# generated using pymatgen
data_Y2Sc3S7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.37152652
_cell_length_b   6.37152755
_cell_length_c   11.25795475
_cell_angle_alpha   75.97289672
_cell_angle_beta   75.97289533
_cell_angle_gamma   33.77805276
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2Sc3S7
_chemical_formula_sum   'Y2 Sc3 S7'
_cell_volume   245.81221689
_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
  Y  Y0  1  0.30225824  0.30225824  0.80555660  1.0
  Y  Y1  1  0.69774176  0.69774176  0.19444340  1.0
  Sc  Sc2  1  0.11136016  0.11136016  0.57415473  1.0
  Sc  Sc3  1  0.88863984  0.88863984  0.42584527  1.0
  Sc  Sc4  1  0.00000000  0.00000000  0.00000000  1.0
  S  S5  1  0.26151723  0.26151723  0.36033066  1.0
  S  S6  1  0.73848277  0.73848277  0.63966934  1.0
  S  S7  1  0.97035598  0.97035598  0.78400893  1.0
  S  S8  1  0.02964402  0.02964402  0.21599107  1.0
  S  S9  1  0.65391021  0.65391021  0.95089953  1.0
  S  S10  1  0.50000000  0.50000000  0.50000000  1.0
  S  S11  1  0.34608979  0.34608979  0.04910047  1.0