# generated using pymatgen
data_MnVH14(C7N8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11819859
_cell_length_b   10.13511523
_cell_length_c   12.55857807
_cell_angle_alpha   90.03925903
_cell_angle_beta   89.98592114
_cell_angle_gamma   106.45694719
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVH14(C7N8)2
_chemical_formula_sum   'Mn2 V2 H28 C28 N32'
_cell_volume   990.97391824
_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
  Mn  Mn0  1  0.16412960  0.13217250  0.55127512  1
  V  V1  1  0.34036802  0.87116093  0.05505491  1
  Mn  Mn2  1  0.83622063  0.86765378  0.44823740  1
  V  V3  1  0.65981087  0.12877276  0.94540687  1
  H  H4  1  0.11382200  0.44868218  0.57934422  1
  H  H5  1  0.38689366  0.55151431  0.08148108  1
  H  H6  1  0.88418229  0.55023740  0.41963459  1
  H  H7  1  0.61124112  0.44755057  0.91957660  1
  H  H8  1  0.18713414  0.64928168  0.45973593  1
  H  H9  1  0.31217196  0.35106086  0.96136515  1
  H  H10  1  0.81122545  0.35007333  0.53964125  1
  H  H11  1  0.68629970  0.64839446  0.03942900  1
  H  H12  1  0.38811515  0.65482834  0.30386577  1
  H  H13  1  0.11238414  0.34703763  0.80492735  1
  H  H14  1  0.61188578  0.34551852  0.69618480  1
  H  H15  1  0.88805057  0.65347399  0.19496562  1
  H  H16  1  0.50409900  0.45139549  0.27826938  1
  H  H17  1  0.99831598  0.55106406  0.77939978  1
  H  H18  1  0.49686798  0.54950797  0.72194303  1
  H  H19  1  0.00288898  0.44985889  0.22033354  1
  H  H20  1  0.52914840  0.23197851  0.34435832  1
  H  H21  1  0.97662517  0.77238014  0.84575110  1
  H  H22  1  0.47148209  0.76864368  0.65539193  1
  H  H23  1  0.02423167  0.22823981  0.15432035  1
  H  H24  1  0.50332870  0.00549889  0.37710270  1
  H  H25  1  1.00067131  0.99466690  0.87773385  1
  H  H26  1  0.49727884  0.99497937  0.62199941  1
  H  H27  1  0.00006676  0.00599118  0.12285215  1
  H  H28  1  0.33228303  0.90337162  0.45614251  1
  H  H29  1  0.16817811  0.09907387  0.95793916  1
  H  H30  1  0.66857788  0.09672864  0.54282252  1
  H  H31  1  0.83265839  0.90120657  0.04280664  1
  C  C32  1  0.19466992  0.44890430  0.50991763  1
  C  C33  1  0.30807307  0.55237919  0.01117075  1
  C  C34  1  0.80407055  0.55051222  0.48933945  1
  C  C35  1  0.69081510  0.44716843  0.98960852  1
  C  C36  1  0.23932168  0.56354750  0.44317643  1
  C  C37  1  0.26165826  0.43763642  0.94447788  1
  C  C38  1  0.75962786  0.43610213  0.55633040  1
  C  C39  1  0.73743329  0.56209849  0.05611417  1
  C  C40  1  0.35094442  0.56675609  0.35729444  1
  C  C41  1  0.15028935  0.43504590  0.85850166  1
  C  C42  1  0.64885224  0.43343180  0.64258037  1
  C  C43  1  0.84979023  0.56522942  0.14164425  1
  C  C44  1  0.41626357  0.45596586  0.34282422  1
  C  C45  1  0.08640708  0.54642173  0.84378251  1
  C  C46  1  0.58404053  0.54448211  0.65711353  1
  C  C47  1  0.91414496  0.45407999  0.15623755  1
  C  C48  1  0.36332952  0.34241684  0.41202698  1
  C  C49  1  0.14135091  0.66051549  0.91249938  1
  C  C50  1  0.63668272  0.65774950  0.58760499  1
  C  C51  1  0.85886198  0.33972138  0.08780980  1
  C  C52  1  0.42577561  0.22432317  0.40226735  1
  C  C53  1  0.07922682  0.77828202  0.90377792  1
  C  C54  1  0.57454981  0.77600103  0.59732684  1
  C  C55  1  0.92127672  0.22211175  0.09648262  1
  C  C56  1  0.43666674  -0.00056767  0.45400571  1
  C  C57  1  0.06541815  1.00202029  0.95545159  1
  C  C58  1  0.56393058  1.00081968  0.54510064  1
  C  C59  1  0.93523697  -0.00163176  0.04514465  1
  N  N60  1  0.24835479  0.33618342  0.49331503  1
  N  N61  1  0.25851805  0.66715204  0.99314239  1
  N  N62  1  0.75114365  0.66357006  0.50608463  1
  N  N63  1  0.74111112  0.33268985  0.00746386  1
  N  N64  1  0.35976815  0.11423813  0.45889582  1
  N  N65  1  0.14476895  0.88830057  0.96210332  1
  N  N66  1  0.64047906  0.88580735  0.54038580  1
  N  N67  1  0.85556027  0.11189464  0.03840458  1
  N  N68  1  0.03245536  0.91513473  0.57381545  1
  N  N69  1  0.47123500  0.08096438  0.06730058  1
  N  N70  1  0.96698679  0.08459539  0.42584226  1
  N  N71  1  0.52914964  0.91892759  0.93341018  1
  N  N72  1  0.09206731  0.83058034  0.61471485  1
  N  N73  1  0.41249945  0.16592966  0.11136501  1
  N  N74  1  0.90748114  0.16915243  0.38487758  1
  N  N75  1  0.58742387  0.83380290  0.88919280  1
  N  N76  1  0.15334650  0.74860446  0.64913357  1
  N  N77  1  0.35242664  0.24613236  0.14823567  1
  N  N78  1  0.84624289  0.25110816  0.35036574  1
  N  N79  1  0.64724130  0.75355249  0.85215288  1
  N  N80  1  0.95382837  0.19628499  0.65791245  1
  N  N81  1  0.52255517  0.80272003  0.14622394  1
  N  N82  1  0.04618254  0.80326605  0.34250348  1
  N  N83  1  0.47698637  0.19642911  0.85419254  1
  N  N84  1  0.86599085  0.15803317  0.73259840  1
  N  N85  1  0.61842978  0.84218918  0.21930472  1
  N  N86  1  0.13415970  0.84179611  0.26789452  1
  N  N87  1  0.38228741  0.15739018  0.78048881  1
  N  N88  1  0.77733150  0.12516465  0.80893298  1
  N  N89  1  0.71613485  0.87744763  0.28976535  1
  N  N90  1  0.22288783  0.87485521  0.19163403  1
  N  N91  1  0.28562666  0.12259689  0.70945534  1
