# generated using pymatgen
data_TaPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.59164941
_cell_length_b   4.89359383
_cell_length_c   5.57011528
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaPt3
_chemical_formula_sum   'Ta2 Pt6'
_cell_volume   125.15863673
_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
  Ta  Ta0  1  0.75000000  0.34011807  0.75000000  1.0
  Ta  Ta1  1  0.25000000  0.65988193  0.25000000  1.0
  Pt  Pt2  1  0.25000000  0.16602583  0.50012065  1.0
  Pt  Pt3  1  0.75000000  0.83397417  0.49987935  1.0
  Pt  Pt4  1  0.25000000  0.16602583  0.99987935  1.0
  Pt  Pt5  1  0.75000000  0.83397417  0.00012065  1.0
  Pt  Pt6  1  0.25000000  0.65830054  0.75000000  1.0
  Pt  Pt7  1  0.75000000  0.34169846  0.25000000  1.0