# generated using pymatgen
data_Ca2AlP3Pt7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.80140024
_cell_length_b   13.80140024
_cell_length_c   13.80140024
_cell_angle_alpha   163.29772807
_cell_angle_beta   163.29772807
_cell_angle_gamma   23.70575738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2AlP3Pt7
_chemical_formula_sum   'Ca2 Al1 P3 Pt7'
_cell_volume   217.08888484
_cell_formula_units_Z   1
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  0.66609160  0.66609160  0.00000000  1.0
  Ca  Ca1  1  0.33390840  0.33390840  -0.00000000  1.0
  Al  Al2  1  0.50000000  0.50000000  -0.00000000  1.0
  P  P3  1  0.87818778  0.87818778  0.00000000  1.0
  P  P4  1  0.12181222  0.12181222  -0.00000000  1.0
  P  P5  1  0.25000000  0.75000000  0.50000000  1.0
  Pt  Pt6  1  0.42894045  0.92894045  0.50000000  1.0
  Pt  Pt7  1  0.92699307  0.42699307  0.50000000  1.0
  Pt  Pt8  1  0.57300693  0.07300693  0.50000000  1.0
  Pt  Pt9  1  0.07105955  0.57105955  0.50000000  1.0
  Pt  Pt10  1  0.79369371  0.79369371  0.00000000  1.0
  Pt  Pt11  1  0.20630629  0.20630629  -0.00000000  1.0
  Pt  Pt12  1  -0.00000000  -0.00000000  0.00000000  1.0