# generated using pymatgen
data_Sc4Ga17SiIr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.41146346
_cell_length_b   7.39498966
_cell_length_c   9.32112579
_cell_angle_alpha   90.04860607
_cell_angle_beta   89.88506777
_cell_angle_gamma   120.02646435
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4Ga17SiIr6
_chemical_formula_sum   'Sc4 Ga17 Si1 Ir6'
_cell_volume   442.30697336
_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  0.99754760  0.66248175  0.24774961  1.0
  Sc  Sc1  1  0.00201062  0.33058918  0.75252690  1.0
  Sc  Sc2  1  0.67570995  0.00598789  0.24751121  1.0
  Sc  Sc3  1  0.32854849  0.00051922  0.74777421  1.0
  Ga  Ga4  1  0.12818268  0.12735539  0.25113081  1.0
  Ga  Ga5  1  0.87244061  0.87472402  0.75087456  1.0
  Ga  Ga6  1  0.00153223  0.67275504  0.91621716  1.0
  Ga  Ga7  1  0.00207732  0.66563407  0.58179687  1.0
  Ga  Ga8  1  0.33367362  0.99560723  0.41712649  1.0
  Ga  Ga9  1  0.99830616  0.33416111  0.41952234  1.0
  Ga  Ga10  1  0.66551806  0.00218044  0.58186414  1.0
  Ga  Ga11  1  0.65724912  0.99709749  0.91595607  1.0
  Ga  Ga12  1  0.33247569  0.99589802  0.08197586  1.0
  Ga  Ga13  1  0.33159547  0.33054954  0.57371110  1.0
  Ga  Ga14  1  0.67092402  0.67132049  0.42627286  1.0
  Ga  Ga15  1  0.66966268  0.67168616  0.07572714  1.0
  Ga  Ga16  1  0.33704308  0.33011881  0.92530078  1.0
  Ga  Ga17  1  0.33882545  0.54757696  0.25150130  1.0
  Ga  Ga18  1  0.66349756  0.44986040  0.75164836  1.0
  Ga  Ga19  1  0.54755414  0.33770958  0.25089209  1.0
  Ga  Ga20  1  0.45032920  0.65985274  0.75085772  1.0
  Si  Si21  1  0.99901343  0.33434863  0.07303476  1.0
  Ir  Ir22  1  0.68412272  0.33087740  0.00465386  1.0
  Ir  Ir23  1  0.31464586  0.65775228  0.00159855  1.0
  Ir  Ir24  1  0.32865301  0.67082695  0.50065145  1.0
  Ir  Ir25  1  0.67166579  0.32879097  0.50002361  1.0
  Ir  Ir26  1  0.99697359  0.01337334  0.00156400  1.0
  Ir  Ir27  1  0.00022087  0.00036687  0.50053518  1.0