
Title        Mn3O4


Lattice parameters

                         
a                         10.40453
b                         11.88254
c                         25.03409
alpha                      88.35676
beta                       88.61831
gamma                      79.84190


Structure parameters


   label     occupancy    x           y             z          type  equiv    symbol

   Mn1        1.0     0.775319      0.902155      0.673335     Biso  1.000000 Mn
   Mn2        1.0     0.008039      0.693355      0.449227     Biso  1.000000 Mn
   Mn3        1.0     0.459181      0.843094      0.373413     Biso  1.000000 Mn
   Mn4        1.0     0.511226      0.553676      0.549284     Biso  1.000000 Mn
   Mn5        1.0     0.781735      0.900293      0.365118     Biso  1.000000 Mn
   Mn6        1.0     0.066838      0.973581      0.689330     Biso  1.000000 Mn
   Mn7        1.0     0.825852      0.642127      0.589031     Biso  1.000000 Mn
   Mn8        1.0     0.304616      0.792965      0.479852     Biso  1.000000 Mn
   Mn9        1.0     0.561026      0.699540      0.675962     Biso  1.000000 Mn
   Mn10       1.0     0.041463      0.839268      0.567306     Biso  1.000000 Mn
   Mn11       1.0     0.271458      0.636518      0.361515     Biso  1.000000 Mn
   Mn12       1.0     0.521629      0.994153      0.465508     Biso  1.000000 Mn
   Mn13       1.0     0.779823      0.906768      0.518038     Biso  1.000000 Mn
   Mn14       1.0     0.995353      0.681684      0.312852     Biso  1.000000 Mn
   Mn15       1.0     0.309641      0.772545      0.617096     Biso  1.000000 Mn
   Mn16       1.0     0.524938      0.557327      0.414413     Biso  1.000000 Mn
   Mn17       1.0     0.417710      0.942449      0.678445     Biso  1.000000 Mn
   Mn18       1.0     0.658785      0.737260      0.461641     Biso  1.000000 Mn
   Mn19       1.0     0.155345      0.889872      0.361635     Biso  1.000000 Mn
   Mn20       1.0     0.068331      0.708698      0.672875     Biso  1.000000 Mn
   Mn21       1.0     0.543175      0.836585      0.568927     Biso  1.000000 Mn
   Mn22       1.0     0.022925      0.985971      0.469305     Biso  1.000000 Mn
   Mn23       1.0     0.764651      0.627351      0.354894     Biso  1.000000 Mn
   Mn24       1.0     0.174271      0.593484      0.568966     Biso  1.000000 Mn
   Mn25       1.0     0.041633      0.413212      0.669603     Biso  1.000000 Mn
   Mn26       1.0     0.245621      0.188950      0.455311     Biso  1.000000 Mn
   Mn27       1.0     0.702540      0.333317      0.365241     Biso  1.000000 Mn
   Mn28       1.0     0.822005      0.070338      0.592251     Biso  1.000000 Mn
   Mn29       1.0     0.041287      0.419727      0.374290     Biso  1.000000 Mn
   Mn30       1.0     0.366410      0.496313      0.673728     Biso  1.000000 Mn
   Mn31       1.0     0.080652      0.132101      0.576571     Biso  1.000000 Mn
   Mn32       1.0     0.567114      0.284510      0.493280     Biso  1.000000 Mn
   Mn33       1.0     0.819063      0.208619      0.675295     Biso  1.000000 Mn
   Mn34       1.0     0.295605      0.336390      0.574724     Biso  1.000000 Mn
