# generated using pymatgen
data_Tm3Pa(ReB6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.67328473
_cell_length_b   9.09121954
_cell_length_c   11.44774050
_cell_angle_alpha   90.30085251
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Pa(ReB6)2
_chemical_formula_sum   'Tm6 Pa2 Re4 B24'
_cell_volume   382.28787848
_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  0.00000000  0.82348444  0.08528522  1.0
  Tm  Tm1  1  0.00000000  0.17651556  0.91471478  1.0
  Tm  Tm2  1  0.00000000  0.94475873  0.37204210  1.0
  Tm  Tm3  1  0.00000000  0.05524127  0.62795790  1.0
  Tm  Tm4  1  0.00000000  0.44350487  0.12622456  1.0
  Tm  Tm5  1  0.00000000  0.55649513  0.87377544  1.0
  Pa  Pa6  1  0.00000000  0.32107766  0.41311443  1.0
  Pa  Pa7  1  0.00000000  0.67892234  0.58688557  1.0
  Re  Re8  1  0.00000000  0.63602372  0.32392159  1.0
  Re  Re9  1  0.00000000  0.36397628  0.67607841  1.0
  Re  Re10  1  0.00000000  0.14011821  0.18139416  1.0
  Re  Re11  1  0.00000000  0.85988179  0.81860584  1.0
  B  B12  1  0.50000000  0.55365100  0.43281334  1.0
  B  B13  1  0.50000000  0.44634900  0.56718666  1.0
  B  B14  1  0.50000000  0.05319613  0.06671208  1.0
  B  B15  1  0.50000000  0.94680387  0.93328792  1.0
  B  B16  1  0.50000000  0.74944703  0.41891071  1.0
  B  B17  1  0.50000000  0.25055297  0.58108929  1.0
  B  B18  1  0.50000000  0.24841307  0.07953685  1.0
  B  B19  1  0.50000000  0.75158693  0.92046315  1.0
  B  B20  1  0.50000000  0.79203580  0.26478069  1.0
  B  B21  1  0.50000000  0.20796420  0.73521931  1.0
  B  B22  1  0.50000000  0.29223979  0.23338788  1.0
  B  B23  1  0.50000000  0.70776021  0.76661212  1.0
  B  B24  1  0.50000000  0.63135469  0.18459062  1.0
  B  B25  1  0.50000000  0.36864531  0.81540938  1.0
  B  B26  1  0.50000000  0.13096106  0.31398426  1.0
  B  B27  1  0.50000000  0.86903894  0.68601574  1.0
  B  B28  1  0.50000000  0.98132644  0.21185360  1.0
  B  B29  1  0.50000000  0.01867356  0.78814640  1.0
  B  B30  1  0.50000000  0.48272482  0.28596389  1.0
  B  B31  1  0.50000000  0.51727518  0.71403611  1.0
  B  B32  1  0.50000000  0.60453524  0.02923971  1.0
  B  B33  1  0.50000000  0.39546476  0.97076029  1.0
  B  B34  1  0.50000000  0.10782177  0.47006977  1.0
  B  B35  1  0.50000000  0.89217823  0.52993023  1.0