# generated using pymatgen
data_VCrH48Pd2(C19N3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.27124399
_cell_length_b   14.08749890
_cell_length_c   16.08240768
_cell_angle_alpha   101.77453490
_cell_angle_beta   95.39705689
_cell_angle_gamma   90.00484628
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCrH48Pd2(C19N3)4
_chemical_formula_sum   'V1 Cr1 H48 Pd2 C76 N12'
_cell_volume   1605.25210646
_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
  V  V0  1  0.50063371  1.00234758  0.49961204  1
  Cr  Cr1  1  0.49977964  0.49965617  0.49676124  1
  H  H2  1  0.55879354  0.98903566  0.68484079  1
  H  H3  1  0.44197055  0.01140487  0.31664009  1
  H  H4  1  0.56632079  0.09415799  0.82918779  1
  H  H5  1  0.43317333  0.90622259  0.17230547  1
  H  H6  1  0.48472174  0.33948722  0.70712148  1
  H  H7  1  0.51556292  0.66102559  0.29434719  1
  H  H8  1  0.48468487  0.22617339  0.56794753  1
  H  H9  1  0.51616317  0.77421099  0.43347613  1
  H  H10  1  0.77237633  0.52239489  0.36456064  1
  H  H11  1  0.22895592  0.47509137  0.63608938  1
  H  H12  1  0.78027489  0.49287336  0.20847827  1
  H  H13  1  0.22106269  0.50549745  0.79185589  1
  H  H14  1  0.20503811  0.40425221  0.18142998  1
  H  H15  1  0.79404767  0.59722147  0.81854688  1
  H  H16  1  0.21256186  0.44069197  0.33845838  1
  H  H17  1  0.78463155  0.56335535  0.66187467  1
  H  H18  1  0.47399747  0.20407151  0.32164899  1
  H  H19  1  0.52595518  0.79604588  0.67837934  1
  H  H20  1  0.19211159  0.11164600  0.24986134  1
  H  H21  1  0.80771591  0.88845284  0.75025804  1
  H  H22  1  0.16191033  0.05111809  0.09156956  1
  H  H23  1  0.83777775  0.94890227  0.90855509  1
  H  H24  1  0.41302366  0.08630898  0.00597569  1
  H  H25  1  0.58659354  0.91358249  0.99407545  1
  H  H26  1  0.77808351  0.27263448  0.31438284  1
  H  H27  1  0.22215106  0.72710340  0.68555325  1
  H  H28  1  0.03827803  0.29760488  0.23041998  1
  H  H29  1  0.96182204  0.70203137  0.76940424  1
  H  H30  1  0.00262071  0.24471000  0.07113081  1
  H  H31  1  0.99708497  0.75511067  0.92867818  1
  H  H32  1  0.71268520  0.15931344  0.99805600  1
  H  H33  1  0.28690062  0.84050759  0.00188595  1
  H  H34  1  0.11765881  0.15670697  0.95062017  1
  H  H35  1  0.88213146  0.84334593  0.04947984  1
  H  H36  1  0.16588172  0.98637644  0.87614028  1
  H  H37  1  0.83387373  0.01369367  0.12392629  1
  H  H38  1  0.12435539  0.94231233  0.71636572  1
  H  H39  1  0.87537066  0.05781124  0.28372310  1
  H  H40  1  0.03600255  0.06764247  0.63288332  1
  H  H41  1  0.96369700  0.93249340  0.36720061  1
  H  H42  1  0.96397513  0.23553721  0.62773513  1
  H  H43  1  0.03538231  0.76460077  0.37249242  1
  H  H44  1  0.91360769  0.40531535  0.70158974  1
  H  H45  1  0.08613230  0.59488814  0.29863936  1
  H  H46  1  0.94912186  0.44948155  0.86153829  1
  H  H47  1  0.05016931  0.55056534  0.13868405  1
  H  H48  1  0.03894192  0.32419247  0.94541307  1
  H  H49  1  0.96059517  0.67581777  0.05473041  1
  Pd  Pd50  1  0.99328970  0.23655996  0.46365449  1
  Pd  Pd51  1  0.00798208  0.76211997  0.53389646  1
  C  C52  1  0.54197358  0.06690976  0.69258345  1
  C  C53  1  0.45860101  0.93346492  0.30880332  1
  C  C54  1  0.54544780  0.12533263  0.77283867  1
  C  C55  1  0.45450885  0.87492784  0.22852743  1
  C  C56  1  0.52246090  0.22631896  0.78075325  1
  C  C57  1  0.47746415  0.77385860  0.22036682  1
  C  C58  1  0.50096833  0.26255152  0.70463462  1
  C  C59  1  0.49943703  0.73792324  0.29670925  1
  C  C60  1  0.49980266  0.19912296  0.62690944  1
  C  C61  1  0.50104137  0.80132283  0.37453022  1
  C  C62  1  0.52059891  0.28767002  0.86095207  1
  C  C63  1  0.47911112  0.71244150  0.13994931  1
  C  C64  1  0.51333908  0.33497472  0.93476746  1
  C  C65  1  0.48648112  0.66452381  0.06631062  1
