# generated using pymatgen
data_VNiH24C20(N3O4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.32645164
_cell_length_b   11.84745935
_cell_length_c   13.32799159
_cell_angle_alpha   116.04965700
_cell_angle_beta   86.95266373
_cell_angle_gamma   90.01232556
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VNiH24C20(N3O4)4
_chemical_formula_sum   'V1 Ni1 H24 C20 N12 O16'
_cell_volume   1037.53102200
_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
  Ni  Ni0  1  0.49994670  0.50006427  0.50005012  1
  V  V1  1  1.00033063  0.99997091  0.50015594  1
  H  H2  1  0.44881948  0.28934244  0.57894006  1
  H  H3  1  0.05371144  0.70830435  0.42072009  1
  H  H4  1  0.55131052  0.71066668  0.42103409  1
  H  H5  1  0.95048714  0.29167386  0.57885214  1
  H  H6  1  0.45349889  0.26666659  0.75191373  1
  H  H7  1  0.04338155  0.51438419  0.24910099  1
  H  H8  1  0.54646693  0.73332060  0.24806968  1
  H  H9  1  0.95400974  0.48536525  0.75094490  1
  H  H10  1  0.53727968  0.66646519  0.92821539  1
  H  H11  1  0.96008221  0.73673354  0.07019011  1
  H  H12  1  0.46268215  0.33352718  0.07179822  1
  H  H13  1  0.03874962  0.26321466  0.92997387  1
  H  H14  1  0.53078039  0.67648793  0.74841361  1
  H  H15  1  0.97217570  0.92614330  0.24820161  1
  H  H16  1  0.46916303  0.32354539  0.25163586  1
  H  H17  1  0.03249050  0.07391087  0.75145919  1
  H  H18  1  0.39611475  0.74540914  0.59491572  1
  H  H19  1  0.10457506  0.15509924  0.40246065  1
  H  H20  1  0.60356789  0.25460015  0.40509370  1
  H  H21  1  0.89420644  0.84511683  0.59763704  1
  H  H22  1  0.21311480  0.67166493  0.59417748  1
  H  H23  1  0.28717120  0.07862028  0.40262835  1
  H  H24  1  0.78665900  0.32843710  0.40593356  1
  H  H25  1  0.71137232  0.92061739  0.59709994  1
  C  C26  1  0.46969692  0.37251286  0.65639671  1
  C  C27  1  0.03170514  0.71451319  0.34307457  1
  C  C28  1  0.53032803  0.62749454  0.34360419  1
  C  C29  1  0.97056970  0.28538924  0.65668173  1
  C  C30  1  0.47035518  0.35855557  0.75399963  1
  C  C31  1  0.02826357  0.60397552  0.24623020  1
  C  C32  1  0.52962605  0.64143305  0.24599302  1
  C  C33  1  0.97155649  0.39589072  0.75370826  1
  C  C34  1  0.49308797  0.46468386  0.85494313  1
  C  C35  1  0.00468535  0.60888321  0.14479691  1
  C  C36  1  0.50680549  0.53530722  0.14505818  1
  C  C37  1  0.99416344  0.39101245  0.85526260  1
  C  C38  1  0.51655013  0.58127129  0.85257100  1
  C  C39  1  0.98255833  0.72733577  0.14614611  1
  C  C40  1  0.48340384  0.41872048  0.14744452  1
  C  C41  1  0.01794255  0.27263527  0.85383478  1
  C  C42  1  0.51427809  0.58628186  0.75096317  1
  C  C43  1  0.98721918  0.83374048  0.24670605  1
  C  C44  1  0.48566470  0.41374093  0.24906727  1
  C  C45  1  0.01534913  0.16624734  0.75312731  1
  N  N46  1  0.49242526  0.48350437  0.65277857  1
  N  N47  1  0.00908814  0.83045186  0.34708341  1
  N  N48  1  0.50751288  0.51652943  0.34725347  1
  N  N49  1  0.99226626  0.16942929  0.65281583  1
  N  N50  1  0.49154264  0.44942747  0.95581155  1
  N  N51  1  0.00487371  0.49351546  0.04470568  1
  N  N52  1  0.50828533  0.55055330  0.04418995  1
  N  N53  1  0.99210461  0.50632851  0.95547521  1
  N  N54  1  0.86813760  0.62702498  0.59080785  1
  N  N55  1  0.62864158  0.03380270  0.40814111  1
  N  N56  1  0.13193322  0.37329370  0.40921575  1
  N  N57  1  0.37069319  0.96619265  0.59198908  1
  O  O58  1  0.71736872  0.63143806  0.54768696  1
  O  O59  1  0.78096066  0.08165790  0.45219483  1
  O  O60  1  0.28257924  0.36877201  0.45239269  1
  O  O61  1  0.21761160  0.91917300  0.54891792  1
  O  O62  1  0.91050210  0.53925637  0.61224307  1
  O  O63  1  0.58978188  0.92456410  0.38701627  1
  O  O64  1  0.08976506  0.46115069  0.38786356  1
  O  O65  1  0.41096632  0.07500248  0.61232457  1
  O  O66  1  0.97601767  0.71957668  0.61062144  1
  O  O67  1  0.52207401  0.10619071  0.38921950  1
  O  O68  1  0.02392557  0.28078044  0.38929975  1
  O  O69  1  0.47665774  0.89333971  0.61073706  1
  O  O70  1  0.34797752  0.66313482  0.58435126  1
  O  O71  1  0.15161486  0.08197547  0.41397632  1
  O  O72  1  0.65180144  0.33688141  0.41571676  1
  O  O73  1  0.84693372  0.91808021  0.58602473  1
