# generated using pymatgen
data_Ca(LaPt)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.73773696
_cell_length_b   7.73773745
_cell_length_c   7.73773748
_cell_angle_alpha   71.86019963
_cell_angle_beta   71.86019750
_cell_angle_gamma   71.86019626
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(LaPt)2
_chemical_formula_sum   'Ca3 La6 Pt6'
_cell_volume   406.41006566
_cell_formula_units_Z   3
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
  Ca  Ca0  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca1  1  0.80218267  0.80218267  0.80218267  1.0
  Ca  Ca2  1  0.19781733  0.19781733  0.19781733  1.0
  La  La3  1  0.32492843  0.60445722  0.84695166  1.0
  La  La4  1  0.84695166  0.32492843  0.60445722  1.0
  La  La5  1  0.60445722  0.84695166  0.32492843  1.0
  La  La6  1  0.67507157  0.39554278  0.15304834  1.0
  La  La7  1  0.15304834  0.67507157  0.39554278  1.0
  La  La8  1  0.39554278  0.15304834  0.67507157  1.0
  Pt  Pt9  1  0.17299136  0.95332373  0.58546029  1.0
  Pt  Pt10  1  0.58546029  0.17299136  0.95332373  1.0
  Pt  Pt11  1  0.95332373  0.58546029  0.17299136  1.0
  Pt  Pt12  1  0.82700864  0.04667627  0.41453971  1.0
  Pt  Pt13  1  0.41453971  0.82700864  0.04667627  1.0
  Pt  Pt14  1  0.04667627  0.41453971  0.82700864  1.0