[CIF]
data_NaScSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.41684828
_cell_length_b   7.41684828
_cell_length_c   7.41684828
_cell_angle_alpha   152.11038511
_cell_angle_beta   150.13924878
_cell_angle_gamma   41.31524907
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaScSe2
_chemical_formula_sum   'Na1 Sc1 Se2'
_cell_volume   94.81409180
_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
  Na  Na0  1  -0.00000000  0.00000000  7.49115299  1
  Sc  Sc1  1  0.00000000  1.91091451  4.17960452  1
  Se  Se2  1  0.00000000  0.00000000  13.04918716  1
  Se  Se3  1  1.78736480  0.00000000  3.03998955  1
[/CIF]
