# generated using pymatgen
data_Tm8Fe(B8Ir)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58631182
_cell_length_b   9.06935546
_cell_length_c   11.41075028
_cell_angle_alpha   89.95889860
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm8Fe(B8Ir)3
_chemical_formula_sum   'Tm8 Fe1 B24 Ir3'
_cell_volume   371.14068097
_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
  Tm  Tm0  1  0.00000000  0.32028836  0.41448296  1.0
  Tm  Tm1  1  0.00000000  0.68333110  0.59147146  1.0
  Tm  Tm2  1  0.00000000  0.82268402  0.08011181  1.0
  Tm  Tm3  1  0.00000000  0.17351587  0.91155576  1.0
  Tm  Tm4  1  0.00000000  0.94423022  0.37497384  1.0
  Tm  Tm5  1  0.00000000  0.05176128  0.62889052  1.0
  Tm  Tm6  1  0.00000000  0.44431105  0.12429234  1.0
  Tm  Tm7  1  0.00000000  0.56053999  0.87417635  1.0
  Fe  Fe8  1  0.00000000  0.86179921  0.82109729  1.0
  B  B9  1  0.50000000  0.55314408  0.43441209  1.0
  B  B10  1  0.50000000  0.44691690  0.56625311  1.0
  B  B11  1  0.50000000  0.05224031  0.06521041  1.0
  B  B12  1  0.50000000  0.94729168  0.93287816  1.0
  B  B13  1  0.50000000  0.74977346  0.42169825  1.0
  B  B14  1  0.50000000  0.24942307  0.57973049  1.0
  B  B15  1  0.50000000  0.24885710  0.07818123  1.0
  B  B16  1  0.50000000  0.75410730  0.91813276  1.0
  B  B17  1  0.50000000  0.79267461  0.26522584  1.0
  B  B18  1  0.50000000  0.20597770  0.73477984  1.0
  B  B19  1  0.50000000  0.29305817  0.23502557  1.0
  B  B20  1  0.50000000  0.70823476  0.76521355  1.0
  B  B21  1  0.50000000  0.63222022  0.18312922  1.0
  B  B22  1  0.50000000  0.36781180  0.81564789  1.0
  B  B23  1  0.50000000  0.13269397  0.31681523  1.0
  B  B24  1  0.50000000  0.86703754  0.68624999  1.0
  B  B25  1  0.50000000  0.98145091  0.21273710  1.0
  B  B26  1  0.50000000  0.01563288  0.78822996  1.0
  B  B27  1  0.50000000  0.48146965  0.28651020  1.0
  B  B28  1  0.50000000  0.51908987  0.71352205  1.0
  B  B29  1  0.50000000  0.61132028  0.03019645  1.0
  B  B30  1  0.50000000  0.38932927  0.96920117  1.0
  B  B31  1  0.50000000  0.10889337  0.47042166  1.0
  B  B32  1  0.50000000  0.89028211  0.53035686  1.0
  Ir  Ir33  1  0.00000000  0.63810753  0.32168343  1.0
  Ir  Ir34  1  0.00000000  0.36198673  0.67781651  1.0
  Ir  Ir35  1  0.00000000  0.13851263  0.17969066  1.0