# generated using pymatgen
data_TmSc2Ni9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82089122
_cell_length_b   4.82089163
_cell_length_c   8.31711687
_cell_angle_alpha   73.15297725
_cell_angle_beta   73.15297881
_cell_angle_gamma   59.99999542
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmSc2Ni9
_chemical_formula_sum   'Tm1 Sc2 Ni9'
_cell_volume   157.74896706
_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  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc1  1  0.14044568  0.14044568  0.57866397  1.0
  Sc  Sc2  1  0.85955432  0.85955432  0.42133603  1.0
  Ni  Ni3  1  0.08074467  0.58549415  0.74826802  1.0
  Ni  Ni4  1  0.58549415  0.58549415  0.74826802  1.0
  Ni  Ni5  1  0.58549415  0.08074467  0.74826802  1.0
  Ni  Ni6  1  0.91925533  0.41450585  0.25173198  1.0
  Ni  Ni7  1  0.41450585  0.41450585  0.25173198  1.0
  Ni  Ni8  1  0.41450585  0.91925533  0.25173198  1.0
  Ni  Ni9  1  0.33358299  0.33358299  0.99925202  1.0
  Ni  Ni10  1  0.66641701  0.66641701  0.00074798  1.0
  Ni  Ni11  1  0.50000000  0.50000000  0.50000000  1.0