# generated using pymatgen
data_TmTaB6Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.44972127
_cell_length_b   8.92808452
_cell_length_c   11.21488446
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmTaB6Ru
_chemical_formula_sum   'Tm4 Ta4 B24 Ru4'
_cell_volume   345.41174678
_cell_formula_units_Z   4
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  0.32288197  0.41295932  1.0
  Tm  Tm1  1  0.00000000  0.67711803  0.58704068  1.0
  Tm  Tm2  1  0.00000000  0.82288197  0.08704068  1.0
  Tm  Tm3  1  0.00000000  0.17711803  0.91295932  1.0
  Ta  Ta4  1  0.00000000  0.94685599  0.37516107  1.0
  Ta  Ta5  1  0.00000000  0.05314401  0.62483893  1.0
  Ta  Ta6  1  0.00000000  0.44685599  0.12483893  1.0
  Ta  Ta7  1  0.00000000  0.55314401  0.87516107  1.0
  B  B8  1  0.50000000  0.55477715  0.43516518  1.0
  B  B9  1  0.50000000  0.44522285  0.56483482  1.0
  B  B10  1  0.50000000  0.05477715  0.06483482  1.0
  B  B11  1  0.50000000  0.94522285  0.93516518  1.0
  B  B12  1  0.50000000  0.75445259  0.41962094  1.0
  B  B13  1  0.50000000  0.24554741  0.58037906  1.0
  B  B14  1  0.50000000  0.25445259  0.08037906  1.0
  B  B15  1  0.50000000  0.74554741  0.91962094  1.0
  B  B16  1  0.50000000  0.79905733  0.26242757  1.0
  B  B17  1  0.50000000  0.20094267  0.73757243  1.0
  B  B18  1  0.50000000  0.29905733  0.23757243  1.0
  B  B19  1  0.50000000  0.70094267  0.76242757  1.0
  B  B20  1  0.50000000  0.63000907  0.18121485  1.0
  B  B21  1  0.50000000  0.36999093  0.81878515  1.0
  B  B22  1  0.50000000  0.13000907  0.31878515  1.0
  B  B23  1  0.50000000  0.86999093  0.68121485  1.0
  B  B24  1  0.50000000  0.98071158  0.21352877  1.0
  B  B25  1  0.50000000  0.01928842  0.78647123  1.0
  B  B26  1  0.50000000  0.48071158  0.28647123  1.0
  B  B27  1  0.50000000  0.51928842  0.71352877  1.0
  B  B28  1  0.50000000  0.60049547  0.02698295  1.0
  B  B29  1  0.50000000  0.39950453  0.97301705  1.0
  B  B30  1  0.50000000  0.10049547  0.47301705  1.0
  B  B31  1  0.50000000  0.89950453  0.52698295  1.0
  Ru  Ru32  1  0.00000000  0.64397694  0.31897172  1.0
  Ru  Ru33  1  0.00000000  0.35602306  0.68102828  1.0
  Ru  Ru34  1  0.00000000  0.14397694  0.18102828  1.0
  Ru  Ru35  1  0.00000000  0.85602306  0.81897172  1.0