[CIF]
data_ScRe2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.15315636
_cell_length_b   7.19036977
_cell_length_c   7.19036977
_cell_angle_alpha   25.71711369
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScRe2Se
_chemical_formula_sum   'Sc1 Re2 Se1'
_cell_volume   70.74012786
_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
  Re  Re0  1  0.00000000  -0.00000000  2.32972021  1
  Re  Re1  1  1.57657818  -0.00000000  8.01217198  1
  Sc  Sc2  1  0.00000000  0.00000000  13.03709202  1
  Se  Se3  1  1.57657818  0.00000000  4.46056923  1
[/CIF]
