# generated using pymatgen
data_MnCrH14(C7N8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11867431
_cell_length_b   10.13769219
_cell_length_c   12.55817813
_cell_angle_alpha   90.03433139
_cell_angle_beta   89.98801387
_cell_angle_gamma   106.44699116
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrH14(C7N8)2
_chemical_formula_sum   'Mn2 Cr2 H28 C28 N32'
_cell_volume   991.30332110
_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
  Cr  Cr0  1  0.14906930  0.12746907  0.55108891  1
  Mn  Mn1  1  0.33907219  0.86631875  0.05410896  1
  Mn  Mn2  1  0.83921084  0.86643069  0.44601159  1
  Cr  Cr3  1  0.64922668  0.12749413  0.94906518  1
  H  H4  1  0.11218176  0.44929392  0.58159007  1
  H  H5  1  0.38426748  0.55010128  0.08055124  1
  H  H6  1  0.88427014  0.55025953  0.41905583  1
  H  H7  1  0.61227802  0.44957877  0.91892507  1
  H  H8  1  0.18488615  0.64727121  0.46121626  1
  H  H9  1  0.31150551  0.34980305  0.96008247  1
  H  H10  1  0.81182220  0.35008060  0.53951226  1
  H  H11  1  0.68544818  0.64763969  0.03928662  1
  H  H12  1  0.38645813  0.65163670  0.30526281  1
  H  H13  1  0.11064467  0.34495045  0.80458918  1
  H  H14  1  0.61143464  0.34542037  0.69525624  1
  H  H15  1  0.88798139  0.65237926  0.19477812  1
  H  H16  1  0.50054745  0.44837653  0.27971276  1
  H  H17  1  0.99809285  0.54986351  0.77789608  1
  H  H18  1  0.49855039  0.55020041  0.72203087  1
  H  H19  1  0.00136754  0.44874846  0.22030181  1
  H  H20  1  0.52707735  0.22896046  0.34752745  1
  H  H21  1  0.97234443  0.76753172  0.84548663  1
  H  H22  1  0.47167799  0.76740865  0.65401151  1
  H  H23  1  0.02683352  0.22889189  0.15275662  1
  H  H24  1  0.49736161  0.00226406  0.37746465  1
  H  H25  1  1.00101279  0.99762741  0.87750981  1
  H  H26  1  0.50075426  0.99757749  0.62237222  1
  H  H27  1  -0.00328440  0.00201540  0.12246580  1
  H  H28  1  0.33058120  0.89931641  0.45904850  1
  H  H29  1  0.16800625  0.09741251  0.96017478  1
  H  H30  1  0.66777093  0.09750236  0.53988180  1
  H  H31  1  0.83023619  0.89957267  0.04042185  1
  C  C32  1  0.19272909  0.44733293  0.51222361  1
  C  C33  1  0.30531960  0.55062317  0.01035108  1
  C  C34  1  0.80542382  0.55079439  0.48932060  1
  C  C35  1  0.69301381  0.44764420  0.98817733  1
  C  C36  1  0.23719302  0.56144775  0.44513322  1
  C  C37  1  0.26045547  0.43610564  0.94340976  1
  C  C38  1  0.76076412  0.43638323  0.55626727  1
  C  C39  1  0.73778898  0.56184807  0.05526295  1
  C  C40  1  0.34867537  0.56405587  0.35917282  1
  C  C41  1  0.14933406  0.43355333  0.85743330  1
  C  C42  1  0.64983386  0.43391341  0.64235959  1
  C  C43  1  0.84958649  0.56455746  0.14104979  1
  C  C44  1  0.41359506  0.45302192  0.34475507  1
  C  C45  1  0.08559331  0.54508750  0.84257042  1
  C  C46  1  0.58589304  0.54535228  0.65725434  1
  C  C47  1  0.91424725  0.45339898  0.15539199  1
  C  C48  1  0.36102181  0.33965173  0.41428705  1
  C  C49  1  0.13914372  0.65856612  0.91192958  1
  C  C50  1  0.63913184  0.65869069  0.58783954  1
  C  C51  1  0.86133814  0.33993262  0.08587192  1
  C  C52  1  0.42214591  0.22080394  0.40447702  1
  C  C53  1  0.07645726  0.77681556  0.90309216  1
  C  C54  1  0.57615607  0.77679123  0.59664350  1
  C  C55  1  0.92227360  0.22100755  0.09560536  1
  C  C56  1  0.43268333  -0.00345136  0.45506737  1
  C  C57  1  0.06436296  1.00111033  0.95534057  1
  C  C58  1  0.56425284  1.00112734  0.54457083  1
  C  C59  1  0.93256418  -0.00336169  0.04473124  1
  N  N60  1  0.24658529  0.33438588  0.49614422  1
  N  N61  1  0.25401134  0.66420414  0.99286315  1
  N  N62  1  0.75409281  0.66436809  0.50692059  1
  N  N63  1  0.74680536  0.33466169  0.00409937  1
  N  N64  1  0.35252127  0.10989976  0.46003013  1
  N  N65  1  0.14234475  0.88664974  0.95995138  1
  N  N66  1  0.64229872  0.88671561  0.54002363  1
  N  N67  1  0.85274971  0.11018939  0.03983820  1
  N  N68  1  0.03540978  0.92205676  0.57820857  1
  N  N69  1  0.48135054  0.09048658  0.07152269  1
  N  N70  1  0.98135633  0.09018111  0.42842654  1
  N  N71  1  0.53593236  0.92187852  0.92228501  1
  N  N72  1  0.09707769  0.83736035  0.61746478  1
  N  N73  1  0.41777752  0.17373442  0.11177734  1
  N  N74  1  0.91780189  0.17331990  0.38808036  1
  N  N75  1  0.59769297  0.83720519  0.88298198  1
  N  N76  1  0.15604150  0.75316074  0.64949653  1
  N  N77  1  0.34853234  0.24918118  0.14792428  1
  N  N78  1  0.84856394  0.24866551  0.35185595  1
  N  N79  1  0.65601484  0.75271976  0.85067675  1
  N  N80  1  0.95999410  0.19032940  0.64783798  1
  N  N81  1  0.53048690  0.80170886  0.14925731  1
  N  N82  1  0.03179056  0.80233394  0.35139305  1
  N  N83  1  0.46018050  0.19052262  0.85220250  1
  N  N84  1  0.87793792  0.15826172  0.72693564  1
  N  N85  1  0.62085267  0.84163389  0.22400260  1
  N  N86  1  0.12115256  0.84202242  0.27621065  1
  N  N87  1  0.37829426  0.15859220  0.77304296  1
  N  N88  1  0.79555536  0.13627030  0.80563598  1
  N  N89  1  0.71729129  0.88393959  0.29463063  1
  N  N90  1  0.21606341  0.88440566  0.20487688  1
  N  N91  1  0.29578089  0.13676973  0.69438193  1
