# generated using pymatgen
data_TmScFeB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.40468231
_cell_length_b   8.86334514
_cell_length_c   11.20556065
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmScFeB6
_chemical_formula_sum   'Tm4 Sc4 Fe4 B24'
_cell_volume   338.14879689
_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  0.82182118  0.08546667  1.0
  Tm  Tm1  1  0.00000000  0.17817882  0.91453333  1.0
  Tm  Tm2  1  0.00000000  0.32182118  0.41453333  1.0
  Tm  Tm3  1  0.00000000  0.67817882  0.58546667  1.0
  Sc  Sc4  1  0.00000000  0.44395638  0.12840539  1.0
  Sc  Sc5  1  0.00000000  0.55604362  0.87159461  1.0
  Sc  Sc6  1  0.00000000  0.94395638  0.37159461  1.0
  Sc  Sc7  1  0.00000000  0.05604362  0.62840539  1.0
  Fe  Fe8  1  0.00000000  0.14018792  0.18127572  1.0
  Fe  Fe9  1  0.00000000  0.85981208  0.81872428  1.0
  Fe  Fe10  1  0.00000000  0.64018792  0.31872428  1.0
  Fe  Fe11  1  0.00000000  0.35981208  0.68127572  1.0
  B  B12  1  0.50000000  0.05529484  0.06824702  1.0
  B  B13  1  0.50000000  0.94470516  0.93175298  1.0
  B  B14  1  0.50000000  0.55529484  0.43175298  1.0
  B  B15  1  0.50000000  0.44470516  0.56824702  1.0
  B  B16  1  0.50000000  0.25042140  0.08237623  1.0
  B  B17  1  0.50000000  0.74957860  0.91762377  1.0
  B  B18  1  0.50000000  0.75042140  0.41762377  1.0
  B  B19  1  0.50000000  0.24957860  0.58237623  1.0
  B  B20  1  0.50000000  0.29204591  0.23475594  1.0
  B  B21  1  0.50000000  0.70795409  0.76524406  1.0
  B  B22  1  0.50000000  0.79204591  0.26524406  1.0
  B  B23  1  0.50000000  0.20795409  0.73475594  1.0
  B  B24  1  0.50000000  0.13024972  0.31594962  1.0
  B  B25  1  0.50000000  0.86975028  0.68405038  1.0
  B  B26  1  0.50000000  0.63024972  0.18405038  1.0
  B  B27  1  0.50000000  0.36975028  0.81594962  1.0
  B  B28  1  0.50000000  0.48416566  0.28672104  1.0
  B  B29  1  0.50000000  0.51583434  0.71327896  1.0
  B  B30  1  0.50000000  0.98416566  0.21327896  1.0
  B  B31  1  0.50000000  0.01583434  0.78672104  1.0
  B  B32  1  0.50000000  0.10128874  0.47266737  1.0
  B  B33  1  0.50000000  0.89871126  0.52733263  1.0
  B  B34  1  0.50000000  0.60128874  0.02733263  1.0
  B  B35  1  0.50000000  0.39871126  0.97266737  1.0