# generated using pymatgen
data_Li2TcP2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.99281603
_cell_length_b   3.99281603
_cell_length_c   5.84642801
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TcP2Ir
_chemical_formula_sum   'Li2 Tc1 P2 Ir1'
_cell_volume   93.20714519
_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  0.50000000  0.34787619  1.0
  Li  Li1  1  0.50000000  0.00000000  0.65212381  1.0
  Tc  Tc2  1  0.50000000  0.50000000  0.00000000  1.0
  P  P3  1  0.00000000  0.50000000  0.78710258  1.0
  P  P4  1  0.50000000  0.00000000  0.21289742  1.0
  Ir  Ir5  1  0.00000000  0.00000000  0.00000000  1.0