.83168976  0.66338153  0.74999900  1.0
  Lu  Lu4  1  0.33661647  0.16830824  0.74999900  1.0
  Lu  Lu5  1  0.83169076  0.16830824  0.74999900  1.0
  Tl  Tl6  1  0.33333400  0.66666700  0.74999900  1.0
  Tl  Tl7  1  0.66666700  0.33333300  0.25000000  1.0