# generated using pymatgen
data_Ti2NbZn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.92032459
_cell_length_b   12.92032459
_cell_length_c   12.92032459
_cell_angle_alpha   133.95820970
_cell_angle_beta   124.18727537
_cell_angle_gamma   75.16518456
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2NbZn
_chemical_formula_sum   'Ti2 Nb1 Zn1'
_cell_volume   1251.37812962
_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
  Ti  Ti0  1  0.00000000  0.27897700  0.27897700  1.0
  Ti  Ti1  1  0.00000000  0.72102300  0.72102300  1.0
  Nb  Nb2  1  0.00000000  0.50000000  0.50000000  1.0
  Zn  Zn3  1  0.00000000  0.00000000  0.00000000  1.0