# generated using pymatgen
data_TbTh3(Ga3Ir)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.61162863
_cell_length_b   7.62393719
_cell_length_c   9.43598914
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.70273882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbTh3(Ga3Ir)6
_chemical_formula_sum   'Tb1 Th3 Ga18 Ir6'
_cell_volume   475.62872247
_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
  Tb  Tb0  1  0.32944755  0.00351752  0.75000000  1.0
  Th  Th1  1  0.99769286  0.66998492  0.25000000  1.0
  Th  Th2  1  0.00087563  0.33035505  0.75000000  1.0
  Th  Th3  1  0.67024041  0.99700533  0.25000000  1.0
  Ga  Ga4  1  0.13734113  0.13364002  0.25000000  1.0
  Ga  Ga5  1  0.86902062  0.86766082  0.75000000  1.0
  Ga  Ga6  1  0.00700496  0.33495358  0.07870024  1.0
  Ga  Ga7  1  0.00009073  0.67108752  0.91866453  1.0
  Ga  Ga8  1  0.00009073  0.67108752  0.58133547  1.0
  Ga  Ga9  1  0.33504947  0.00536372  0.42757387  1.0
  Ga  Ga10  1  0.00700496  0.33495358  0.42129976  1.0
  Ga  Ga11  1  0.65891565  0.99461696  0.58119625  1.0
  Ga  Ga12  1  0.65891565  0.99461696  0.91880375  1.0
  Ga  Ga13  1  0.33504947  0.00536372  0.07242613  1.0
  Ga  Ga14  1  0.33700598  0.33241456  0.56748059  1.0
  Ga  Ga15  1  0.66153864  0.66132601  0.43967787  1.0
  Ga  Ga16  1  0.66153864  0.66132601  0.06032213  1.0
  Ga  Ga17  1  0.33700598  0.33241456  0.93251941  1.0
  Ga  Ga18  1  0.34116209  0.54195271  0.25000000  1.0
  Ga  Ga19  1  0.65753094  0.45391001  0.75000000  1.0
  Ga  Ga20  1  0.54198343  0.33805552  0.25000000  1.0
  Ga  Ga21  1  0.45622103  0.66342737  0.75000000  1.0
  Ir  Ir22  1  0.67513386  0.32985760  0.00036194  1.0
  Ir  Ir23  1  0.32713448  0.67054360  0.00050178  1.0
  Ir  Ir24  1  0.32713448  0.67054360  0.49949822  1.0
  Ir  Ir25  1  0.67513386  0.32985760  0.49963806  1.0
  Ir  Ir26  1  0.99736887  0.00008032  0.00070385  1.0
  Ir  Ir27  1  0.99736887  0.00008032  0.49929615  1.0