# generated using pymatgen
data_CrFeH24C20(N3O4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.32758577
_cell_length_b   11.84922779
_cell_length_c   13.33629543
_cell_angle_alpha   116.04467549
_cell_angle_beta   86.94833020
_cell_angle_gamma   90.01987340
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrFeH24C20(N3O4)4
_chemical_formula_sum   'Cr1 Fe1 H24 C20 N12 O16'
_cell_volume   1038.53617532
_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
  Cr  Cr0  1  0.49992362  0.50005351  0.50002345  1
  Fe  Fe1  1  0.99951598  1.00013281  0.50023804  1
  H  H2  1  0.44918381  0.28852668  0.57935980  1
  H  H3  1  0.05382521  0.70836437  0.41953175  1
  H  H4  1  0.55090060  0.71144135  0.42060878  1
  H  H5  1  0.95019594  0.29161806  0.58007803  1
  H  H6  1  0.45371660  0.26523987  0.75117384  1
  H  H7  1  0.04342950  0.51237114  0.24847046  1
  H  H8  1  0.54621948  0.73474291  0.24879235  1
  H  H9  1  0.95413049  0.48747015  0.75167480  1
  H  H10  1  0.53650642  0.66551871  0.92970981  1
  H  H11  1  0.96064990  0.73464337  0.06810941  1
  H  H12  1  0.46346404  0.33445475  0.07027520  1
  H  H13  1  0.03817765  0.26533458  0.93204759  1
  H  H14  1  0.53065877  0.67726256  0.75116991  1
  H  H15  1  0.97244345  0.92402647  0.24701308  1
  H  H16  1  0.46928194  0.32274785  0.24886763  1
  H  H17  1  0.03213237  0.07606279  0.75269753  1
  H  H18  1  0.39733256  0.74652362  0.59439381  1
  H  H19  1  0.10601273  0.15031182  0.40178239  1
  H  H20  1  0.60234939  0.25350821  0.40561092  1
  H  H21  1  0.89269307  0.84935262  0.59815099  1
  H  H22  1  0.21483498  0.66853314  0.59223660  1
  H  H23  1  0.28908161  0.07802499  0.40282186  1
  H  H24  1  0.78502158  0.33151653  0.40782150  1
  H  H25  1  0.70923751  0.92099262  0.59688021  1
  C  C26  1  0.46991468  0.37188575  0.65679452  1
  C  C27  1  0.03170140  0.71298064  0.34129580  1
  C  C28  1  0.53002684  0.62810757  0.34318671  1
  C  C29  1  0.97045812  0.28698717  0.65849780  1
  C  C30  1  0.47030252  0.35757746  0.75390897  1
  C  C31  1  0.02857240  0.60172809  0.24514507  1
  C  C32  1  0.52966000  0.64240467  0.24606555  1
  C  C33  1  0.97134573  0.39818216  0.75482493  1
  C  C34  1  0.49256146  0.46362584  0.85537029  1
  C  C35  1  0.00536444  0.60738133  0.14389290  1
  C  C36  1  0.50730843  0.53635167  0.14462228  1
  C  C37  1  0.99373509  0.39256273  0.85617141  1
  C  C38  1  0.51587736  0.58072654  0.85375451  1
  C  C39  1  0.98293847  0.72535136  0.14405719  1
  C  C40  1  0.48403842  0.41924748  0.14624207  1
  C  C41  1  0.01761190  0.27465460  0.85593543  1
  C  C42  1  0.51412285  0.58679775  0.75297149  1
  C  C43  1  0.98723873  0.83133383  0.24464263  1
  C  C44  1  0.48573557  0.41320494  0.24703965  1
  C  C45  1  0.01533198  0.16869672  0.75521793  1
  N  N46  1  0.49236044  0.48393409  0.65308263  1
  N  N47  1  0.00990496  0.82655252  0.34300272  1
  N  N48  1  0.50737611  0.51610186  0.34694834  1
  N  N49  1  0.99266313  0.17348219  0.65686728  1
  N  N50  1  0.49130995  0.44909840  0.95598902  1
  N  N51  1  0.00563418  0.49288328  0.04435409  1
  N  N52  1  0.50844710  0.55089092  0.04401807  1
  N  N53  1  0.99117998  0.50700943  0.95585877  1
  N  N54  1  0.86767629  0.62239057  0.59034552  1
  N  N55  1  0.63052844  0.03799041  0.40834155  1
  N  N56  1  0.13230161  0.37786540  0.40965598  1
  N  N57  1  0.36904464  0.96229692  0.59185845  1
  O  O58  1  0.71396258  0.62774998  0.54728590  1
  O  O59  1  0.78029458  0.08598765  0.45178610  1
  O  O60  1  0.28597304  0.37239100  0.45270931  1
  O  O61  1  0.21809237  0.91542917  0.54964612  1
  O  O62  1  0.90615965  0.53343014  0.61048095  1
  O  O63  1  0.59006882  0.92841484  0.38615867  1
  O  O64  1  0.09388865  0.46697996  0.38971756  1
  O  O65  1  0.41140763  0.07133441  0.61322858  1
  O  O66  1  0.97525637  0.71272167  0.60862712  1
  O  O67  1  0.52183407  0.11054976  0.38878754  1
  O  O68  1  0.02471977  0.28748319  0.39118459  1
  O  O69  1  0.47696633  0.88910245  0.61116233  1
  O  O70  1  0.35020480  0.66160216  0.58079147  1
  O  O71  1  0.15410222  0.07987448  0.41427543  1
  O  O72  1  0.64967751  0.33844772  0.41945878  1
  O  O73  1  0.84419877  0.91944656  0.58527978  1
