# generated using pymatgen
data_TiFeGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.09806104
_cell_length_b   10.98631984
_cell_length_c   6.40637558
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiFeGe
_chemical_formula_sum   'Ti12 Fe12 Ge12'
_cell_volume   499.57921824
_cell_formula_units_Z   12
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
  Ti  Ti0  1  0.01487000  0.25000000  0.22642400  1
  Ti  Ti1  1  0.51487000  0.25000000  0.27357600  1
  Ti  Ti2  1  0.16385500  0.25000000  0.49880500  1
  Ti  Ti3  1  0.66385500  0.25000000  0.00119500  1
  Ti  Ti4  1  0.55001400  0.75000000  0.30351700  1
  Ti  Ti5  1  0.05001400  0.75000000  0.19648300  1
  Ti  Ti6  1  0.51487000  0.75000000  0.72642400  1
  Ti  Ti7  1  0.01487000  0.75000000  0.77357600  1
  Ti  Ti8  1  0.66385500  0.75000000  0.99880500  1
  Ti  Ti9  1  0.16385500  0.75000000  0.50119500  1
  Ti  Ti10  1  0.05001400  0.25000000  0.80351700  1
  Ti  Ti11  1  0.55001400  0.25000000  0.69648300  1
  Fe  Fe12  1  0.00116400  0.00000000  0.00000000  1
  Fe  Fe13  1  0.00116400  0.50000000  0.00000000  1
  Fe  Fe14  1  0.37218100  0.53768700  0.12319900  1
  Fe  Fe15  1  0.87218100  0.96231300  0.37680100  1
  Fe  Fe16  1  0.87218100  0.53768700  0.37680100  1
  Fe  Fe17  1  0.37218100  0.96231300  0.12319900  1
  Fe  Fe18  1  0.50116400  0.50000000  0.50000000  1
  Fe  Fe19  1  0.50116400  0.00000000  0.50000000  1
  Fe  Fe20  1  0.87218100  0.03768700  0.62319900  1
  Fe  Fe21  1  0.37218100  0.46231300  0.87680100  1
  Fe  Fe22  1  0.37218100  0.03768700  0.87680100  1
  Fe  Fe23  1  0.87218100  0.46231300  0.62319900  1
  Ge  Ge24  1  0.25425300  0.25000000  0.03199400  1
  Ge  Ge25  1  0.75425300  0.25000000  0.46800600  1
  Ge  Ge26  1  0.24584200  0.50606000  0.33268800  1
  Ge  Ge27  1  0.74584200  0.99394000  0.16731200  1
  Ge  Ge28  1  0.74584200  0.50606000  0.16731200  1
  Ge  Ge29  1  0.24584200  0.99394000  0.33268800  1
  Ge  Ge30  1  0.75425300  0.75000000  0.53199400  1
  Ge  Ge31  1  0.25425300  0.75000000  0.96800600  1
  Ge  Ge32  1  0.74584200  0.00606000  0.83268800  1
  Ge  Ge33  1  0.24584200  0.49394000  0.66731200  1
  Ge  Ge34  1  0.24584200  0.00606000  0.66731200  1
  Ge  Ge35  1  0.74584200  0.49394000  0.83268800  1