   Mn35       1.0     0.516793      0.137062      0.363179     Biso  1.000000 Mn
   Mn36       1.0     0.791167      0.493730      0.465149     Biso  1.000000 Mn
   Mn37       1.0     0.041732      0.416027      0.521906     Biso  1.000000 Mn
   Mn38       1.0     0.230083      0.166810      0.323621     Biso  1.000000 Mn
   Mn39       1.0     0.555388      0.274363      0.626903     Biso  1.000000 Mn
   Mn40       1.0     0.760178      0.078118      0.425258     Biso  1.000000 Mn
   Mn41       1.0     0.694086      0.462041      0.677142     Biso  1.000000 Mn
   Mn42       1.0     0.905878      0.244603      0.471030     Biso  1.000000 Mn
   Mn43       1.0     0.383434      0.382914      0.362323     Biso  1.000000 Mn
   Mn44       1.0     0.280821      0.179789      0.672520     Biso  1.000000 Mn
   Mn45       1.0     0.791878      0.359231      0.570225     Biso  1.000000 Mn
   Mn46       1.0     0.284374      0.486521      0.469519     Biso  1.000000 Mn
   Mn47       1.0     0.988288      0.135133      0.360952     Biso  1.000000 Mn
   Mn48       1.0     0.415518      0.078414      0.571485     Biso  1.000000 Mn
   O1         1.0     0.524495      0.550641      0.698099     Biso  1.000000 O
   O2         1.0     0.933749      0.993116      0.395493     Biso  1.000000 O
   O3         1.0     0.007821      0.688745      0.588068     Biso  1.000000 O
   O4         1.0     0.485502      0.834940      0.473303     Biso  1.000000 O
   O5         1.0     0.707033      0.759062      0.536530     Biso  1.000000 O
   O6         1.0     0.181648      0.913166      0.440120     Biso  1.000000 O
   O7         1.0     0.925937      0.540127      0.329260     Biso  1.000000 O
   O8         1.0     0.243769      0.628451      0.639992     Biso  1.000000 O
   O9         1.0     0.383708      0.785216      0.687311     Biso  1.000000 O
   O10        1.0     0.612224      0.572263      0.480227     Biso  1.000000 O
   O11        1.0     0.963430      0.843811      0.486968     Biso  1.000000 O
   O12        1.0     0.448304      0.006924      0.381728     Biso  1.000000 O
   O13        1.0     0.950219      0.836928      0.702641     Biso  1.000000 O
   O14        1.0     0.373058      0.910832      0.592627     Biso  1.000000 O
   O15        1.0     0.120209      0.571031      0.494987     Biso  1.000000 O
   O16        1.0     0.609278      0.716483      0.387731     Biso  1.000000 O
   O17        1.0     0.599714      0.853592      0.663932     Biso  1.000000 O
   O18        1.0     0.077113      0.984134      0.541129     Biso  1.000000 O
   O19        1.0     0.830149      0.644582      0.442019     Biso  1.000000 O
   O20        1.0     0.321605      0.777003      0.339393     Biso  1.000000 O
   O21        1.0     0.702183      0.911337      0.446582     Biso  1.000000 O
   O22        1.0     0.142042      0.841662      0.641612     Biso  1.000000 O
   O23        1.0     0.352744      0.632230      0.444293     Biso  1.000000 O
   O24        1.0     0.588718      0.982726      0.549955     Biso  1.000000 O
   O25        1.0     0.813564      0.763582      0.322114     Biso  1.000000 O
