# generated using pymatgen
data_Sc20Cd6TcRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.93433412
_cell_length_b   8.93435967
_cell_length_c   9.22556487
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00017465
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc20Cd6TcRu
_chemical_formula_sum   'Sc20 Cd6 Tc1 Ru1'
_cell_volume   637.74704638
_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  0.00000000  0.00000000  0.50036307  1.0
  Sc  Sc1  1  0.00000000  0.00000000  0.99963693  1.0
  Sc  Sc2  1  0.21063287  0.78936713  0.44322131  1.0
  Sc  Sc3  1  0.21063287  0.42126574  0.44322231  1.0
  Sc  Sc4  1  0.57873426  0.78936713  0.44322331  1.0
  Sc  Sc5  1  0.78949090  0.21051010  0.55813150  1.0
  Sc  Sc6  1  0.78948990  0.57897880  0.55813150  1.0
  Sc  Sc7  1  0.42102120  0.21051010  0.55813150  1.0
  Sc  Sc8  1  0.78949090  0.21051010  0.94186850  1.0
  Sc  Sc9  1  0.78948990  0.57897880  0.94186850  1.0
  Sc  Sc10  1  0.42102120  0.21051010  0.94186850  1.0
  Sc  Sc11  1  0.21063287  0.78936713  0.05677869  1.0
  Sc  Sc12  1  0.21063287  0.42126574  0.05677769  1.0
  Sc  Sc13  1  0.57873426  0.78936713  0.05677669  1.0
  Sc  Sc14  1  0.53905644  0.46094456  0.25000000  1.0
  Sc  Sc15  1  0.53905544  0.07811188  0.25000000  1.0
  Sc  Sc16  1  0.92188812  0.46094456  0.25000000  1.0
  Sc  Sc17  1  0.45980017  0.54019983  0.75000000  1.0
  Sc  Sc18  1  0.45980017  0.91960134  0.75000000  1.0
  Sc  Sc19  1  0.08039866  0.54019983  0.75000000  1.0
  Cd  Cd20  1  0.88574027  0.11426073  0.25000000  1.0
  Cd  Cd21  1  0.88573927  0.77147854  0.25000000  1.0
  Cd  Cd22  1  0.22852046  0.11426073  0.25000000  1.0
  Cd  Cd23  1  0.11419472  0.88580528  0.75000000  1.0
  Cd  Cd24  1  0.11419472  0.22839045  0.75000000  1.0
  Cd  Cd25  1  0.77161055  0.88580528  0.75000000  1.0
  Tc  Tc26  1  0.33333300  0.66666600  0.25000000  1.0
  Ru  Ru27  1  0.66666700  0.33333200  0.75000000  1.0