# generated using pymatgen
data_LuAl2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01732359
_cell_length_b   5.30058437
_cell_length_c   6.80435735
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.26870889
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuAl2Ni
_chemical_formula_sum   'Lu2 Al4 Ni2'
_cell_volume   134.08650344
_cell_formula_units_Z   2
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  0.43714075  0.87427950  0.25000000  1.0
  Lu  Lu1  1  0.56285925  0.12572050  0.75000000  1.0
  Al  Al2  1  0.15392985  0.30786071  0.05371786  1.0
  Al  Al3  1  0.84607015  0.69213929  0.94628214  1.0
  Al  Al4  1  0.84607015  0.69213929  0.55371786  1.0
  Al  Al5  1  0.15392985  0.30786071  0.44628214  1.0
  Ni  Ni6  1  0.71385648  0.42771296  0.25000000  1.0
  Ni  Ni7  1  0.28614352  0.57228704  0.75000000  1.0