# generated using pymatgen
data_Y4ScGa2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.45802210
_cell_length_b   7.45802210
_cell_length_c   14.71446416
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y4ScGa2Hg
_chemical_formula_sum   'Y16 Sc4 Ga8 Hg4'
_cell_volume   818.44930318
_cell_formula_units_Z   4
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  0.82886681  0.82666140  0.89256405  1.0
  Y  Y1  1  0.17333860  0.17113319  0.60743595  1.0
  Y  Y2  1  0.82886681  0.17333860  0.39256405  1.0
  Y  Y3  1  0.17113319  0.82666140  0.39256405  1.0
  Y  Y4  1  0.32666140  0.32886681  0.39256405  1.0
  Y  Y5  1  0.82666140  0.17113319  0.10743595  1.0
  Y  Y6  1  0.32666140  0.67113319  0.89256405  1.0
  Y  Y7  1  0.17333860  0.82886681  0.10743595  1.0
  Y  Y8  1  0.32886681  0.67333860  0.60743595  1.0
  Y  Y9  1  0.67113319  0.67333860  0.10743595  1.0
  Y  Y10  1  0.67113319  0.32666140  0.60743595  1.0
  Y  Y11  1  0.82666140  0.82886681  0.60743595  1.0
  Y  Y12  1  0.67333860  0.32886681  0.89256405  1.0
  Y  Y13  1  0.17113319  0.17333860  0.89256405  1.0
  Y  Y14  1  0.67333860  0.67113319  0.39256405  1.0
  Y  Y15  1  0.32886681  0.32666140  0.10743595  1.0
  Sc  Sc16  1  0.50000000  0.00000000  0.75159464  1.0
  Sc  Sc17  1  0.00000000  0.50000000  0.24840536  1.0
  Sc  Sc18  1  0.00000000  0.50000000  0.74840536  1.0
  Sc  Sc19  1  0.50000000  0.00000000  0.25159464  1.0
  Ga  Ga20  1  0.62433255  0.37566745  0.25000000  1.0
  Ga  Ga21  1  0.37566745  0.62433255  0.25000000  1.0
  Ga  Ga22  1  0.12433255  0.12433255  0.25000000  1.0
  Ga  Ga23  1  0.37566745  0.37566745  0.75000000  1.0
  Ga  Ga24  1  0.12433255  0.87566745  0.75000000  1.0
  Ga  Ga25  1  0.87566745  0.87566745  0.25000000  1.0
  Ga  Ga26  1  0.62433255  0.62433255  0.75000000  1.0
  Ga  Ga27  1  0.87566745  0.12433255  0.75000000  1.0
  Hg  Hg28  1  0.00000000  0.50000000  0.00125184  1.0
  Hg  Hg29  1  0.50000000  0.00000000  0.99874816  1.0
  Hg  Hg30  1  0.50000000  0.00000000  0.49874816  1.0
  Hg  Hg31  1  0.00000000  0.50000000  0.50125184  1.0