# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.77017960
_cell_length_b   13.82896935
_cell_length_c   47.09726273
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.98660135
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H16 Pd48'
_cell_volume   1804.23621787
_cell_formula_units_Z   16
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
  H  H1  1  0.224157  0.138089  0.316174  1
  H  H2  1  0.238790  0.658065  0.301519  1
  H  H3  1  0.255050  0.341933  0.302765  1
  H  H4  1  0.725965  0.978613  0.306370  1
  H  H5  1  0.790399  0.582900  0.470577  1
  H  H6  1  0.707681  0.942152  0.415364  1
  H  H7  1  0.281217  0.594897  0.415399  1
  H  H8  1  0.517091  0.219545  0.455762  1
  H  H9  1  0.123568  0.875834  0.577399  1
  H  H10  1  0.987730  0.231523  0.519648  1
  H  H11  1  0.612058  0.897471  0.519378  1
  H  H12  1  0.878101  0.541510  0.573531  1
  H  H13  1  0.651142  0.126812  0.676495  1
  H  H14  1  0.901675  0.500300  0.677584  1
  H  H15  1  0.397759  0.336902  0.667987  1
  H  H16  1  0.145729  0.876573  0.653066  1
  Pd  Pd17  1  0.232971  0.196633  0.366632  1
  Pd  Pd18  1  0.749915  0.551043  0.330411  1
  Pd  Pd19  1  0.226832  0.046310  0.292993  1
  Pd  Pd20  1  0.244935  0.709717  0.349097  1
  Pd  Pd21  1  0.243666  0.374804  0.340248  1
  Pd  Pd22  1  0.739937  0.727831  0.297435  1
  Pd  Pd23  1  0.754372  0.390589  0.289315  1
  Pd  Pd24  1  0.729944  0.040316  0.344792  1
  Pd  Pd25  1  0.260003  0.527662  0.380486  1
  Pd  Pd26  1  0.230580  0.883405  0.320939  1
  Pd  Pd27  1  0.724305  0.215957  0.313020  1
  Pd  Pd28  1  0.248880  0.564037  0.282039  1
  Pd  Pd29  1  0.301061  0.494795  0.482752  1
  Pd  Pd30  1  0.185839  0.851116  0.427402  1
  Pd  Pd31  1  0.738628  0.350948  0.391859  1
  Pd  Pd32  1  0.673678  1.006462  0.451173  1
  Pd  Pd33  1  0.288186  0.672176  0.453672  1
  Pd  Pd34  1  0.222957  0.021340  0.397759  1
  Pd  Pd35  1  0.761569  0.689007  0.401203  1
  Pd  Pd36  1  0.237005  0.328641  0.446137  1
  Pd  Pd37  1  0.607326  0.834827  0.483175  1
  Pd  Pd38  1  0.731177  0.177997  0.420649  1
  Pd  Pd39  1  0.782658  0.506949  0.431133  1
  Pd  Pd40  1  0.718277  0.865667  0.374190  1
  Pd  Pd41  1  0.632666  0.788409  0.590922  1
  Pd  Pd42  1  0.515328  0.144728  0.534379  1
  Pd  Pd43  1  0.810169  0.653104  0.505857  1
  Pd  Pd44  1  0.957223  0.294482  0.561264  1
  Pd  Pd45  1  0.615673  0.966520  0.562414  1
  Pd  Pd46  1  0.463419  0.318126  0.507238  1
  Pd  Pd47  1  0.098799  0.988512  0.507343  1
  Pd  Pd48  1  0.360010  0.629073  0.558822  1
  Pd  Pd49  1  0.081168  0.122290  0.587228  1
  Pd  Pd50  1  0.870179  0.473819  0.535454  1
  Pd  Pd51  1  0.121198  0.812531  0.536689  1
  Pd  Pd52  1  0.985603  0.169566  0.479072  1
  Pd  Pd53  1  0.150393  0.076817  0.687761  1
  Pd  Pd54  1  0.927676  0.432859  0.638940  1
  Pd  Pd55  1  0.128861  0.941951  0.616194  1
  Pd  Pd56  1  0.618817  0.598762  0.666266  1
  Pd  Pd57  1  0.895763  0.258104  0.670509  1
  Pd  Pd58  1  0.879070  0.605273  0.610262  1
  Pd  Pd59  1  0.469694  0.275518  0.615335  1
  Pd  Pd60  1  0.646404  0.910460  0.668844  1
  Pd  Pd61  1  0.384395  0.432155  0.689590  1
  Pd  Pd62  1  0.154011  0.759178  0.643660  1
  Pd  Pd63  1  0.621394  0.098748  0.638158  1
  Pd  Pd64  1  0.392044  0.449936  0.586445  1
