# generated using pymatgen
data_Pr3B(CBr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.13335994
_cell_length_b   3.95072218
_cell_length_c   11.49934599
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3B(CBr)2
_chemical_formula_sum   'Pr12 B4 C8 Br8'
_cell_volume   687.51945698
_cell_formula_units_Z   4
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
  Pr  Pr0  1  0.33035484  0.25000100  0.69896572  1.0
  Pr  Pr1  1  0.16964516  0.75000000  0.19896572  1.0
  Pr  Pr2  1  0.83035584  0.25000100  0.80103328  1.0
  Pr  Pr3  1  0.66964416  0.75000000  0.30103428  1.0
  Pr  Pr4  1  0.13804152  0.25000100  0.87759706  1.0
  Pr  Pr5  1  0.36195848  0.75000000  0.37759806  1.0
  Pr  Pr6  1  0.63804152  0.25000100  0.62240294  1.0
  Pr  Pr7  1  0.86195848  0.75000000  0.12240294  1.0
  Pr  Pr8  1  0.33935071  0.25000100  0.05303132  1.0
  Pr  Pr9  1  0.16064929  0.75000000  0.55303132  1.0
  Pr  Pr10  1  0.83935171  0.25000100  0.44696868  1.0
  Pr  Pr11  1  0.66064829  0.75000000  0.94696868  1.0
  B  B12  1  0.25467265  0.75000000  0.87505878  1.0
  B  B13  1  0.24532735  0.25000100  0.37505978  1.0
  B  B14  1  0.75467265  0.75000000  0.62494022  1.0
  B  B15  1  0.74532735  0.25000100  0.12494122  1.0
  C  C16  1  0.27529414  0.25000100  0.25210478  1.0
  C  C17  1  0.22470586  0.75000000  0.75210478  1.0
  C  C18  1  0.77529414  0.25000100  0.24789522  1.0
  C  C19  1  0.72470586  0.75000000  0.74789422  1.0
  C  C20  1  0.26808149  0.25000100  0.50026164  1.0
  C  C21  1  0.23191851  0.75000000  0.00026264  1.0
  C  C22  1  0.76808149  0.25000100  0.99973736  1.0
  C  C23  1  0.73191851  0.75000000  0.49973836  1.0
  Br  Br24  1  0.01002348  0.25000100  0.63403416  1.0
  Br  Br25  1  0.48997652  0.75000000  0.13403316  1.0
  Br  Br26  1  0.51002348  0.25000100  0.86596684  1.0
  Br  Br27  1  0.98997652  0.75000000  0.36596684  1.0
  Br  Br28  1  0.02695633  0.25000100  0.11537238  1.0
  Br  Br29  1  0.47304467  0.75000000  0.61537338  1.0
  Br  Br30  1  0.52695633  0.25000100  0.38462762  1.0
  Br  Br31  1  0.97304367  0.75000000  0.88462662  1.0