# generated using pymatgen
data_Lu3Si2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.02355149
_cell_length_b   10.96307538
_cell_length_c   10.95379783
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3Si2Ni
_chemical_formula_sum   'Lu12 Si8 Ni4'
_cell_volume   483.17748042
_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
  Lu  Lu0  1  0.25000000  0.05822016  0.88217028  1.0
  Lu  Lu1  1  0.25000000  0.44177984  0.38217028  1.0
  Lu  Lu2  1  0.75000000  0.94177984  0.11782972  1.0
  Lu  Lu3  1  0.75000000  0.55822016  0.61782972  1.0
  Lu  Lu4  1  0.25000000  0.12483207  0.55842420  1.0
  Lu  Lu5  1  0.25000000  0.37516793  0.05842420  1.0
  Lu  Lu6  1  0.75000000  0.87516793  0.44157580  1.0
  Lu  Lu7  1  0.75000000  0.62483207  0.94157580  1.0
  Lu  Lu8  1  0.25000000  0.80138810  0.71675376  1.0
  Lu  Lu9  1  0.25000000  0.69861190  0.21675376  1.0
  Lu  Lu10  1  0.75000000  0.19861190  0.28324624  1.0
  Lu  Lu11  1  0.75000000  0.30138810  0.78324624  1.0
  Si  Si12  1  0.25000000  0.81328587  0.97766828  1.0
  Si  Si13  1  0.25000000  0.68671413  0.47766828  1.0
  Si  Si14  1  0.75000000  0.18671413  0.02233172  1.0
  Si  Si15  1  0.75000000  0.31328587  0.52233172  1.0
  Si  Si16  1  0.25000000  0.49407237  0.80433798  1.0
  Si  Si17  1  0.25000000  0.00592763  0.30433798  1.0
  Si  Si18  1  0.75000000  0.50592763  0.19566202  1.0
  Si  Si19  1  0.75000000  0.99407237  0.69566202  1.0
  Ni  Ni20  1  0.25000000  0.36430507  0.63066079  1.0
  Ni  Ni21  1  0.25000000  0.13569493  0.13066079  1.0
  Ni  Ni22  1  0.75000000  0.63569493  0.36933921  1.0
  Ni  Ni23  1  0.75000000  0.86430507  0.86933921  1.0