   O26        1.0     0.733654      0.615953      0.659560     Biso  1.000000 O
   O27        1.0     0.226203      0.757632      0.550110     Biso  1.000000 O
   O28        1.0     0.437346      0.532778      0.347689     Biso  1.000000 O
   O29        1.0     0.853014      0.898731      0.587459     Biso  1.000000 O
   O30        1.0     0.096627      0.724058      0.373819     Biso  1.000000 O
   O31        1.0     0.034718      0.562044      0.692722     Biso  1.000000 O
   O32        1.0     0.483355      0.699099      0.591308     Biso  1.000000 O
   O33        1.0     0.752060      0.072575      0.677491     Biso  1.000000 O
   O34        1.0     0.215868      0.481429      0.381706     Biso  1.000000 O
   O35        1.0     0.249594      0.174421      0.590492     Biso  1.000000 O
   O36        1.0     0.741145      0.344401      0.483675     Biso  1.000000 O
   O37        1.0     0.955336      0.264831      0.542650     Biso  1.000000 O
   O38        1.0     0.450603      0.403708      0.446536     Biso  1.000000 O
   O39        1.0     0.127046      0.042789      0.323219     Biso  1.000000 O
   O40        1.0     0.449381      0.089614      0.650212     Biso  1.000000 O
   O41        1.0     0.646421      0.309087      0.689840     Biso  1.000000 O
   O42        1.0     0.842836      0.064517      0.494542     Biso  1.000000 O
   O43        1.0     0.218632      0.340220      0.497090     Biso  1.000000 O
   O44        1.0     0.698487      0.494109      0.383663     Biso  1.000000 O
   O45        1.0     0.132961      0.275325      0.694245     Biso  1.000000 O
   O46        1.0     0.628139      0.440607      0.593761     Biso  1.000000 O
   O47        1.0     0.366459      0.072039      0.497907     Biso  1.000000 O
   O48        1.0     0.843484      0.223835      0.399460     Biso  1.000000 O
   O49        1.0     0.867591      0.367122      0.660859     Biso  1.000000 O
   O50        1.0     0.338565      0.498361      0.551018     Biso  1.000000 O
   O51        1.0     0.064161      0.139524      0.452906     Biso  1.000000 O
   O52        1.0     0.543574      0.289287      0.338036     Biso  1.000000 O
   O53        1.0     0.966014      0.409657      0.450635     Biso  1.000000 O
   O54        1.0     0.372953      0.332959      0.651132     Biso  1.000000 O
   O55        1.0     0.587316      0.140105      0.449429     Biso  1.000000 O
   O56        1.0     0.867624      0.492683      0.546982     Biso  1.000000 O
   O57        1.0     0.053977      0.267861      0.337573     Biso  1.000000 O
   O58        1.0     0.975255      0.113621      0.644352     Biso  1.000000 O
   O59        1.0     0.467577      0.250209      0.560529     Biso  1.000000 O
   O60        1.0     0.694430      0.065618      0.353688     Biso  1.000000 O
   O61        1.0     0.123692      0.423598      0.592279     Biso  1.000000 O
   O62        1.0     0.331444      0.231981      0.377460     Biso  1.000000 O
   O63        1.0     0.248448      0.029227      0.699625     Biso  1.000000 O
   O64        1.0     0.719417      0.227037      0.589318     Biso  1.000000 O