  C  C66  1  0.79335124  0.13838968  0.45886028  1
  C  C67  1  0.20782721  0.86060068  0.54262134  1
  C  C68  1  0.19292266  0.33575956  0.47323863  1
  C  C69  1  0.80737164  0.66315303  0.52128299  1
  C  C70  1  0.80923991  0.34166659  0.47992403  1
  C  C71  1  0.19051014  0.65716918  0.51281684  1
  C  C72  1  0.18114239  0.13358223  0.45614593  1
  C  C73  1  0.82142029  0.86549990  0.54539984  1
  C  C74  1  0.64777904  0.49697898  0.32287650  1
  C  C75  1  0.35301073  0.50244291  0.67745152  1
  C  C76  1  0.65391647  0.47934327  0.23543390  1
  C  C77  1  0.34691040  0.51999174  0.76500566  1
  C  C78  1  0.49428965  0.44270836  0.18103745  1
  C  C79  1  0.50586342  0.55739361  0.81958834  1
  C  C80  1  0.33212396  0.43019631  0.22039743  1
  C  C81  1  0.66689638  0.57099259  0.77982429  1
  C  C82  1  0.33732485  0.45125641  0.30851261  1
  C  C83  1  0.66042043  0.55095387  0.69154416  1
  C  C84  1  0.49738261  0.41586291  0.09238112  1
  C  C85  1  0.50277016  0.58374379  0.90851248  1
  C  C86  1  0.50273240  0.38066094  0.01524449  1
  C  C87  1  0.49740054  0.61859521  0.98578886  1
  C  C88  1  0.45929293  0.17735713  0.25267794  1
  C  C89  1  0.54068811  0.82258400  0.74736810  1
  C  C90  1  0.30201812  0.12632463  0.21221311  1
  C  C91  1  0.69788066  0.87364634  0.78789485  1
  C  C92  1  0.28478767  0.09244192  0.12311972  1
  C  C93  1  0.71499345  0.90750570  0.87698997  1
  C  C94  1  0.42432956  0.11103352  0.07519136  1
  C  C95  1  0.57539548  0.88885405  0.92486006  1
  C  C96  1  0.60543256  0.19561061  0.20550721  1
  C  C97  1  0.39451679  0.80424006  0.79446769  1
  C  C98  1  0.76913932  0.24572803  0.24538470  1
  C  C99  1  0.23093969  0.75402080  0.75451313  1
  C  C100  1  0.91118211  0.26132358  0.19789218  1
  C  C101  1  0.08884373  0.73840927  0.80195949  1
  C  C102  1  0.89169683  0.23035956  0.10837209  1
  C  C103  1  0.10812233  0.76943332  0.89148131  1
  C  C104  1  0.73231582  0.18166410  0.06747754  1
  C  C105  1  0.26743069  0.81814406  0.93246195  1
  C  C106  1  0.58734727  0.16211016  0.11480844  1
  C  C107  1  0.41246149  0.83772374  0.88517511  1
  C  C108  1  0.04853181  0.20856246  0.83486614  1
  C  C109  1  0.95108596  0.79150716  0.16525928  1
  C  C110  1  0.09872859  0.13560362  0.88112048  1
  C  C111  1  0.90097477  0.86445880  0.11898139  1
  C  C112  1  0.12547584  0.04127615  0.83921041  1
  C  C113  1  0.87423634  0.95879688  0.16086698  1
  C  C114  1  0.10202004  0.01644792  0.74939732  1
  C  C115  1  0.89767702  0.98366657  0.25067943  1
  C  C116  1  0.05357725  0.08619725  0.70243963  1
  C  C117  1  0.94610404  0.91391999  0.29764922  1
  C  C118  1  0.02682237  0.18327790  0.74359101  1
  C  C119  1  0.97279598  0.81682006  0.25654354  1
  C  C120  1  0.97949035  0.25633828  0.69724123  1
  C  C121  1  0.02003863  0.74381681  0.30294824  1
  C  C122  1  0.95243478  0.35059523  0.73884674  1
  C  C123  1  0.04705727  0.64953751  0.26132346  1
  C  C124  1  0.97287810  0.37543891  0.82875797  1
  C  C125  1  0.02658599  0.62464610  0.17141964  1
  C  C126  1  0.02095221  0.30568440  0.87581931  1
  C  C127  1  0.97856910  0.69437140  0.12432386  1
  N  N128  1  0.51709023  0.10163620  0.61957455  1
  N  N129  1  0.48377883  0.89879615  0.38186273  1
  N  N130  1  0.67656919  0.08140100  0.46187317  1
  N  N131  1  0.32449417  0.91803046  0.54150992  1
  N  N132  1  0.31032204  0.39491277  0.48118849  1
  N  N133  1  0.68914182  0.60428486  0.51243905  1
  N  N134  1  0.69937718  0.40272834  0.49134162  1
  N  N135  1  0.30045547  0.59620778  0.50104139  1
  N  N136  1  0.49275950  0.48297216  0.36045099  1
  N  N137  1  0.50620676  0.51795873  0.63927996  1
  N  N138  1  0.29627567  0.07495979  0.45784023  1
  N  N139  1  0.70722924  0.92462855  0.54588106  1
