# generated using pymatgen
data_Mn2CrH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.05708425
_cell_length_b   11.02380207
_cell_length_c   11.04455375
_cell_angle_alpha   88.65356874
_cell_angle_beta   88.60256181
_cell_angle_gamma   62.93583043
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CrH8C14(NO)6
_chemical_formula_sum   'Mn4 Cr2 H16 C28 N12 O12'
_cell_volume   1198.34419707
_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  0.89713162  0.10062274  0.24379834  1
  Mn  Mn1  1  0.10286725  0.89937856  0.75620059  1
  Mn  Mn2  1  0.85094077  0.99649339  -0.00664359  1
  Cr  Cr3  1  0.00603783  0.14334615  0.51409448  1
  Mn  Mn4  1  0.14906017  0.00350464  1.00664307  1
  Cr  Cr5  1  0.99395783  0.85665742  0.48590709  1
  H  H6  1  0.53095088  0.17996618  0.40582836  1
  H  H7  1  0.82194855  0.45103570  0.10869980  1
  H  H8  1  0.46905346  0.82002674  0.59417376  1
  H  H9  1  0.17805606  0.54896395  0.89129819  1
  H  H10  1  0.33261635  0.16727234  0.50947154  1
  H  H11  1  0.83885035  0.64460865  0.99911635  1
  H  H12  1  0.66738656  0.83272345  0.49053039  1
  H  H13  1  0.16115858  0.35538788  0.00088063  1
  H  H14  1  0.42597818  0.06532487  0.06517611  1
  H  H15  1  0.91643883  0.57679735  0.44887902  1
  H  H16  1  0.57402247  0.93467281  0.93482593  1
  H  H17  1  0.08355307  0.42320797  0.55112221  1
  H  H18  1  0.89927095  0.21485822  0.02477178  1
  H  H19  1  0.79513681  0.09817940  0.46182716  1
  H  H20  1  0.10072442  0.78514383  0.97522862  1
  H  H21  1  0.20485931  0.90182425  0.53816854  1
  C  C22  1  0.62067702  0.11300779  0.17259134  1
  C  C23  1  0.87536970  0.37281295  0.34258329  1
  C  C24  1  0.37932341  0.88698753  0.82740817  1
  C  C25  1  0.12462640  0.62718794  0.65741380  1
  C  C26  1  0.49510922  0.11728949  0.23047827  1
  C  C27  1  0.87418482  0.49720569  0.28434353  1
  C  C28  1  0.50489302  0.88270733  0.76952567  1
  C  C29  1  0.12581307  0.50279554  0.71565345  1
  C  C30  1  0.46532460  0.15047695  0.35491441  1
  C  C31  1  0.84781988  0.52032084  0.15821947  1
  C  C32  1  0.53467731  0.84951798  0.64508778  1
  C  C33  1  0.15218251  0.47967810  0.84177725  1
  C  C34  1  0.35478290  0.14485882  0.41363196  1
  C  C35  1  0.85649485  0.62737343  0.09591303  1
  C  C36  1  0.64521927  0.85513787  0.58637038  1
  C  C37  1  0.14351118  0.37262483  0.90408417  1
  C  C38  1  0.27354619  0.10637941  0.34523480  1
  C  C39  1  0.88948280  0.71406395  0.16280439  1
  C  C40  1  0.72645354  0.89362024  0.65476687  1
  C  C41  1  0.11052230  0.28593334  0.83719368  1
  C  C42  1  0.30277228  0.07397027  0.22208620  1
  C  C43  1  0.90809967  0.69620267  0.28878422  1
  C  C44  1  0.69722653  0.92603074  0.77791529  1
  C  C45  1  0.09189913  0.30379857  0.71121575  1
  C  C46  1  0.40989124  0.08438884  0.16172707  1
  C  C47  1  0.90092023  0.58850585  0.35175031  1
  C  C48  1  0.59010974  0.91560847  0.83827255  1
  C  C49  1  0.09907552  0.41149581  0.64824839  1
  N  N50  1  0.16432739  0.08207033  0.37447849  1
  N  N51  1  0.91785563  0.81949585  0.12785992  1
  N  N52  1  0.83567055  0.91793222  0.62552296  1
  N  N53  1  0.08215197  0.18049995  0.87213876  1
  N  N54  1  0.13090057  0.03471492  0.27691497  1
  N  N55  1  0.95220845  0.86430515  0.22543118  1
  N  N56  1  0.86909593  0.96529007  0.72308573  1
  N  N57  1  0.04779337  0.13569457  0.77456914  1
  N  N58  1  0.21310860  0.02823222  0.18427259  1
  N  N59  1  0.94131818  0.79596342  0.32464102  1
  N  N60  1  0.78688733  0.97177331  0.81572773  1
  N  N61  1  0.05867834  0.20403973  0.67535867  1
  O  O62  1  0.93336746  0.12274725  0.05803018  1
  O  O63  1  0.88925930  0.05903204  0.43339360  1
  O  O64  1  0.06663167  0.87725361  0.94196881  1
  O  O65  1  0.11073761  0.94097098  0.56660617  1
  O  O66  1  0.69056831  0.15004754  0.23799356  1
  O  O67  1  0.83346132  0.30614374  0.27861093  1
  O  O68  1  0.30943249  0.84995140  0.76200638  1
  O  O69  1  0.16654066  0.69385928  0.72138863  1
  O  O70  1  0.65178646  0.06904074  0.06429647  1
  O  O71  1  0.92071584  0.33865366  0.45089227  1
  O  O72  1  0.34821610  0.93095344  0.93570581  1
  O  O73  1  0.07927834  0.66134961  0.54910666  1
