# generated using pymatgen
data_Sc5Al16BiIr7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71543819
_cell_length_b   8.74800067
_cell_length_c   8.74800164
_cell_angle_alpha   59.75389414
_cell_angle_beta   60.12306315
_cell_angle_gamma   60.12306313
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc5Al16BiIr7
_chemical_formula_sum   'Sc5 Al16 Bi1 Ir7'
_cell_volume   471.60670306
_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  0.79068631  0.20931369  0.20931369  1.0
  Sc  Sc1  1  0.77387509  0.22612491  0.76659758  1.0
  Sc  Sc2  1  0.77387509  0.76659758  0.22612491  1.0
  Sc  Sc3  1  0.23340242  0.76659758  0.22612491  1.0
  Sc  Sc4  1  0.23340242  0.22612491  0.76659758  1.0
  Al  Al5  1  0.86314386  0.83325704  0.83325704  1.0
  Al  Al6  1  0.84768680  0.82206890  0.48255951  1.0
  Al  Al7  1  0.47034306  0.83325704  0.83325704  1.0
  Al  Al8  1  0.84768680  0.48255951  0.82206890  1.0
  Al  Al9  1  0.17793110  0.15231320  0.15231320  1.0
  Al  Al10  1  0.16674296  0.13685614  0.52965694  1.0
  Al  Al11  1  0.16674296  0.52965694  0.13685614  1.0
  Al  Al12  1  0.51744049  0.15231320  0.15231320  1.0
  Al  Al13  1  0.60558487  0.62427717  0.62427717  1.0
  Al  Al14  1  0.63219045  0.61577686  0.11984224  1.0
  Al  Al15  1  0.14585980  0.62427717  0.62427717  1.0
  Al  Al16  1  0.63219045  0.11984224  0.61577686  1.0
  Al  Al17  1  0.38422314  0.36780955  0.36780955  1.0
  Al  Al18  1  0.37572283  0.39441513  0.85414020  1.0
  Al  Al19  1  0.37572283  0.85414020  0.39441513  1.0
  Al  Al20  1  0.88015776  0.36780955  0.36780955  1.0
  Bi  Bi21  1  0.03305775  0.96694225  0.96694225  1.0
  Ir  Ir22  1  0.51092161  0.48907839  0.48907839  1.0
  Ir  Ir23  1  0.01120088  0.48879912  0.48879912  1.0
  Ir  Ir24  1  0.51120088  0.98879912  0.98879912  1.0
  Ir  Ir25  1  0.51540454  0.99590135  0.48459546  1.0
  Ir  Ir26  1  0.51540454  0.48459546  0.99590135  1.0
  Ir  Ir27  1  0.00409865  0.48459546  0.99590135  1.0
  Ir  Ir28  1  0.00409865  0.99590135  0.48459546  1.0