# generated using pymatgen
data_MnCrCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.89708905
_cell_length_b   10.90501507
_cell_length_c   10.95433890
_cell_angle_alpha   88.99363533
_cell_angle_beta   88.70075961
_cell_angle_gamma   63.56053237
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrCoH8C14(NO)6
_chemical_formula_sum   'Mn2 Cr2 Co2 H16 C28 N12 O12'
_cell_volume   1165.24113338
_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  0.91901976  0.08521589  0.25449864  1
  Co  Co1  1  0.08098119  0.91478557  0.74550031  1
  Cr  Cr2  1  0.85648316  0.99156955  -0.00828948  1
  Mn  Mn3  1  0.00262021  0.14983645  0.50499010  1
  Cr  Cr4  1  0.14351716  0.00843197  1.00828804  1
  Mn  Mn5  1  0.99737744  0.85016642  0.49500967  1
  H  H6  1  0.54735410  0.17002269  0.40233526  1
  H  H7  1  0.82382856  0.46468307  0.08408096  1
  H  H8  1  0.45264909  0.82996825  0.59766751  1
  H  H9  1  0.17617523  0.53531692  0.91591713  1
  H  H10  1  0.34594100  0.15569192  0.50382034  1
  H  H11  1  0.83393060  0.66801017  0.98368270  1
  H  H12  1  0.65405878  0.84430468  0.49618066  1
  H  H13  1  0.16607838  0.33198701  0.01631555  1
  H  H14  1  0.42612268  0.08650430  0.05013955  1
  H  H15  1  0.93127960  0.57311977  0.43125975  1
  H  H16  1  0.57388023  0.91349027  0.94986108  1
  H  H17  1  0.06871240  0.42688570  0.56874256  1
  H  H18  1  0.89440775  0.20476021  0.05603034  1
  H  H19  1  0.78138974  0.10903359  0.44623792  1
  H  H20  1  0.10559185  0.79524419  0.94396843  1
  H  H21  1  0.21860875  0.89096889  0.55375846  1
  C  C22  1  0.63426474  0.11645329  0.16735852  1
  C  C23  1  0.88594141  0.37431345  0.31914613  1
  C  C24  1  0.36573648  0.88354257  0.83264243  1
  C  C25  1  0.11405378  0.62569014  0.68085356  1
  C  C26  1  0.50516658  0.12077533  0.22125495  1
  C  C27  1  0.88150292  0.50263162  0.26285949  1
  C  C28  1  0.49483484  0.87921946  0.77874625  1
  C  C29  1  0.11849497  0.49737138  0.73714108  1
  C  C30  1  0.47813601  0.14565757  0.34854491  1
  C  C31  1  0.85049968  0.53275145  0.13739847  1
  C  C32  1  0.52186613  0.85433643  0.65145744  1
  C  C33  1  0.14950225  0.46724821  0.86260018  1
  C  C34  1  0.36638930  0.13874126  0.40631857  1
  C  C35  1  0.85484907  0.64643296  0.08049703  1
  C  C36  1  0.63361096  0.86125509  0.59368191  1
  C  C37  1  0.14515574  0.35356647  0.91949957  1
  C  C38  1  0.27963556  0.10798388  0.33404299  1
  C  C39  1  0.89082773  0.73031942  0.15154802  1
  C  C40  1  0.72036318  0.89201559  0.66595737  1
  C  C41  1  0.10917571  0.26968014  0.84845144  1
  C  C42  1  0.30106548  0.09118291  0.20717119  1
  C  C43  1  0.92259675  0.70002880  0.27530157  1
  C  C44  1  0.69893524  0.90881535  0.79282817  1
  C  C45  1  0.07740132  0.29997212  0.72469964  1
  C  C46  1  0.41264139  0.09836911  0.14856824  1
  C  C47  1  0.91280609  0.58993792  0.33398241  1
  C  C48  1  0.58736024  0.90162681  0.85143484  1
  C  C49  1  0.08718882  0.41006582  0.66601489  1
  N  N50  1  0.16918208  0.08414819  0.36462784  1
  N  N51  1  0.91446540  0.84260177  0.12519570  1
  N  N52  1  0.83081444  0.91585448  0.63537044  1
  N  N53  1  0.08554204  0.15739536  0.87480321  1
  N  N54  1  0.12476558  0.05144888  0.26448801  1
  N  N55  1  0.96415704  0.87454197  0.22493647  1
  N  N56  1  0.87523144  0.94855371  0.73551038  1
  N  N57  1  0.03584484  0.12545756  0.77506417  1
  N  N58  1  0.19837734  0.06197081  0.16618079  1
  N  N59  1  0.96925418  0.79023999  0.31566806  1
  N  N60  1  0.80162211  0.93802910  0.83381790  1
  N  N61  1  0.03074332  0.20976123  0.68433374  1
  O  O62  1  0.94189334  0.10538526  0.06759146  1
  O  O63  1  0.88079407  0.06401385  0.43753192  1
  O  O64  1  0.05810697  0.89461859  0.93240634  1
  O  O65  1  0.11920524  0.93598793  0.56246760  1
  O  O66  1  0.71013678  0.14232651  0.23736224  1
  O  O67  1  0.85831754  0.29788608  0.24978026  1
  O  O68  1  0.28986507  0.85767041  0.76264025  1
  O  O69  1  0.14167516  0.70211933  0.75021918  1
  O  O70  1  0.66167679  0.08474408  0.05309883  1
  O  O71  1  0.92075111  0.34912670  0.43105121  1
  O  O72  1  0.33832450  0.91525270  0.94690333  1
  O  O73  1  0.07924402  0.65087638  0.56894846  1
