# generated using pymatgen
data_Sc(TaSe2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.95734607
_cell_length_b   6.95734668
_cell_length_c   13.51967689
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001130
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc(TaSe2)4
_chemical_formula_sum   'Sc2 Ta8 Se16'
_cell_volume   566.74036512
_cell_formula_units_Z   2
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  0.00000000  0.00000000  0.50000000  1.0
  Sc  Sc1  1  0.00000000  0.00000000  0.00000000  1.0
  Ta  Ta2  1  0.50809783  0.49190217  0.75000000  1.0
  Ta  Ta3  1  0.01619465  0.50809783  0.25000000  1.0
  Ta  Ta4  1  0.49190217  0.98380535  0.25000000  1.0
  Ta  Ta5  1  0.50809783  0.01619465  0.75000000  1.0
  Ta  Ta6  1  0.98380535  0.49190217  0.75000000  1.0
  Ta  Ta7  1  0.49190217  0.50809783  0.25000000  1.0
  Ta  Ta8  1  0.00000000  0.00000000  0.75000000  1.0
  Ta  Ta9  1  0.00000000  0.00000000  0.25000000  1.0
  Se  Se10  1  0.83055404  0.16944596  0.37162054  1.0
  Se  Se11  1  0.83055404  0.66110807  0.37162054  1.0
  Se  Se12  1  0.33889193  0.16944596  0.37162054  1.0
  Se  Se13  1  0.66110807  0.83055404  0.87162054  1.0
  Se  Se14  1  0.16944596  0.33889193  0.62837946  1.0
  Se  Se15  1  0.16944596  0.83055404  0.87162054  1.0
  Se  Se16  1  0.16944596  0.33889193  0.87162054  1.0
  Se  Se17  1  0.83055404  0.16944596  0.12837946  1.0
  Se  Se18  1  0.33889193  0.16944596  0.12837946  1.0
  Se  Se19  1  0.66110807  0.83055404  0.62837946  1.0
  Se  Se20  1  0.33333300  0.66666700  0.12305493  1.0
  Se  Se21  1  0.66666700  0.33333300  0.62305493  1.0
  Se  Se22  1  0.66666700  0.33333300  0.87694507  1.0
  Se  Se23  1  0.33333300  0.66666700  0.37694507  1.0
  Se  Se24  1  0.83055404  0.66110807  0.12837946  1.0
  Se  Se25  1  0.16944596  0.83055404  0.62837946  1.0