# generated using pymatgen
data_Sc3Ni11Ge4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.07399297
_cell_length_b   8.07399297
_cell_length_c   8.42927700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99718918
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Ni11Ge4
_chemical_formula_sum   'Sc6 Ni22 Ge8'
_cell_volume   475.89373982
_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
  Sc  Sc0  1  0.80331400  0.60670800  0.75000000  1.0
  Sc  Sc1  1  0.80330600  0.19669400  0.75000000  1.0
  Sc  Sc2  1  0.39329200  0.19668600  0.75000000  1.0
  Sc  Sc3  1  0.19668600  0.39329200  0.25000000  1.0
  Sc  Sc4  1  0.19669400  0.80330600  0.25000000  1.0
  Sc  Sc5  1  0.60670800  0.80331400  0.25000000  1.0
  Ni  Ni6  1  0.84589900  0.69195900  0.09332100  1.0
  Ni  Ni7  1  0.84599400  0.15400600  0.09338500  1.0
  Ni  Ni8  1  0.30804100  0.15410100  0.09332100  1.0
  Ni  Ni9  1  0.15410100  0.30804100  0.90667900  1.0
  Ni  Ni10  1  0.15400600  0.84599400  0.90661500  1.0
  Ni  Ni11  1  0.69195900  0.84589900  0.90667900  1.0
  Ni  Ni12  1  0.15410100  0.30804100  0.59332100  1.0
  Ni  Ni13  1  0.15400600  0.84599400  0.59338500  1.0
  Ni  Ni14  1  0.69195900  0.84589900  0.59332100  1.0
  Ni  Ni15  1  0.84589900  0.69195900  0.40667900  1.0
  Ni  Ni16  1  0.84599400  0.15400600  0.40661500  1.0
  Ni  Ni17  1  0.30804100  0.15410100  0.40667900  1.0
  Ni  Ni18  1  0.43596400  0.87195100  0.75000000  1.0
  Ni  Ni19  1  0.43596400  0.56403600  0.75000000  1.0
  Ni  Ni20  1  0.12804900  0.56403600  0.75000000  1.0
  Ni  Ni21  1  0.56403600  0.12804900  0.25000000  1.0
  Ni  Ni22  1  0.56403600  0.43596400  0.25000000  1.0
  Ni  Ni23  1  0.87195100  0.43596400  0.25000000  1.0
  Ni  Ni24  1  0.66666700  0.33333300  0.50522400  1.0
  Ni  Ni25  1  0.33333300  0.66666700  0.49477600  1.0
  Ni  Ni26  1  0.33333300  0.66666700  0.00522400  1.0
  Ni  Ni27  1  0.66666700  0.33333300  0.99477600  1.0
  Ge  Ge28  1  0.50000000  0.00000000  0.50000000  1.0
  Ge  Ge29  1  0.50000000  0.50000000  0.50000000  1.0
  Ge  Ge30  1  0.00000000  0.50000000  0.50000000  1.0
  Ge  Ge31  1  0.50000000  0.00000000  0.00000000  1.0
  Ge  Ge32  1  0.50000000  0.50000000  0.00000000  1.0
  Ge  Ge33  1  0.00000000  0.50000000  0.00000000  1.0
  Ge  Ge34  1  0.99998000  0.00002000  0.75000000  1.0
  Ge  Ge35  1  0.00002000  0.99998000  0.25000000  1.0