# generated using pymatgen
data_MnV2Cr2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35631055
_cell_length_b   9.70842309
_cell_length_c   13.67396773
_cell_angle_alpha   103.32684436
_cell_angle_beta   90.00001523
_cell_angle_gamma   90.00012671
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnV2Cr2H32C12(NO2)6
_chemical_formula_sum   'Mn2 V4 Cr4 H64 C24 N12 O24'
_cell_volume   1208.62728827
_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
  Cr  Cr0  1  0.10180355  0.87082024  0.73010841  1
  Cr  Cr1  1  0.60180608  0.62917158  0.76989086  1
  Cr  Cr2  1  0.89819482  0.12917932  0.26989097  1
  Cr  Cr3  1  0.39819411  0.37082979  0.23011123  1
  V  V4  1  0.95724927  0.56324482  0.72009818  1
  V  V5  1  0.45724885  0.93674468  0.77990327  1
  V  V6  1  0.04275053  0.43675786  0.27990325  1
  V  V7  1  0.54275038  0.06325529  0.22009645  1
  Mn  Mn8  1  -0.00000038  0.99999991  0.99999979  1
  Mn  Mn9  1  0.50000032  0.50000038  0.50000097  1
  H  H10  1  0.19435603  0.19149084  0.08874711  1
  H  H11  1  0.69435157  0.30850717  0.41125097  1
  H  H12  1  0.80564472  0.80850921  0.91125219  1
  H  H13  1  0.30564763  0.69149502  0.58875111  1
  H  H14  1  0.27820744  0.09632507  0.98717702  1
  H  H15  1  0.77820683  0.40367184  0.51281981  1
  H  H16  1  0.72179210  0.90367399  0.01282196  1
  H  H17  1  0.22179240  0.59632979  0.48718248  1
  H  H18  1  0.57778709  0.38109448  0.86637154  1
  H  H19  1  0.07778931  0.11889610  0.63362928  1
  H  H20  1  0.42221183  0.61890744  0.13362936  1
  H  H21  1  0.92220933  0.88110477  0.36636910  1
  H  H22  1  0.54719510  0.21081450  0.88180685  1
  H  H23  1  0.04719423  0.28917673  0.61819598  1
  H  H24  1  0.45280376  0.78918627  0.11819309  1
  H  H25  1  0.95280567  0.71082520  0.38180340  1
  H  H26  1  0.77631416  0.03387579  0.84782937  1
  H  H27  1  0.27631339  0.46611929  0.65217298  1
  H  H28  1  0.22368574  0.96612484  0.15216920  1
  H  H29  1  0.72368798  0.53387957  0.34782959  1
  H  H30  1  0.92977166  0.10880265  0.80560917  1
  H  H31  1  0.42977163  0.39119400  0.69439311  1
  H  H32  1  0.07022715  0.89119843  0.19438909  1
  H  H33  1  0.57022873  0.60880220  0.30560829  1
  H  H34  1  0.21506238  0.32804033  0.96634409  1
  H  H35  1  0.71506170  0.17195743  0.53365350  1
  H  H36  1  0.78493867  0.67195849  0.03365420  1
  H  H37  1  0.28493969  0.82804306  0.46634746  1
  H  H38  1  0.15022852  0.18197914  0.87506839  1
  H  H39  1  0.65023046  0.31801901  0.62493063  1
  H  H40  1  0.84977154  0.81801928  0.12493038  1
  H  H41  1  0.34977023  0.68198025  0.37507127  1
  H  H42  1  0.57626403  0.36501094  0.04288295  1
  H  H43  1  0.07626574  0.13498076  0.45711815  1
  H  H44  1  0.42373632  0.63498836  0.95711670  1
  H  H45  1  0.92373531  0.86502226  0.54288043  1
  H  H46  1  0.73570067  0.43377456  0.00157451  1
  H  H47  1  0.23570421  0.06622081  0.49842770  1
  H  H48  1  0.26429904  0.56622533  0.99842558  1
  H  H49  1  0.76429492  0.93377951  0.50157080  1
  H  H50  1  0.78961202  0.25849512  0.10346961  1
  H  H51  1  0.28960947  0.24150300  0.39653240  1
  H  H52  1  0.21038931  0.74150369  0.89652917  1
  H  H53  1  0.71039323  0.75849875  0.60346854  1
  H  H54  1  0.68803392  0.12717343  0.02061865  1
  H  H55  1  0.18803151  0.37282180  0.47938489  1
  H  H56  1  0.31196723  0.87282587  0.97938055  1
  H  H57  1  0.81197200  0.62718056  0.52061538  1
  H  H58  1  0.80961134  0.33534106  0.81405191  1
  H  H59  1  0.30961338  0.16465433  0.68595105  1
  H  H60  1  0.19038723  0.66465987  0.18594792  1
  H  H61  1  0.69038464  0.83534157  0.31404644  1
  H  H62  1  0.70363478  0.19287051  0.74464584  1
