# generated using pymatgen
data_TiSiNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.14702418
_cell_length_b   3.65718864
_cell_length_c   7.01542592
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiSiNi
_chemical_formula_sum   'Ti4 Si4 Ni4'
_cell_volume   157.71257645
_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
  Ti  Ti0  1  0.25000000  0.52266000  0.31933100  1
  Ti  Ti1  1  0.75000000  0.97734000  0.81933100  1
  Ti  Ti2  1  0.75000000  0.47734000  0.68066900  1
  Ti  Ti3  1  0.25000000  0.02266000  0.18066900  1
  Si  Si4  1  0.75000000  0.73390800  0.12214000  1
  Si  Si5  1  0.25000000  0.26609200  0.87786000  1
  Si  Si6  1  0.25000000  0.76609200  0.62214000  1
  Si  Si7  1  0.75000000  0.23390800  0.37786000  1
  Ni  Ni8  1  0.75000000  0.35870600  0.06012000  1
  Ni  Ni9  1  0.75000000  0.85870600  0.43988000  1
  Ni  Ni10  1  0.25000000  0.64129400  0.93988000  1
  Ni  Ni11  1  0.25000000  0.14129400  0.56012000  1
