# generated using pymatgen
data_Mn2VCoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11800726
_cell_length_b   10.13528487
_cell_length_c   12.55904138
_cell_angle_alpha   90.02943699
_cell_angle_beta   89.99142131
_cell_angle_gamma   106.44311617
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VCoH28(C7N8)4
_chemical_formula_sum   'Mn2 V1 Co1 H28 C28 N32'
_cell_volume   991.07444901
_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  0.15841516  0.13254153  0.55218771  1
  V  V1  1  0.34375122  0.87143758  0.05728757  1
  Co  Co2  1  0.85058366  0.87346974  0.44916971  1
  Mn  Mn3  1  0.66408463  0.13544541  0.94402603  1
  H  H4  1  0.11377681  0.44884223  0.57923963  1
  H  H5  1  0.38639119  0.54934804  0.08094662  1
  H  H6  1  0.88522094  0.55062595  0.41924993  1
  H  H7  1  0.61436513  0.44948655  0.92141926  1
  H  H8  1  0.18731771  0.64979564  0.45951125  1
  H  H9  1  0.31165392  0.34986685  0.96067723  1
  H  H10  1  0.81168572  0.35086917  0.53882798  1
  H  H11  1  0.68751114  0.65048308  0.04129009  1
  H  H12  1  0.38840722  0.65463146  0.30375476  1
  H  H13  1  0.11171922  0.34699308  0.80404540  1
  H  H14  1  0.61234409  0.34726409  0.69588343  1
  H  H15  1  0.88913132  0.65556782  0.19690366  1
  H  H16  1  0.50392452  0.45100635  0.27838573  1
  H  H17  1  0.99827417  0.55115921  0.77922850  1
  H  H18  1  0.49793728  0.55118867  0.72115399  1
  H  H19  1  0.00443527  0.45184735  0.22220166  1
  H  H20  1  0.52839091  0.23273686  0.34423910  1
  H  H21  1  0.97727838  0.77325069  0.84607357  1
  H  H22  1  0.47323986  0.76856800  0.65420126  1
  H  H23  1  0.02681974  0.23275163  0.15754117  1
  H  H24  1  0.50260234  0.00522893  0.37666935  1
  H  H25  1  1.00101043  0.99407527  0.87862917  1
  H  H26  1  0.49925538  0.99473280  0.62192691  1
  H  H27  1  0.00256925  0.00551666  0.12395339  1
  H  H28  1  0.33341306  0.90327350  0.45664986  1
  H  H29  1  0.16939102  0.09833364  0.95783313  1
  H  H30  1  0.66856749  0.09742480  0.54205380  1
  H  H31  1  0.83388653  0.90404932  0.04382590  1
  C  C32  1  0.19437226  0.44905839  0.50970385  1
  C  C33  1  0.30682038  0.55084621  0.01109358  1
  C  C34  1  0.80502300  0.55201210  0.48877468  1
  C  C35  1  0.69493903  0.44986678  0.99099097  1
  C  C36  1  0.23926199  0.56381282  0.44305154  1
  C  C37  1  0.26082259  0.43641587  0.94423449  1
  C  C38  1  0.76047411  0.43714929  0.55554342  1
  C  C39  1  0.73958893  0.56463379  0.05769612  1
  C  C40  1  0.35116903  0.56683460  0.35738570  1
  C  C41  1  0.14969276  0.43445911  0.85817156  1
  C  C42  1  0.64969684  0.43464516  0.64170499  1
  C  C43  1  0.85160861  0.56765123  0.14326731  1
  C  C44  1  0.41618793  0.45588521  0.34293303  1
  C  C45  1  0.08613851  0.54616892  0.84363912  1
  C  C46  1  0.58496081  0.54571298  0.65633599  1
  C  C47  1  0.91643714  0.45657636  0.15780698  1
  C  C48  1  0.36269788  0.34218716  0.41195993  1
  C  C49  1  0.14075031  0.65997583  0.91277768  1
  C  C50  1  0.63793058  0.65898683  0.58668149  1
  C  C51  1  0.86278145  0.34276101  0.08883944  1
  C  C52  1  0.42501682  0.22384366  0.40242110  1
  C  C53  1  0.07971157  0.77841486  0.90418320  1
  C  C54  1  0.57618306  0.77794824  0.59599171  1
  C  C55  1  0.92487233  0.22428019  0.09843879  1
  C  C56  1  0.43678756  -0.00015605  0.45383415  1
  C  C57  1  0.06636609  1.00143195  0.95616741  1
  C  C58  1  0.56537190  1.00091363  0.54470996  1
  C  C59  1  0.93744037  0.00054639  0.04655341  1
  N  N60  1  0.24719454  0.33598389  0.49275985  1
  N  N61  1  0.25566090  0.66478438  0.99423812  1
  N  N62  1  0.75138376  0.66434950  0.50534232  1
  N  N63  1  0.74737856  0.33674874  0.00813424  1
  N  N64  1  0.35931336  0.11453130  0.45975278  1
  N  N65  1  0.14448909  0.88711585  0.96378180  1
  N  N66  1  0.64312780  0.88662654  0.53885122  1
  N  N67  1  0.86046380  0.11537583  0.04032823  1
  N  N68  1  0.02617824  0.91626387  0.57235149  1
  N  N69  1  0.45888634  0.07692589  0.07542761  1
  N  N70  1  0.97033856  0.07927899  0.42454144  1
  N  N71  1  0.51746527  0.90703526  0.93169450  1
  N  N72  1  0.08365872  0.82826824  0.60994176  1
  N  N73  1  0.40093277  0.16326200  0.11624226  1
  N  N74  1  0.90428915  0.16123723  0.38543702  1
  N  N75  1  0.58058896  0.82363376  0.89120358  1
  N  N76  1  0.14809415  0.74892898  0.64576285  1
  N  N77  1  0.34968779  0.25069324  0.14995624  1
  N  N78  1  0.84584217  0.24565764  0.35221884  1
  N  N79  1  0.65009274  0.75005944  0.85253035  1
  N  N80  1  0.96978346  0.19815131  0.64927600  1
  N  N81  1  0.52040300  0.80317684  0.14978036  1
  N  N82  1  0.03982113  0.80584226  0.34711927  1
  N  N83  1  0.46912770  0.19912290  0.85069666  1
  N  N84  1  0.87766960  0.15744035  0.72302334  1
  N  N85  1  0.61735713  0.84191683  0.22297666  1
  N  N86  1  0.12644377  0.84305494  0.27165493  1
  N  N87  1  0.37796312  0.15888140  0.77631699  1
  N  N88  1  0.77952597  0.11385509  0.79270324  1
  N  N89  1  0.71929175  0.87953401  0.29029911  1
  N  N90  1  0.21666435  0.87118963  0.19551373  1
  N  N91  1  0.28043078  0.11641570  0.70627766  1
