# generated using pymatgen
data_Er5Tm(Sc2In3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.18454584
_cell_length_b   8.81967609
_cell_length_c   8.82465047
_cell_angle_alpha   120.01992449
_cell_angle_beta   89.99859467
_cell_angle_gamma   90.00095982
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er5Tm(Sc2In3)2
_chemical_formula_sum   'Er5 Tm1 Sc4 In6'
_cell_volume   416.77471476
_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
  Er  Er0  1  0.74999817  0.23555540  0.00000772  1.0
  Er  Er1  1  0.75000173  0.76448934  0.76447531  1.0
  Er  Er2  1  0.74999274  0.00000375  0.23609253  1.0
  Er  Er3  1  0.24999798  0.76424172  0.99979844  1.0
  Er  Er4  1  0.24999651  0.23571515  0.23552867  1.0
  Tm  Tm5  1  0.25000587  0.99998866  0.76409210  1.0
  Sc  Sc6  1  0.49999086  0.33337386  0.66670356  1.0
  Sc  Sc7  1  0.49999330  0.66663297  0.33338290  1.0
  Sc  Sc8  1  0.00001585  0.66661979  0.33336783  1.0
  Sc  Sc9  1  0.00001779  0.33338333  0.66671318  1.0
  In  In10  1  0.74996675  0.59212091  0.99992437  1.0
  In  In11  1  0.75000108  0.40791052  0.40779400  1.0
  In  In12  1  0.75001328  0.99998585  0.59226952  1.0
  In  In13  1  0.25001090  0.40740340  0.99966349  1.0
  In  In14  1  0.25000712  0.59258727  0.59222536  1.0
  In  In15  1  0.24998805  0.99998709  0.40796102  1.0