# generated using pymatgen
data_V2H26C36S(N2O5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.09246296
_cell_length_b   11.23585799
_cell_length_c   13.25469199
_cell_angle_alpha   107.34232247
_cell_angle_beta   107.77476566
_cell_angle_gamma   90.01246587
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2H26C36S(N2O5)2
_chemical_formula_sum   'V2 H26 C36 S1 N4 O10'
_cell_volume   1089.96048700
_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
  V  V0  1  0.85892824  0.07563114  0.62414044  1
  V  V1  1  0.23479425  0.92443090  0.37588522  1
  H  H2  1  0.69217112  0.78899510  0.94712511  1
  H  H3  1  0.74497699  0.21090442  0.05282978  1
  H  H4  1  0.42398587  0.69404316  0.77995441  1
  H  H5  1  0.64395484  0.30578481  0.22000353  1
  H  H6  1  0.33456369  0.79404672  0.63044465  1
  H  H7  1  0.70418618  0.20579395  0.36952454  1
  H  H8  1  0.68820931  0.80964571  0.45667903  1
  H  H9  1  0.23139648  0.19043787  0.54334273  1
  H  H10  1  0.67414759  0.59175062  0.46150147  1
  H  H11  1  0.21247053  0.40828851  0.53842833  1
  H  H12  1  0.04891093  0.71844830  0.79250938  1
  H  H13  1  0.25661861  0.28157166  0.20753544  1
  H  H14  1  0.04806296  0.93200972  0.77912595  1
  H  H15  1  0.26917775  0.06805155  0.22100594  1
  H  H16  1  0.11019305  0.30893331  0.74411960  1
  H  H17  1  0.36610255  0.69117989  0.25586028  1
  H  H18  1  0.12372853  0.52967719  0.74396692  1
  H  H19  1  0.37987188  0.47046499  0.25602965  1
  H  H20  1  0.58878065  0.45631529  0.52754318  1
  H  H21  1  0.06151386  0.54364736  0.47252812  1
  H  H22  1  0.59260836  0.23731910  0.53264996  1
  H  H23  1  0.06013008  0.76263629  0.46738388  1
  H  H24  1  0.19930022  0.03397290  0.61782507  1
  H  H25  1  0.58157518  0.96609560  0.38219665  1
  H  H26  1  0.20198110  0.09693367  0.74302529  1
  H  H27  1  0.45896041  0.90316270  0.25700036  1
  C  C28  1  0.53956053  0.94607569  0.71293825  1
  C  C29  1  0.82659074  0.05379368  0.28700319  1
  C  C30  1  0.68073385  0.00438265  0.80943942  1
  C  C31  1  0.87129985  0.99554756  0.19052128  1
  C  C32  1  0.73611875  0.94184410  0.88895543  1
  C  C33  1  0.84714259  0.05809956  0.11100971  1
  C  C34  1  0.64592457  0.83114749  0.88038500  1
  C  C35  1  0.76547159  0.16875307  0.11956996  1
  C  C36  1  0.49867229  0.77922898  0.78819093  1
  C  C37  1  0.71040825  0.22062358  0.21175867  1
  C  C38  1  0.44631606  0.83606557  0.70477635  1
  C  C39  1  0.74150625  0.16377985  0.29516591  1
  C  C40  1  0.48901626  0.99600433  0.61674782  1
  C  C41  1  0.87228536  0.00391915  0.38321882  1
  C  C42  1  0.77608615  0.13005079  0.82943009  1
  C  C43  1  0.94670959  0.86992192  0.17052558  1
  C  C44  1  0.76772279  0.78697837  0.52978574  1
  C  C45  1  0.23787431  0.21308883  0.47023670  1
  C  C46  1  0.75662839  0.66563617  0.53353953  1
  C  C47  1  0.22305116  0.33441635  0.46643698  1
  C  C48  1  0.86108517  0.63693393  0.62781182  1
  C  C49  1  0.23338754  0.36310910  0.37219343  1
  C  C50  1  0.97214045  0.73493969  0.71548071  1
  C  C51  1  0.25683800  0.26510094  0.28456930  1
  C  C52  1  0.97033299  0.85503544  0.70799114  1
  C  C53  1  0.26250327  0.14502337  0.29210311  1
  C  C54  1  0.99788709  0.34386306  0.69569850  1
  C  C55  1  0.30226949  0.65622165  0.30430180  1
  C  C56  1  0.00369796  0.46747354  0.69742558  1
  C  C57  1  0.30637929  0.53261465  0.30257128  1
  C  C58  1  0.85752430  0.50950538  0.63292468  1
  C  C59  1  0.22475284  0.49053068  0.36707444  1
  C  C60  1  0.70781507  0.42459862  0.57246435  1
  C  C61  1  0.13554834  0.57539193  0.42756247  1
  C  C62  1  0.70901179  0.30330766  0.57711852  1
  C  C63  1  0.13205355  0.69668193  0.42290813  1
  S  S64  1  0.93111688  0.00001441  0.99999512  1
  N  N65  1  0.87091945  0.88305741  0.61614688  1
  N  N66  1  0.25481855  0.11701975  0.38393432  1
  N  N67  1  0.85439610  0.26095188  0.63343553  1
  N  N68  1  0.22106494  0.73908822  0.36657954  1
  O  O69  1  0.59529073  0.06057356  0.59598457  1
  O  O70  1  -0.00074618  0.93931373  0.40395662  1
  O  O71  1  0.32868748  0.96601276  0.54953036  1
  O  O72  1  0.77929103  0.03399732  0.45049671  1
  O  O73  1  0.90160898  0.12218528  0.78297321  1
  O  O74  1  0.11869494  0.87785581  0.21703825  1
  O  O75  1  0.73729882  0.22792463  0.88447056  1
  O  O76  1  0.85293466  0.77201235  0.11542491  1
  O  O77  1  0.13660561  0.08982967  0.66591923  1
  O  O78  1  0.47068756  0.91030398  0.33411222  1
