# generated using pymatgen
data_HfSc7Se12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.70331656
_cell_length_b   12.11240557
_cell_length_c   6.67365277
_cell_angle_alpha   79.35141941
_cell_angle_beta   69.56416954
_cell_angle_gamma   30.96709109
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc7Se12
_chemical_formula_sum   'Hf1 Sc7 Se12'
_cell_volume   480.92338485
_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
  Hf  Hf0  1  0.33391331  0.33391331  0.16608669  1.0
  Sc  Sc1  1  0.16575504  0.16575504  0.33424496  1.0
  Sc  Sc2  1  0.91758868  0.91758868  0.08241132  1.0
  Sc  Sc3  1  0.08305556  0.08305556  0.91694444  1.0
  Sc  Sc4  1  0.99961040  0.99961040  0.50038960  1.0
  Sc  Sc5  1  0.50111087  0.50111087  0.99888913  1.0
  Sc  Sc6  1  0.25010934  0.25010934  0.74989066  1.0
  Sc  Sc7  1  0.74854026  0.74854026  0.25145974  1.0
  Se  Se8  1  0.00617622  0.49695377  0.49354024  1.0
  Se  Se9  1  0.49695377  0.00617622  0.00333077  1.0
  Se  Se10  1  0.24673987  0.75269438  0.75303742  1.0
  Se  Se11  1  0.75269438  0.24673987  0.24752833  1.0
  Se  Se12  1  0.66266887  0.16976732  0.83842816  1.0
  Se  Se13  1  0.83628023  0.32762200  0.66617060  1.0
  Se  Se14  1  0.32762200  0.83628023  0.16992717  1.0
  Se  Se15  1  0.16976732  0.66266887  0.32913565  1.0
  Se  Se16  1  0.58070376  0.08436184  0.41139033  1.0
  Se  Se17  1  0.41386659  0.92248167  0.58362564  1.0
  Se  Se18  1  0.92248167  0.41386659  0.08002710  1.0
  Se  Se19  1  0.08436184  0.58070376  0.92354407  1.0