# generated using pymatgen
data_MnVH14(C7N8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11756290
_cell_length_b   10.13878962
_cell_length_c   12.55823877
_cell_angle_alpha   90.03425990
_cell_angle_beta   89.98795777
_cell_angle_gamma   106.45617427
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVH14(C7N8)2
_chemical_formula_sum   'Mn2 V2 H28 C28 N32'
_cell_volume   991.23278517
_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  0.15044820  0.12556741  0.54959408  1
  Mn  Mn1  1  0.33597127  0.86440569  0.05519203  1
  Mn  Mn2  1  0.83601374  0.86450694  0.44482734  1
  V  V3  1  0.65062480  0.12559538  0.95049133  1
  H  H4  1  0.11108621  0.44889057  0.58152230  1
  H  H5  1  0.38414336  0.54976716  0.08031955  1
  H  H6  1  0.88414400  0.54988146  0.41927983  1
  H  H7  1  0.61117788  0.44917225  0.91897777  1
  H  H8  1  0.18550370  0.64880999  0.46094092  1
  H  H9  1  0.31125033  0.34930569  0.95993140  1
  H  H10  1  0.81156562  0.34955593  0.53966433  1
  H  H11  1  0.68601466  0.64917966  0.03959983  1
  H  H12  1  0.38677302  0.65244986  0.30497893  1
  H  H13  1  0.11077482  0.34452908  0.80426999  1
  H  H14  1  0.61147938  0.34495604  0.69553956  1
  H  H15  1  0.88814590  0.65314402  0.19507470  1
  H  H16  1  0.50074699  0.44876081  0.28004708  1
  H  H17  1  0.99824862  0.54960172  0.77742507  1
  H  H18  1  0.49867644  0.54991311  0.72246949  1
  H  H19  1  0.00157890  0.44913572  0.21996839  1
  H  H20  1  0.52454941  0.22842548  0.34843511  1
  H  H21  1  0.97296193  0.76704161  0.84465794  1
  H  H22  1  0.47264773  0.76705831  0.65502385  1
  H  H23  1  0.02444022  0.22845961  0.15179759  1
  H  H24  1  0.49587920  0.00315524  0.37816955  1
  H  H25  1  1.00061804  0.99666523  0.87696868  1
  H  H26  1  0.50028445  0.99662513  0.62292491  1
  H  H27  1  -0.00436112  0.00310303  0.12171680  1
  H  H28  1  0.32940273  0.89979767  0.45964366  1
  H  H29  1  0.16796673  0.09681540  0.95928375  1
  H  H30  1  0.66772727  0.09687054  0.54077811  1
  H  H31  1  0.82919029  0.90000850  0.04002065  1
  C  C32  1  0.19084437  0.44824783  0.51158103  1
  C  C33  1  0.30522619  0.55010174  0.01007094  1
  C  C34  1  0.80532394  0.55023123  0.48959136  1
  C  C35  1  0.69111958  0.44853997  0.98881632  1
  C  C36  1  0.23660395  0.56245861  0.44449594  1
  C  C37  1  0.26025529  0.43559655  0.94315405  1
  C  C38  1  0.76056487  0.43584045  0.55652167  1
  C  C39  1  0.73717838  0.56284921  0.05590278  1
  C  C40  1  0.34814777  0.56462526  0.35864877  1
  C  C41  1  0.14902577  0.43303447  0.85721046  1
  C  C42  1  0.64948363  0.43335376  0.64256140  1
  C  C43  1  0.84905264  0.56511279  0.14157666  1
  C  C44  1  0.41229377  0.45324468  0.34428434  1
  C  C45  1  0.08530035  0.54456648  0.84232380  1
  C  C46  1  0.58559646  0.54481146  0.65748505  1
  C  C47  1  0.91295093  0.45361642  0.15586467  1
  C  C48  1  0.35776545  0.33961751  0.41343419  1
  C  C49  1  0.13895512  0.65805404  0.91163687  1
  C  C50  1  0.63903150  0.65819330  0.58815627  1
  C  C51  1  0.85807530  0.33988647  0.08672949  1
  C  C52  1  0.41961589  0.22152567  0.40502478  1
  C  C53  1  0.07639503  0.77628509  0.90275884  1
  C  C54  1  0.57628770  0.77634137  0.59704709  1
  C  C55  1  0.91973593  0.22171427  0.09508662  1
  C  C56  1  0.43210184  -0.00315220  0.45610572  1
  C  C57  1  0.06402154  1.00062831  0.95480476  1
  C  C58  1  0.56385811  1.00063657  0.54512510  1
  C  C59  1  0.93207266  -0.00305798  0.04373213  1
  N  N60  1  0.24159234  0.33408445  0.49442061  1
  N  N61  1  0.25410414  0.66370729  0.99241086  1
  N  N62  1  0.75420995  0.66383788  0.50737268  1
  N  N63  1  0.74183635  0.33435276  0.00581371  1
  N  N64  1  0.35260254  0.11076042  0.46242833  1
  N  N65  1  0.14166703  0.88595419  0.95990039  1
  N  N66  1  0.64158514  0.88600903  0.54000151  1
  N  N67  1  0.85278818  0.11100330  0.03751243  1
  N  N68  1  0.04263253  0.92282482  0.57650504  1
  N  N69  1  0.48348440  0.09228503  0.07095521  1
  N  N70  1  0.98361854  0.09209412  0.42896915  1
  N  N71  1  0.54313966  0.92260952  0.92423659  1
  N  N72  1  0.09999012  0.83645315  0.61753971  1
  N  N73  1  0.41940856  0.17548417  0.11172472  1
  N  N74  1  0.91936580  0.17510434  0.38818922  1
  N  N75  1  0.60009661  0.83623022  0.88271656  1
  N  N76  1  0.15441879  0.75097953  0.65158703  1
  N  N77  1  0.34844594  0.24907330  0.14841055  1
  N  N78  1  0.84828240  0.24857596  0.35153686  1
  N  N79  1  0.65420303  0.75075849  0.84825394  1
  N  N80  1  0.96723899  0.18960609  0.64808116  1
  N  N81  1  0.53012835  0.80127027  0.14925896  1
  N  N82  1  0.03157005  0.80195742  0.35141590  1
  N  N83  1  0.46764487  0.18991032  0.85196977  1
  N  N84  1  0.88078375  0.15822365  0.72549226  1
  N  N85  1  0.62146375  0.84286080  0.22324655  1
  N  N86  1  0.12173290  0.84318609  0.27689219  1
  N  N87  1  0.38131543  0.15885916  0.77437924  1
  N  N88  1  0.79582302  0.13640240  0.80311258  1
  N  N89  1  0.71840250  0.88668587  0.29344977  1
  N  N90  1  0.21742682  0.88745389  0.20618139  1
  N  N91  1  0.29644585  0.13736076  0.69678233  1