Title        SSC


Lattice parameters

                                
a                         10.40450
b                         11.88250
c                         25.03410
alpha                      88.35680
beta                       88.61830
gamma                      79.84190


Structure parameters


   label     occupancy    x           y             z          type  equiv    symbol

   Mn1        1.0     0.782228      0.893082      0.674567     Biso  1.000000 Mn
   Mn2        1.0     0.004529      0.692523      0.451215     Biso  1.000000 Mn
   Mn3        1.0     0.454892      0.845225      0.369613     Biso  1.000000 Mn
   Mn4        1.0     0.512545      0.554773      0.552914     Biso  1.000000 Mn
   Mn5        1.0     0.776673      0.898669      0.361123     Biso  1.000000 Mn
   Mn6        1.0     0.073406      0.971339      0.687415     Biso  1.000000 Mn
   Mn7        1.0     0.827095      0.640162      0.590715     Biso  1.000000 Mn
   Mn8        1.0     0.306701      0.789139      0.479208     Biso  1.000000 Mn
   Mn9        1.0     0.556933      0.701479      0.676366     Biso  1.000000 Mn
   Mn10       1.0     0.046644      0.838768      0.568475     Biso  1.000000 Mn
   Mn11       1.0     0.268388      0.630892      0.363167     Biso  1.000000 Mn
   Mn12       1.0     0.523392      0.995350      0.463980     Biso  1.000000 Mn
   Mn13       1.0     0.784059      0.899976      0.516830     Biso  1.000000 Mn
   Mn14       1.0     0.996621      0.670847      0.312465     Biso  1.000000 Mn
   Mn15       1.0     0.312332      0.774065      0.616719     Biso  1.000000 Mn
   Mn16       1.0     0.519667      0.556195      0.413790     Biso  1.000000 Mn
   Mn17       1.0     0.419419      0.948767      0.676693     Biso  1.000000 Mn
   Mn18       1.0     0.655710      0.737362      0.460450     Biso  1.000000 Mn
   Mn19       1.0     0.142431      0.882127      0.363714     Biso  1.000000 Mn
   Mn20       1.0     0.068910      0.703844      0.674411     Biso  1.000000 Mn
   Mn21       1.0     0.551252      0.840476      0.568172     Biso  1.000000 Mn
   Mn22       1.0     0.026293      0.987988      0.472437     Biso  1.000000 Mn
   Mn23       1.0     0.761578      0.626748      0.354357     Biso  1.000000 Mn
   Mn24       1.0     0.177535      0.592139      0.571669     Biso  1.000000 Mn
   Mn25       1.0     0.044087      0.419682      0.668899     Biso  1.000000 Mn
   Mn26       1.0     0.248597      0.192821      0.455895     Biso  1.000000 Mn
   Mn27       1.0     0.706696      0.334850      0.362093     Biso  1.000000 Mn
   Mn28       1.0     0.795727      0.068499      0.588473     Biso  1.000000 Mn
   Mn29       1.0     0.041041      0.413376      0.372475     Biso  1.000000 Mn
   Mn30       1.0     0.080233      0.134740      0.579472     Biso  1.000000 Mn
   Mn31       1.0     0.563203      0.286687      0.493149     Biso  1.000000 Mn
   Mn32       1.0     0.821779      0.209881      0.672907     Biso  1.000000 Mn
   Mn33       1.0     0.292904      0.340359      0.575225     Biso  1.000000 Mn
   Mn34       1.0     0.518134      0.142438      0.362633     Biso  1.000000 Mn
   Mn35       1.0     0.784960      0.494760      0.464820     Biso  1.000000 Mn
   Mn36       1.0     0.039729      0.421413      0.520463     Biso  1.000000 Mn
   Mn37       1.0     0.241328      0.146517      0.330611     Biso  1.000000 Mn
   Mn38       1.0     0.553948      0.273099      0.630087     Biso  1.000000 Mn
   Mn39       1.0     0.762246      0.077988      0.426583     Biso  1.000000 Mn
   Mn40       1.0     0.690560      0.462179      0.675419     Biso  1.000000 Mn
   Mn41       1.0     0.907217      0.244585      0.470224     Biso  1.000000 Mn
   Mn42       1.0     0.385045      0.385122      0.363233     Biso  1.000000 Mn
   Mn43       1.0     0.282523      0.190827      0.675005     Biso  1.000000 Mn
   Mn44       1.0     0.797070      0.358704      0.570493     Biso  1.000000 Mn
   Mn45       1.0     0.283766      0.486385      0.469089     Biso  1.000000 Mn
   Mn46       1.0     0.990252      0.130867      0.361420     Biso  1.000000 Mn
   Mn47       1.0     0.418970      0.085780      0.572591     Biso  1.000000 Mn
   Co1        1.0     0.371847      0.495015      0.672428     Biso  1.000000 Co
   O1         1.0     0.518883      0.549013      0.695971     Biso  1.000000 O
   O2         1.0     0.933519      0.991757      0.397261     Biso  1.000000 O
   O3         1.0     0.007501      0.690242      0.589389     Biso  1.000000 O
   O4         1.0     0.484612      0.838223      0.472246     Biso  1.000000 O
   O5         1.0     0.705863      0.748590      0.536038     Biso  1.000000 O
