# generated using pymatgen
data_LiTa2Re
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.60562803
_cell_length_b   12.60312381
_cell_length_c   12.60312463
_cell_angle_alpha   66.30050143
_cell_angle_beta   65.11780426
_cell_angle_gamma   65.11779889
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTa2Re
_chemical_formula_sum   'Li1 Ta2 Re1'
_cell_volume   1333.58098705
_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
  Li  Li0  1  -0.00000000  -0.00000000  0.00000000  1
  Ta  Ta1  1  0.71424382  0.00000000  1.00000000  1
  Ta  Ta2  1  0.28575618  1.00000000  0.00000000  1
  Re  Re3  1  0.50000000  -0.00000000  0.00000000  1
