# generated using pymatgen
data_TmZr3(ScRu2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47569596
_cell_length_b   4.57614363
_cell_length_c   9.15564356
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99934076
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmZr3(ScRu2)4
_chemical_formula_sum   'Tm1 Zr3 Sc4 Ru8'
_cell_volume   271.31573033
_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  0.74990036  0.25000000  0.12499528  1.0
  Zr  Zr1  1  0.25001847  0.75000000  0.37508844  1.0
  Zr  Zr2  1  0.75010132  0.25000000  0.62502624  1.0
  Zr  Zr3  1  0.24998913  0.75000000  0.87489795  1.0
  Sc  Sc4  1  0.24989591  0.25000000  0.12498084  1.0
  Sc  Sc5  1  0.75001041  0.75000000  0.37551677  1.0
  Sc  Sc6  1  0.25011143  0.25000000  0.62500018  1.0
  Sc  Sc7  1  0.74998290  0.75000000  0.87449903  1.0
  Ru  Ru8  1  0.49272532  0.75000000  0.12497278  1.0
  Ru  Ru9  1  0.00710854  0.75000000  0.12495824  1.0
  Ru  Ru10  1  0.49671516  0.25000000  0.37962830  1.0
  Ru  Ru11  1  0.00327182  0.25000000  0.37963029  1.0
  Ru  Ru12  1  0.99972237  0.75000000  0.62502109  1.0
  Ru  Ru13  1  0.50043825  0.75000000  0.62502464  1.0
  Ru  Ru14  1  0.00327683  0.25000000  0.87038284  1.0
  Ru  Ru15  1  0.49672977  0.25000000  0.87037909  1.0