# generated using pymatgen
data_Mn2VCrH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11814340
_cell_length_b   10.13840467
_cell_length_c   12.55816224
_cell_angle_alpha   90.02660359
_cell_angle_beta   89.99601686
_cell_angle_gamma   106.45237763
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VCrH28(C7N8)4
_chemical_formula_sum   'Mn2 V1 Cr1 H28 C28 N32'
_cell_volume   991.27946115
_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  0.16202428  0.13381314  0.55412478  1
  V  V1  1  0.34726171  0.87399462  0.05185164  1
  Cr  Cr2  1  0.85064813  0.87208880  0.44884506  1
  Mn  Mn3  1  0.66393855  0.13489110  0.94481817  1
  H  H4  1  0.11386021  0.44880872  0.58015043  1
  H  H5  1  0.38720921  0.54989095  0.08200167  1
  H  H6  1  0.88615890  0.54978051  0.41750827  1
  H  H7  1  0.61412867  0.44934436  0.92054566  1
  H  H8  1  0.18637149  0.64923920  0.45992816  1
  H  H9  1  0.31272458  0.35040047  0.96124396  1
  H  H10  1  0.81348695  0.35211185  0.53806936  1
  H  H11  1  0.68717720  0.65002575  0.04059541  1
  H  H12  1  0.38807141  0.65478925  0.30475382  1
  H  H13  1  0.11252899  0.34741717  0.80495632  1
  H  H14  1  0.61344759  0.34852267  0.69467045  1
  H  H15  1  0.88979412  0.65601146  0.19533547  1
  H  H16  1  0.50196551  0.45044340  0.27814732  1
  H  H17  1  1.00001062  0.55195792  0.77967348  1
  H  H18  1  0.50030023  0.55220954  0.72044936  1
  H  H19  1  0.00302873  0.45134557  0.22212554  1
  H  H20  1  0.52841978  0.23321707  0.34553261  1
  H  H21  1  0.97605686  0.77200761  0.84822525  1
  H  H22  1  0.47297902  0.77165126  0.65193022  1
  H  H23  1  0.02801654  0.23344455  0.15520435  1
  H  H24  1  0.49962808  0.00284105  0.37680013  1
  H  H25  1  1.00537059  0.99803794  0.87877096  1
  H  H26  1  0.50389915  0.99851876  0.62166532  1
  H  H27  1  -0.00048205  0.00342969  0.12369168  1
  H  H28  1  0.33310987  0.90273948  0.45955184  1
  H  H29  1  0.17175600  0.10037832  0.96090853  1
  H  H30  1  0.67056955  0.10074813  0.53969230  1
  H  H31  1  0.83273003  0.90336943  0.04095985  1
  C  C32  1  0.19326665  0.44863401  0.51009803  1
  C  C33  1  0.30799699  0.55119838  0.01190612  1
  C  C34  1  0.80635651  0.55220353  0.48716549  1
  C  C35  1  0.69355388  0.44926682  0.99060468  1
  C  C36  1  0.23791258  0.56317625  0.44328444  1
  C  C37  1  0.26215196  0.43702737  0.94477065  1
  C  C38  1  0.76195190  0.43825552  0.55441279  1
  C  C39  1  0.73865691  0.56397274  0.05732056  1
  C  C40  1  0.34970551  0.56621500  0.35755494  1
  C  C41  1  0.15126034  0.43528574  0.85861338  1
  C  C42  1  0.65123879  0.43608148  0.64070505  1
  C  C43  1  0.85088035  0.56711282  0.14281360  1
  C  C44  1  0.41431950  0.45510396  0.34281741  1
  C  C45  1  0.08792777  0.54703432  0.84406069  1
  C  C46  1  0.58671055  0.54728501  0.65517433  1
  C  C47  1  0.91494310  0.45575666  0.15768693  1
  C  C48  1  0.36081257  0.34148359  0.41195451  1
  C  C49  1  0.14237621  0.66059605  0.91340065  1
  C  C50  1  0.63899800  0.66046431  0.58541960  1
  C  C51  1  0.86082188  0.34194708  0.08872294  1
  C  C52  1  0.42396159  0.22352434  0.40300343  1
  C  C53  1  0.08066339  0.77876056  0.90500752  1
  C  C54  1  0.57785439  0.77928023  0.59506424  1
  C  C55  1  0.92380309  0.22391093  0.09758980  1
  C  C56  1  0.43636408  -0.00076093  0.45467421  1
  C  C57  1  0.06860303  1.00365840  0.95682941  1
  C  C58  1  0.56817296  1.00375824  0.54398209  1
  C  C59  1  0.93649622  -0.00039493  0.04572563  1
  N  N60  1  0.24533239  0.33537454  0.49264119  1
  N  N61  1  0.25800051  0.66568346  0.99456663  1
  N  N62  1  0.75323785  0.66548237  0.50342790  1
  N  N63  1  0.74511414  0.33583781  0.00816932  1
  N  N64  1  0.35795692  0.11336538  0.45940664  1
  N  N65  1  0.14742637  0.88935779  0.96266173  1
  N  N66  1  0.64755652  0.89000525  0.53922663  1
  N  N67  1  0.85835830  0.11405346  0.04066629  1
  N  N68  1  0.01833898  0.91007776  0.57128808  1
  N  N69  1  0.45802703  0.07761914  0.07632266  1
  N  N70  1  0.96289468  0.07731895  0.42074894  1
  N  N71  1  0.51806505  0.90824503  0.92940627  1
  N  N72  1  0.08167709  0.82667716  0.61150491  1
  N  N73  1  0.40014269  0.16345697  0.11786244  1
  N  N74  1  0.90125942  0.16216540  0.38180787  1
  N  N75  1  0.58182236  0.82510622  0.88873992  1
  N  N76  1  0.15098082  0.75138212  0.64770708  1
  N  N77  1  0.34430378  0.24803758  0.15224315  1
  N  N78  1  0.84305613  0.24693775  0.34993624  1
  N  N79  1  0.65107183  0.75004483  0.85230898  1
  N  N80  1  0.96908027  0.19722892  0.64885221  1
  N  N81  1  0.52995976  0.80815736  0.14922887  1
  N  N82  1  0.04261874  0.81078685  0.35217781  1
  N  N83  1  0.46913892  0.19723000  0.85125541  1
  N  N84  1  0.87905473  0.15679435  0.72358613  1
  N  N85  1  0.61894295  0.83978245  0.22583934  1
  N  N86  1  0.12387342  0.84288610  0.27316992  1
  N  N87  1  0.37975513  0.15803978  0.77600873  1
  N  N88  1  0.78334283  0.11326436  0.79440481  1
  N  N89  1  0.70480014  0.86087434  0.30288804  1
  N  N90  1  0.20603414  0.86521946  0.19427652  1
  N  N91  1  0.28483193  0.11621609  0.70459165  1
