# generated using pymatgen
data_Zr2Tc3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12512389
_cell_length_b   5.12512374
_cell_length_c   8.91853213
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999475
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Tc3Ir
_chemical_formula_sum   'Zr4 Tc6 Ir2'
_cell_volume   202.87697445
_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
  Zr  Zr0  1  0.33333300  0.66666700  0.43057343  1.0
  Zr  Zr1  1  0.66666700  0.33333300  0.56942657  1.0
  Zr  Zr2  1  0.66666700  0.33333300  0.93057343  1.0
  Zr  Zr3  1  0.33333300  0.66666700  0.06942657  1.0
  Tc  Tc4  1  0.82840388  0.17159612  0.25000000  1.0
  Tc  Tc5  1  0.82840388  0.65680977  0.25000000  1.0
  Tc  Tc6  1  0.34319023  0.17159612  0.25000000  1.0
  Tc  Tc7  1  0.17159612  0.82840388  0.75000000  1.0
  Tc  Tc8  1  0.17159612  0.34319023  0.75000000  1.0
  Tc  Tc9  1  0.65680977  0.82840388  0.75000000  1.0
  Ir  Ir10  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir11  1  0.00000000  0.00000000  0.00000000  1.0