# generated using pymatgen
data_Er3Sc2In3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.82301788
_cell_length_b   8.82301801
_cell_length_c   6.19063994
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999950
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er3Sc2In3
_chemical_formula_sum   'Er6 Sc4 In6'
_cell_volume   417.35008300
_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
  Er  Er0  1  0.76443405  0.76443405  0.75000000  1.0
  Er  Er1  1  0.23556595  0.00000000  0.75000000  1.0
  Er  Er2  1  1.00000000  0.23556595  0.75000000  1.0
  Er  Er3  1  0.23556595  0.23556595  0.25000000  1.0
  Er  Er4  1  0.76443405  0.00000000  0.25000000  1.0
  Er  Er5  1  0.00000000  0.76443405  0.25000000  1.0
  Sc  Sc6  1  0.66666700  0.33333300  0.00000000  1.0
  Sc  Sc7  1  0.33333300  0.66666700  0.00000000  1.0
  Sc  Sc8  1  0.33333300  0.66666700  0.50000000  1.0
  Sc  Sc9  1  0.66666700  0.33333300  0.50000000  1.0
  In  In10  1  0.40893514  0.40893514  0.75000000  1.0
  In  In11  1  0.59106486  0.00000000  0.75000000  1.0
  In  In12  1  0.00000000  0.59106486  0.75000000  1.0
  In  In13  1  0.59106486  0.59106486  0.25000000  1.0
  In  In14  1  0.40893514  0.00000000  0.25000000  1.0
  In  In15  1  0.00000000  0.40893514  0.25000000  1.0