# generated using pymatgen
data_Zr3Sc(InPt2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.58267696
_cell_length_b   7.58267758
_cell_length_c   6.73880189
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.75724442
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Sc(InPt2)2
_chemical_formula_sum   'Zr6 Sc2 In4 Pt8'
_cell_volume   387.45737771
_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
  Zr  Zr0  1  0.68067503  0.31932497  0.50000000  1.0
  Zr  Zr1  1  0.31932497  0.68067503  0.50000000  1.0
  Zr  Zr2  1  0.18123959  0.18123959  0.00000000  1.0
  Zr  Zr3  1  0.81876041  0.81876041  0.00000000  1.0
  Zr  Zr4  1  0.84383905  0.84383905  0.50000000  1.0
  Zr  Zr5  1  0.15616095  0.15616095  0.50000000  1.0
  Sc  Sc6  1  0.34559956  0.65440044  0.00000000  1.0
  Sc  Sc7  1  0.65440044  0.34559956  0.00000000  1.0
  In  In8  1  0.50000000  0.00000000  0.25163937  1.0
  In  In9  1  0.00000000  0.50000000  0.74836063  1.0
  In  In10  1  0.50000000  0.00000000  0.74836063  1.0
  In  In11  1  0.00000000  0.50000000  0.25163937  1.0
  Pt  Pt12  1  0.86965697  0.13034303  0.22432117  1.0
  Pt  Pt13  1  0.13034303  0.86965697  0.22432117  1.0
  Pt  Pt14  1  0.36888509  0.36888509  0.72485008  1.0
  Pt  Pt15  1  0.63111491  0.63111491  0.72485008  1.0
  Pt  Pt16  1  0.13034303  0.86965697  0.77567883  1.0
  Pt  Pt17  1  0.86965697  0.13034303  0.77567883  1.0
  Pt  Pt18  1  0.63111491  0.63111491  0.27514992  1.0
  Pt  Pt19  1  0.36888509  0.36888509  0.27514992  1.0