# generated using pymatgen
data_VCoNiH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86552523
_cell_length_b   10.85998396
_cell_length_c   10.84967343
_cell_angle_alpha   89.26149002
_cell_angle_beta   89.06195992
_cell_angle_gamma   63.77945648
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCoNiH8C14(NO)6
_chemical_formula_sum   'V2 Co2 Ni2 H16 C28 N12 O12'
_cell_volume   1148.34027274
_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
  Co  Co0  1  0.91024798  0.08901500  0.24716345  1
  Co  Co1  1  0.08975525  0.91098668  0.75283457  1
  Ni  Ni2  1  0.85621185  0.98571487  -0.00489339  1
  V  V3  1  0.01049770  0.14753813  0.49882550  1
  Ni  Ni4  1  0.14379037  0.01428239  1.00489235  1
  V  V5  1  0.98949818  0.85246625  0.50117473  1
  H  H6  1  0.53689160  0.16775577  0.41358761  1
  H  H7  1  0.83143169  0.46429942  0.08717664  1
  H  H8  1  0.46310985  0.83223385  0.58641804  1
  H  H9  1  0.16857375  0.53570239  0.91282060  1
  H  H10  1  0.33306440  0.15475329  0.51230311  1
  H  H11  1  0.84318238  0.66844211  0.98910714  1
  H  H12  1  0.66693042  0.84524543  0.48769687  1
  H  H13  1  0.15682431  0.33156016  0.01089135  1
  H  H14  1  0.42487362  0.07327250  0.05748921  1
  H  H15  1  0.93037116  0.57463190  0.44236935  1
  H  H16  1  0.57513387  0.92672659  0.94251311  1
  H  H17  1  0.06962112  0.42537425  0.55763211  1
  H  H18  1  0.87711099  0.20926185  0.04376746  1
  H  H19  1  0.78707968  0.12315437  0.45393838  1
  H  H20  1  0.12288980  0.79074007  0.95623065  1
  H  H21  1  0.21291677  0.87685001  0.54605912  1
  C  C22  1  0.62581182  0.11672778  0.17584893  1
  C  C23  1  0.88373402  0.37575161  0.32439635  1
  C  C24  1  0.37419041  0.88326231  0.82415413  1
  C  C25  1  0.11626224  0.62425145  0.67560168  1
  C  C26  1  0.49681107  0.11727636  0.23020772  1
  C  C27  1  0.88383928  0.50312086  0.27032341  1
  C  C28  1  0.50319168  0.88271424  0.76979590  1
  C  C29  1  0.11615990  0.49688225  0.72967579  1
  C  C30  1  0.46811578  0.14322093  0.35774440  1
  C  C31  1  0.85654160  0.53293180  0.14283663  1
  C  C32  1  0.53188508  0.85677145  0.64225930  1
  C  C33  1  0.14346191  0.46707035  0.85716194  1
  C  C34  1  0.35440606  0.13729912  0.41391302  1
  C  C35  1  0.86199000  0.64673057  0.08715668  1
  C  C36  1  0.64559151  0.86269741  0.58608769  1
  C  C37  1  0.13801537  0.35327093  0.91284208  1
  C  C38  1  0.26857275  0.10647335  0.33916290  1
  C  C39  1  0.89380632  0.73313251  0.16155495  1
  C  C40  1  0.73142518  0.89352465  0.66083650  1
  C  C41  1  0.10619845  0.26686864  0.83844504  1
  C  C42  1  0.29384009  0.08304210  0.21246055  1
  C  C43  1  0.91829939  0.70575284  0.28785463  1
  C  C44  1  0.70615789  0.91695421  0.78753885  1
  C  C45  1  0.08169881  0.29425149  0.71214617  1
  C  C46  1  0.40763908  0.08984769  0.15603765  1
  C  C47  1  0.91249767  0.59223695  0.34420026  1
  C  C48  1  0.59236168  0.91014698  0.84396478  1
  C  C49  1  0.08749862  0.40776722  0.65580005  1
  N  N50  1  0.15097220  0.09277256  0.36458096  1
  N  N51  1  0.90894754  0.85011188  0.13595317  1
  N  N52  1  0.84902221  0.90723143  0.63541752  1
  N  N53  1  0.09106381  0.14988573  0.86404569  1
  N  N54  1  0.10838812  0.05685487  0.25921570  1
  N  N55  1  0.94396640  0.89216054  0.23836615  1
  N  N56  1  0.89160377  0.94315329  0.74078115  1
  N  N57  1  0.05603923  0.10784033  0.76163377  1
  N  N58  1  0.19106700  0.05497209  0.16665111  1
  N  N59  1  0.94731841  0.80832184  0.33349233  1
  N  N60  1  0.80892844  0.94502846  0.83334750  1
  N  N61  1  0.05267989  0.19168291  0.66650836  1
  O  O62  1  0.92909999  0.11127661  0.05886549  1
  O  O63  1  0.88659171  0.07005010  0.44779228  1
  O  O64  1  0.07090035  0.88872455  0.94113093  1
  O  O65  1  0.11340494  0.92995392  0.55220748  1
  O  O66  1  0.69836366  0.14651223  0.24997203  1
  O  O67  1  0.85240160  0.30208964  0.25451507  1
  O  O68  1  0.30163836  0.85348190  0.75002794  1
  O  O69  1  0.14759423  0.69791544  0.74548081  1
  O  O70  1  0.65353286  0.08482083  0.06269919  1
  O  O71  1  0.91754777  0.34683706  0.43926009  1
  O  O72  1  0.34647151  0.91516199  0.93730554  1
  O  O73  1  0.08244613  0.65316722  0.56073822  1
