# generated using pymatgen
data_Mn2CrH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.03204184
_cell_length_b   11.04945590
_cell_length_c   11.04636583
_cell_angle_alpha   88.80650405
_cell_angle_beta   88.46228394
_cell_angle_gamma   62.93639051
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CrH8C14(NO)6
_chemical_formula_sum   'Mn4 Cr2 H16 C28 N12 O12'
_cell_volume   1198.60008682
_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  0.89937310  0.10330326  0.25687180  1
  Mn  Mn1  1  0.10062660  0.89669810  0.74312800  1
  Cr  Cr2  1  0.85695127  0.99352357  -0.01374771  1
  Mn  Mn3  1  0.00347820  0.14916292  0.50702251  1
  Cr  Cr4  1  0.14304831  0.00647560  1.01374787  1
  Mn  Mn5  1  0.99651849  0.85084008  0.49297807  1
  H  H6  1  0.54872178  0.17718971  0.39234253  1
  H  H7  1  0.81860300  0.46973324  0.09608592  1
  H  H8  1  0.45128165  0.82280176  0.60766034  1
  H  H9  1  0.18140096  0.53026613  0.90391140  1
  H  H10  1  0.35517714  0.15958681  0.50160656  1
  H  H11  1  0.83043096  0.66816254  0.99217046  1
  H  H12  1  0.64482331  0.84041045  0.49839454  1
  H  H13  1  0.16957643  0.33183519  0.00782724  1
  H  H14  1  0.42288761  0.08606960  0.05087101  1
  H  H15  1  0.93878800  0.57354957  0.43440141  1
  H  H16  1  0.57711682  0.91392496  0.94912792  1
  H  H17  1  0.06120582  0.42645453  0.56559916  1
  H  H18  1  0.90124471  0.20492261  0.03883519  1
  H  H19  1  0.78549999  0.10045301  0.47677366  1
  H  H20  1  0.09875610  0.79507576  0.96116281  1
  H  H21  1  0.21449714  0.89955085  0.52322620  1
  C  C22  1  0.62734506  0.12486974  0.15816990  1
  C  C23  1  0.88805430  0.37947873  0.32813652  1
  C  C24  1  0.37265569  0.87512788  0.84183002  1
  C  C25  1  0.11194281  0.62052324  0.67186177  1
  C  C26  1  0.50256666  0.12633560  0.21610665  1
  C  C27  1  0.88417864  0.50479783  0.27024147  1
  C  C28  1  0.49743515  0.87366035  0.78389480  1
  C  C29  1  0.11581968  0.49520403  0.72975703  1
  C  C30  1  0.47945526  0.15178732  0.34252793  1
  C  C31  1  0.84926189  0.53495404  0.14640107  1
  C  C32  1  0.52054788  0.84820752  0.65747368  1
  C  C33  1  0.15074042  0.46504629  0.85359677  1
  C  C34  1  0.37248835  0.14258449  0.40464768  1
  C  C35  1  0.85435395  0.64557512  0.08753689  1
  C  C36  1  0.62751205  0.85741280  0.59535316  1
  C  C37  1  0.14565023  0.35442445  0.91246127  1
  C  C38  1  0.28597786  0.11004300  0.33725694  1
  C  C39  1  0.89445150  0.72629910  0.15505552  1
  C  C40  1  0.71402124  0.88995696  0.66274321  1
  C  C41  1  0.10555047  0.27370114  0.84494409  1
  C  C42  1  0.30345336  0.09288099  0.21099891  1
  C  C43  1  0.92915844  0.69633528  0.27742878  1
  C  C44  1  0.69654757  0.90711748  0.78900087  1
  C  C45  1  0.07084001  0.30366681  0.72257173  1
  C  C46  1  0.41109579  0.10063048  0.14827026  1
  C  C47  1  0.91889232  0.58944902  0.33811887  1
  C  C48  1  0.58890595  0.89936581  0.85173218  1
  C  C49  1  0.08110421  0.41055372  0.66188118  1
  N  N50  1  0.18075587  0.08129734  0.37196593  1
  N  N51  1  0.91759094  0.83612498  0.12562500  1
  N  N52  1  0.81924197  0.91870514  0.62803295  1
  N  N53  1  0.08241260  0.16387449  0.87437489  1
  N  N54  1  0.13562217  0.04811322  0.27399298  1
  N  N55  1  0.96657833  0.86921234  0.22226032  1
  N  N56  1  0.86437623  0.95188911  0.72600565  1
  N  N57  1  0.03342164  0.13078884  0.77774081  1
  N  N58  1  0.20329920  0.06051646  0.17477565  1
  N  N59  1  0.97528360  0.78610180  0.31448388  1
  N  N60  1  0.79669892  0.93948333  0.82522464  1
  N  N61  1  0.02471343  0.21390113  0.68551718  1
  O  O62  1  0.94064644  0.11080162  0.06696612  1
  O  O63  1  0.87732611  0.06650599  0.44256583  1
  O  O64  1  0.05935325  0.88919710  0.93303201  1
  O  O65  1  0.12267160  0.93349663  0.55743483  1
  O  O66  1  0.69417008  0.16581307  0.22257223  1
  O  O67  1  0.84940443  0.31025048  0.26350946  1
  O  O68  1  0.30582942  0.83418946  0.77743050  1
  O  O69  1  0.15059420  0.68975187  0.73648917  1
  O  O70  1  0.66145880  0.07998044  0.04933271  1
  O  O71  1  0.93319504  0.34789036  0.43582089  1
  O  O72  1  0.33854112  0.92001561  0.95066593  1
  O  O73  1  0.06680105  0.65211242  0.56417894  1
