# generated using pymatgen
data_MnVNiH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.85415099
_cell_length_b   10.84572833
_cell_length_c   10.95899291
_cell_angle_alpha   88.98104158
_cell_angle_beta   88.76374869
_cell_angle_gamma   63.82653147
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVNiH8C14(NO)6
_chemical_formula_sum   'Mn2 V2 Ni2 H16 C28 N12 O12'
_cell_volume   1157.50295380
_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  0.90804978  0.09382574  0.25661547  1
  V  V1  1  0.09194894  0.90617640  0.74338438  1
  Mn  Mn2  1  0.84588779  0.99822225  -0.00926939  1
  Ni  Ni3  1  0.01833965  0.14767242  0.50964323  1
  Mn  Mn4  1  0.15411135  0.00177783  1.00926903  1
  Ni  Ni5  1  0.98165743  0.85233064  0.49035647  1
  H  H6  1  0.53785123  0.17210230  0.41943889  1
  H  H7  1  0.82913758  0.46145660  0.09553112  1
  H  H8  1  0.46215130  0.82789148  0.58056345  1
  H  H9  1  0.17086678  0.53854351  0.90446533  1
  H  H10  1  0.33346947  0.16196162  0.51910688  1
  H  H11  1  0.84386142  0.66308533  0.99505327  1
  H  H12  1  0.66652959  0.83803700  0.48089410  1
  H  H13  1  0.15614696  0.33691228  0.00494369  1
  H  H14  1  0.42563025  0.07166311  0.07040293  1
  H  H15  1  0.92557725  0.57750788  0.44499516  1
  H  H16  1  0.57437245  0.92833115  0.92959887  1
  H  H17  1  0.07441480  0.42249707  0.55500435  1
  H  H18  1  0.88945205  0.21521449  0.06094131  1
  H  H19  1  0.79668402  0.12714447  0.46332378  1
  H  H20  1  0.11054640  0.78478660  0.93905856  1
  H  H21  1  0.20331486  0.87285783  0.53667542  1
  C  C22  1  0.62456277  0.11639046  0.18006322  1
  C  C23  1  0.88592235  0.37367346  0.33182371  1
  C  C24  1  0.37543794  0.88360597  0.81993832  1
  C  C25  1  0.11407527  0.62632924  0.66817462  1
  C  C26  1  0.49802339  0.11850874  0.23899284  1
  C  C27  1  0.88334774  0.50184517  0.27562868  1
  C  C28  1  0.50197781  0.88148695  0.76100914  1
  C  C29  1  0.11665138  0.49815645  0.72436926  1
  C  C30  1  0.46888322  0.14670111  0.36552482  1
  C  C31  1  0.85608522  0.52966057  0.14907276  1
  C  C32  1  0.53111780  0.85329492  0.63447726  1
  C  C33  1  0.14391774  0.47033985  0.85092458  1
  C  C34  1  0.35516893  0.14130227  0.42216150  1
  C  C35  1  0.86351082  0.64185780  0.09196538  1
  C  C36  1  0.64483084  0.85869577  0.57783965  1
  C  C37  1  0.13649446  0.35814191  0.90803232  1
  C  C38  1  0.26946170  0.10586289  0.35142788  1
  C  C39  1  0.89787380  0.72792213  0.16323795  1
  C  C40  1  0.73053763  0.89413638  0.64857276  1
  C  C41  1  0.10212871  0.27207884  0.83676084  1
  C  C42  1  0.29760729  0.07920091  0.22634638  1
  C  C43  1  0.91903596  0.70501931  0.28941820  1
  C  C44  1  0.70239326  0.92079655  0.77365444  1
  C  C45  1  0.08096108  0.29498342  0.71058114  1
  C  C46  1  0.40898742  0.08879900  0.16797008  1
  C  C47  1  0.91038094  0.59276379  0.34715962  1
  C  C48  1  0.59101423  0.91119669  0.83203145  1
  C  C49  1  0.08961455  0.40723974  0.65283946  1
  N  N50  1  0.15559709  0.08476105  0.37892634  1
  N  N51  1  0.91879273  0.83987333  0.13227986  1
  N  N52  1  0.84440154  0.91524049  0.62107408  1
  N  N53  1  0.08121695  0.16012387  0.86771911  1
  N  N54  1  0.11404838  0.04978269  0.27540532  1
  N  N55  1  0.94668085  0.88883931  0.23480824  1
  N  N56  1  0.88594967  0.95021876  0.72459486  1
  N  N57  1  0.05332072  0.11116145  0.76519305  1
  N  N58  1  0.20224715  0.04125862  0.18357110  1
  N  N59  1  0.94916220  0.80787714  0.33065514  1
  N  N60  1  0.79775228  0.95874023  0.81642947  1
  N  N61  1  0.05083371  0.19212551  0.66934578  1
  O  O62  1  0.93195779  0.11601336  0.07631173  1
  O  O63  1  0.89099033  0.07678833  0.43277153  1
  O  O64  1  0.06804150  0.88398758  0.92368712  1
  O  O65  1  0.10900765  0.92321369  0.56722807  1
  O  O66  1  0.70426170  0.14387717  0.24786036  1
  O  O67  1  0.85693290  0.29708653  0.26027496  1
  O  O68  1  0.29573730  0.85612325  0.75213987  1
  O  O69  1  0.14306577  0.70291524  0.73972286  1
  O  O70  1  0.64717834  0.08426758  0.06785556  1
  O  O71  1  0.91851092  0.34709482  0.44280621  1
  O  O72  1  0.35282293  0.91572584  0.93214661  1
  O  O73  1  0.08148444  0.65290877  0.55719267  1
