# generated using pymatgen
data_Sc5Ge4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.23318329
_cell_length_b   7.17416486
_cell_length_c   13.78569667
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc5Ge4
_chemical_formula_sum   'Sc20 Ge16'
_cell_volume   715.36805241
_cell_formula_units_Z   4
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  0.16122371  0.62066509  0.11925826  1.0
  Sc  Sc1  1  0.33877629  0.12066509  0.38074174  1.0
  Sc  Sc2  1  0.83877629  0.37933491  0.61925826  1.0
  Sc  Sc3  1  0.66122371  0.87933491  0.88074174  1.0
  Sc  Sc4  1  0.83877629  0.37933491  0.88074174  1.0
  Sc  Sc5  1  0.66122371  0.87933491  0.61925826  1.0
  Sc  Sc6  1  0.16122371  0.62066509  0.38074174  1.0
  Sc  Sc7  1  0.33877629  0.12066509  0.11925826  1.0
  Sc  Sc8  1  0.67637443  0.46792100  0.10045103  1.0
  Sc  Sc9  1  0.82362557  0.96792100  0.39954897  1.0
  Sc  Sc10  1  0.32362557  0.53207900  0.60045103  1.0
  Sc  Sc11  1  0.17637443  0.03207900  0.89954897  1.0
  Sc  Sc12  1  0.32362557  0.53207900  0.89954897  1.0
  Sc  Sc13  1  0.17637443  0.03207900  0.60045103  1.0
  Sc  Sc14  1  0.67637443  0.46792100  0.39954897  1.0
  Sc  Sc15  1  0.82362557  0.96792100  0.10045103  1.0
  Sc  Sc16  1  0.49708045  0.78739387  0.25000000  1.0
  Sc  Sc17  1  0.00291955  0.28739387  0.25000000  1.0
  Sc  Sc18  1  0.50291955  0.21260613  0.75000000  1.0
  Sc  Sc19  1  0.99708045  0.71260613  0.75000000  1.0
  Ge  Ge20  1  0.96762100  0.71944805  0.95688369  1.0
  Ge  Ge21  1  0.53237900  0.21944805  0.54311631  1.0
  Ge  Ge22  1  0.03237900  0.28055195  0.45688369  1.0
  Ge  Ge23  1  0.46762100  0.78055195  0.04311631  1.0
  Ge  Ge24  1  0.03237900  0.28055195  0.04311631  1.0
  Ge  Ge25  1  0.46762100  0.78055195  0.45688369  1.0
  Ge  Ge26  1  0.96762100  0.71944805  0.54311631  1.0
  Ge  Ge27  1  0.53237900  0.21944805  0.95688369  1.0
  Ge  Ge28  1  0.38099265  0.42035917  0.25000000  1.0
  Ge  Ge29  1  0.11900735  0.92035917  0.25000000  1.0
  Ge  Ge30  1  0.61900735  0.57964083  0.75000000  1.0
  Ge  Ge31  1  0.88099265  0.07964083  0.75000000  1.0
  Ge  Ge32  1  0.85858639  0.65979444  0.25000000  1.0
  Ge  Ge33  1  0.64141361  0.15979444  0.25000000  1.0
  Ge  Ge34  1  0.14141361  0.34020556  0.75000000  1.0
  Ge  Ge35  1  0.35858639  0.84020556  0.75000000  1.0