[CIF]
data_Sc2TaSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.78361086
_cell_length_b   4.78361086
_cell_length_c   4.78361086
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2TaSe
_chemical_formula_sum   'Sc2 Ta1 Se1'
_cell_volume   77.40206237
_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
  Sc  Sc0  1  5.07378552  5.07378552  5.07378552  1
  Sc  Sc1  1  1.69126184  1.69126184  1.69126184  1
  Se  Se2  1  0.00000000  0.00000000  0.00000000  1
  Ta  Ta3  1  3.38252368  3.38252368  3.38252368  1
[/CIF]
