# generated using pymatgen
data_ScNb8CrSe16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.00265778
_cell_length_b   7.00265862
_cell_length_c   13.15331972
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999605
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNb8CrSe16
_chemical_formula_sum   'Sc1 Nb8 Cr1 Se16'
_cell_volume   558.58836236
_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  0.00000000  0.00000000  0.50000000  1.0
  Nb  Nb1  1  0.00000000  0.00000000  0.24518503  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.75481497  1.0
  Nb  Nb3  1  0.50864946  0.01729891  0.24292206  1.0
  Nb  Nb4  1  0.98270109  0.49135054  0.24292206  1.0
  Nb  Nb5  1  0.50864946  0.49135054  0.24292206  1.0
  Nb  Nb6  1  0.49135054  0.98270109  0.75707794  1.0
  Nb  Nb7  1  0.01729891  0.50864946  0.75707794  1.0
  Nb  Nb8  1  0.49135054  0.50864946  0.75707794  1.0
  Cr  Cr9  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se10  1  0.33333300  0.66666700  0.88737617  1.0
  Se  Se11  1  0.66666700  0.33333300  0.11262383  1.0
  Se  Se12  1  0.66666700  0.33333300  0.37422224  1.0
  Se  Se13  1  0.33333300  0.66666700  0.62577776  1.0
  Se  Se14  1  0.16920038  0.83079962  0.36925225  1.0
  Se  Se15  1  0.16920038  0.33839976  0.36925225  1.0
  Se  Se16  1  0.66160024  0.83079962  0.36925225  1.0
  Se  Se17  1  0.83079962  0.16920038  0.63074775  1.0
  Se  Se18  1  0.83079962  0.66160024  0.63074775  1.0
  Se  Se19  1  0.33839976  0.16920038  0.63074775  1.0
  Se  Se20  1  0.83278687  0.16721313  0.88195566  1.0
  Se  Se21  1  0.83278687  0.66557275  0.88195566  1.0
  Se  Se22  1  0.33442725  0.16721313  0.88195566  1.0
  Se  Se23  1  0.16721313  0.83278687  0.11804434  1.0
  Se  Se24  1  0.16721313  0.33442725  0.11804434  1.0
  Se  Se25  1  0.66557275  0.83278687  0.11804434  1.0