# generated using pymatgen
data_MnCrCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.90922125
_cell_length_b   10.88836381
_cell_length_c   10.94365907
_cell_angle_alpha   88.91977438
_cell_angle_beta   88.81226355
_cell_angle_gamma   63.57316033
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrCoH8C14(NO)6
_chemical_formula_sum   'Mn2 Cr2 Co2 H16 C28 N12 O12'
_cell_volume   1163.77152351
_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
  Co  Co0  1  0.91387450  0.08180783  0.24591167  1
  Co  Co1  1  0.08612198  0.91819586  0.75408664  1
  Mn  Mn2  1  0.85006507  0.99834098  -0.00477249  1
  Cr  Cr3  1  0.00792438  0.14393944  0.50827811  1
  Mn  Mn4  1  0.14993350  0.00166075  1.00477367  1
  Cr  Cr5  1  0.99207458  0.85606359  0.49172153  1
  H  H6  1  0.53645070  0.17422404  0.41764100  1
  H  H7  1  0.82944370  0.45315251  0.09773927  1
  H  H8  1  0.46355351  0.82576702  0.58236060  1
  H  H9  1  0.17055942  0.54684758  0.90225920  1
  H  H10  1  0.33332992  0.16314429  0.51814059  1
  H  H11  1  0.84297721  0.65457415  0.99653193  1
  H  H12  1  0.66667085  0.83685295  0.48186209  1
  H  H13  1  0.15703210  0.34542207  0.00346547  1
  H  H14  1  0.42581463  0.07328307  0.06811356  1
  H  H15  1  0.91633809  0.57379104  0.44949519  1
  H  H16  1  0.57418499  0.92671081  0.93189002  1
  H  H17  1  0.08365227  0.42621670  0.55050456  1
  H  H18  1  0.89055367  0.21947328  0.05391470  1
  H  H19  1  0.79505714  0.10591073  0.44614932  1
  H  H20  1  0.10944269  0.78053008  0.94608463  1
  H  H21  1  0.20494436  0.89409488  0.55384508  1
  C  C22  1  0.62540434  0.11571074  0.18100806  1
  C  C23  1  0.88373033  0.36618753  0.33278394  1
  C  C24  1  0.37459743  0.88428041  0.81899230  1
  C  C25  1  0.11626595  0.63381547  0.66721584  1
  C  C26  1  0.49718185  0.11991831  0.23757801  1
  C  C27  1  0.88012424  0.49487419  0.27871025  1
  C  C28  1  0.50282077  0.88007425  0.76242419  1
  C  C29  1  0.11987438  0.50512792  0.72128888  1
  C  C30  1  0.46784681  0.14887674  0.36380697  1
  C  C31  1  0.85440429  0.52200777  0.15165069  1
  C  C32  1  0.53215594  0.85111610  0.63619496  1
  C  C33  1  0.14559809  0.47799283  0.84834753  1
  C  C34  1  0.35430911  0.14400300  0.42078228  1
  C  C35  1  0.86083999  0.63408874  0.09383224  1
  C  C36  1  0.64569196  0.85599339  0.57922070  1
  C  C37  1  0.13916637  0.36590957  0.90616552  1
  C  C38  1  0.26954207  0.11004990  0.34902839  1
  C  C39  1  0.89202514  0.72097272  0.16602799  1
  C  C40  1  0.73045731  0.88994956  0.65097390  1
  C  C41  1  0.10798073  0.27902555  0.83397015  1
  C  C42  1  0.29823656  0.08164542  0.22421842  1
  C  C43  1  0.90999354  0.69918037  0.29267588  1
  C  C44  1  0.70176371  0.91835207  0.77578432  1
  C  C45  1  0.09000618  0.30082207  0.70732310  1
  C  C46  1  0.40896744  0.09082171  0.16577444  1
  C  C47  1  0.90355530  0.58730615  0.35125604  1
  C  C48  1  0.59103363  0.90917218  0.83422678  1
  C  C49  1  0.09643988  0.41269748  0.64874393  1
  N  N50  1  0.15779560  0.08538583  0.37548205  1
  N  N51  1  0.91511351  0.83189219  0.13544625  1
  N  N52  1  0.84219468  0.91462704  0.62451742  1
  N  N53  1  0.08489668  0.16810370  0.86455189  1
  N  N54  1  0.12466539  0.03833504  0.27450423  1
  N  N55  1  0.94894057  0.87600916  0.23529644  1
  N  N56  1  0.87532891  0.96167104  0.72549594  1
  N  N57  1  0.05106564  0.12398891  0.76470275  1
  N  N58  1  0.20690485  0.03695548  0.18298143  1
  N  N59  1  0.93910135  0.80204888  0.33377157  1
  N  N60  1  0.79308910  0.96305103  0.81701953  1
  N  N61  1  0.06089765  0.19795318  0.66622742  1
  O  O62  1  0.93588188  0.12003382  0.06255432  1
  O  O63  1  0.89429607  0.05884723  0.43318172  1
  O  O64  1  0.06411540  0.87996992  0.93744597  1
  O  O65  1  0.10570579  0.94115592  0.56681526  1
  O  O66  1  0.70229797  0.14192399  0.25089367  1
  O  O67  1  0.85656932  0.29065807  0.26331855  1
  O  O68  1  0.29770437  0.85806834  0.74910500  1
  O  O69  1  0.14342442  0.70934649  0.73668138  1
  O  O70  1  0.65016604  0.08246594  0.06838126  1
  O  O71  1  0.91619576  0.33878824  0.44696322  1
  O  O72  1  0.34983405  0.91752386  0.93161935  1
  O  O73  1  0.08380294  0.66121365  0.55303569  1
