# generated using pymatgen
data_Ce3Sc2Tc2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.54501556
_cell_length_b   7.74510068
_cell_length_c   7.72750224
_cell_angle_alpha   120.07536862
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3Sc2Tc2Ru
_chemical_formula_sum   'Ce6 Sc4 Tc4 Ru2'
_cell_volume   338.98243148
_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
  Ce  Ce0  1  0.75000000  0.76078225  0.75423946  1.0
  Ce  Ce1  1  0.25000000  0.23921775  0.24576054  1.0
  Ce  Ce2  1  0.75000000  0.00654280  0.24576054  1.0
  Ce  Ce3  1  0.25000000  0.99345720  0.75423946  1.0
  Ce  Ce4  1  0.75000000  0.24445972  0.00000000  1.0
  Ce  Ce5  1  0.25000000  0.75554028  1.00000000  1.0
  Sc  Sc6  1  0.00000000  0.66429826  0.32859452  1.0
  Sc  Sc7  1  0.00000000  0.33570174  0.67140548  1.0
  Sc  Sc8  1  0.50000000  0.33570174  0.67140548  1.0
  Sc  Sc9  1  0.50000000  0.66429826  0.32859452  1.0
  Tc  Tc10  1  0.75000000  0.36568302  0.36660758  1.0
  Tc  Tc11  1  0.25000000  0.63431698  0.63339242  1.0
  Tc  Tc12  1  0.75000000  0.99907544  0.63339242  1.0
  Tc  Tc13  1  0.25000000  0.00092456  0.36660758  1.0
  Ru  Ru14  1  0.75000000  0.63257864  1.00000000  1.0
  Ru  Ru15  1  0.25000000  0.36742136  0.00000000  1.0