# generated using pymatgen
data_Mn3CoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11919670
_cell_length_b   10.13525872
_cell_length_c   12.56184908
_cell_angle_alpha   90.03796522
_cell_angle_beta   89.98291943
_cell_angle_gamma   106.43343334
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3CoH28(C7N8)4
_chemical_formula_sum   'Mn3 Co1 H28 C28 N32'
_cell_volume   991.48804218
_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  0.15965867  0.13403887  0.55586447  1
  Mn  Mn1  1  0.34178059  0.86802386  0.05292657  1
  Mn  Mn2  1  0.83992470  0.86538898  0.44658782  1
  Co  Co3  1  0.65761166  0.13269888  0.94451324  1
  H  H4  1  0.11375771  0.44917407  0.57865210  1
  H  H5  1  0.38415525  0.54963491  0.07917725  1
  H  H6  1  0.88400517  0.54977648  0.42024837  1
  H  H7  1  0.61271145  0.44945326  0.92161134  1
  H  H8  1  0.18721573  0.64975880  0.45937385  1
  H  H9  1  0.31068107  0.34934665  0.95968875  1
  H  H10  1  0.81103991  0.34959942  0.54015635  1
  H  H11  1  0.68716680  0.64921656  0.04021212  1
  H  H12  1  0.38851674  0.65439516  0.30289932  1
  H  H13  1  0.10995104  0.34514523  0.80294211  1
  H  H14  1  0.61176356  0.34589244  0.69719311  1
  H  H15  1  0.88952731  0.65419259  0.19648054  1
  H  H16  1  0.50421342  0.45130410  0.27785311  1
  H  H17  1  0.99587242  0.54899226  0.77772803  1
  H  H18  1  0.49665806  0.54937554  0.72236630  1
  H  H19  1  0.00489400  0.45065393  0.22158660  1
  H  H20  1  0.52695008  0.23184979  0.34294789  1
  H  H21  1  0.97354377  0.76826044  0.84298061  1
  H  H22  1  0.47322973  0.76894261  0.65684973  1
  H  H23  1  0.02610496  0.23170471  0.15602667  1
  H  H24  1  0.50389937  0.00727347  0.37704547  1
  H  H25  1  0.99705227  0.99374613  0.87739391  1
  H  H26  1  0.49698188  0.99358801  0.62226464  1
  H  H27  1  0.00211067  0.00784675  0.12253984  1
  H  H28  1  0.33324194  0.90462941  0.45523658  1
  H  H29  1  0.16733823  0.09582487  0.95645576  1
  H  H30  1  0.66780302  0.09571181  0.54412825  1
  H  H31  1  0.83215958  0.90390582  0.04388073  1
  C  C32  1  0.19550502  0.44955382  0.50965045  1
  C  C33  1  0.30332102  0.54989110  0.00986938  1
  C  C34  1  0.80321357  0.55002003  0.48959680  1
  C  C35  1  0.69490535  0.44866919  0.99022779  1
  C  C36  1  0.23999888  0.56423833  0.44282614  1
  C  C37  1  0.25867319  0.43521201  0.94293510  1
  C  C38  1  0.75895450  0.43554210  0.55659369  1
  C  C39  1  0.73965640  0.56360446  0.05695177  1
  C  C40  1  0.35167516  0.56698584  0.35706297  1
  C  C41  1  0.14742949  0.43270769  0.85705523  1
  C  C42  1  0.64817178  0.43311143  0.64280789  1
  C  C43  1  0.85192453  0.56659032  0.14244935  1
  C  C44  1  0.41695002  0.45606760  0.34272007  1
  C  C45  1  0.08288916  0.54391589  0.84263317  1
  C  C46  1  0.58324363  0.54418030  0.65724290  1
  C  C47  1  0.91728612  0.45579707  0.15703092  1
  C  C48  1  0.36399940  0.34270245  0.41209581  1
  C  C49  1  0.13608385  0.65729150  0.91208620  1
  C  C50  1  0.63575769  0.65739146  0.58771195  1
  C  C51  1  0.86376638  0.34235544  0.08760106  1
  C  C52  1  0.42539458  0.22391334  0.40219953  1
  C  C53  1  0.07503264  0.77617646  0.90223646  1
  C  C54  1  0.57465069  0.77621158  0.59763440  1
  C  C55  1  0.92455512  0.22296012  0.09699406  1
  C  C56  1  0.43711839  0.00081185  0.45395116  1
  C  C57  1  0.06329882  0.99974751  0.95440471  1
  C  C58  1  0.56381867  0.99961723  0.54537578  1
  C  C59  1  0.93557574  0.00030741  0.04544031  1
  N  N60  1  0.24971621  0.33706635  0.49353307  1
  N  N61  1  0.25032264  0.66283626  0.99341275  1
  N  N62  1  0.74978116  0.66290974  0.50612399  1
  N  N63  1  0.75117221  0.33751349  0.00603225  1
  N  N64  1  0.36018762  0.11566533  0.46061768  1
  N  N65  1  0.13991266  0.88472453  0.96048850  1
  N  N66  1  0.64017073  0.88437493  0.53900464  1
  N  N67  1  0.85872440  0.11496998  0.03892917  1
  N  N68  1  0.03032349  0.91415324  0.57364411  1
  N  N69  1  0.47504853  0.08525776  0.07200971  1
  N  N70  1  0.96867579  0.08525574  0.42668750  1
  N  N71  1  0.52829174  0.91711279  0.92560625  1
  N  N72  1  0.08987688  0.82931111  0.61415699  1
  N  N73  1  0.41672547  0.17251394  0.10978725  1
  N  N74  1  0.90949505  0.17005625  0.38579957  1
  N  N75  1  0.59364865  0.83504192  0.88620832  1
  N  N76  1  0.15156423  0.74736323  0.64813830  1
  N  N77  1  0.35181704  0.25133254  0.14615140  1
  N  N78  1  0.84836018  0.25217684  0.35149264  1
  N  N79  1  0.65223634  0.75062604  0.85295646  1
  N  N80  1  0.96662152  0.19988196  0.65507576  1
  N  N81  1  0.52909125  0.79997315  0.15017856  1
  N  N82  1  0.02968777  0.79955086  0.35012328  1
  N  N83  1  0.47321616  0.19950721  0.85105781  1
  N  N84  1  0.87265046  0.16051598  0.72846495  1
  N  N85  1  0.62392192  0.83973401  0.22294786  1
  N  N86  1  0.12408078  0.84021831  0.27726800  1
  N  N87  1  0.38057590  0.15843371  0.77777311  1
  N  N88  1  0.77402588  0.11208309  0.79680871  1
  N  N89  1  0.72279209  0.88336193  0.29219570  1
  N  N90  1  0.22188280  0.88500298  0.20775227  1
  N  N91  1  0.28103889  0.11657169  0.70838974  1
