# generated using pymatgen
data_HfZr4Sn3P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.59954252
_cell_length_b   8.59954280
_cell_length_c   5.90041101
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999128
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfZr4Sn3P
_chemical_formula_sum   'Hf2 Zr8 Sn6 P2'
_cell_volume   377.88847356
_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
  Hf  Hf0  1  0.66666700  0.33333300  0.00000000  1.0
  Hf  Hf1  1  0.33333300  0.66666700  0.00000000  1.0
  Zr  Zr2  1  0.33333300  0.66666700  0.50000000  1.0
  Zr  Zr3  1  0.66666700  0.33333300  0.50000000  1.0
  Zr  Zr4  1  0.74890059  0.74890059  0.75049499  1.0
  Zr  Zr5  1  0.25109941  1.00000000  0.75049499  1.0
  Zr  Zr6  1  1.00000000  0.25109941  0.75049499  1.0
  Zr  Zr7  1  0.25109941  0.25109941  0.24950501  1.0
  Zr  Zr8  1  0.74890059  0.00000000  0.24950501  1.0
  Zr  Zr9  1  0.00000000  0.74890059  0.24950501  1.0
  Sn  Sn10  1  0.39969911  0.39969911  0.75229319  1.0
  Sn  Sn11  1  0.60030089  0.00000000  0.75229319  1.0
  Sn  Sn12  1  0.00000000  0.60030089  0.75229319  1.0
  Sn  Sn13  1  0.60030089  0.60030089  0.24770681  1.0
  Sn  Sn14  1  0.39969911  1.00000000  0.24770681  1.0
  Sn  Sn15  1  1.00000000  0.39969911  0.24770681  1.0
  P  P16  1  0.00000000  0.00000000  0.00000000  1.0
  P  P17  1  0.00000000  0.00000000  0.50000000  1.0