# generated using pymatgen
data_KCa(PrB12)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.19435764
_cell_length_b   7.19435655
_cell_length_c   5.88145494
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.49553871
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCa(PrB12)2
_chemical_formula_sum   'K1 Ca1 Pr2 B24'
_cell_volume   286.96390903
_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
  K  K0  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca1  1  0.50000000  0.50000000  0.00000000  1.0
  Pr  Pr2  1  0.75200408  0.24799592  0.50000000  1.0
  Pr  Pr3  1  0.24799592  0.75200408  0.50000000  1.0
  B  B4  1  0.17683134  0.32566346  0.64959663  1.0
  B  B5  1  0.92444777  0.57409674  0.14864789  1.0
  B  B6  1  0.67433654  0.82316866  0.64959663  1.0
  B  B7  1  0.42590326  0.07555223  0.14864789  1.0
  B  B8  1  0.17683134  0.32566346  0.35040337  1.0
  B  B9  1  0.92444777  0.57409674  0.85135211  1.0
  B  B10  1  0.67433654  0.82316866  0.35040337  1.0
  B  B11  1  0.42590326  0.07555223  0.85135211  1.0
  B  B12  1  0.39985005  0.39985005  0.50000000  1.0
  B  B13  1  0.14826539  0.65003711  0.00000000  1.0
  B  B14  1  0.89834283  0.89834283  0.50000000  1.0
  B  B15  1  0.65003711  0.14826539  0.00000000  1.0
  B  B16  1  0.32566346  0.17683134  0.64959663  1.0
  B  B17  1  0.07555223  0.42590326  0.14864789  1.0
  B  B18  1  0.82316866  0.67433654  0.64959663  1.0
  B  B19  1  0.57409674  0.92444777  0.14864789  1.0
  B  B20  1  0.10165717  0.10165717  0.50000000  1.0
  B  B21  1  0.85173461  0.34996289  0.00000000  1.0
  B  B22  1  0.60014995  0.60014995  0.50000000  1.0
  B  B23  1  0.34996289  0.85173461  0.00000000  1.0
  B  B24  1  0.32566346  0.17683134  0.35040337  1.0
  B  B25  1  0.07555223  0.42590326  0.85135211  1.0
  B  B26  1  0.82316866  0.67433654  0.35040337  1.0
  B  B27  1  0.57409674  0.92444777  0.85135211  1.0