# generated using pymatgen
data_Sc6Al6SnAu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92938993
_cell_length_b   6.92939034
_cell_length_c   8.16764624
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998890
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6Al6SnAu5
_chemical_formula_sum   'Sc6 Al6 Sn1 Au5'
_cell_volume   339.63905712
_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  0.58048456  0.99600536  0.73901441  1.0
  Sc  Sc1  1  0.00399464  0.58447920  0.73901441  1.0
  Sc  Sc2  1  0.41552080  0.41951544  0.73901441  1.0
  Sc  Sc3  1  0.00399089  0.58446271  0.26095850  1.0
  Sc  Sc4  1  0.58047182  0.99600911  0.26095850  1.0
  Sc  Sc5  1  0.41553729  0.41952818  0.26095850  1.0
  Al  Al6  1  0.74678232  0.77072820  0.00000535  1.0
  Al  Al7  1  0.22927180  0.97605412  0.00000535  1.0
  Al  Al8  1  0.02394588  0.25321768  0.00000535  1.0
  Al  Al9  1  0.75662404  0.75330858  0.50001176  1.0
  Al  Al10  1  0.24669142  0.00331546  0.50001176  1.0
  Al  Al11  1  0.99668454  0.24337596  0.50001176  1.0
  Sn  Sn12  1  0.66666700  0.33333300  0.99997828  1.0
  Au  Au13  1  0.00000000  0.00000000  0.75149393  1.0
  Au  Au14  1  0.00000000  0.00000000  0.24855030  1.0
  Au  Au15  1  0.66666700  0.33333300  0.50002852  1.0
  Au  Au16  1  0.33333300  0.66666700  0.49994433  1.0
  Au  Au17  1  0.33333300  0.66666700  0.00003359  1.0