# generated using pymatgen
data_MnVCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.89628707
_cell_length_b   10.89185193
_cell_length_c   10.86688123
_cell_angle_alpha   89.25909577
_cell_angle_beta   89.03686519
_cell_angle_gamma   63.67033961
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVCoH8C14(NO)6
_chemical_formula_sum   'Mn2 V2 Co2 H16 C28 N12 O12'
_cell_volume   1155.70834699
_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
  Mn  Mn0  1  0.89868355  0.10313456  0.25781261  1
  Mn  Mn1  1  0.10131244  0.89687045  0.74218485  1
  V  V2  1  0.85630832  0.98628503  0.00083551  1
  Co  Co3  1  0.01939634  0.13973881  0.50450864  1
  V  V4  1  0.14369324  0.01371397  0.99916350  1
  Co  Co5  1  0.98059900  0.86026602  0.49549114  1
  H  H6  1  0.53759774  0.16791497  0.41206310  1
  H  H7  1  0.82988669  0.46336604  0.08782026  1
  H  H8  1  0.46240542  0.83207494  0.58794109  1
  H  H9  1  0.17011806  0.53663400  0.91217685  1
  H  H10  1  0.33335955  0.15623797  0.50959818  1
  H  H11  1  0.84143941  0.66635838  0.98839340  1
  H  H12  1  0.66663873  0.84376026  0.49040346  1
  H  H13  1  0.15856835  0.33364100  0.01160382  1
  H  H14  1  0.42646669  0.07577747  0.05499457  1
  H  H15  1  0.92873960  0.57495546  0.44152275  1
  H  H16  1  0.57353449  0.92421772  0.94500718  1
  H  H17  1  0.07125213  0.42504956  0.55847758  1
  H  H18  1  0.87399930  0.21477673  0.02855602  1
  H  H19  1  0.78585470  0.12699936  0.48202031  1
  H  H20  1  0.12599973  0.78522475  0.97143951  1
  H  H21  1  0.21414342  0.87300590  0.51797778  1
  C  C22  1  0.62181675  0.12024309  0.17189660  1
  C  C23  1  0.88143413  0.37835408  0.32624104  1
  C  C24  1  0.37818523  0.87974943  0.82810712  1
  C  C25  1  0.11856107  0.62164990  0.67375738  1
  C  C26  1  0.49749448  0.11789774  0.22810938  1
  C  C27  1  0.88203705  0.50435214  0.27013775  1
  C  C28  1  0.50250775  0.88209467  0.77189347  1
  C  C29  1  0.11796035  0.49565068  0.72986073  1
  C  C30  1  0.46912961  0.14343453  0.35616962  1
  C  C31  1  0.85521670  0.53195821  0.14278342  1
  C  C32  1  0.53087312  0.85655721  0.64383340  1
  C  C33  1  0.14478566  0.46804311  0.85721420  1
  C  C34  1  0.35530601  0.13846430  0.41150580  1
  C  C35  1  0.85985716  0.64542871  0.08642814  1
  C  C36  1  0.64469438  0.86153180  0.58849619  1
  C  C37  1  0.14014817  0.35457136  0.91356967  1
  C  C38  1  0.26867767  0.10934830  0.33605461  1
  C  C39  1  0.88990471  0.73214006  0.16075946  1
  C  C40  1  0.73132111  0.89065077  0.66394664  1
  C  C41  1  0.11010110  0.26785901  0.83923944  1
  C  C42  1  0.29508282  0.08656945  0.20921380  1
  C  C43  1  0.91733985  0.70511456  0.28655589  1
  C  C44  1  0.70491755  0.91342794  0.79078784  1
  C  C45  1  0.08265948  0.29488695  0.71344421  1
  C  C46  1  0.40884873  0.09121056  0.15348161  1
  C  C47  1  0.91123705  0.59228414  0.34336511  1
  C  C48  1  0.59115310  0.90878325  0.84652054  1
  C  C49  1  0.08875813  0.40771937  0.65663481  1
  N  N50  1  0.15564126  0.08746753  0.36225301  1
  N  N51  1  0.90918311  0.84628358  0.13454391  1
  N  N52  1  0.84435281  0.91253867  0.63774571  1
  N  N53  1  0.09082822  0.15371242  0.86545505  1
  N  N54  1  0.12530807  0.03674465  0.26306484  1
  N  N55  1  0.96119175  0.87831789  0.23564125  1
  N  N56  1  0.87468620  0.96326169  0.73693340  1
  N  N57  1  0.03881495  0.12168019  0.76435855  1
  N  N58  1  0.19701982  0.05075558  0.16519955  1
  N  N59  1  0.95499481  0.80251542  0.32968215  1
  N  N60  1  0.80297730  0.94924738  0.83479958  1
  N  N61  1  0.04500615  0.19748523  0.67031855  1
  O  O62  1  0.92746870  0.11810068  0.05028843  1
  O  O63  1  0.87843061  0.07703952  0.44871725  1
  O  O64  1  0.07253024  0.88190137  0.94970902  1
  O  O65  1  0.12156753  0.92296470  0.55128134  1
  O  O66  1  0.69094172  0.15874572  0.23978460  1
  O  O67  1  0.84664457  0.30875527  0.25361986  1
  O  O68  1  0.30905720  0.84125189  0.76021786  1
  O  O69  1  0.15335072  0.69124921  0.74637772  1
  O  O70  1  0.65339242  0.08173951  0.05868696  1
  O  O71  1  0.91779782  0.34832066  0.43783334  1
  O  O72  1  0.34661168  0.91825152  0.94131722  1
  O  O73  1  0.08219700  0.65168383  0.56216524  1
