# generated using pymatgen
data_LuSi3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.72899300
_cell_length_b   18.49067100
_cell_length_c   6.65898000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuSi3Ni5
_chemical_formula_sum   'Lu4 Si12 Ni20'
_cell_volume   459.14721033
_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  0.75000000  0.64367100  0.12257400  1.0
  Lu  Lu1  1  0.25000000  0.35632900  0.87742600  1.0
  Lu  Lu2  1  0.25000000  0.85632900  0.62257400  1.0
  Lu  Lu3  1  0.75000000  0.14367100  0.37742600  1.0
  Si  Si4  1  0.75000000  0.73826400  0.62208200  1.0
  Si  Si5  1  0.25000000  0.26173600  0.37791800  1.0
  Si  Si6  1  0.25000000  0.76173600  0.12208200  1.0
  Si  Si7  1  0.75000000  0.23826400  0.87791800  1.0
  Si  Si8  1  0.75000000  0.92430000  0.34875900  1.0
  Si  Si9  1  0.25000000  0.07570000  0.65124100  1.0
  Si  Si10  1  0.25000000  0.57570000  0.84875900  1.0
  Si  Si11  1  0.75000000  0.42430000  0.15124100  1.0
  Si  Si12  1  0.75000000  0.91470300  0.91039800  1.0
  Si  Si13  1  0.25000000  0.08529700  0.08960200  1.0
  Si  Si14  1  0.25000000  0.58529700  0.41039800  1.0
  Si  Si15  1  0.75000000  0.41470300  0.58960200  1.0
  Ni  Ni16  1  0.75000000  0.80008400  0.31758300  1.0
  Ni  Ni17  1  0.25000000  0.19991600  0.68241700  1.0
  Ni  Ni18  1  0.25000000  0.69991600  0.81758300  1.0
  Ni  Ni19  1  0.75000000  0.30008400  0.18241700  1.0
  Ni  Ni20  1  0.75000000  0.99467100  0.63092900  1.0
  Ni  Ni21  1  0.25000000  0.00532900  0.36907100  1.0
  Ni  Ni22  1  0.25000000  0.50532900  0.13092900  1.0
  Ni  Ni23  1  0.75000000  0.49467100  0.86907100  1.0
  Ni  Ni24  1  0.75000000  0.51352400  0.38116500  1.0
  Ni  Ni25  1  0.25000000  0.48647600  0.61883500  1.0
  Ni  Ni26  1  0.25000000  0.98647600  0.88116500  1.0
  Ni  Ni27  1  0.75000000  0.01352400  0.11883500  1.0
  Ni  Ni28  1  0.75000000  0.79401900  0.92969400  1.0
  Ni  Ni29  1  0.25000000  0.20598100  0.07030600  1.0
  Ni  Ni30  1  0.25000000  0.70598100  0.42969400  1.0
  Ni  Ni31  1  0.75000000  0.29401900  0.57030600  1.0
  Ni  Ni32  1  0.75000000  0.61432700  0.64216400  1.0
  Ni  Ni33  1  0.25000000  0.38567300  0.35783600  1.0
  Ni  Ni34  1  0.25000000  0.88567300  0.14216400  1.0
  Ni  Ni35  1  0.75000000  0.11432700  0.85783600  1.0