# generated using pymatgen
data_Sc3TcP3Ru2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.62949431
_cell_length_b   6.68384510
_cell_length_c   3.52361207
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.27156994
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3TcP3Ru2
_chemical_formula_sum   'Sc3 Tc1 P3 Ru2'
_cell_volume   134.84365887
_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
  Sc  Sc0  1  0.40615443  0.40737176  0.50000000  1.0
  Sc  Sc1  1  0.59384557  0.00121734  0.50000000  1.0
  Sc  Sc2  1  1.00000000  0.59403914  0.50000000  1.0
  Tc  Tc3  1  0.00000000  0.24488709  0.00000000  1.0
  P  P4  1  0.66585163  0.33348297  0.00000000  1.0
  P  P5  1  0.33414837  0.66763234  0.00000000  1.0
  P  P6  1  1.00000000  0.99611820  0.50000000  1.0
  Ru  Ru7  1  0.24455021  0.99990118  0.00000000  1.0
  Ru  Ru8  1  0.75544979  0.75535097  0.00000000  1.0