# generated using pymatgen
data_ZrScTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.94446863
_cell_length_b   10.94446863
_cell_length_c   10.94446863
_cell_angle_alpha   127.97778693
_cell_angle_beta   116.48432237
_cell_angle_gamma   86.48505772
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScTc2
_chemical_formula_sum   'Zr1 Sc1 Tc2'
_cell_volume   881.70396027
_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  0.50000000  0.50000000  1.0
  Sc  Sc1  1  0.00000000  0.00000000  0.00000000  1.0
  Tc  Tc2  1  0.00000000  0.25395800  0.25395800  1.0
  Tc  Tc3  1  0.00000000  0.74604200  0.74604200  1.0