# generated using pymatgen
data_Mn2VCrH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11873303
_cell_length_b   10.13698339
_cell_length_c   12.55772829
_cell_angle_alpha   90.02669066
_cell_angle_beta   89.99641757
_cell_angle_gamma   106.46526090
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VCrH28(C7N8)4
_chemical_formula_sum   'Mn2 V1 Cr1 H28 C28 N32'
_cell_volume   991.11238860
_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  0.15109110  0.12765915  0.55336346  1
  Mn  Mn1  1  0.33554462  0.86779855  0.04969747  1
  V  V2  1  0.84257435  0.87180989  0.44694809  1
  Mn  Mn3  1  0.66072324  0.13234661  0.94947579  1
  H  H4  1  0.11099515  0.44782167  0.58208187  1
  H  H5  1  0.38425898  0.55061638  0.08110072  1
  H  H6  1  0.88789133  0.55271417  0.41690250  1
  H  H7  1  0.61387733  0.44875227  0.91979381  1
  H  H8  1  0.18426387  0.64642503  0.46236513  1
  H  H9  1  0.31165737  0.35078608  0.96090421  1
  H  H10  1  0.81432506  0.35267093  0.53689891  1
  H  H11  1  0.68709816  0.64890906  0.03985358  1
  H  H12  1  0.38531807  0.65151127  0.30636607  1
  H  H13  1  0.11083477  0.34552376  0.80504706  1
  H  H14  1  0.61421153  0.34815770  0.69345783  1
  H  H15  1  0.88896532  0.65478909  0.19498827  1
  H  H16  1  0.49928790  0.44755853  0.27981552  1
  H  H17  1  0.99790525  0.54982907  0.77822808  1
  H  H18  1  0.50144324  0.55267144  0.72028315  1
  H  H19  1  0.00307878  0.45089510  0.22151725  1
  H  H20  1  0.52562560  0.22927073  0.34707071  1
  H  H21  1  0.97004802  0.76832571  0.84658067  1
  H  H22  1  0.47503904  0.77123097  0.65254661  1
  H  H23  1  0.02992335  0.23286561  0.15359511  1
  H  H24  1  0.49654759  0.00212118  0.37641268  1
  H  H25  1  1.00169279  0.99808274  0.87762506  1
  H  H26  1  0.50424750  0.99902168  0.62183862  1
  H  H27  1  -0.00130267  0.00231117  0.12271319  1
  H  H28  1  0.33243691  0.89854825  0.45938094  1
  H  H29  1  0.17033512  0.09818471  0.95987232  1
  H  H30  1  0.66883537  0.10137050  0.53831197  1
  H  H31  1  0.83024936  0.90243291  0.04026419  1
  C  C32  1  0.19108258  0.44603788  0.51245016  1
  C  C33  1  0.30550057  0.55158432  0.01085930  1
  C  C34  1  0.80980631  0.55380749  0.48755659  1
  C  C35  1  0.69343178  0.44822954  0.98973136  1
  C  C36  1  0.23598713  0.56044584  0.44569292  1
  C  C37  1  0.26059131  0.43701013  0.94402249  1
  C  C38  1  0.76400673  0.43925946  0.55426622  1
  C  C39  1  0.73865285  0.56288933  0.05644778  1
  C  C40  1  0.34751780  0.56335297  0.35968291  1
  C  C41  1  0.14947029  0.43418093  0.85791719  1
  C  C42  1  0.65305089  0.43668514  0.64057700  1
  C  C43  1  0.85046287  0.56606123  0.14221670  1
  C  C44  1  0.41215366  0.45231232  0.34476134  1
  C  C45  1  0.08546827  0.54555106  0.84298819  1
  C  C46  1  0.58931855  0.54802514  0.65576455  1
  C  C47  1  0.91507649  0.45497467  0.15696765  1
  C  C48  1  0.35880363  0.33847361  0.41379916  1
  C  C49  1  0.13873328  0.65920830  0.91217539  1
  C  C50  1  0.64361878  0.66204156  0.58706092  1
  C  C51  1  0.86144063  0.34125791  0.08792918  1
  C  C52  1  0.42033888  0.21992414  0.40383199  1
  C  C53  1  0.07560547  0.77702320  0.90298915  1
  C  C54  1  0.58031657  0.77928477  0.59608840  1
  C  C55  1  0.92446703  0.22334048  0.09691545  1
  C  C56  1  0.43326533  -0.00351334  0.45450952  1
  C  C57  1  0.06570473  1.00245807  0.95529224  1
  C  C58  1  0.56670123  1.00410639  0.54353841  1
  C  C59  1  0.93472880  -0.00176704  0.04503613  1
  N  N60  1  0.24393775  0.33274772  0.49540201  1
  N  N61  1  0.25377383  0.66515700  0.99346213  1
  N  N62  1  0.76062181  0.66877545  0.50624943  1
  N  N63  1  0.74582786  0.33494320  0.00701142  1
  N  N64  1  0.35077856  0.10857728  0.45883784  1
  N  N65  1  0.14242985  0.88778094  0.95877261  1
  N  N66  1  0.64710811  0.89074469  0.53962980  1
  N  N67  1  0.85732313  0.11280760  0.04108846  1
  N  N68  1  0.02357480  0.91873118  0.57135139  1
  N  N69  1  0.46343219  0.08351443  0.07454515  1
  N  N70  1  0.97380501  0.08116778  0.43118996  1
  N  N71  1  0.53503359  0.91568914  0.92610873  1
  N  N72  1  0.08704622  0.83571785  0.61360470  1
  N  N73  1  0.40376142  0.16783252  0.11594768  1
  N  N74  1  0.91352785  0.16466707  0.38666825  1
  N  N75  1  0.59564279  0.83206399  0.88454559  1
  N  N76  1  0.15273881  0.75779747  0.64845868  1
  N  N77  1  0.34244596  0.24953233  0.15077974  1
  N  N78  1  0.85038610  0.24303432  0.34979365  1
  N  N79  1  0.65714097  0.75058454  0.84951281  1
  N  N80  1  0.96694870  0.19112628  0.64485060  1
  N  N81  1  0.54875328  0.80599662  0.15747075  1
  N  N82  1  0.02620244  0.80503640  0.35414619  1
  N  N83  1  0.45516913  0.19372907  0.84251018  1
  N  N84  1  0.87994310  0.15512433  0.72202564  1
  N  N85  1  0.63383275  0.84018585  0.23390746  1
  N  N86  1  0.11787016  0.84203923  0.27874122  1
  N  N87  1  0.37011957  0.15945787  0.76578979  1
  N  N88  1  0.78994107  0.12481502  0.79656418  1
  N  N89  1  0.71800082  0.86835646  0.31255853  1
  N  N90  1  0.21057477  0.87247926  0.20542746  1
  N  N91  1  0.28798877  0.13454596  0.68669166  1
