# generated using pymatgen
data_ReTc(IrRu)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.48093073
_cell_length_b   5.47113427
_cell_length_c   4.32135939
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.22640047
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReTc(IrRu)3
_chemical_formula_sum   'Re1 Tc1 Ir3 Ru3'
_cell_volume   111.96631751
_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
  Re  Re0  1  0.33490101  0.67039795  0.75000000  1.0
  Tc  Tc1  1  0.66773677  0.33015720  0.25000000  1.0
  Ir  Ir2  1  0.16562013  0.33339453  0.25000000  1.0
  Ir  Ir3  1  0.83264441  0.66444904  0.75000000  1.0
  Ir  Ir4  1  0.33545036  0.16621419  0.75000000  1.0
  Ru  Ru5  1  0.66637525  0.83544235  0.25000000  1.0
  Ru  Ru6  1  0.16758763  0.83301885  0.25000000  1.0
  Ru  Ru7  1  0.82968445  0.16692690  0.75000000  1.0