   O6         1.0     0.177731      0.906129      0.441303     Biso  1.000000 O
   O7         1.0     0.918698      0.533359      0.328003     Biso  1.000000 O
   O8         1.0     0.236859      0.610287      0.644180     Biso  1.000000 O
   O9         1.0     0.382259      0.793873      0.686890     Biso  1.000000 O
   O10        1.0     0.605175      0.572095      0.480194     Biso  1.000000 O
   O11        1.0     0.963814      0.842003      0.492900     Biso  1.000000 O
   O12        1.0     0.441807      0.011230      0.376134     Biso  1.000000 O
   O13        1.0     0.955527      0.836094      0.705258     Biso  1.000000 O
   O14        1.0     0.389069      0.930442      0.589618     Biso  1.000000 O
   O15        1.0     0.121995      0.574342      0.497504     Biso  1.000000 O
   O16        1.0     0.606703      0.719809      0.385844     Biso  1.000000 O
   O17        1.0     0.601342      0.854704      0.665431     Biso  1.000000 O
   O18        1.0     0.085094      0.983925      0.543583     Biso  1.000000 O
   O19        1.0     0.826317      0.644839      0.441225     Biso  1.000000 O
   O20        1.0     0.312407      0.774825      0.342098     Biso  1.000000 O
   O21        1.0     0.705570      0.910386      0.443918     Biso  1.000000 O
   O22        1.0     0.139056      0.836735      0.638131     Biso  1.000000 O
   O23        1.0     0.346419      0.627245      0.443275     Biso  1.000000 O
   O24        1.0     0.614872      0.978994      0.545613     Biso  1.000000 O
   O25        1.0     0.815928      0.759391      0.319477     Biso  1.000000 O
   O26        1.0     0.727442      0.615638      0.659804     Biso  1.000000 O
   O27        1.0     0.238282      0.745712      0.549797     Biso  1.000000 O
   O28        1.0     0.434729      0.533755      0.347602     Biso  1.000000 O
   O29        1.0     0.850620      0.906860      0.589454     Biso  1.000000 O
   O30        1.0     0.090427      0.715536      0.375189     Biso  1.000000 O
   O31        1.0     0.008989      0.568862      0.694561     Biso  1.000000 O
   O32        1.0     0.486465      0.705426      0.592318     Biso  1.000000 O
   O33        1.0     0.746531      0.070441      0.664043     Biso  1.000000 O
   O34        1.0     0.213707      0.479616      0.376392     Biso  1.000000 O
   O35        1.0     0.240351      0.197147      0.593127     Biso  1.000000 O
   O36        1.0     0.739529      0.344663      0.484409     Biso  1.000000 O
   O37        1.0     0.958766      0.266710      0.541926     Biso  1.000000 O
   O38        1.0     0.447204      0.401039      0.443621     Biso  1.000000 O
   O39        1.0     0.125437      0.033412      0.324356     Biso  1.000000 O
   O40        1.0     0.452082      0.099547      0.650606     Biso  1.000000 O
   O41        1.0     0.652816      0.305413      0.690967     Biso  1.000000 O
   O42        1.0     0.846885      0.071602      0.498665     Biso  1.000000 O
   O43        1.0     0.212811      0.348313      0.492547     Biso  1.000000 O
   O44        1.0     0.694012      0.495179      0.383433     Biso  1.000000 O
   O45        1.0     0.134095      0.285441      0.698992     Biso  1.000000 O
   O46        1.0     0.632014      0.436797      0.595167     Biso  1.000000 O
   O47        1.0     0.373149      0.078077      0.498052     Biso  1.000000 O
   O48        1.0     0.844732      0.223063      0.398476     Biso  1.000000 O
   O49        1.0     0.866481      0.367595      0.660442     Biso  1.000000 O
   O50        1.0     0.342928      0.488322      0.553715     Biso  1.000000 O
   O51        1.0     0.069734      0.138356      0.452041     Biso  1.000000 O
   O52        1.0     0.544897      0.292069      0.336745     Biso  1.000000 O
   O53        1.0     0.961668      0.413537      0.449427     Biso  1.000000 O
   O54        1.0     0.378327      0.336973      0.657611     Biso  1.000000 O
   O55        1.0     0.588892      0.141256      0.448385     Biso  1.000000 O
   O56        1.0     0.866957      0.494136      0.546546     Biso  1.000000 O
   O57        1.0     0.064283      0.257829      0.338376     Biso  1.000000 O
   O58        1.0     0.975360      0.113098      0.645614     Biso  1.000000 O
   O59        1.0     0.468443      0.246056      0.562594     Biso  1.000000 O
   O60        1.0     0.694851      0.065452      0.353471     Biso  1.000000 O
   O61        1.0     0.118210      0.430580      0.592280     Biso  1.000000 O
   O62        1.0     0.336750      0.234253      0.378348     Biso  1.000000 O
   O63        1.0     0.249855      0.034455      0.696689     Biso  1.000000 O
   O64        1.0     0.721707      0.224894      0.589185     Biso  1.000000 O



