# generated using pymatgen
data_Sc3Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.52834422
_cell_length_b   6.52834422
_cell_length_c   5.17358100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000221
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Bi
_chemical_formula_sum   'Sc6 Bi2'
_cell_volume   190.95365060
_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  0.16491400  0.32982800  0.25000000  1.0
  Sc  Sc1  1  0.67017200  0.83508600  0.25000000  1.0
  Sc  Sc2  1  0.16491400  0.83508600  0.25000000  1.0
  Sc  Sc3  1  0.83508600  0.67017200  0.75000000  1.0
  Sc  Sc4  1  0.32982800  0.16491400  0.75000000  1.0
  Sc  Sc5  1  0.83508600  0.16491400  0.75000000  1.0
  Bi  Bi6  1  0.33333300  0.66666700  0.75000000  1.0
  Bi  Bi7  1  0.66666700  0.33333300  0.25000000  1.0