# generated using pymatgen
data_Tm2B8MoIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56296476
_cell_length_b   5.95542469
_cell_length_c   11.52450136
_cell_angle_alpha   89.62626801
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2B8MoIr
_chemical_formula_sum   'Tm4 B16 Mo2 Ir2'
_cell_volume   244.53282704
_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
  Tm  Tm0  1  0.50000000  0.13038652  0.14864667  1.0
  Tm  Tm1  1  0.50000000  0.86961348  0.85135333  1.0
  Tm  Tm2  1  0.50000000  0.62820788  0.34984924  1.0
  Tm  Tm3  1  0.50000000  0.37179212  0.65015076  1.0
  B  B4  1  0.00000000  0.47566420  0.19157866  1.0
  B  B5  1  0.00000000  0.52433580  0.80842134  1.0
  B  B6  1  0.00000000  0.97704098  0.30516369  1.0
  B  B7  1  0.00000000  0.02295902  0.69483631  1.0
  B  B8  1  0.00000000  0.29192684  0.31219089  1.0
  B  B9  1  0.00000000  0.70807316  0.68780911  1.0
  B  B10  1  0.00000000  0.79097537  0.18610581  1.0
  B  B11  1  0.00000000  0.20902463  0.81389419  1.0
  B  B12  1  0.00000000  0.36815082  0.46787087  1.0
  B  B13  1  0.00000000  0.63184918  0.53212913  1.0
  B  B14  1  0.00000000  0.86498422  0.03028105  1.0
  B  B15  1  0.00000000  0.13501578  0.96971895  1.0
  B  B16  1  0.00000000  0.38647685  0.04733056  1.0
  B  B17  1  0.00000000  0.61352315  0.95266944  1.0
  B  B18  1  0.00000000  0.88507314  0.45282259  1.0
  B  B19  1  0.00000000  0.11492686  0.54717741  1.0
  Mo  Mo20  1  0.50000000  0.12840729  0.41436962  1.0
  Mo  Mo21  1  0.50000000  0.87159271  0.58563038  1.0
  Ir  Ir22  1  0.50000000  0.64689099  0.09516337  1.0
  Ir  Ir23  1  0.50000000  0.35310901  0.90483663  1.0