# generated using pymatgen
data_Zr2TcAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.16953630
_cell_length_b   11.16953630
_cell_length_c   11.16953630
_cell_angle_alpha   126.25155430
_cell_angle_beta   117.98999949
_cell_angle_gamma   86.52293618
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2TcAu
_chemical_formula_sum   'Zr2 Tc1 Au1'
_cell_volume   945.16850524
_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
  Zr  Zr0  1  0.00000000  0.22468400  0.22468400  1.0
  Zr  Zr1  1  0.00000000  0.77531600  0.77531600  1.0
  Tc  Tc2  1  0.00000000  0.00000000  0.00000000  1.0
  Au  Au3  1  0.00000000  0.50000000  0.50000000  1.0