# generated using pymatgen
data_Zr3Ti3Sn5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56024414
_cell_length_b   9.56024435
_cell_length_c   5.80692396
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999928
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Ti3Sn5
_chemical_formula_sum   'Zr6 Ti6 Sn10'
_cell_volume   459.63675470
_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  0.84589910  0.69179820  0.75000000  1.0
  Zr  Zr1  1  0.15410090  0.84589910  0.25000000  1.0
  Zr  Zr2  1  0.69179820  0.84589910  0.25000000  1.0
  Zr  Zr3  1  0.30820180  0.15410090  0.75000000  1.0
  Zr  Zr4  1  0.84589910  0.15410090  0.75000000  1.0
  Zr  Zr5  1  0.15410090  0.30820180  0.25000000  1.0
  Ti  Ti6  1  0.50000000  0.00000000  0.50000000  1.0
  Ti  Ti7  1  0.50000000  0.50000000  0.00000000  1.0
  Ti  Ti8  1  0.00000000  0.50000000  0.00000000  1.0
  Ti  Ti9  1  0.00000000  0.50000000  0.50000000  1.0
  Ti  Ti10  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti11  1  0.50000000  0.50000000  0.50000000  1.0
  Sn  Sn12  1  0.21123836  0.42247672  0.75000000  1.0
  Sn  Sn13  1  0.78876164  0.21123836  0.25000000  1.0
  Sn  Sn14  1  0.42247672  0.21123836  0.25000000  1.0
  Sn  Sn15  1  0.57752328  0.78876164  0.75000000  1.0
  Sn  Sn16  1  0.21123836  0.78876164  0.75000000  1.0
  Sn  Sn17  1  0.78876164  0.57752328  0.25000000  1.0
  Sn  Sn18  1  0.66666700  0.33333300  0.75000000  1.0
  Sn  Sn19  1  0.33333300  0.66666700  0.25000000  1.0
  Sn  Sn20  1  0.00000000  0.00000000  0.50000000  1.0
  Sn  Sn21  1  0.00000000  0.00000000  0.00000000  1.0