# generated using pymatgen
data_Sc3Tc2P3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74342920
_cell_length_b   6.74343031
_cell_length_c   3.44135645
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.37497467
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Tc2P3Ru
_chemical_formula_sum   'Sc3 Tc2 P3 Ru1'
_cell_volume   135.01081380
_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  0.40353941  0.40353941  0.50000000  1.0
  Sc  Sc1  1  0.59683092  0.00117222  0.50000000  1.0
  Sc  Sc2  1  0.00117222  0.59683092  0.50000000  1.0
  Tc  Tc3  1  0.99930743  0.24743309  0.00000000  1.0
  Tc  Tc4  1  0.24743309  0.99930743  0.00000000  1.0
  P  P5  1  0.66685337  0.33353242  0.00000000  1.0
  P  P6  1  0.33353242  0.66685337  0.00000000  1.0
  P  P7  1  0.99940083  0.99940083  0.50000000  1.0
  Ru  Ru8  1  0.75193030  0.75193030  0.00000000  1.0