# generated using pymatgen
data_Y16Lu3MgIr12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.79472997
_cell_length_b   10.79472997
_cell_length_c   6.31401709
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y16Lu3MgIr12
_chemical_formula_sum   'Y16 Lu3 Mg1 Ir12'
_cell_volume   735.74838781
_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
  Y  Y0  1  0.28238633  0.08419941  0.38315280  1.0
  Y  Y1  1  0.29059828  0.91136528  0.88440697  1.0
  Y  Y2  1  0.70940172  0.08863472  0.88440697  1.0
  Y  Y3  1  0.71761367  0.91580059  0.38315280  1.0
  Y  Y4  1  0.58969454  0.79130480  0.88405330  1.0
  Y  Y5  1  0.58658969  0.20914598  0.38193400  1.0
  Y  Y6  1  0.41341031  0.79085402  0.38193400  1.0
  Y  Y7  1  0.41030546  0.20869520  0.88405330  1.0
  Y  Y8  1  0.20914598  0.41341031  0.61806600  1.0
  Y  Y9  1  0.20869520  0.58969454  0.11594670  1.0
  Y  Y10  1  0.79130480  0.41030546  0.11594670  1.0
  Y  Y11  1  0.79085402  0.58658969  0.61806600  1.0
  Y  Y12  1  0.91136528  0.70940172  0.11559303  1.0
  Y  Y13  1  0.91580059  0.28238633  0.61684720  1.0
  Y  Y14  1  0.08419941  0.71761367  0.61684720  1.0
  Y  Y15  1  0.08863472  0.29059828  0.11559303  1.0
  Lu  Lu16  1  0.00000000  0.00000000  0.00000000  1.0
  Lu  Lu17  1  0.50000000  0.50000000  0.00000000  1.0
  Lu  Lu18  1  0.50000000  0.50000000  0.50000000  1.0
  Mg  Mg19  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir20  1  0.84967582  0.15292627  0.24476661  1.0
  Ir  Ir21  1  0.84707373  0.84967582  0.75523339  1.0
  Ir  Ir22  1  0.15292627  0.15032418  0.75523339  1.0
  Ir  Ir23  1  0.15032418  0.84707373  0.24476661  1.0
  Ir  Ir24  1  0.65005685  0.34968509  0.74808967  1.0
  Ir  Ir25  1  0.65031491  0.65005685  0.25191033  1.0
  Ir  Ir26  1  0.34968509  0.34994315  0.25191033  1.0
  Ir  Ir27  1  0.34994315  0.65031491  0.74808967  1.0
  Ir  Ir28  1  0.50000000  0.00000000  0.13237161  1.0
  Ir  Ir29  1  0.50000000  0.00000000  0.62599362  1.0
  Ir  Ir30  1  0.00000000  0.50000000  0.86762839  1.0
  Ir  Ir31  1  0.00000000  0.50000000  0.37400638  1.0