Title        DSC


Lattice parameters

                              
a                         10.40450
b                         11.88250
c                         25.03410
alpha                      88.35680
beta                       88.61830
gamma                      79.84190


Structure parameters


   label     occupancy    x           y             z          type  equiv    symbol

   Mn1        1.0     0.791360      0.899969      0.674452     Biso  1.000000 Mn
   Mn2        1.0     0.000840      0.686917      0.449978     Biso  1.000000 Mn
   Mn3        1.0     0.441670      0.849522      0.370399     Biso  1.000000 Mn
   Mn4        1.0     0.509408      0.560645      0.554551     Biso  1.000000 Mn
   Mn5        1.0     0.776643      0.890291      0.357073     Biso  1.000000 Mn
   Mn6        1.0     0.082418      0.973316      0.694152     Biso  1.000000 Mn
   Mn7        1.0     0.833464      0.643709      0.589272     Biso  1.000000 Mn
   Mn8        1.0     0.303773      0.793586      0.481394     Biso  1.000000 Mn
   Mn9        1.0     0.560440      0.706640      0.678429     Biso  1.000000 Mn
   Mn10       1.0     0.049193      0.844603      0.571864     Biso  1.000000 Mn
   Mn11       1.0     0.261240      0.630336      0.361131     Biso  1.000000 Mn
   Mn12       1.0     0.534257      0.994728      0.468058     Biso  1.000000 Mn
   Mn13       1.0     0.797166      0.895797      0.513221     Biso  1.000000 Mn
   Mn14       1.0     0.988260      0.654484      0.311792     Biso  1.000000 Mn
   Mn15       1.0     0.313801      0.779914      0.620683     Biso  1.000000 Mn
   Mn16       1.0     0.512438      0.555427      0.416109     Biso  1.000000 Mn
   Mn17       1.0     0.428054      0.955309      0.678163     Biso  1.000000 Mn
   Mn18       1.0     0.651658      0.737667      0.459430     Biso  1.000000 Mn
   Mn19       1.0     0.128450      0.877665      0.362749     Biso  1.000000 Mn
   Mn20       1.0     0.070595      0.706521      0.678088     Biso  1.000000 Mn
   Mn21       1.0     0.560922      0.843278      0.571610     Biso  1.000000 Mn
   Mn22       1.0     0.035557      0.989534      0.470211     Biso  1.000000 Mn
   Mn23       1.0     0.749947      0.620259      0.353725     Biso  1.000000 Mn
   Mn24       1.0     0.176231      0.595680      0.574144     Biso  1.000000 Mn
   Mn25       1.0     0.045730      0.422458      0.670463     Biso  1.000000 Mn
   Mn26       1.0     0.248006      0.194026      0.459885     Biso  1.000000 Mn
   Mn27       1.0     0.709231      0.336297      0.362097     Biso  1.000000 Mn
   Mn28       1.0     0.777090      0.067256      0.583956     Biso  1.000000 Mn
   Mn29       1.0     0.040225      0.402706      0.371283     Biso  1.000000 Mn
   Mn30       1.0     0.072749      0.136574      0.585567     Biso  1.000000 Mn
   Mn31       1.0     0.562797      0.283405      0.490063     Biso  1.000000 Mn
   Mn32       1.0     0.824348      0.204802      0.674405     Biso  1.000000 Mn
   Mn33       1.0     0.290475      0.341893      0.576608     Biso  1.000000 Mn
   Mn34       1.0     0.515095      0.140909      0.359464     Biso  1.000000 Mn
