# generated using pymatgen
data_Gd4NiB16Rh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.96770311
_cell_length_b   6.96770274
_cell_length_c   6.96770299
_cell_angle_alpha   112.61128484
_cell_angle_beta   111.53553399
_cell_angle_gamma   104.38549684
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Gd4NiB16Rh3
_chemical_formula_sum   'Gd4 Ni1 B16 Rh3'
_cell_volume   258.85792825
_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
  Gd  Gd0  1  0.21352263  0.21147079  0.00205285  1.0
  Gd  Gd1  1  0.79058306  0.78853021  0.00205285  1.0
  Gd  Gd2  1  0.74825960  0.24801756  0.50024104  1.0
  Gd  Gd3  1  0.25222349  0.75198244  0.50024104  1.0
  Ni  Ni4  1  0.25784751  0.50000000  0.75784751  1.0
  B  B5  1  0.10907017  0.27238174  0.38145190  1.0
  B  B6  1  0.89243176  0.73417560  0.62660435  1.0
  B  B7  1  0.89243176  0.26582640  0.15825616  1.0
  B  B8  1  0.10907017  0.72761826  0.83668743  1.0
  B  B9  1  0.72950044  0.89068657  0.62018400  1.0
  B  B10  1  0.26636398  0.10967458  0.37603856  1.0
  B  B11  1  0.72949944  0.10931643  0.83881487  1.0
  B  B12  1  0.26636498  0.89032842  0.15669140  1.0
  B  B13  1  0.41281772  0.41807972  0.53088225  1.0
  B  B14  1  0.89180960  0.89176751  0.47752575  1.0
  B  B15  1  0.58575824  0.10823249  0.00004309  1.0
  B  B16  1  0.11280253  0.58192128  0.99473900  1.0
  B  B17  1  0.58575824  0.58571515  0.47752575  1.0
  B  B18  1  0.11280353  0.11806453  0.53088225  1.0
  B  B19  1  0.89180960  0.41428385  0.00004309  1.0
  B  B20  1  0.41281572  0.88193647  0.99473900  1.0
  Rh  Rh21  1  0.49732579  0.26940127  0.76672706  1.0
  Rh  Rh22  1  0.49732679  0.73060073  0.22792553  1.0
  Rh  Rh23  1  0.74181627  0.50000100  0.24181527  1.0