# generated using pymatgen
data_Mn2VCrH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11873409
_cell_length_b   10.13687425
_cell_length_c   12.55787824
_cell_angle_alpha   90.04149742
_cell_angle_beta   89.98051856
_cell_angle_gamma   106.46417156
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VCrH28(C7N8)4
_chemical_formula_sum   'Mn2 V1 Cr1 H28 C28 N32'
_cell_volume   991.11909195
_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  0.16127848  0.13220842  0.55061603  1
  V  V1  1  0.34184159  0.87202262  0.05380134  1
  Mn  Mn2  1  0.83564708  0.86759836  0.45008309  1
  Cr  Cr3  1  0.65118287  0.12769278  0.94675265  1
  H  H4  1  0.11376740  0.44839451  0.58056620  1
  H  H5  1  0.38782476  0.55233758  0.08252875  1
  H  H6  1  0.88433723  0.55084023  0.41860330  1
  H  H7  1  0.61128863  0.44815885  0.91846495  1
  H  H8  1  0.18663041  0.64860834  0.46058635  1
  H  H9  1  0.31373521  0.35221271  0.96253548  1
  H  H10  1  0.81197590  0.35096668  0.53869686  1
  H  H11  1  0.68497114  0.64700372  0.03821681  1
  H  H12  1  0.38800036  0.65439999  0.30519543  1
  H  H13  1  0.11324020  0.34763435  0.80625201  1
  H  H14  1  0.61139288  0.34594106  0.69489505  1
  H  H15  1  0.88695198  0.65223551  0.19389428  1
  H  H16  1  0.50240181  0.45055624  0.27844595  1
  H  H17  1  1.00081861  0.55228289  0.77959322  1
  H  H18  1  0.49829291  0.55004485  0.72168342  1
  H  H19  1  0.00019692  0.44808511  0.22028243  1
  H  H20  1  0.53008327  0.23278404  0.34644801  1
  H  H21  1  0.97545395  0.77136637  0.84709677  1
  H  H22  1  0.46964499  0.76828356  0.65324521  1
  H  H23  1  0.02568511  0.22921123  0.15328886  1
  H  H24  1  0.49918912  0.00244298  0.37710172  1
  H  H25  1  1.00431077  0.99884406  0.87804257  1
  H  H26  1  0.50101035  0.99789735  0.62223378  1
  H  H27  1  -0.00339498  0.00225872  0.12343356  1
  H  H28  1  0.33048766  0.90229775  0.45919289  1
  H  H29  1  0.16898277  0.10113908  0.96144342  1
  H  H30  1  0.66997545  0.09818039  0.54033080  1
  H  H31  1  0.83235784  0.89888585  0.04039439  1
  C  C32  1  0.19329390  0.44801915  0.51058033  1
  C  C33  1  0.30949548  0.55352514  0.01203255  1
  C  C34  1  0.80554028  0.55166420  0.48886759  1
  C  C35  1  0.69152856  0.44645606  0.98801074  1
  C  C36  1  0.23819739  0.56260469  0.44384976  1
  C  C37  1  0.26347945  0.43884837  0.94534195  1
  C  C38  1  0.76082349  0.43715779  0.55568456  1
  C  C39  1  0.73668070  0.56099261  0.05479475  1
  C  C40  1  0.34978101  0.56571335  0.35795557  1
  C  C41  1  0.15237784  0.43620683  0.85915494  1
  C  C42  1  0.64988021  0.43441242  0.64189262  1
  C  C43  1  0.84853107  0.56396926  0.14062654  1
  C  C44  1  0.41457342  0.45470261  0.34311709  1
  C  C45  1  0.08883283  0.54766267  0.84402445  1
  C  C46  1  0.58572086  0.54571845  0.65683678  1
  C  C47  1  0.91292273  0.45278957  0.15543526  1
  C  C48  1  0.36130400  0.34108266  0.41219029  1
  C  C49  1  0.14337246  0.66178627  0.91273784  1
  C  C50  1  0.63863846  0.65927756  0.58765197  1
  C  C51  1  0.85935221  0.33889395  0.08639534  1
  C  C52  1  0.42448348  0.22322976  0.40304466  1
  C  C53  1  0.08032223  0.77919550  0.90380784  1
  C  C54  1  0.57530486  0.77700651  0.59690247  1
  C  C55  1  0.92073117  0.22026787  0.09631081  1
  C  C56  1  0.43492198  -0.00182791  0.45471268  1
  C  C57  1  0.06671597  1.00394964  0.95631856  1
  C  C58  1  0.56544442  1.00235977  0.54468622  1
  C  C59  1  0.93338788  -0.00326664  0.04532643  1
  N  N60  1  0.24591228  0.33483879  0.49324555  1
  N  N61  1  0.26023067  0.66837867  0.99353366  1
  N  N62  1  0.75373281  0.66522442  0.50636761  1
  N  N63  1  0.74446136  0.33314044  0.00480621  1
  N  N64  1  0.35742827  0.11265263  0.45875340  1
  N  N65  1  0.14689022  0.89050715  0.96052486  1
  N  N66  1  0.64224440  0.88769306  0.54115304  1
  N  N67  1  0.85136088  0.10912901  0.04093853  1
  N  N68  1  0.03457629  0.91578853  0.57414467  1
  N  N69  1  0.47367812  0.08114257  0.06898457  1
  N  N70  1  0.96357897  0.08332839  0.42562059  1
  N  N71  1  0.52371293  0.91821230  0.92928154  1
  N  N72  1  0.09514213  0.83215897  0.61561306  1
  N  N73  1  0.41333087  0.16478397  0.11328157  1
  N  N74  1  0.90407458  0.16757894  0.38409895  1
  N  N75  1  0.58708757  0.83528210  0.88678858  1
  N  N76  1  0.15678624  0.75072120  0.65049691  1
  N  N77  1  0.35062388  0.24359865  0.14991502  1
  N  N78  1  0.84281555  0.24921503  0.34916089  1
  N  N79  1  0.65256483  0.75725613  0.85170649  1
  N  N80  1  0.95465829  0.19400522  0.65742568  1
  N  N81  1  0.52429678  0.80426506  0.14644916  1
  N  N82  1  0.04944275  0.80590430  0.34269732  1
  N  N83  1  0.46736838  0.19158458  0.85512494  1
  N  N84  1  0.86951644  0.15923365  0.73402022  1
  N  N85  1  0.61760707  0.84166963  0.22111435  1
  N  N86  1  0.13409720  0.84103257  0.26623534  1
  N  N87  1  0.38009526  0.15544416  0.77807774  1
  N  N88  1  0.78742008  0.13311197  0.81307142  1
  N  N89  1  0.71152063  0.87245353  0.29376840  1
  N  N90  1  0.21854904  0.87015651  0.18783980  1
  N  N91  1  0.29000125  0.12530986  0.70353662  1
