# generated using pymatgen
data_VH14C16(NO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.86723164
_cell_length_b   11.62694708
_cell_length_c   12.29661951
_cell_angle_alpha   118.35460025
_cell_angle_beta   100.15995212
_cell_angle_gamma   89.90483026
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VH14C16(NO3)2
_chemical_formula_sum   'V2 H28 C32 N4 O12'
_cell_volume   969.93857984
_cell_formula_units_Z   2
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
  V  V0  1  0.99999872  0.99999931  0.49999867  1
  V  V1  1  0.50000177  0.50000066  0.50000135  1
  H  H2  1  0.83645453  0.90558058  0.61878642  1
  H  H3  1  0.66378431  0.28601539  0.38151324  1
  H  H4  1  0.16354365  0.09441862  0.38121158  1
  H  H5  1  0.33621907  0.71398556  0.61848830  1
  H  H6  1  0.02390234  0.84577230  0.61403005  1
  H  H7  1  0.47610468  0.23117129  0.38586855  1
  H  H8  1  0.97609657  0.15422754  0.38596837  1
  H  H9  1  0.52389811  0.76882947  0.61413281  1
  H  H10  1  0.76666898  0.94251115  0.25516278  1
  H  H11  1  0.73111396  0.68957095  0.74737483  1
  H  H12  1  0.23332999  0.05748822  0.74483509  1
  H  H13  1  0.26888791  0.31043085  0.25263149  1
  H  H14  1  0.57820202  0.75398410  0.07861717  1
  H  H15  1  0.91878079  0.67739369  0.92381418  1
  H  H16  1  0.42179828  0.24601614  0.92137932  1
  H  H17  1  0.08121751  0.32260577  0.07619273  1
  H  H18  1  0.79569825  0.51257871  0.24007652  1
  H  H19  1  0.70701806  0.27212079  0.75760659  1
  H  H20  1  0.20429569  0.48742023  0.75992037  1
  H  H21  1  0.29298227  0.72787720  0.24239233  1
  H  H22  1  0.98860412  0.70716775  0.40412225  1
  H  H23  1  0.51308339  0.30355242  0.59476698  1
  H  H24  1  0.01139018  0.29283074  0.59587564  1
  H  H25  1  0.48692015  0.69644816  0.40523201  1
  H  H26  1  0.57266865  0.41142991  0.05522247  1
  H  H27  1  0.92928293  0.35537815  0.94246500  1
  H  H28  1  0.42732802  0.58857007  0.94477406  1
  H  H29  1  0.07071519  0.64461931  0.05753672  1
  C  C30  1  0.76944487  0.84553991  0.24828023  1
  C  C31  1  0.72920629  0.59897029  0.75331807  1
  C  C32  1  0.23055338  0.15445973  0.75171730  1
  C  C33  1  0.27079541  0.40103084  0.24668694  1
  C  C34  1  0.66380337  0.73979253  0.15040707  1
  C  C35  1  0.83461212  0.59092117  0.85109323  1
  C  C36  1  0.33619529  0.26020738  0.84958990  1
  C  C37  1  0.16538762  0.40907848  0.14891158  1
  C  C38  1  0.66818904  0.61585877  0.14548657  1
  C  C39  1  0.83190417  0.47111581  0.85454563  1
  C  C40  1  0.33180783  0.38414086  0.85451008  1
  C  C41  1  0.16809526  0.52888263  0.14545683  1
  C  C42  1  0.78671838  0.60638082  0.24046651  1
  C  C43  1  0.71469335  0.36625386  0.75858458  1
  C  C44  1  0.21327714  0.39361833  0.75953068  1
  C  C45  1  0.28530731  0.63374475  0.24141590  1
  C  C46  1  0.89201292  0.71546910  0.33344614  1
  C  C47  1  0.60903382  0.38273506  0.66610291  1
  C  C48  1  0.10798279  0.28452973  0.66655156  1
  C  C49  1  0.39096902  0.61726525  0.33389817  1
  C  C50  1  0.62204284  0.03632652  0.50349669  1
  C  C51  1  0.87784282  0.53298807  0.49672065  1
  C  C52  1  0.37795533  0.96367445  0.49650402  1
  C  C53  1  0.12216031  0.46701330  0.50328178  1
  C  C54  1  0.55531223  0.94454030  0.54029298  1
  C  C55  1  0.94480413  0.40408401  0.45929796  1
  C  C56  1  0.44468589  0.05546083  0.45970770  1
  C  C57  1  0.05519933  0.59591742  0.54070476  1
  C  C58  1  0.55906289  0.50141091  0.04844543  1
  C  C59  1  0.94145912  0.45300794  0.95095136  1
  C  C60  1  0.44093395  0.49858895  0.95155097  1
  C  C61  1  0.05853881  0.54698959  0.04905060  1
  N  N62  1  0.88013787  0.83601888  0.34198259  1
  N  N63  1  0.61982979  0.49532737  0.65861166  1
  N  N64  1  0.11985924  0.16397981  0.65801484  1
  N  N65  1  0.38017386  0.50467417  0.34139147  1
  O  O66  1  0.96130144  0.92158274  0.61602596  1
  O  O67  1  0.53888934  0.30497012  0.38420291  1
  O  O68  1  0.03869640  0.07841623  0.38397154  1
  O  O69  1  0.46111418  0.69503122  0.61579976  1
  O  O70  1  0.77017863  0.08614653  0.51190255  1
  O  O71  1  0.72961723  0.57466215  0.48883440  1
  O  O72  1  0.22981967  0.91385226  0.48809510  1
  O  O73  1  0.27038625  0.42533959  0.51116846  1
  O  O74  1  0.62635271  0.88843647  0.60118007  1
  O  O75  1  0.87382663  0.28696086  0.39893470  1
  O  O76  1  0.37364613  0.11156427  0.39882034  1
  O  O77  1  0.12617655  0.71304040  0.60106448  1
