# generated using pymatgen
data_Ti4Si4Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.67259187
_cell_length_b   5.09878858
_cell_length_c   12.74771158
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4Si4Ni
_chemical_formula_sum   'Ti32 Si32 Ni8'
_cell_volume   1018.68534322
_cell_formula_units_Z   8
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  0.96948300  0.44632700  1
  Ti  Ti1  1  0.25000000  0.53051700  0.94632700  1
  Ti  Ti2  1  0.75000000  0.03051700  0.55367300  1
  Ti  Ti3  1  0.75000000  0.46948300  0.05367300  1
  Ti  Ti4  1  0.75000000  0.84950000  0.03695200  1
  Ti  Ti5  1  0.75000000  0.65050000  0.53695200  1
  Ti  Ti6  1  0.25000000  0.15050000  0.96304800  1
  Ti  Ti7  1  0.25000000  0.34950000  0.46304800  1
  Ti  Ti8  1  0.75000000  0.82075500  0.70977000  1
  Ti  Ti9  1  0.75000000  0.67924500  0.20977000  1
  Ti  Ti10  1  0.25000000  0.17924500  0.29023000  1
  Ti  Ti11  1  0.25000000  0.32075500  0.79023000  1
  Ti  Ti12  1  0.75000000  0.18169700  0.85153800  1
  Ti  Ti13  1  0.75000000  0.31830300  0.35153800  1
  Ti  Ti14  1  0.25000000  0.81830300  0.14846200  1
  Ti  Ti15  1  0.25000000  0.68169700  0.64846200  1
  Ti  Ti16  1  0.75000000  0.23620100  0.05380400  1
  Ti  Ti17  1  0.75000000  0.26379900  0.55380400  1
  Ti  Ti18  1  0.25000000  0.76379900  0.94619600  1
  Ti  Ti19  1  0.25000000  0.73620100  0.44619600  1
  Ti  Ti20  1  0.25000000  0.95666200  0.67824900  1
  Ti  Ti21  1  0.25000000  0.54333800  0.17824900  1
  Ti  Ti22  1  0.75000000  0.04333800  0.32175100  1
  Ti  Ti23  1  0.75000000  0.45666200  0.82175100  1
  Ti  Ti24  1  0.49720000  0.54249400  0.36598600  1
  Ti  Ti25  1  0.00280000  0.95750600  0.86598600  1
  Ti  Ti26  1  0.99720000  0.45750600  0.63401400  1
  Ti  Ti27  1  0.50280000  0.04249400  0.13401400  1
  Ti  Ti28  1  0.50280000  0.45750600  0.63401400  1
  Ti  Ti29  1  0.99720000  0.04249400  0.13401400  1
  Ti  Ti30  1  0.00280000  0.54249400  0.36598600  1
  Ti  Ti31  1  0.49720000  0.95750600  0.86598600  1
  Si  Si32  1  0.75000000  0.88911300  0.43218200  1
  Si  Si33  1  0.75000000  0.61088700  0.93218200  1
  Si  Si34  1  0.25000000  0.11088700  0.56781800  1
  Si  Si35  1  0.25000000  0.38911300  0.06781800  1
  Si  Si36  1  0.25000000  0.51820000  0.77012600  1
  Si  Si37  1  0.25000000  0.98180000  0.27012600  1
  Si  Si38  1  0.75000000  0.48180000  0.22987400  1
  Si  Si39  1  0.75000000  0.01820000  0.72987400  1
  Si  Si40  1  0.25000000  0.28941200  0.62079100  1
  Si  Si41  1  0.25000000  0.21058800  0.12079100  1
  Si  Si42  1  0.75000000  0.71058800  0.37920900  1
  Si  Si43  1  0.75000000  0.78941200  0.87920900  1
  Si  Si44  1  0.25000000  0.38445900  0.30272200  1
  Si  Si45  1  0.25000000  0.11554100  0.80272200  1
  Si  Si46  1  0.75000000  0.61554100  0.69727800  1
  Si  Si47  1  0.75000000  0.88445900  0.19727800  1
  Si  Si48  1  0.75000000  0.05537700  0.98616500  1
  Si  Si49  1  0.75000000  0.44462300  0.48616500  1
  Si  Si50  1  0.25000000  0.94462300  0.01383500  1
  Si  Si51  1  0.25000000  0.55537700  0.51383500  1
  Si  Si52  1  0.25000000  0.69239600  0.28309200  1
  Si  Si53  1  0.25000000  0.80760400  0.78309200  1
  Si  Si54  1  0.75000000  0.30760400  0.71690800  1
  Si  Si55  1  0.75000000  0.19239600  0.21690800  1
  Si  Si56  1  0.49542300  0.66024200  0.06434600  1
  Si  Si57  1  0.00457700  0.83975800  0.56434600  1
  Si  Si58  1  0.99542300  0.33975800  0.93565400  1
  Si  Si59  1  0.50457700  0.16024200  0.43565400  1
  Si  Si60  1  0.50457700  0.33975800  0.93565400  1
  Si  Si61  1  0.99542300  0.16024200  0.43565400  1
  Si  Si62  1  0.00457700  0.66024200  0.06434600  1
  Si  Si63  1  0.49542300  0.83975800  0.56434600  1
  Ni  Ni64  1  0.99690800  0.34155700  0.18511100  1
  Ni  Ni65  1  0.50309200  0.15844300  0.68511100  1
  Ni  Ni66  1  0.49690800  0.65844300  0.81488900  1
  Ni  Ni67  1  0.00309200  0.84155700  0.31488900  1
  Ni  Ni68  1  0.00309200  0.65844300  0.81488900  1
  Ni  Ni69  1  0.49690800  0.84155700  0.31488900  1
  Ni  Ni70  1  0.50309200  0.34155700  0.18511100  1
  Ni  Ni71  1  0.99690800  0.15844300  0.68511100  1
