# generated using pymatgen
data_TiNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.89168664
_cell_length_b   3.96696035
_cell_length_c   4.82562680
_cell_angle_alpha   90.00000000
_cell_angle_beta   105.22958986
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNi
_chemical_formula_sum   'Ti2 Ni2'
_cell_volume   53.41171910
_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
  Ti  Ti0  1  0.63045201  0.75000000  0.78292620  1.0
  Ti  Ti1  1  0.36954799  0.25000000  0.21707380  1.0
  Ni  Ni2  1  0.92337785  0.75000000  0.32889776  1.0
  Ni  Ni3  1  0.07662215  0.25000000  0.67110224  1.0