# generated using pymatgen
data_MnVH14(C7N8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11818220
_cell_length_b   10.13512754
_cell_length_c   12.55859063
_cell_angle_alpha   90.02912903
_cell_angle_beta   89.99068036
_cell_angle_gamma   106.45682664
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVH14(C7N8)2
_chemical_formula_sum   'Mn2 V2 H28 C28 N32'
_cell_volume   990.97483361
_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
  V  V0  1  0.15976752  0.12884269  0.55471961  1
  Mn  Mn1  1  0.33617598  0.86761497  0.05185275  1
  V  V2  1  0.84046933  0.87107254  0.44496861  1
  Mn  Mn3  1  0.66416251  0.13221623  0.94876243  1
  H  H4  1  0.11113806  0.44724548  0.58094306  1
  H  H5  1  0.38417963  0.55005495  0.07993929  1
  H  H6  1  0.88682972  0.55169586  0.41805747  1
  H  H7  1  0.61390357  0.44899997  0.92118162  1
  H  H8  1  0.18561929  0.64794682  0.46101344  1
  H  H9  1  0.31080796  0.34972724  0.95988598  1
  H  H10  1  0.81257767  0.35136904  0.53823280  1
  H  H11  1  0.68769584  0.64973064  0.04084065  1
  H  H12  1  0.38685280  0.65283083  0.30518412  1
  H  H13  1  0.11096355  0.34500974  0.80365000  1
  H  H14  1  0.61327158  0.34755354  0.69491895  1
  H  H15  1  0.88957480  0.65554829  0.19621387  1
  H  H16  1  0.50206146  0.44947501  0.27969274  1
  H  H17  1  0.99633994  0.54913438  0.77799926  1
  H  H18  1  0.49878176  0.55134915  0.72050276  1
  H  H19  1  0.00495034  0.45185928  0.22173260  1
  H  H20  1  0.52431404  0.22815084  0.34589465  1
  H  H21  1  0.97187552  0.76862493  0.84432684  1
  H  H22  1  0.47622170  0.77237450  0.65387615  1
  H  H23  1  0.02905033  0.23205010  0.15578172  1
  H  H24  1  0.50025028  0.00605906  0.37701775  1
  H  H25  1  0.99773416  0.99504167  0.87785149  1
  H  H26  1  0.50027907  0.99460812  0.62212513  1
  H  H27  1  0.00307084  0.00552845  0.12276158  1
  H  H28  1  0.33278507  0.90097816  0.45678347  1
  H  H29  1  0.16889681  0.09663545  0.95721991  1
  H  H30  1  0.66789089  0.09913490  0.54210650  1
  H  H31  1  0.83200791  0.90364036  0.04345760  1
  C  C32  1  0.19059265  0.44690283  0.51082937  1
  C  C33  1  0.30397583  0.55031055  0.01029547  1
  C  C34  1  0.80813815  0.55253631  0.48844953  1
  C  C35  1  0.69493317  0.44923597  0.99049949  1
  C  C36  1  0.23685655  0.56169560  0.44428164  1
  C  C37  1  0.25927148  0.43578713  0.94331224  1
  C  C38  1  0.76202170  0.43793015  0.55518735  1
  C  C39  1  0.73990821  0.56399195  0.05722759  1
  C  C40  1  0.34897352  0.56475070  0.35860694  1
  C  C41  1  0.14829041  0.43304087  0.85719181  1
  C  C42  1  0.65083485  0.43541995  0.64127250  1
  C  C43  1  0.85184355  0.56728420  0.14292736  1
  C  C44  1  0.41352009  0.45369828  0.34393484  1
  C  C45  1  0.08367293  0.54418025  0.84272214  1
  C  C46  1  0.58674561  0.54670324  0.65602000  1
  C  C47  1  0.91691410  0.45636883  0.15731181  1
  C  C48  1  0.35857726  0.33945230  0.41238726  1
  C  C49  1  0.13664467  0.65756470  0.91220243  1
  C  C50  1  0.64139882  0.66067502  0.58726778  1
  C  C51  1  0.86359176  0.34270703  0.08813565  1
  C  C52  1  0.42112744  0.22191687  0.40361123  1
  C  C53  1  0.07471673  0.77590735  0.90251265  1
  C  C54  1  0.57908849  0.77835970  0.59599998  1
  C  C55  1  0.92586393  0.22452834  0.09779265  1
  C  C56  1  0.43519347  -0.00175434  0.45467136  1
  C  C57  1  0.06411790  1.00080848  0.95483306  1
  C  C58  1  0.56522033  1.00202198  0.54446021  1
  C  C59  1  0.93662838  -0.00043655  0.04578739  1
  N  N60  1  0.24100136  0.33245401  0.49284802  1
  N  N61  1  0.25111435  0.66338681  0.99368010  1
  N  N62  1  0.75853591  0.66731109  0.50659393  1
  N  N63  1  0.74852066  0.33647986  0.00694322  1
  N  N64  1  0.35529307  0.11162828  0.46149709  1
  N  N65  1  0.14055713  0.88570367  0.95957599  1
  N  N66  1  0.64471328  0.88838463  0.53778488  1
  N  N67  1  0.85997221  0.11451883  0.04097179  1
  N  N68  1  0.02877769  0.91906892  0.56703506  1
  N  N69  1  0.46707371  0.08481372  0.07413473  1
  N  N70  1  0.97128842  0.08091970  0.43270747  1
  N  N71  1  0.53297174  0.91490301  0.92669074  1
  N  N72  1  0.08723150  0.83399292  0.61107776  1
  N  N73  1  0.40751075  0.16942402  0.11506202  1
  N  N74  1  0.91247045  0.16572226  0.38857844  1
  N  N75  1  0.59234246  0.83029267  0.88555529  1
  N  N76  1  0.14732464  0.75381710  0.64787419  1
  N  N77  1  0.34626990  0.25145615  0.14953185  1
  N  N78  1  0.85221754  0.24576570  0.35170152  1
  N  N79  1  0.65348218  0.74829660  0.85092594  1
  N  N80  1  0.97626957  0.19597961  0.64573239  1
  N  N81  1  0.54473994  0.80267170  0.15805890  1
  N  N82  1  0.02419337  0.80347642  0.35458999  1
  N  N83  1  0.45457956  0.19661214  0.84204257  1
  N  N84  1  0.88173196  0.15681777  0.71946924  1
  N  N85  1  0.63354089  0.84105224  0.23235096  1
  N  N86  1  0.11866111  0.84266534  0.28082584  1
  N  N87  1  0.36671212  0.15867517  0.76732516  1
  N  N88  1  0.78522724  0.12177470  0.79055007  1
  N  N89  1  0.72343855  0.87387920  0.30813407  1
  N  N90  1  0.21527498  0.87822732  0.20987187  1
  N  N91  1  0.27780687  0.12615380  0.69106520  1
