# generated using pymatgen
data_ZrPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69323639
_cell_length_b   5.69323639
_cell_length_c   9.29995900
_cell_angle_alpha   89.99999985
_cell_angle_beta   90.00000015
_cell_angle_gamma   120.00014046
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrPt3
_chemical_formula_sum   'Zr4 Pt12'
_cell_volume   261.05347801
_cell_formula_units_Z   4
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  0.00000000  0.00000000  0.50000000  1.0
  Zr  Zr1  1  0.00000000  0.00000000  -0.00000000  1.0
  Zr  Zr2  1  0.66667074  0.33332926  0.74999716  1.0
  Zr  Zr3  1  0.33332926  0.66667074  0.25000284  1.0
  Pt  Pt4  1  0.50000000  0.00000000  0.50000000  1.0
  Pt  Pt5  1  0.50000000  0.50000000  0.50000000  1.0
  Pt  Pt6  1  0.00000000  0.50000000  0.50000000  1.0
  Pt  Pt7  1  0.50000000  0.00000000  -0.00000000  1.0
  Pt  Pt8  1  0.50000000  0.50000000  -0.00000000  1.0
  Pt  Pt9  1  0.00000000  0.50000000  -0.00000000  1.0
  Pt  Pt10  1  0.17014111  0.82985889  0.75002001  1.0
  Pt  Pt11  1  0.65973128  0.82985662  0.75002001  1.0
  Pt  Pt12  1  0.17014338  0.34026872  0.75002001  1.0
  Pt  Pt13  1  0.82985889  0.17014111  0.24997999  1.0
  Pt  Pt14  1  0.34026872  0.17014338  0.24997999  1.0
  Pt  Pt15  1  0.82985662  0.65973128  0.24997999  1.0