# generated using pymatgen
data_Ca3PrTi8O20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84092829
_cell_length_b   7.63304372
_cell_length_c   8.60658410
_cell_angle_alpha   90.11024226
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3PrTi8O20
_chemical_formula_sum   'Ca3 Pr1 Ti8 O20'
_cell_volume   383.71576033
_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  0.00000000  0.36409305  0.66524432  1.0
  Ca  Ca1  1  0.00000000  0.63827546  0.33574285  1.0
  Ca  Ca2  1  0.00000000  0.85408615  0.83030603  1.0
  Pr  Pr3  1  0.00000000  0.13376441  0.16562548  1.0
  Ti  Ti4  1  0.50000000  0.11664912  0.85548870  1.0
  Ti  Ti5  1  0.50000000  0.88328908  0.14266038  1.0
  Ti  Ti6  1  0.50000000  0.61468806  0.64090437  1.0
  Ti  Ti7  1  0.50000000  0.38485027  0.35877825  1.0
  Ti  Ti8  1  0.24181031  0.50243185  0.99862395  1.0
  Ti  Ti9  1  0.75747687  0.00064661  0.50465052  1.0
  Ti  Ti10  1  0.75818969  0.50243185  0.99862395  1.0
  Ti  Ti11  1  0.24252313  0.00064661  0.50465052  1.0
  O  O12  1  0.25851587  0.90292107  0.29159388  1.0
  O  O13  1  0.25905957  0.10464004  0.70730486  1.0
  O  O14  1  0.74076732  0.39203265  0.20531140  1.0
  O  O15  1  0.73933018  0.60312004  0.79380465  1.0
  O  O16  1  0.74094043  0.10464004  0.70730486  1.0
  O  O17  1  0.74148413  0.90292107  0.29159388  1.0
  O  O18  1  0.26066982  0.60312004  0.79380465  1.0
  O  O19  1  0.25923268  0.39203265  0.20531140  1.0
  O  O20  1  0.50000000  0.33899761  0.92549901  1.0
  O  O21  1  0.50000000  0.65829230  0.07873174  1.0
  O  O22  1  0.50000000  0.83971831  0.57403066  1.0
  O  O23  1  0.50000000  0.16174428  0.42798611  1.0
  O  O24  1  0.28665343  0.99806105  0.99833859  1.0
  O  O25  1  0.71380104  0.50100551  0.49893313  1.0
  O  O26  1  0.71334657  0.99806105  0.99833859  1.0
  O  O27  1  0.28619896  0.50100551  0.49893313  1.0
  O  O28  1  0.00000000  0.16133756  0.44520004  1.0
  O  O29  1  0.00000000  0.83955837  0.55585440  1.0
  O  O30  1  0.00000000  0.66116300  0.05789858  1.0
  O  O31  1  0.00000000  0.33977635  0.94292412  1.0