# generated using pymatgen
data_VCoNiH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86760173
_cell_length_b   10.86435385
_cell_length_c   10.85419893
_cell_angle_alpha   89.25513677
_cell_angle_beta   89.03135901
_cell_angle_gamma   63.76926891
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCoNiH8C14(NO)6
_chemical_formula_sum   'V2 Co2 Ni2 H16 C28 N12 O12'
_cell_volume   1149.39128121
_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
  Ni  Ni0  1  0.90476571  0.09655588  0.25473592  1
  Ni  Ni1  1  0.09523301  0.90344674  0.74526230  1
  V  V2  1  0.85404593  0.98837936  0.00108039  1
  Co  Co3  1  0.01687373  0.14035529  0.50517082  1
  V  V4  1  0.14595644  0.01161840  0.99891975  1
  Co  Co5  1  0.98312241  0.85964970  0.49482997  1
  H  H6  1  0.53699000  0.16791880  0.41366453  1
  H  H7  1  0.83007976  0.46348277  0.08669724  1
  H  H8  1  0.46301248  0.83207099  0.58633979  1
  H  H9  1  0.16992549  0.53651844  0.91329951  1
  H  H10  1  0.33216383  0.15548631  0.51084609  1
  H  H11  1  0.84229441  0.66752734  0.98839593  1
  H  H12  1  0.66783336  0.84451215  0.48915460  1
  H  H13  1  0.15771312  0.33247375  0.01160262  1
  H  H14  1  0.42550228  0.07430100  0.05602850  1
  H  H15  1  0.92926070  0.57438854  0.44171303  1
  H  H16  1  0.57449875  0.92569637  0.94397278  1
  H  H17  1  0.07073147  0.42561722  0.55828693  1
  H  H18  1  0.87503494  0.21501362  0.04407844  1
  H  H19  1  0.78982047  0.12520316  0.45791782  1
  H  H20  1  0.12496488  0.78498703  0.95591843  1
  H  H21  1  0.21017641  0.87480140  0.54207893  1
  C  C22  1  0.62518700  0.11711158  0.17463265  1
  C  C23  1  0.88391299  0.37402247  0.32519550  1
  C  C24  1  0.37481669  0.88287846  0.82537064  1
  C  C25  1  0.11608282  0.62598141  0.67480230  1
  C  C26  1  0.49809562  0.11698154  0.22950231  1
  C  C27  1  0.88351318  0.50218104  0.26981254  1
  C  C28  1  0.50190661  0.88301094  0.77050060  1
  C  C29  1  0.11648468  0.49782281  0.73018613  1
  C  C30  1  0.46861517  0.14302964  0.35750733  1
  C  C31  1  0.85615916  0.53118286  0.14250571  1
  C  C32  1  0.53138605  0.85696270  0.64249602  1
  C  C33  1  0.14384338  0.46881943  0.85749222  1
  C  C34  1  0.35445919  0.13751096  0.41274618  1
  C  C35  1  0.86108920  0.64521126  0.08633256  1
  C  C36  1  0.64553931  0.86248531  0.58725493  1
  C  C37  1  0.13891640  0.35478937  0.91366585  1
  C  C38  1  0.26791477  0.10715817  0.33779053  1
  C  C39  1  0.89223039  0.73147742  0.16053340  1
  C  C40  1  0.73208314  0.89284061  0.66220925  1
  C  C41  1  0.10777482  0.26852260  0.83946590  1
  C  C42  1  0.29465651  0.08488379  0.21086396  1
  C  C43  1  0.91785033  0.70477541  0.28671278  1
  C  C44  1  0.70534367  0.91511374  0.78913612  1
  C  C45  1  0.08214909  0.29522740  0.71328724  1
  C  C46  1  0.40870436  0.09014951  0.15474431  1
  C  C47  1  0.91188408  0.59111622  0.34337220  1
  C  C48  1  0.59129804  0.90984477  0.84525744  1
  C  C49  1  0.08811118  0.40888851  0.65662763  1
  N  N50  1  0.15328683  0.08712598  0.36349885  1
  N  N51  1  0.90907327  0.84767365  0.13509627  1
  N  N52  1  0.84670749  0.91287951  0.63649971  1
  N  N53  1  0.09093635  0.15232363  0.86490282  1
  N  N54  1  0.11307743  0.05050195  0.26161679  1
  N  N55  1  0.95110930  0.88638693  0.23855527  1
  N  N56  1  0.88691741  0.94950376  0.73838146  1
  N  N57  1  0.04889509  0.11361309  0.76144569  1
  N  N58  1  0.19408015  0.05302990  0.16578325  1
  N  N59  1  0.95026883  0.80559968  0.33113137  1
  N  N60  1  0.80591853  0.94697193  0.83421582  1
  N  N61  1  0.04973035  0.19440297  0.66886963  1
  O  O62  1  0.92882198  0.11587781  0.05540814  1
  O  O63  1  0.88653229  0.07271163  0.43654508  1
  O  O64  1  0.07117744  0.88412296  0.94458946  1
  O  O65  1  0.11346520  0.92729315  0.56345408  1
  O  O66  1  0.69883187  0.14924708  0.24366574  1
  O  O67  1  0.85327191  0.30076359  0.25278570  1
  O  O68  1  0.30116706  0.85075008  0.75633594  1
  O  O69  1  0.14672372  0.69924041  0.74721251  1
  O  O70  1  0.65353564  0.08281460  0.05990307  1
  O  O71  1  0.91629483  0.34777250  0.43825907  1
  O  O72  1  0.34646974  0.91717006  0.94010092  1
  O  O73  1  0.08370037  0.65223176  0.56173920  1
