# generated using pymatgen
data_YTh5(SnIr)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.52622987
_cell_length_b   7.54210910
_cell_length_c   8.22101711
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.92895775
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTh5(SnIr)6
_chemical_formula_sum   'Y1 Th5 Sn6 Ir6'
_cell_volume   404.42400567
_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  0.40413750  0.99997257  0.75000000  1.0
  Th  Th1  1  0.41355310  0.99993349  0.25000000  1.0
  Th  Th2  1  0.58498117  0.58774757  0.75000000  1.0
  Th  Th3  1  0.59028794  0.58799017  0.25000000  1.0
  Th  Th4  1  0.00220376  0.41196098  0.25000000  1.0
  Th  Th5  1  0.99723422  0.41224555  0.75000000  1.0
  Sn  Sn6  1  0.25173032  0.24669933  0.50206424  1.0
  Sn  Sn7  1  0.25173032  0.24669933  0.99793576  1.0
  Sn  Sn8  1  0.74414732  0.99999901  0.99634275  1.0
  Sn  Sn9  1  0.00503616  0.75331825  0.50208925  1.0
  Sn  Sn10  1  0.74414732  0.99999901  0.50365725  1.0
  Sn  Sn11  1  0.00503616  0.75331825  0.99791075  1.0
  Ir  Ir12  1  0.67189445  0.33823311  0.49988179  1.0
  Ir  Ir13  1  0.67189445  0.33823311  0.00011821  1.0
  Ir  Ir14  1  0.33367226  0.66182210  0.00017085  1.0
  Ir  Ir15  1  0.33367226  0.66182210  0.49982915  1.0
  Ir  Ir16  1  0.99492897  0.00003079  0.75000000  1.0
  Ir  Ir17  1  0.99971430  0.99997328  0.25000000  1.0