# generated using pymatgen
data_Sc3Ti2Sn3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.32200856
_cell_length_b   8.32200965
_cell_length_c   5.77172244
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999565
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Ti2Sn3
_chemical_formula_sum   'Sc6 Ti4 Sn6'
_cell_volume   346.17241836
_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
  Sc  Sc0  1  0.23998594  0.00000000  0.25000000  1.0
  Sc  Sc1  1  0.23998594  0.23998594  0.75000000  1.0
  Sc  Sc2  1  0.00000000  0.76001406  0.75000000  1.0
  Sc  Sc3  1  1.00000000  0.23998594  0.25000000  1.0
  Sc  Sc4  1  0.76001406  0.76001406  0.25000000  1.0
  Sc  Sc5  1  0.76001406  0.00000000  0.75000000  1.0
  Ti  Ti6  1  0.33333300  0.66666700  0.00000000  1.0
  Ti  Ti7  1  0.66666700  0.33333300  0.50000000  1.0
  Ti  Ti8  1  0.66666700  0.33333300  0.00000000  1.0
  Ti  Ti9  1  0.33333300  0.66666700  0.50000000  1.0
  Sn  Sn10  1  0.60231230  0.00000000  0.25000000  1.0
  Sn  Sn11  1  0.60231230  0.60231230  0.75000000  1.0
  Sn  Sn12  1  0.00000000  0.39768770  0.75000000  1.0
  Sn  Sn13  1  1.00000000  0.60231230  0.25000000  1.0
  Sn  Sn14  1  0.39768770  0.39768770  0.25000000  1.0
  Sn  Sn15  1  0.39768770  0.00000000  0.75000000  1.0