# generated using pymatgen
data_Sr3Yb(ScSe2)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.94311301
_cell_length_b   12.19934872
_cell_length_c   14.27905754
_cell_angle_alpha   89.93085847
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3Yb(ScSe2)8
_chemical_formula_sum   'Sr3 Yb1 Sc8 Se16'
_cell_volume   686.87086839
_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
  Sr  Sr0  1  0.25000000  0.23784817  0.33155683  1.0
  Sr  Sr1  1  0.75000000  0.26091954  0.83076153  1.0
  Sr  Sr2  1  0.25000000  0.73769037  0.16991539  1.0
  Yb  Yb3  1  0.75000000  0.76111537  0.66781842  1.0
  Sc  Sc4  1  0.25000000  0.08212168  0.59790785  1.0
  Sc  Sc5  1  0.25000000  0.05571332  0.11029322  1.0
  Sc  Sc6  1  0.75000000  0.41836851  0.09670153  1.0
  Sc  Sc7  1  0.75000000  0.93922027  0.88642173  1.0
  Sc  Sc8  1  0.75000000  0.44689709  0.61183461  1.0
  Sc  Sc9  1  0.25000000  0.55812015  0.39244204  1.0
  Sc  Sc10  1  0.75000000  0.91546620  0.40676199  1.0
  Sc  Sc11  1  0.25000000  0.58424721  0.90160980  1.0
  Se  Se12  1  0.25000000  0.87308840  0.53553368  1.0
  Se  Se13  1  0.25000000  0.79552746  0.82749144  1.0
  Se  Se14  1  0.25000000  0.96908570  0.28662732  1.0
  Se  Se15  1  0.75000000  0.41084548  0.42769102  1.0
  Se  Se16  1  0.25000000  0.47120273  0.21591471  1.0
  Se  Se17  1  0.25000000  0.08711998  0.92462882  1.0
  Se  Se18  1  0.75000000  0.20231402  0.15914735  1.0
  Se  Se19  1  0.75000000  0.02711467  0.71460559  1.0
  Se  Se20  1  0.25000000  0.59641889  0.57719665  1.0
  Se  Se21  1  0.75000000  0.70249564  0.34174171  1.0
  Se  Se22  1  0.25000000  0.29892781  0.65930556  1.0
  Se  Se23  1  0.25000000  0.37724326  0.97001448  1.0
  Se  Se24  1  0.75000000  0.62515213  0.02781222  1.0
  Se  Se25  1  0.75000000  0.53445183  0.78334486  1.0
  Se  Se26  1  0.75000000  0.12260946  0.47169546  1.0
  Se  Se27  1  0.75000000  0.90867067  0.07322718  1.0