# generated using pymatgen
data_Ca8ThPt6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.58343493
_cell_length_b   7.60400335
_cell_length_c   7.67705967
_cell_angle_alpha   70.98402718
_cell_angle_beta   70.48422769
_cell_angle_gamma   70.64387236
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca8ThPt6
_chemical_formula_sum   'Ca8 Th1 Pt6'
_cell_volume   381.98463408
_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  0.98837769  0.00978896  0.99770961  1.0
  Ca  Ca1  1  0.20002282  0.20107082  0.20010990  1.0
  Ca  Ca2  1  0.85356589  0.59824512  0.33407701  1.0
  Ca  Ca3  1  0.66693752  0.15337918  0.39982180  1.0
  Ca  Ca4  1  0.33445689  0.84898672  0.60222867  1.0
  Ca  Ca5  1  0.15064250  0.39522143  0.67280127  1.0
  Ca  Ca6  1  0.81203083  0.80418990  0.79070751  1.0
  Ca  Ca7  1  0.59983408  0.32896972  0.84164130  1.0
  Th  Th8  1  0.39993176  0.67680881  0.14189899  1.0
  Pt  Pt9  1  0.80574159  0.43337925  0.05160914  1.0
  Pt  Pt10  1  0.58376968  0.93953012  0.17074815  1.0
  Pt  Pt11  1  0.06482785  0.83300778  0.40152555  1.0
  Pt  Pt12  1  0.95482837  0.15888725  0.58420848  1.0
  Pt  Pt13  1  0.40986316  0.03302618  0.85003547  1.0
  Pt  Pt14  1  0.17516937  0.58550974  0.96087614  1.0