# generated using pymatgen
data_ScUS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.63064800
_cell_length_b   6.63064800
_cell_length_c   6.63064800
_cell_angle_alpha   131.54783203
_cell_angle_beta   131.54783203
_cell_angle_gamma   70.94412145
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScUS2
_chemical_formula_sum   'Sc2 U2 S4'
_cell_volume   159.90015979
_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  0.50000000  0.50000000  0.00000000  1.0
  Sc  Sc1  1  0.25000000  0.75000000  0.50000000  1.0
  U  U2  1  -0.00000000  -0.00000000  0.00000000  1.0
  U  U3  1  0.75000000  0.25000000  0.50000000  1.0
  S  S4  1  0.49122659  0.99122659  0.50000000  1.0
  S  S5  1  0.00877341  0.50877341  0.50000000  1.0
  S  S6  1  0.74122659  0.74122659  0.00000000  1.0
  S  S7  1  0.25877341  0.25877341  -0.00000000  1.0