# generated using pymatgen
data_MnH28C14(NO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.14006291
_cell_length_b   8.07284101
_cell_length_c   8.74522263
_cell_angle_alpha   87.81307200
_cell_angle_beta   90.24771276
_cell_angle_gamma   76.57920020
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnH28C14(NO6)2
_chemical_formula_sum   'Mn1 H28 C14 N2 O12'
_cell_volume   489.91207458
_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
  Mn  Mn0  1  0.50000413  0.99999028  0.49999400  1
  H  H1  1  0.70066626  0.32482443  0.22009441  1
  H  H2  1  0.29933765  0.67517813  0.77990949  1
  H  H3  1  0.85418596  0.45840837  0.42192814  1
  H  H4  1  0.14582283  0.54158805  0.57807851  1
  H  H5  1  0.04782959  0.27123142  0.41820451  1
  H  H6  1  0.95217425  0.72876095  0.58180417  1
  H  H7  1  -0.00146230  0.04482037  0.27094480  1
  H  H8  1  1.00146148  0.95517775  0.72905776  1
  H  H9  1  0.01161251  0.12431030  0.08010025  1
  H  H10  1  0.98839351  0.87569012  0.91990383  1
  H  H11  1  0.84028236  0.55905293  0.18285451  1
  H  H12  1  0.15972519  0.44094745  0.81715389  1
  H  H13  1  0.66592042  0.45812944  0.97278028  1
  H  H14  1  0.33408735  0.54187188  0.02722723  1
  H  H15  1  0.87833085  0.31692557  0.91452861  1
  H  H16  1  0.12167638  0.68307610  0.08547874  1
  H  H17  1  0.18044888  0.42055482  0.24790529  1
  H  H18  1  0.81955813  0.57944636  0.75210126  1
  H  H19  1  0.19724157  0.29492285  0.08488405  1
  H  H20  1  0.80276622  0.70507903  0.91512279  1
  H  H21  1  0.57846239  0.90688136  0.79861650  1
  H  H22  1  0.42153732  0.09311894  0.20137626  1
  H  H23  1  0.69844277  0.04437044  0.73492360  1
  H  H24  1  0.30155431  0.95563181  0.26506781  1
  H  H25  1  0.30613139  0.20173416  0.72577791  1
  H  H26  1  0.69384978  0.79826670  0.27420359  1
  H  H27  1  0.46862649  0.28786825  0.65390079  1
  H  H28  1  0.53135232  0.71213075  0.34608314  1
  C  C29  1  0.89294682  0.32262058  0.39836989  1
  C  C30  1  0.10705832  0.67737592  0.60163533  1
  C  C31  1  0.77898026  0.22539274  0.49971649  1
  C  C32  1  0.22101483  0.77460856  0.50028349  1
  C  C33  1  0.91718270  0.12389144  0.17817324  1
  C  C34  1  0.08281974  0.87610936  0.82182857  1
  C  C35  1  0.74405337  0.05474710  0.13285259  1
  C  C36  1  0.25595077  0.94525608  0.86714510  1
  C  C37  1  0.90693148  0.43854158  0.12965530  1
  C  C38  1  0.09307517  0.56145985  0.87035208  1
  C  C39  1  0.82314809  0.43931978  0.96829289  1
  C  C40  1  0.17685953  0.56068176  0.03171405  1
  C  C41  1  0.12530174  0.41774407  0.13088112  1
  C  C42  1  0.87470529  0.58225733  0.86912515  1
  N  N43  1  0.84885704  0.30357566  0.23224652  1
  N  N44  1  0.15114867  0.69642414  0.76775805  1
  O  O45  1  0.71589542  0.11266495  0.43074088  1
  O  O46  1  0.28409184  0.88734459  0.56925612  1
  O  O47  1  0.75414932  0.25855926  0.63893255  1
  O  O48  1  0.24583743  0.74144266  0.36106768  1
  O  O49  1  0.58629078  0.16420338  0.10563263  1
  O  O50  1  0.41371368  0.83580133  0.89436616  1
  O  O51  1  0.77190727  0.89456556  0.12450341  1
  O  O52  1  0.22809308  0.10543634  0.87549365  1
  O  O53  1  0.66598689  0.93475385  0.71555213  1
  O  O54  1  0.33401305  0.06524516  0.28444058  1
  O  O55  1  0.35311994  0.24706098  0.62767728  1
  O  O56  1  0.64686134  0.75293523  0.37230331  1
