# generated using pymatgen
data_Y7Th(AlIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62446914
_cell_length_b   9.62446812
_cell_length_c   9.62036209
_cell_angle_alpha   60.01411501
_cell_angle_beta   60.01411852
_cell_angle_gamma   60.17150784
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y7Th(AlIr)2
_chemical_formula_sum   'Y14 Th2 Al4 Ir4'
_cell_volume   631.07732768
_cell_formula_units_Z   2
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  0.35495000  0.94134376  0.35185312  1.0
  Y  Y1  1  0.94134376  0.35495000  0.35185312  1.0
  Y  Y2  1  0.80836912  0.19421240  0.19164677  1.0
  Y  Y3  1  0.19421240  0.80836912  0.80577172  1.0
  Y  Y4  1  0.19421240  0.80836912  0.19164677  1.0
  Y  Y5  1  0.80836912  0.19421240  0.80577172  1.0
  Y  Y6  1  0.19053180  0.19053180  0.80946820  1.0
  Y  Y7  1  0.80694658  0.80694658  0.19305342  1.0
  Y  Y8  1  0.93828207  0.56381948  0.56169373  1.0
  Y  Y9  1  0.56381948  0.93828207  0.93620672  1.0
  Y  Y10  1  0.56381948  0.93828207  0.56169373  1.0
  Y  Y11  1  0.93828207  0.56381948  0.93620672  1.0
  Y  Y12  1  0.56197314  0.56197314  0.93802686  1.0
  Y  Y13  1  0.94293054  0.94293054  0.55706946  1.0
  Th  Th14  1  0.34666004  0.34666004  0.35201649  1.0
  Th  Th15  1  0.34666004  0.34666004  0.95466443  1.0
  Al  Al16  1  0.57855039  0.57855039  0.57837229  1.0
  Al  Al17  1  0.57855039  0.57855039  0.26452893  1.0
  Al  Al18  1  0.57730192  0.26558711  0.57855599  1.0
  Al  Al19  1  0.26558711  0.57730192  0.57855599  1.0
  Ir  Ir20  1  0.14071369  0.14071369  0.14532358  1.0
  Ir  Ir21  1  0.14071369  0.14071369  0.57325003  1.0
  Ir  Ir22  1  0.14442139  0.57280138  0.14138961  1.0
  Ir  Ir23  1  0.57280138  0.14442139  0.14138961  1.0