# generated using pymatgen
data_Lu3AlN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.60314447
_cell_length_b   4.60314447
_cell_length_c   4.60314447
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3AlN
_chemical_formula_sum   'Lu3 Al1 N1'
_cell_volume   97.53574744
_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
  Lu  Lu0  1  0.50000000  0.50000000  0.00000000  1.0
  Lu  Lu1  1  0.50000000  -0.00000000  0.50000000  1.0
  Lu  Lu2  1  0.00000000  0.50000000  0.50000000  1.0
  Al  Al3  1  0.00000000  -0.00000000  0.00000000  1.0
  N  N4  1  0.50000000  0.50000000  0.50000000  1.0