# generated using pymatgen
data_Ca2Pt2O6F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.22569805
_cell_length_b   7.22565920
_cell_length_c   7.22565990
_cell_angle_alpha   59.99966033
_cell_angle_beta   59.99982014
_cell_angle_gamma   59.99982794
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Pt2O6F
_chemical_formula_sum   'Ca4 Pt4 O12 F2'
_cell_volume   266.75804876
_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
  Ca  Ca0  1  0.12500000  0.12500000  0.62500000  1.0
  Ca  Ca1  1  0.12500000  0.62500000  0.12500000  1.0
  Ca  Ca2  1  0.62500000  0.12500000  0.12500000  1.0
  Ca  Ca3  1  0.12500000  0.12500000  0.12500000  1.0
  Pt  Pt4  1  0.62500000  0.62500000  0.12500000  1.0
  Pt  Pt5  1  0.62500000  0.12500000  0.62500000  1.0
  Pt  Pt6  1  0.12500000  0.62500000  0.62500000  1.0
  Pt  Pt7  1  0.62500000  0.62500000  0.62500000  1.0
  O  O8  1  0.29113297  0.29113319  0.70886602  1.0
  O  O9  1  0.70886782  0.70886602  0.29113319  1.0
  O  O10  1  0.95886706  0.54113294  0.54113294  1.0
  O  O11  1  0.70886540  0.29113460  0.29113460  1.0
  O  O12  1  0.54113239  0.95886664  0.54113410  1.0
  O  O13  1  0.54113218  0.54113398  0.95886681  1.0
  O  O14  1  0.29113294  0.70886706  0.70886706  1.0
  O  O15  1  0.95886686  0.54113410  0.95886664  1.0
  O  O16  1  0.54113460  0.95886540  0.95886540  1.0
  O  O17  1  0.70886761  0.29113336  0.70886590  1.0
  O  O18  1  0.29113314  0.70886590  0.29113336  1.0
  O  O19  1  0.95886703  0.95886681  0.54113398  1.0
  F  F20  1  0.24999975  0.25000025  0.25000025  1.0
  F  F21  1  0.00000025  0.99999975  0.99999975  1.0