# generated using pymatgen
data_GdB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.04503389
_cell_length_b   7.13801637
_cell_length_c   7.13801655
_cell_angle_alpha   89.99999446
_cell_angle_beta   90.00000239
_cell_angle_gamma   90.00000117
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GdB4
_chemical_formula_sum   'Gd4 B16'
_cell_volume   206.09965023
_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
  Gd  Gd0  1  0.00000000  0.31698993  0.81698994  1.0
  Gd  Gd1  1  -0.00000000  0.68301007  0.18301006  1.0
  Gd  Gd2  1  -0.00000000  0.18301017  0.31698972  1.0
  Gd  Gd3  1  0.00000000  0.81698983  0.68301028  1.0
  B  B4  1  0.79656395  0.50000000  0.50000001  1.0
  B  B5  1  0.79656394  0.00000001  0.00000001  1.0
  B  B6  1  0.20343605  0.50000000  0.49999999  1.0
  B  B7  1  0.20343606  -0.00000001  -0.00000001  1.0
  B  B8  1  0.49999998  0.53852976  0.67538210  1.0
  B  B9  1  0.50000002  0.46147024  0.32461790  1.0
  B  B10  1  0.49999999  0.96147012  0.17538212  1.0
  B  B11  1  0.50000001  0.03852988  0.82461788  1.0
  B  B12  1  0.50000001  0.67538213  0.46147015  1.0
  B  B13  1  0.49999999  0.32461787  0.53852985  1.0
  B  B14  1  0.49999998  0.17538213  0.03852975  1.0
  B  B15  1  0.50000002  0.82461787  0.96147025  1.0
  B  B16  1  0.50000001  0.58753178  0.91246820  1.0
  B  B17  1  0.49999999  0.41246822  0.08753180  1.0
  B  B18  1  0.50000002  0.91246827  0.41246823  1.0
  B  B19  1  0.49999998  0.08753173  0.58753177  1.0