# generated using pymatgen
data_Nd2BeSi8Ni17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.92444101
_cell_length_b   7.81216980
_cell_length_c   7.72073878
_cell_angle_alpha   61.34710369
_cell_angle_beta   59.89501539
_cell_angle_gamma   58.75787067
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2BeSi8Ni17
_chemical_formula_sum   'Nd2 Be1 Si8 Ni17'
_cell_volume   337.62663889
_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
  Nd  Nd0  1  0.25000000  0.25000000  0.25000000  1.0
  Nd  Nd1  1  0.75000000  0.75000000  0.75000000  1.0
  Be  Be2  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si3  1  0.70896179  0.05462452  0.94537548  1.0
  Si  Si4  1  0.05462452  0.70896179  0.29103821  1.0
  Si  Si5  1  0.20835102  0.55616516  0.79164898  1.0
  Si  Si6  1  0.55616516  0.20835102  0.44383484  1.0
  Si  Si7  1  0.29103821  0.94537548  0.05462452  1.0
  Si  Si8  1  0.94537548  0.29103821  0.70896179  1.0
  Si  Si9  1  0.79164898  0.44383484  0.20835102  1.0
  Si  Si10  1  0.44383484  0.79164898  0.55616516  1.0
  Ni  Ni11  1  0.71721702  0.28278298  0.06104762  1.0
  Ni  Ni12  1  0.28278298  0.71721702  0.93895238  1.0
  Ni  Ni13  1  0.20193363  0.79806637  0.43542865  1.0
  Ni  Ni14  1  0.79806637  0.20193363  0.56457135  1.0
  Ni  Ni15  1  0.43542865  0.56457135  0.20193363  1.0
  Ni  Ni16  1  0.56457135  0.43542865  0.79806637  1.0
  Ni  Ni17  1  0.06104762  0.93895238  0.71721702  1.0
  Ni  Ni18  1  0.93895238  0.06104762  0.28278298  1.0
  Ni  Ni19  1  0.44688396  0.18727209  0.81272791  1.0
  Ni  Ni20  1  0.18727209  0.44688396  0.55311604  1.0
  Ni  Ni21  1  0.94016896  0.69245887  0.05983104  1.0
  Ni  Ni22  1  0.69245887  0.94016896  0.30754113  1.0
  Ni  Ni23  1  0.55311604  0.81272791  0.18727209  1.0
  Ni  Ni24  1  0.81272791  0.55311604  0.44688396  1.0
  Ni  Ni25  1  0.05983104  0.30754113  0.94016896  1.0
  Ni  Ni26  1  0.30754113  0.05983104  0.69245887  1.0
  Ni  Ni27  1  0.50000000  0.50000000  0.50000000  1.0