# generated using pymatgen
data_NdLuSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.40447706
_cell_length_b   7.40447689
_cell_length_c   7.40447647
_cell_angle_alpha   31.28500724
_cell_angle_beta   31.28500906
_cell_angle_gamma   31.28501091
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdLuSe2
_chemical_formula_sum   'Nd1 Lu1 Se2'
_cell_volume   97.15898552
_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  0.00000000  0.00000000  0.00000000  1.0
  Lu  Lu1  1  0.50000000  0.50000000  0.50000000  1.0
  Se  Se2  1  0.75897353  0.75897353  0.75897353  1.0
  Se  Se3  1  0.24102647  0.24102647  0.24102647  1.0