# generated using pymatgen
data_VFeCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86865187
_cell_length_b   10.86283885
_cell_length_c   10.85650414
_cell_angle_alpha   89.26124105
_cell_angle_beta   89.05921650
_cell_angle_gamma   63.77128330
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VFeCoH8C14(NO)6
_chemical_formula_sum   'V2 Fe2 Co2 H16 C28 N12 O12'
_cell_volume   1149.61451030
_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  0.91590543  0.08532215  0.24934442  1
  Co  Co1  1  0.08409242  0.91468194  0.75065343  1
  Fe  Fe2  1  0.85453280  0.99430646  -0.00425182  1
  V  V3  1  0.01050141  0.14711544  0.49848273  1
  Fe  Fe4  1  0.14546827  0.00569047  1.00424986  1
  V  V5  1  0.98949426  0.85288934  0.50151907  1
  H  H6  1  0.53712803  0.16836261  0.41447093  1
  H  H7  1  0.83104255  0.46416343  0.08743219  1
  H  H8  1  0.46287394  0.83162697  0.58553420  1
  H  H9  1  0.16896266  0.53583783  0.91256478  1
  H  H10  1  0.33354662  0.15545702  0.51368833  1
  H  H11  1  0.84334291  0.66851073  0.99029830  1
  H  H12  1  0.66644826  0.84454174  0.48631239  1
  H  H13  1  0.15666408  0.33149061  0.00970074  1
  H  H14  1  0.42438598  0.07365932  0.05876825  1
  H  H15  1  0.92979977  0.57385075  0.44343374  1
  H  H16  1  0.57561741  0.92633814  0.94123392  1
  H  H17  1  0.07019242  0.42615535  0.55656700  1
  H  H18  1  0.87667213  0.21598492  0.04574482  1
  H  H19  1  0.78578224  0.12401374  0.45420326  1
  H  H20  1  0.12332895  0.78401571  0.95425211  1
  H  H21  1  0.21421457  0.87599104  0.54579462  1
  C  C22  1  0.62499760  0.11714689  0.17689064  1
  C  C23  1  0.88367316  0.37498834  0.32475469  1
  C  C24  1  0.37500582  0.88284168  0.82311219  1
  C  C25  1  0.11632291  0.62501617  0.67524312  1
  C  C26  1  0.49677361  0.11779560  0.23133320  1
  C  C27  1  0.88373104  0.50237181  0.27074249  1
  C  C28  1  0.50322954  0.88219656  0.76867128  1
  C  C29  1  0.11626783  0.49763214  0.72925638  1
  C  C30  1  0.46840265  0.14372070  0.35883186  1
  C  C31  1  0.85647344  0.53235360  0.14336108  1
  C  C32  1  0.53159796  0.85627148  0.64117190  1
  C  C33  1  0.14352970  0.46764899  0.85663684  1
  C  C34  1  0.35486560  0.13795100  0.41540136  1
  C  C35  1  0.86228280  0.64617744  0.08816849  1
  C  C36  1  0.64513165  0.86204550  0.58459981  1
  C  C37  1  0.13772260  0.35382402  0.91183046  1
  C  C38  1  0.26840680  0.10724537  0.34130463  1
  C  C39  1  0.89456196  0.73174519  0.16312424  1
  C  C40  1  0.73159062  0.89275301  0.65869475  1
  C  C41  1  0.10544264  0.26825627  0.83687531  1
  C  C42  1  0.29413648  0.08374167  0.21469111  1
  C  C43  1  0.91820186  0.70485599  0.28948772  1
  C  C44  1  0.70586397  0.91625600  0.78530879  1
  C  C45  1  0.08179586  0.29514835  0.71051294  1
  C  C46  1  0.40739716  0.09033402  0.15737919  1
  C  C47  1  0.91234946  0.59116911  0.34521973  1
  C  C48  1  0.59260603  0.90966097  0.84262317  1
  C  C49  1  0.08764648  0.40883628  0.65478047  1
  N  N50  1  0.15066763  0.09320344  0.36662793  1
  N  N51  1  0.91130828  0.84800254  0.13711516  1
  N  N52  1  0.84932627  0.90680077  0.63336951  1
  N  N53  1  0.08870603  0.15199300  0.86288341  1
  N  N54  1  0.10805243  0.05641179  0.26182432  1
  N  N55  1  0.94512126  0.89151080  0.23965642  1
  N  N56  1  0.89194234  0.94359375  0.73817210  1
  N  N57  1  0.05488388  0.10848945  0.76034412  1
  N  N58  1  0.19169296  0.05479625  0.16960787  1
  N  N59  1  0.94743702  0.80798088  0.33470882  1
  N  N60  1  0.80830476  0.94520672  0.83039050  1
  N  N61  1  0.05256184  0.19202267  0.66529222  1
  O  O62  1  0.93162915  0.11796112  0.05750680  1
  O  O63  1  0.88527882  0.06929011  0.44900606  1
  O  O64  1  0.06837101  0.88203911  0.94249027  1
  O  O65  1  0.11471821  0.93071471  0.55099310  1
  O  O66  1  0.69922690  0.14625655  0.24925876  1
  O  O67  1  0.85291616  0.30069811  0.25490838  1
  O  O68  1  0.30077373  0.85373848  0.75074205  1
  O  O69  1  0.14707990  0.69930682  0.74508932  1
  O  O70  1  0.65126539  0.08468629  0.06333105  1
  O  O71  1  0.91695426  0.34712197  0.43959714  1
  O  O72  1  0.34873855  0.91529622  0.93667276  1
  O  O73  1  0.08303937  0.65288141  0.56040124  1
