# generated using pymatgen
data_Tm3Sc2In3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17794927
_cell_length_b   8.79560885
_cell_length_c   8.79614570
_cell_angle_alpha   119.99797869
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Sc2In3
_chemical_formula_sum   'Tm6 Sc4 In6'
_cell_volume   413.94451883
_cell_formula_units_Z   2
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  0.74999291  0.23583824  0.00000000  1.0
  Tm  Tm1  1  0.74999416  0.76414578  0.76412929  1.0
  Tm  Tm2  1  0.74999416  0.00001648  0.23587071  1.0
  Tm  Tm3  1  0.24999291  0.76416176  1.00000000  1.0
  Tm  Tm4  1  0.24999416  0.23585422  0.23587071  1.0
  Tm  Tm5  1  0.24999416  0.99998352  0.76412929  1.0
  Sc  Sc6  1  0.49999365  0.33340209  0.66681163  1.0
  Sc  Sc7  1  0.49999365  0.66658946  0.33318837  1.0
  Sc  Sc8  1  0.99999365  0.66659791  0.33318837  1.0
  Sc  Sc9  1  0.99999365  0.33341054  0.66681163  1.0
  In  In10  1  0.75003693  0.59245813  1.00000000  1.0
  In  In11  1  0.74999678  0.40754259  0.40752998  1.0
  In  In12  1  0.74999678  0.00001361  0.59247002  1.0
  In  In13  1  0.25003693  0.40754187  0.00000000  1.0
  In  In14  1  0.24999678  0.59245741  0.59247002  1.0
  In  In15  1  0.24999678  0.99998639  0.40752998  1.0