# generated using pymatgen
data_Nb4Si7Ni4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.64942354
_cell_length_b   12.64942354
_cell_length_c   5.02342578
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb4Si7Ni4
_chemical_formula_sum   'Nb16 Si28 Ni16'
_cell_volume   803.78788971
_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
  Nb  Nb0  1  0.13454100  0.13454100  0.00000000  1
  Nb  Nb1  1  0.36545900  0.36545900  0.50000000  1
  Nb  Nb2  1  0.63454100  0.36545900  0.50000000  1
  Nb  Nb3  1  0.86545900  0.13454100  0.00000000  1
  Nb  Nb4  1  0.30856100  0.50000000  0.00000000  1
  Nb  Nb5  1  0.69143900  0.50000000  0.00000000  1
  Nb  Nb6  1  0.00000000  0.19143900  0.50000000  1
  Nb  Nb7  1  0.00000000  0.80856100  0.50000000  1
  Nb  Nb8  1  0.63454100  0.63454100  0.50000000  1
  Nb  Nb9  1  0.86545900  0.86545900  0.00000000  1
  Nb  Nb10  1  0.13454100  0.86545900  0.00000000  1
  Nb  Nb11  1  0.36545900  0.63454100  0.50000000  1
  Nb  Nb12  1  0.80856100  0.00000000  0.50000000  1
  Nb  Nb13  1  0.19143900  0.00000000  0.50000000  1
  Nb  Nb14  1  0.50000000  0.69143900  0.00000000  1
  Nb  Nb15  1  0.50000000  0.30856100  0.00000000  1
  Si  Si16  1  0.09298400  0.50000000  0.00000000  1
  Si  Si17  1  0.90701600  0.50000000  0.00000000  1
  Si  Si18  1  0.00000000  0.40701600  0.50000000  1
  Si  Si19  1  0.00000000  0.59298400  0.50000000  1
  Si  Si20  1  0.00000000  0.00000000  0.75050900  1
  Si  Si21  1  0.00000000  0.00000000  0.24949100  1
  Si  Si22  1  0.29229800  0.29229800  0.00000000  1
  Si  Si23  1  0.20770200  0.20770200  0.50000000  1
  Si  Si24  1  0.79229800  0.20770200  0.50000000  1
  Si  Si25  1  0.70770200  0.29229800  0.00000000  1
  Si  Si26  1  0.79188200  0.50000000  0.50000000  1
  Si  Si27  1  0.20811800  0.50000000  0.50000000  1
  Si  Si28  1  0.00000000  0.70811800  0.00000000  1
  Si  Si29  1  0.00000000  0.29188200  0.00000000  1
  Si  Si30  1  0.59298400  0.00000000  0.50000000  1
  Si  Si31  1  0.40701600  0.00000000  0.50000000  1
  Si  Si32  1  0.50000000  0.90701600  0.00000000  1
  Si  Si33  1  0.50000000  0.09298400  0.00000000  1
  Si  Si34  1  0.50000000  0.50000000  0.25050900  1
  Si  Si35  1  0.50000000  0.50000000  0.74949100  1
  Si  Si36  1  0.79229800  0.79229800  0.50000000  1
  Si  Si37  1  0.70770200  0.70770200  0.00000000  1
  Si  Si38  1  0.29229800  0.70770200  0.00000000  1
  Si  Si39  1  0.20770200  0.79229800  0.50000000  1
  Si  Si40  1  0.29188200  0.00000000  0.00000000  1
  Si  Si41  1  0.70811800  0.00000000  0.00000000  1
  Si  Si42  1  0.50000000  0.20811800  0.50000000  1
  Si  Si43  1  0.50000000  0.79188200  0.50000000  1
  Ni  Ni44  1  0.14810000  0.64810000  0.75000000  1
  Ni  Ni45  1  0.85190000  0.35190000  0.75000000  1
  Ni  Ni46  1  0.14810000  0.35190000  0.75000000  1
  Ni  Ni47  1  0.85190000  0.64810000  0.75000000  1
  Ni  Ni48  1  0.14810000  0.35190000  0.25000000  1
  Ni  Ni49  1  0.85190000  0.64810000  0.25000000  1
  Ni  Ni50  1  0.14810000  0.64810000  0.25000000  1
  Ni  Ni51  1  0.85190000  0.35190000  0.25000000  1
  Ni  Ni52  1  0.64810000  0.14810000  0.25000000  1
  Ni  Ni53  1  0.35190000  0.85190000  0.25000000  1
  Ni  Ni54  1  0.64810000  0.85190000  0.25000000  1
  Ni  Ni55  1  0.35190000  0.14810000  0.25000000  1
  Ni  Ni56  1  0.64810000  0.85190000  0.75000000  1
  Ni  Ni57  1  0.35190000  0.14810000  0.75000000  1
  Ni  Ni58  1  0.64810000  0.14810000  0.75000000  1
  Ni  Ni59  1  0.35190000  0.85190000  0.75000000  1
