# generated using pymatgen
data_Mn2VH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.92294709
_cell_length_b   10.91569152
_cell_length_c   11.06828151
_cell_angle_alpha   88.90405374
_cell_angle_beta   88.70616208
_cell_angle_gamma   63.55367130
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VH8C14(NO)6
_chemical_formula_sum   'Mn4 V2 H16 C28 N12 O12'
_cell_volume   1181.22334231
_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  0.91183115  0.08853178  0.25015758  1
  V  V1  1  0.08816854  0.91146925  0.74984177  1
  Mn  Mn2  1  0.84382692  1.00504488  -0.01201499  1
  Mn  Mn3  1  -0.00453561  0.15605833  0.51213375  1
  Mn  Mn4  1  0.15617393  -0.00504469  1.01201573  1
  Mn  Mn5  1  1.00453316  0.84394433  0.48786588  1
  H  H6  1  0.53838514  0.17664028  0.41026235  1
  H  H7  1  0.82187822  0.46212077  0.09145606  1
  H  H8  1  0.46161780  0.82335449  0.58973960  1
  H  H9  1  0.17812731  0.53787699  0.90854082  1
  H  H10  1  0.33751651  0.16390488  0.51201896  1
  H  H11  1  0.83346490  0.66313745  0.98922278  1
  H  H12  1  0.66248405  0.83609296  0.48798158  1
  H  H13  1  0.16654448  0.33685891  0.01077361  1
  H  H14  1  0.42600146  0.07199505  0.06712265  1
  H  H15  1  0.93266783  0.57349754  0.43230325  1
  H  H16  1  0.57400060  0.92800061  0.93287779  1
  H  H17  1  0.06732095  0.42650902  0.56769564  1
  H  H18  1  0.89927830  0.21450941  0.05298783  1
  H  H19  1  0.78568814  0.10116325  0.44733309  1
  H  H20  1  0.10072050  0.78549294  0.94701216  1
  H  H21  1  0.21430924  0.89884011  0.55266580  1
  C  C22  1  0.62422679  0.11780548  0.17417994  1
  C  C23  1  0.88390710  0.37586487  0.32666017  1
  C  C24  1  0.37577419  0.88219145  0.82582121  1
  C  C25  1  0.11609093  0.62413666  0.67333834  1
  C  C26  1  0.49863009  0.12012833  0.23302897  1
  C  C27  1  0.88143064  0.50127583  0.26753234  1
  C  C28  1  0.50137119  0.87986787  0.76697227  1
  C  C29  1  0.11856753  0.49872515  0.73246495  1
  C  C30  1  0.47061511  0.14923474  0.35829839  1
  C  C31  1  0.85037876  0.52963866  0.14279343  1
  C  C32  1  0.52938609  0.85076102  0.64170184  1
  C  C33  1  0.14962501  0.47036151  0.85720473  1
  C  C34  1  0.35865512  0.14318238  0.41600959  1
  C  C35  1  0.85564266  0.64175515  0.08486613  1
  C  C36  1  0.64134578  0.85681543  0.58399155  1
  C  C37  1  0.14436313  0.35824213  0.91513269  1
  C  C38  1  0.27340031  0.10782249  0.34674376  1
  C  C39  1  0.89230821  0.72680368  0.15329858  1
  C  C40  1  0.72659909  0.89217706  0.65325647  1
  C  C41  1  0.10769461  0.27319560  0.84670057  1
  C  C42  1  0.29966527  0.08105690  0.22253308  1
  C  C43  1  0.92195246  0.69956158  0.27682750  1
  C  C44  1  0.70033509  0.91894183  0.77746760  1
  C  C45  1  0.07804336  0.30044265  0.72317189  1
  C  C46  1  0.40997840  0.08987347  0.16368495  1
  C  C47  1  0.91345587  0.58943157  0.33601103  1
  C  C48  1  0.59002277  0.91012333  0.83631720  1
  C  C49  1  0.08653904  0.41057171  0.66399298  1
  N  N50  1  0.16154580  0.08702662  0.37676317  1
  N  N51  1  0.91164838  0.83946180  0.12317736  1
  N  N52  1  0.83845249  0.91297499  0.62323684  1
  N  N53  1  0.08835712  0.16053606  0.87682153  1
  N  N54  1  0.11872071  0.05118163  0.27591304  1
  N  N55  1  0.94979469  0.88154394  0.22319095  1
  N  N56  1  0.88127738  0.94882006  0.72408681  1
  N  N57  1  0.05020545  0.11845718  0.77680957  1
  N  N58  1  0.20321683  0.04389116  0.18248539  1
  N  N59  1  0.96030031  0.79566860  0.31608879  1
  N  N60  1  0.79678260  0.95610880  0.81751483  1
  N  N61  1  0.03969356  0.20433507  0.68391310  1
  O  O62  1  0.93551211  0.11666885  0.07110375  1
  O  O63  1  0.88358565  0.06467873  0.42917871  1
  O  O64  1  0.06448739  0.88333282  0.92889533  1
  O  O65  1  0.11641316  0.93532228  0.57082118  1
  O  O66  1  0.70439829  0.14269616  0.24136333  1
  O  O67  1  0.85733594  0.29610679  0.26022750  1
  O  O68  1  0.29560222  0.85730251  0.75863604  1
  O  O69  1  0.14266376  0.70389403  0.73977157  1
  O  O70  1  0.64552764  0.08771819  0.06246445  1
  O  O71  1  0.91571888  0.35428202  0.43785039  1
  O  O72  1  0.35447378  0.91227716  0.93753591  1
  O  O73  1  0.08427825  0.64572014  0.56214905  1
