# generated using pymatgen
data_Sc3As2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71362104
_cell_length_b   6.71362135
_cell_length_c   6.71362073
_cell_angle_alpha   146.48374095
_cell_angle_beta   131.89367091
_cell_angle_gamma   59.90206777
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3As2Se
_chemical_formula_sum   'Sc3 As2 Se1'
_cell_volume   123.24959271
_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
  Sc  Sc0  1  0.50000000  0.00000000  0.50000000  1.0
  Sc  Sc1  1  0.17377269  0.67377269  0.50000000  1.0
  Sc  Sc2  1  0.82622731  0.32622731  0.50000000  1.0
  As  As3  1  0.66478034  0.66478034  1.00000000  1.0
  As  As4  1  0.33521966  0.33521966  0.00000000  1.0
  Se  Se5  1  0.00000000  0.00000000  0.00000000  1.0