# generated using pymatgen
data_CoNiH48Pd2(C19N3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.26837873
_cell_length_b   14.08257272
_cell_length_c   16.08081376
_cell_angle_alpha   101.76814360
_cell_angle_beta   95.39915952
_cell_angle_gamma   90.00471498
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoNiH48Pd2(C19N3)4
_chemical_formula_sum   'Co1 Ni1 H48 Pd2 C76 N12'
_cell_volume   1603.93136364
_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
  Ni  Ni0  1  0.50082377  0.99996620  0.50101281  1
  Co  Co1  1  0.49890796  0.49850915  0.48720191  1
  H  H2  1  0.55898443  0.99032449  0.68501640  1
  H  H3  1  0.44173614  0.01021161  0.31649162  1
  H  H4  1  0.56599624  0.09501216  0.82954900  1
  H  H5  1  0.43346804  0.90539499  0.17197533  1
  H  H6  1  0.48473241  0.34009085  0.70765495  1
  H  H7  1  0.51542984  0.66043471  0.29384357  1
  H  H8  1  0.48380858  0.22616394  0.56880486  1
  H  H9  1  0.51710119  0.77435183  0.43276464  1
  H  H10  1  0.77108589  0.52244667  0.36619350  1
  H  H11  1  0.23069437  0.47586193  0.63666872  1
  H  H12  1  0.78008729  0.49305767  0.20849386  1
  H  H13  1  0.22084889  0.50596472  0.79408762  1
  H  H14  1  0.20540136  0.40364337  0.18167022  1
  H  H15  1  0.79384224  0.59838904  0.82065372  1
  H  H16  1  0.21503007  0.44030119  0.34042734  1
  H  H17  1  0.78208049  0.56356268  0.66197347  1
  H  H18  1  0.47357450  0.20373456  0.32188361  1
  H  H19  1  0.52638787  0.79637436  0.67817812  1
  H  H20  1  0.19212920  0.11160548  0.25025137  1
  H  H21  1  0.80771784  0.88849747  0.74987379  1
  H  H22  1  0.16180555  0.05087874  0.09205736  1
  H  H23  1  0.83790289  0.94916653  0.90808823  1
  H  H24  1  0.41215921  0.08532726  0.00639158  1
  H  H25  1  0.58747732  0.91459877  0.99367285  1
  H  H26  1  0.78128537  0.27115205  0.31476374  1
  H  H27  1  0.21878858  0.72861096  0.68523758  1
  H  H28  1  0.03926372  0.29713972  0.23072804  1
  H  H29  1  0.96075301  0.70257169  0.76917311  1
  H  H30  1  0.00445919  0.24381539  0.07160063  1
  H  H31  1  0.99531264  0.75607753  0.92826892  1
  H  H32  1  0.71616233  0.15802249  0.99833028  1
  H  H33  1  0.28358621  0.84186142  0.00167145  1
  H  H34  1  0.11711029  0.15551508  0.95028911  1
  H  H35  1  0.88267404  0.84455373  0.04983306  1
  H  H36  1  0.16534827  0.98580452  0.87583788  1
  H  H37  1  0.83439875  0.01426066  0.12427298  1
  H  H38  1  0.12484144  0.94189661  0.71600662  1
  H  H39  1  0.87489348  0.05817901  0.28407455  1
  H  H40  1  0.03645103  0.06671312  0.63258470  1
  H  H41  1  0.96328234  0.93339005  0.36752957  1
  H  H42  1  0.96366319  0.23577920  0.62718998  1
  H  H43  1  0.03591595  0.76437648  0.37296560  1
  H  H44  1  0.91386923  0.40508990  0.70108177  1
  H  H45  1  0.08568321  0.59510711  0.29916651  1
  H  H46  1  0.94830666  0.44926477  0.86097580  1
  H  H47  1  0.05089337  0.55073564  0.13920337  1
  H  H48  1  0.03678696  0.32431322  0.94498993  1
  H  H49  1  0.96278637  0.67568690  0.05515781  1
  Pd  Pd50  1  0.99491879  0.24495865  0.46563037  1
  Pd  Pd51  1  0.00694591  0.75420356  0.53354726  1
  C  C52  1  0.54269647  0.06815761  0.69245881  1
  C  C53  1  0.45786372  0.93238039  0.30911444  1
  C  C54  1  0.54624525  0.12625770  0.77321454  1
  C  C55  1  0.45356625  0.87424404  0.22833915  1
  C  C56  1  0.52326928  0.22712479  0.78127989  1
  C  C57  1  0.47643078  0.77340586  0.22035291  1
  C  C58  1  0.50155167  0.26317081  0.70526563  1
  C  C59  1  0.49868404  0.73735247  0.29632596  1
  C  C60  1  0.50039210  0.19889030  0.62752958  1
  C  C61  1  0.50037928  0.80165447  0.37406007  1
  C  C62  1  0.52021945  0.28827195  0.86159356  1
  C  C63  1  0.47919084  0.71200918  0.14018489  1
  C  C64  1  0.51246707  0.33575228  0.93533096  1
  C  C65  1  0.48731414  0.66380613  0.06676545  1
