# generated using pymatgen
data_Tm6TiAl23Ru8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.74236319
_cell_length_b   8.74236260
_cell_length_c   9.45775871
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999479
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm6TiAl23Ru8
_chemical_formula_sum   'Tm6 Ti1 Al23 Ru8'
_cell_volume   626.00318829
_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  0.19354019  0.38707838  0.25015069  1.0
  Tm  Tm1  1  0.80683703  0.61367606  0.74895132  1.0
  Tm  Tm2  1  0.61292162  0.80645981  0.25015069  1.0
  Tm  Tm3  1  0.38632394  0.19316297  0.74895132  1.0
  Tm  Tm4  1  0.19354019  0.80645981  0.25015069  1.0
  Tm  Tm5  1  0.80683703  0.19316297  0.74895132  1.0
  Ti  Ti6  1  0.33333300  0.66666700  0.99627855  1.0
  Al  Al7  1  0.66666700  0.33333300  0.98725981  1.0
  Al  Al8  1  0.66666700  0.33333300  0.51341537  1.0
  Al  Al9  1  0.33333300  0.66666700  0.48410880  1.0
  Al  Al10  1  0.16191184  0.32382468  0.57732280  1.0
  Al  Al11  1  0.83766487  0.67533074  0.42246593  1.0
  Al  Al12  1  0.67617532  0.83808816  0.57732280  1.0
  Al  Al13  1  0.83761251  0.67522501  0.07964503  1.0
  Al  Al14  1  0.32466926  0.16233513  0.42246593  1.0
  Al  Al15  1  0.15894848  0.31789796  0.92181007  1.0
  Al  Al16  1  0.16191184  0.83808816  0.57732280  1.0
  Al  Al17  1  0.32477499  0.16238749  0.07964503  1.0
  Al  Al18  1  0.83766487  0.16233513  0.42246593  1.0
  Al  Al19  1  0.68210204  0.84105152  0.92181007  1.0
  Al  Al20  1  0.83761251  0.16238749  0.07964503  1.0
  Al  Al21  1  0.15894848  0.84105152  0.92181007  1.0
  Al  Al22  1  0.56146030  0.12292160  0.25198124  1.0
  Al  Al23  1  0.44010778  0.88021656  0.74982316  1.0
  Al  Al24  1  0.87707840  0.43853970  0.25198124  1.0
  Al  Al25  1  0.11978344  0.55989222  0.74982316  1.0
  Al  Al26  1  0.56146030  0.43853970  0.25198124  1.0
  Al  Al27  1  0.44010778  0.55989222  0.74982316  1.0
  Al  Al28  1  0.00000000  0.00000000  0.24998076  1.0
  Al  Al29  1  0.00000000  0.00000000  0.74949391  1.0
  Ru  Ru30  1  0.49801314  0.99602529  0.00192613  1.0
  Ru  Ru31  1  0.00397471  0.50198686  0.00192613  1.0
  Ru  Ru32  1  0.49971184  0.99942469  0.50248538  1.0
  Ru  Ru33  1  0.49801314  0.50198686  0.00192613  1.0
  Ru  Ru34  1  0.00057531  0.50028816  0.50248538  1.0
  Ru  Ru35  1  0.49971184  0.50028816  0.50248538  1.0
  Ru  Ru36  1  0.00000000  0.00000000  0.00108617  1.0
  Ru  Ru37  1  0.00000000  0.00000000  0.49869536  1.0