# generated using pymatgen
data_MnCrH24C20(N3O4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.33113286
_cell_length_b   11.85303985
_cell_length_c   13.34253643
_cell_angle_alpha   116.04306521
_cell_angle_beta   86.94836507
_cell_angle_gamma   90.01888696
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrH24C20(N3O4)4
_chemical_formula_sum   'Mn1 Cr1 H24 C20 N12 O16'
_cell_volume   1039.87343281
_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
  Mn  Mn0  1  0.49994372  0.50009016  0.50005460  1
  Cr  Cr1  1  0.99993050  1.00007340  0.50025295  1
  H  H2  1  0.44932671  0.28926454  0.58108967  1
  H  H3  1  0.05344601  0.70941853  0.42111643  1
  H  H4  1  0.55084770  0.71068722  0.41885937  1
  H  H5  1  0.95020740  0.29070704  0.57861806  1
  H  H6  1  0.45358530  0.26431965  0.75357153  1
  H  H7  1  0.04334656  0.51436062  0.25069790  1
  H  H8  1  0.54631148  0.73564280  0.24639834  1
  H  H9  1  0.95462113  0.48551106  0.74939333  1
  H  H10  1  0.53607303  0.66472335  0.93220393  1
  H  H11  1  0.96169839  0.73491783  0.06922874  1
  H  H12  1  0.46384585  0.33523462  0.06780766  1
  H  H13  1  0.03754255  0.26516374  0.93101821  1
  H  H14  1  0.52948458  0.67603514  0.75254814  1
  H  H15  1  0.97242952  0.92445724  0.24653872  1
  H  H16  1  0.47045660  0.32394565  0.24747278  1
  H  H17  1  0.03183643  0.07560973  0.75323378  1
  H  H18  1  0.38692274  0.75424186  0.60142249  1
  H  H19  1  0.10222414  0.15137610  0.40430598  1
  H  H20  1  0.61259808  0.24565665  0.39858414  1
  H  H21  1  0.89718939  0.84858701  0.59546668  1
  H  H22  1  0.20396848  0.68253269  0.60044239  1
  H  H23  1  0.28453241  0.07579428  0.40706076  1
  H  H24  1  0.79550552  0.31751324  0.39967036  1
  H  H25  1  0.71471926  0.92388061  0.59225521  1
  C  C26  1  0.46980275  0.37170872  0.65919017  1
  C  C27  1  0.03056586  0.71458759  0.34320691  1
  C  C28  1  0.53029714  0.62824346  0.34076864  1
  C  C29  1  0.97061009  0.28536526  0.65673358  1
  C  C30  1  0.46999647  0.35632229  0.75573786  1
  C  C31  1  0.02838097  0.60349410  0.24684254  1
  C  C32  1  0.52994023  0.64363612  0.24422983  1
  C  C33  1  0.97137259  0.39644712  0.75316974  1
  C  C34  1  0.49244104  0.46269375  0.85662046  1
  C  C35  1  0.00602443  0.60772862  0.14471514  1
  C  C36  1  0.50739777  0.53726620  0.14336375  1
  C  C37  1  0.99313055  0.39222542  0.85535524  1
  C  C38  1  0.51573517  0.58019651  0.85601224  1
  C  C39  1  0.98349430  0.72595156  0.14539692  1
  C  C40  1  0.48418905  0.41976815  0.14399100  1
  C  C41  1  0.01689214  0.27409239  0.85470165  1
  C  C42  1  0.51403209  0.58587150  0.75514510  1
  C  C43  1  0.98665240  0.83247448  0.24559341  1
  C  C44  1  0.48598458  0.41409432  0.24485757  1
  C  C45  1  0.01486373  0.16755662  0.75447618  1
  N  N46  1  0.49314900  0.48325075  0.65715330  1
  N  N47  1  0.00810272  0.82976708  0.34591652  1
  N  N48  1  0.50702183  0.51670383  0.34283311  1
  N  N49  1  0.99238972  0.17018798  0.65419473  1
  N  N50  1  0.49119332  0.44848506  0.95650781  1
  N  N51  1  0.00631240  0.49304919  0.04439761  1
  N  N52  1  0.50851302  0.55147401  0.04347719  1
  N  N53  1  0.99070729  0.50686076  0.95577134  1
  N  N54  1  0.87159399  0.63225350  0.59261821  1
  N  N55  1  0.63233499  0.03094136  0.40965084  1
  N  N56  1  0.12842077  0.36795222  0.40743024  1
  N  N57  1  0.36751996  0.96915546  0.59053258  1
  O  O58  1  0.72236813  0.63766677  0.54924810  1
  O  O59  1  0.78540047  0.08001767  0.45286493  1
  O  O60  1  0.27752566  0.36259753  0.45094591  1
  O  O61  1  0.21392497  0.92042509  0.54793398  1
  O  O62  1  0.91201356  0.54335037  0.61302014  1
  O  O63  1  0.59594022  0.92163685  0.38912391  1
  O  O64  1  0.08812856  0.45685309  0.38699824  1
  O  O65  1  0.40489785  0.07810696  0.61028281  1
  O  O66  1  0.97931242  0.72513664  0.61447583  1
  O  O67  1  0.52367543  0.10242879  0.39149091  1
  O  O68  1  0.02066988  0.27510273  0.38551306  1
  O  O69  1  0.47574477  0.89760229  0.60888306  1
  O  O70  1  0.33925913  0.67152443  0.58942622  1
  O  O71  1  0.14914647  0.07984392  0.41795539  1
  O  O72  1  0.66024184  0.32841679  0.41064223  1
  O  O73  1  0.85009441  0.91974473  0.58137126  1