   Mn35       1.0     0.782713      0.492056      0.464832     Biso  1.000000 Mn
   Mn36       1.0     0.038287      0.420786      0.520801     Biso  1.000000 Mn
   Mn37       1.0     0.247879      0.128181      0.340981     Biso  1.000000 Mn
   Mn38       1.0     0.551497      0.267528      0.631750     Biso  1.000000 Mn
   Mn39       1.0     0.764923      0.074007      0.418655     Biso  1.000000 Mn
   Mn40       1.0     0.907880      0.240339      0.467953     Biso  1.000000 Mn
   Mn41       1.0     0.381494      0.384077      0.362001     Biso  1.000000 Mn
   Mn42       1.0     0.285406      0.195849      0.677425     Biso  1.000000 Mn
   Mn43       1.0     0.800043      0.358923      0.571691     Biso  1.000000 Mn
   Mn44       1.0     0.280960      0.488726      0.472083     Biso  1.000000 Mn
   Mn45       1.0     0.991074      0.126149      0.354485     Biso  1.000000 Mn
   Mn46       1.0     0.415882      0.089876      0.573402     Biso  1.000000 Mn
   Co1        1.0     0.370203      0.496234      0.672386     Biso  1.000000 Co
   Ru1        1.0     0.690666      0.462385      0.674032     Biso  1.000000 Ru
   O1         1.0     0.515325      0.555712      0.696273     Biso  1.000000 O
   O2         1.0     0.928390      0.987379      0.380730     Biso  1.000000 O
   O3         1.0     0.011415      0.692073      0.592851     Biso  1.000000 O
   O4         1.0     0.482947      0.843496      0.468526     Biso  1.000000 O
   O5         1.0     0.707289      0.749527      0.535214     Biso  1.000000 O
   O6         1.0     0.189290      0.909961      0.436724     Biso  1.000000 O
   O7         1.0     0.907015      0.519541      0.329221     Biso  1.000000 O
   O8         1.0     0.237380      0.613158      0.646774     Biso  1.000000 O
   O9         1.0     0.391163      0.800590      0.690283     Biso  1.000000 O
   O10        1.0     0.602635      0.570102      0.482100     Biso  1.000000 O
   O11        1.0     0.970649      0.840743      0.486509     Biso  1.000000 O
   O12        1.0     0.412100      0.019927      0.351816     Biso  1.000000 O
   O13        1.0     0.956141      0.836652      0.709268     Biso  1.000000 O
   O14        1.0     0.397720      0.933943      0.592146     Biso  1.000000 O
   O15        1.0     0.118939      0.576182      0.499616     Biso  1.000000 O
   O16        1.0     0.597260      0.720064      0.385209     Biso  1.000000 O
   O17        1.0     0.610559      0.856694      0.664476     Biso  1.000000 O
   O18        1.0     0.082569      0.989228      0.549512     Biso  1.000000 O
   O19        1.0     0.819949      0.641761      0.439659     Biso  1.000000 O
   O20        1.0     0.303955      0.773436      0.341295     Biso  1.000000 O
   O21        1.0     0.708463      0.907517      0.442170     Biso  1.000000 O
   O22        1.0     0.146545      0.837516      0.647158     Biso  1.000000 O
   O23        1.0     0.342068      0.628522      0.445882     Biso  1.000000 O
   O24        1.0     0.626226      0.979865      0.545474     Biso  1.000000 O
   O25        1.0     0.809016      0.747587      0.317513     Biso  1.000000 O
