# generated using pymatgen
data_CaPr2(BPt2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54882346
_cell_length_b   5.47463878
_cell_length_c   7.79122242
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.44926609
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPr2(BPt2)3
_chemical_formula_sum   'Ca1 Pr2 B3 Pt6'
_cell_volume   204.03687350
_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  0.50000000  0.00000000  0.50000000  1.0
  Pr  Pr1  1  0.00000000  0.50000000  0.17281336  1.0
  Pr  Pr2  1  0.50000000  0.50000000  0.82718664  1.0
  B  B3  1  0.50000000  0.00000000  0.00000000  1.0
  B  B4  1  0.00000000  0.50000000  0.65826323  1.0
  B  B5  1  0.50000000  0.50000000  0.34173677  1.0
  Pt  Pt6  1  0.14490908  0.28981815  0.50000000  1.0
  Pt  Pt7  1  0.69329686  0.84465671  0.16779821  1.0
  Pt  Pt8  1  0.85509092  0.71018185  0.50000000  1.0
  Pt  Pt9  1  0.30670314  0.15534329  0.16779821  1.0
  Pt  Pt10  1  0.15136085  0.84465671  0.83220179  1.0
  Pt  Pt11  1  0.84863915  0.15534329  0.83220179  1.0