# generated using pymatgen
data_Tm7Th3(Al2Ru3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.33499912
_cell_length_b   8.33499865
_cell_length_c   8.33499914
_cell_angle_alpha   109.70530358
_cell_angle_beta   109.70530203
_cell_angle_gamma   109.70529814
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm7Th3(Al2Ru3)2
_chemical_formula_sum   'Tm7 Th3 Al4 Ru6'
_cell_volume   441.84811801
_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  0.78044614  0.78044614  0.78044614  1.0
  Tm  Tm1  1  0.31428262  0.56867248  0.74830745  1.0
  Tm  Tm2  1  0.74830745  0.31428262  0.56867248  1.0
  Tm  Tm3  1  0.56867248  0.74830745  0.31428262  1.0
  Tm  Tm4  1  0.71559372  0.50298801  0.99371018  1.0
  Tm  Tm5  1  0.99371018  0.71559372  0.50298801  1.0
  Tm  Tm6  1  0.50298801  0.99371018  0.71559372  1.0
  Th  Th7  1  0.25506203  0.19611991  0.94193069  1.0
  Th  Th8  1  0.94193069  0.25506203  0.19611991  1.0
  Th  Th9  1  0.19611991  0.94193069  0.25506203  1.0
  Al  Al10  1  0.41938219  0.41938219  0.41938219  1.0
  Al  Al11  1  0.09148183  0.50034686  0.99514249  1.0
  Al  Al12  1  0.99514249  0.09148183  0.50034686  1.0
  Al  Al13  1  0.50034686  0.99514249  0.09148183  1.0
  Ru  Ru14  1  0.88562252  0.12083801  0.75391015  1.0
  Ru  Ru15  1  0.75391015  0.88562252  0.12083801  1.0
  Ru  Ru16  1  0.12083801  0.75391015  0.88562252  1.0
  Ru  Ru17  1  0.23627133  0.61278393  0.36710849  1.0
  Ru  Ru18  1  0.36710849  0.23627133  0.61278393  1.0
  Ru  Ru19  1  0.61278393  0.36710849  0.23627133  1.0