   O26        1.0     0.730988      0.614776      0.660679     Biso  1.000000 O
   O27        1.0     0.232369      0.760091      0.553919     Biso  1.000000 O
   O28        1.0     0.429724      0.534247      0.348801     Biso  1.000000 O
   O29        1.0     0.860930      0.900698      0.586280     Biso  1.000000 O
   O30        1.0     0.080985      0.710102      0.372247     Biso  1.000000 O
   O31        1.0     0.005687      0.571269      0.695672     Biso  1.000000 O
   O32        1.0     0.488090      0.710182      0.593845     Biso  1.000000 O
   O33        1.0     0.746149      0.072715      0.668602     Biso  1.000000 O
   O34        1.0     0.207622      0.476264      0.371303     Biso  1.000000 O
   O35        1.0     0.238683      0.198230      0.594283     Biso  1.000000 O
   O36        1.0     0.740126      0.341233      0.484411     Biso  1.000000 O
   O37        1.0     0.958671      0.262491      0.540689     Biso  1.000000 O
   O38        1.0     0.439680      0.400929      0.445105     Biso  1.000000 O
   O39        1.0     0.136121      0.029079      0.321829     Biso  1.000000 O
   O40        1.0     0.456802      0.105948      0.650273     Biso  1.000000 O
   O41        1.0     0.652633      0.310259      0.692576     Biso  1.000000 O
   O42        1.0     0.849874      0.071038      0.487154     Biso  1.000000 O
   O43        1.0     0.210975      0.350556      0.493867     Biso  1.000000 O
   O44        1.0     0.682234      0.490710      0.384696     Biso  1.000000 O
   O45        1.0     0.139573      0.292100      0.702366     Biso  1.000000 O
   O46        1.0     0.635069      0.448934      0.601011     Biso  1.000000 O
   O47        1.0     0.379401      0.077697      0.498459     Biso  1.000000 O
   O48        1.0     0.849225      0.223671      0.390744     Biso  1.000000 O
   O49        1.0     0.870075      0.364476      0.657153     Biso  1.000000 O
   O50        1.0     0.342133      0.491973      0.556374     Biso  1.000000 O
   O51        1.0     0.073269      0.142044      0.446602     Biso  1.000000 O
   O52        1.0     0.549069      0.293570      0.339785     Biso  1.000000 O
   O53        1.0     0.960644      0.413056      0.448621     Biso  1.000000 O
   O54        1.0     0.377813      0.337438      0.659155     Biso  1.000000 O
   O55        1.0     0.589247      0.137615      0.444588     Biso  1.000000 O
   O56        1.0     0.866612      0.494568      0.546272     Biso  1.000000 O
   O57        1.0     0.091772      0.243544      0.337094     Biso  1.000000 O
   O58        1.0     0.985875      0.117407      0.657004     Biso  1.000000 O
   O59        1.0     0.466864      0.248968      0.561570     Biso  1.000000 O
   O60        1.0     0.683323      0.054944      0.349697     Biso  1.000000 O
   O61        1.0     0.115950      0.428793      0.593417     Biso  1.000000 O
   O62        1.0     0.337010      0.229821      0.379180     Biso  1.000000 O
   O63        1.0     0.261279      0.039130      0.700859     Biso  1.000000 O
   O64        1.0     0.718536      0.231171      0.591083     Biso  1.000000 O