  C  C66  1  0.79527394  0.14447582  0.45778438  1
  C  C67  1  0.20674639  0.85526088  0.54385089  1
  C  C68  1  0.19884884  0.34292520  0.47400745  1
  C  C69  1  0.80152373  0.65580264  0.51869756  1
  C  C70  1  0.80500913  0.34891548  0.47985709  1
  C  C71  1  0.19494050  0.64990959  0.51076612  1
  C  C72  1  0.17932948  0.13834225  0.45468692  1
  C  C73  1  0.82278454  0.86095038  0.54712153  1
  C  C74  1  0.64841110  0.49694387  0.32336367  1
  C  C75  1  0.35334913  0.50279462  0.67913516  1
  C  C76  1  0.65410179  0.47971724  0.23588874  1
  C  C77  1  0.34650645  0.51981410  0.76674399  1
  C  C78  1  0.49408863  0.44314505  0.18180456  1
  C  C79  1  0.50639927  0.55675905  0.82045246  1
  C  C80  1  0.33183821  0.43033658  0.22091917  1
  C  C81  1  0.66778470  0.57105475  0.78148734  1
  C  C82  1  0.33757825  0.45074836  0.30914372  1
  C  C83  1  0.65986296  0.55127520  0.69303555  1
  C  C84  1  0.49723041  0.41613507  0.09310028  1
  C  C85  1  0.50345574  0.58322654  0.90923475  1
  C  C86  1  0.50270548  0.38106918  0.01592355  1
  C  C87  1  0.49764237  0.61818083  0.98633292  1
  C  C88  1  0.45906086  0.17764811  0.25284051  1
  C  C89  1  0.54090316  0.82230080  0.74724054  1
  C  C90  1  0.30184422  0.12633488  0.21250642  1
  C  C91  1  0.69802805  0.87367967  0.78760971  1
  C  C92  1  0.28471689  0.09232225  0.12349534  1
  C  C93  1  0.71508901  0.90765881  0.87662190  1
  C  C94  1  0.42430786  0.11105195  0.07553384  1
  C  C95  1  0.57547741  0.88885842  0.92453559  1
  C  C96  1  0.60523280  0.19613194  0.20568531  1
  C  C97  1  0.39472105  0.80375227  0.79434127  1
  C  C98  1  0.76962820  0.24556845  0.24558932  1
  C  C99  1  0.23044781  0.75420917  0.75438299  1
  C  C100  1  0.91174112  0.26138438  0.19809863  1
  C  C101  1  0.08828508  0.73840856  0.80182736  1
  C  C102  1  0.89244132  0.23038300  0.10862726  1
  C  C103  1  0.10744460  0.76948081  0.89128669  1
  C  C104  1  0.73299755  0.18152183  0.06772204  1
  C  C105  1  0.26686969  0.81832577  0.93228147  1
  C  C106  1  0.58724228  0.16250913  0.11493599  1
  C  C107  1  0.41263488  0.83733490  0.88508528  1
  C  C108  1  0.04802989  0.20821144  0.83447704  1
  C  C109  1  0.95157706  0.79183979  0.16564901  1
  C  C110  1  0.09811952  0.13514601  0.88073194  1
  C  C111  1  0.90161240  0.86491169  0.11938906  1
  C  C112  1  0.12513150  0.04076457  0.83888879  1
  C  C113  1  0.87461357  0.95930130  0.16122087  1
  C  C114  1  0.10196361  0.01592713  0.74912157  1
  C  C115  1  0.89774573  0.98415159  0.25098019  1
  C  C116  1  0.05376964  0.08570922  0.70212299  1
  C  C117  1  0.94594359  0.91438917  0.29799667  1
  C  C118  1  0.02674862  0.18285794  0.74311934  1
  C  C119  1  0.97285946  0.81722202  0.25701296  1
  C  C120  1  0.97948515  0.25593663  0.69675456  1
  C  C121  1  0.02003001  0.74417702  0.30339923  1
  C  C122  1  0.95241868  0.35031596  0.73836347  1
  C  C123  1  0.04702592  0.64977431  0.26180516  1
  C  C124  1  0.97239519  0.37522066  0.82822200  1
  C  C125  1  0.02703158  0.62481564  0.17193979  1
  C  C126  1  0.01994888  0.30537829  0.87536242  1
  C  C127  1  0.97954167  0.69464872  0.12478221  1
  N  N128  1  0.51839364  0.10240787  0.62011436  1
  N  N129  1  0.48265221  0.89813610  0.38148724  1
  N  N130  1  0.68190464  0.08576708  0.45932307  1
  N  N131  1  0.32018731  0.91410499  0.54278289  1
  N  N132  1  0.31756050  0.40062442  0.47834676  1
  N  N133  1  0.68108426  0.59782783  0.50727193  1
  N  N134  1  0.68873805  0.40692495  0.48667382  1
  N  N135  1  0.30914140  0.59160686  0.49692081  1
  N  N136  1  0.49347858  0.48226272  0.36033618  1
  N  N137  1  0.50634590  0.51810700  0.64246539  1
  N  N138  1  0.29043222  0.07806319  0.45601316  1
  N  N139  1  0.71172773  0.92137714  0.54652345  1