  H  H63  1  0.20363515  0.30712435  0.75535598  1
  H  H64  1  0.29636369  0.80713098  0.25535371  1
  H  H65  1  0.79636469  0.69287115  0.24464430  1
  H  H66  1  0.98231138  0.35231248  0.05643975  1
  H  H67  1  0.48230901  0.14768455  0.44356110  1
  H  H68  1  0.01768923  0.64768778  0.94355855  1
  H  H69  1  0.51769251  0.85231567  0.55643995  1
  H  H70  1  0.96721945  0.36875526  0.92831924  1
  H  H71  1  0.46722068  0.13124239  0.57168220  1
  H  H72  1  0.03278125  0.63124473  0.07167907  1
  H  H73  1  0.53277967  0.86875599  0.42831831  1
  C  C74  1  0.83672787  0.13288235  0.85487566  1
  C  C75  1  0.33672817  0.36711278  0.64512623  1
  C  C76  1  0.16327117  0.86711846  0.14512283  1
  C  C77  1  0.66327283  0.63288504  0.35487542  1
  C  C78  1  0.14050473  0.23828449  0.95391466  1
  C  C79  1  0.64050430  0.26171336  0.54608386  1
  C  C80  1  0.85949540  0.76171514  0.04608380  1
  C  C81  1  0.35949640  0.73828591  0.45391755  1
  C  C82  1  0.67095505  0.33795343  0.99489616  1
  C  C83  1  0.17095468  0.16204079  0.50510559  1
  C  C84  1  0.32904525  0.66204640  0.00510385  1
  C  C85  1  0.82904487  0.83796093  0.49489349  1
  C  C86  1  0.75507289  0.22139054  0.02551855  1
  C  C87  1  0.25507160  0.27860568  0.47448341  1
  C  C88  1  0.24492831  0.77860884  0.97448028  1
  C  C89  1  0.74493090  0.72139510  0.52551633  1
  C  C90  1  0.74660930  0.24181177  0.81905793  1
  C  C91  1  0.24660983  0.25818256  0.68094404  1
  C  C92  1  0.25338957  0.75818938  0.18094182  1
  C  C93  1  0.75338931  0.74181426  0.31905503  1
  C  C94  1  0.99010351  0.29526987  0.97718310  1
  C  C95  1  0.49010266  0.20472781  0.52281764  1
  C  C96  1  0.00989679  0.70472971  0.02281523  1
  C  C97  1  0.50989878  0.79527192  0.47718342  1
  N  N98  1  0.88201953  0.17984050  0.96108932  1
  N  N99  1  0.38201851  0.32015597  0.53891224  1
  N  N100  1  0.11798091  0.82015944  0.03890925  1
  N  N101  1  0.61798292  0.67984407  0.46108903  1
  N  N102  1  0.18123057  0.13792966  0.01518247  1
  N  N103  1  0.68122965  0.36206825  0.48481617  1
  N  N104  1  0.81876941  0.86206960  0.98481639  1
  N  N105  1  0.31877029  0.63793268  0.51518607  1
  N  N106  1  0.62437508  0.29152167  0.88824933  1
  N  N107  1  0.12437634  0.20847103  0.61175277  1
  N  N108  1  0.37562368  0.70847844  0.11175061  1
  N  N109  1  0.87562261  0.79152988  0.38824646  1
  O  O110  1  0.05379075  0.90550768  0.85390348  1
  O  O111  1  0.55379950  0.59449001  0.64609590  1
  O  O112  1  0.94620851  0.09449259  0.14609643  1
  O  O113  1  0.44620241  0.40550789  0.35390580  1
  O  O114  1  0.03203310  0.98090402  0.66335734  1
  O  O115  1  0.53203157  0.51908447  0.83663875  1
  O  O116  1  0.96796730  0.01909527  0.33664124  1
  O  O117  1  0.46796787  0.48092008  0.16336592  1
  O  O118  1  0.92092491  0.42307426  0.62398281  1
  O  O119  1  0.42092425  0.07691416  0.87602099  1
  O  O120  1  0.07907401  0.57692398  0.37602167  1
  O  O121  1  0.57907373  0.92308929  0.12397534  1
  O  O122  1  0.05130244  0.69149265  0.66713486  1
  O  O123  1  0.55130593  0.80849928  0.83286540  1
  O  O124  1  0.94869132  0.30850932  0.33286259  1
  O  O125  1  0.44869034  0.19150187  0.16713682  1
  O  O126  1  0.29643991  0.85634794  0.71645320  1
  O  O127  1  0.79644143  0.64364272  0.78355109  1
  O  O128  1  0.70355878  0.14364864  0.28354747  1
  O  O129  1  0.20355781  0.35635844  0.21645144  1
  O  O130  1  0.06050905  0.51058399  0.80393219  1
  O  O131  1  0.56050567  0.98941132  0.69607004  1
  O  O132  1  0.93949422  0.48942335  0.19606891  1
  O  O133  1  0.43949264  0.01058379  0.30392711  1
