# generated using pymatgen
data_ScRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28014091
_cell_length_b   5.28014046
_cell_length_c   8.57513327
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999647
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScRe2
_chemical_formula_sum   'Sc4 Re8'
_cell_volume   207.04393543
_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
  Sc  Sc0  1  0.33333300  0.66666700  0.43746488  1.0
  Sc  Sc1  1  0.66666700  0.33333300  0.93746488  1.0
  Sc  Sc2  1  0.66666700  0.33333300  0.56253512  1.0
  Sc  Sc3  1  0.33333300  0.66666700  0.06253512  1.0
  Re  Re4  1  0.65660721  0.82830311  0.75000000  1.0
  Re  Re5  1  0.34339279  0.17169689  0.25000000  1.0
  Re  Re6  1  0.82830311  0.17169689  0.25000000  1.0
  Re  Re7  1  0.17169689  0.34339279  0.75000000  1.0
  Re  Re8  1  0.17169689  0.82830311  0.75000000  1.0
  Re  Re9  1  0.82830311  0.65660721  0.25000000  1.0
  Re  Re10  1  -0.00000000  -0.00000000  0.50000000  1.0
  Re  Re11  1  -0.00000000  -0.00000000  -0.00000000  1.0