# generated using pymatgen
data_MnVH24C20(N3O4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.33088774
_cell_length_b   11.85350419
_cell_length_c   13.34034687
_cell_angle_alpha   116.05673501
_cell_angle_beta   86.95164027
_cell_angle_gamma   90.01368489
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVH24C20(N3O4)4
_chemical_formula_sum   'Mn1 V1 H24 C20 N12 O16'
_cell_volume   1039.58829280
_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  0.49997867  0.50009342  0.50006548  1
  V  V1  1  0.99985528  1.00010303  0.50017189  1
  H  H2  1  0.44913775  0.28903974  0.58115409  1
  H  H3  1  0.05346124  0.70977819  0.42148593  1
  H  H4  1  0.55107756  0.71095018  0.41881084  1
  H  H5  1  0.95044947  0.29032375  0.57819231  1
  H  H6  1  0.45348878  0.26492449  0.75370990  1
  H  H7  1  0.04337775  0.51491289  0.25059174  1
  H  H8  1  0.54651753  0.73504711  0.24626801  1
  H  H9  1  0.95437490  0.48488211  0.74945096  1
  H  H10  1  0.53665752  0.66548728  0.93171490  1
  H  H11  1  0.96100118  0.73605403  0.07011992  1
  H  H12  1  0.46327281  0.33449095  0.06830383  1
  H  H13  1  0.03806931  0.26391113  0.93003644  1
  H  H14  1  0.52992457  0.67604394  0.75188535  1
  H  H15  1  0.97269265  0.92538705  0.24771009  1
  H  H16  1  0.47003178  0.32396055  0.24814943  1
  H  H17  1  0.03186395  0.07466626  0.75202306  1
  H  H18  1  0.38726167  0.75403955  0.60043816  1
  H  H19  1  0.10479560  0.15352943  0.40169945  1
  H  H20  1  0.61227607  0.24580339  0.39952721  1
  H  H21  1  0.89423811  0.84658802  0.59843183  1
  H  H22  1  0.20476465  0.68199117  0.60001277  1
  H  H23  1  0.28768838  0.07857398  0.40338251  1
  H  H24  1  0.79480381  0.31806040  0.40008956  1
  H  H25  1  0.71130759  0.92105547  0.59599759  1
  C  C26  1  0.46969183  0.37175661  0.65911178  1
  C  C27  1  0.03106817  0.71513980  0.34361214  1
  C  C28  1  0.53043707  0.62822274  0.34086897  1
  C  C29  1  0.97044012  0.28480338  0.65627104  1
  C  C30  1  0.47002966  0.35694573  0.75589900  1
  C  C31  1  0.02841553  0.60414723  0.24689261  1
  C  C32  1  0.52995502  0.64302854  0.24408488  1
  C  C33  1  0.97146713  0.39576089  0.75309048  1
  C  C34  1  0.49273127  0.46355822  0.85665620  1
  C  C35  1  0.00561249  0.60859804  0.14491714  1
  C  C36  1  0.50713407  0.53642585  0.14334261  1
  C  C37  1  0.99355605  0.39127980  0.85511721  1
  C  C38  1  0.51606302  0.58082561  0.85574675  1
  C  C39  1  0.98325410  0.72694874  0.14614767  1
  C  C40  1  0.48387081  0.41915687  0.14426674  1
  C  C41  1  0.01727852  0.27300982  0.85383866  1
  C  C42  1  0.51419581  0.58598200  0.75469253  1
  C  C43  1  0.98707254  0.83339899  0.24667983  1
  C  C44  1  0.48582287  0.41400892  0.24532309  1
  C  C45  1  0.01478799  0.16655416  0.75322317  1
  N  N46  1  0.49312184  0.48313572  0.65685279  1
  N  N47  1  0.00876149  0.83073666  0.34713419  1
  N  N48  1  0.50704961  0.51684623  0.34315398  1
  N  N49  1  0.99185738  0.16914403  0.65286417  1
  N  N50  1  0.49133853  0.44874183  0.95627433  1
  N  N51  1  0.00567386  0.49342310  0.04455420  1
  N  N52  1  0.50840902  0.55122662  0.04372406  1
  N  N53  1  0.99123228  0.50642172  0.95559227  1
  N  N54  1  0.87233475  0.63118161  0.59253798  1
  N  N55  1  0.62979088  0.03177734  0.40880993  1
  N  N56  1  0.12769307  0.36909877  0.40749653  1
  N  N57  1  0.36986996  0.96824229  0.59135207  1
  O  O58  1  0.72335462  0.63753170  0.54941075  1
  O  O59  1  0.78196729  0.07924173  0.45233173  1
  O  O60  1  0.27660546  0.36280470  0.45072295  1
  O  O61  1  0.21713909  0.92121785  0.54845057  1
  O  O62  1  0.91182679  0.54202774  0.61277598  1
  O  O63  1  0.59054847  0.92253789  0.38753214  1
  O  O64  1  0.08825387  0.45827696  0.38729183  1
  O  O65  1  0.40992520  0.07710352  0.61191064  1
  O  O66  1  0.98101175  0.72365331  0.61447932  1
  O  O67  1  0.52325801  0.10446015  0.39051236  1
  O  O68  1  0.01905862  0.27659933  0.38547719  1
  O  O69  1  0.47605493  0.89549459  0.60974279  1
  O  O70  1  0.34007313  0.67124065  0.58898415  1
  O  O71  1  0.15220611  0.08156059  0.41430186  1
  O  O72  1  0.65947466  0.32870154  0.41111330  1
  O  O73  1  0.84685628  0.91832730  0.58548974  1
