 Diffusion in Zeolites. ZSM5 (Silicate) Crystal Structure, Si(96)O(192) + Benzene
         1         2
     20.318360000000      0.000000000000      0.000000000000
      0.000000000000     20.171460000000      0.000000000000
      0.000000000000      0.000000000000     13.585862950000
Si      
      1.472966644000     -1.083748616000     -4.482671658000
     -0.481250138000      4.496698657000     -5.084276616000
Si      
     -8.533439226000     -8.929809282000     -2.273511655000
      0.261487588000      0.188781651700      1.747404629000
Si      
     -8.451321528000     -1.016800583000     -2.478137743000
      2.370796126000     -1.609372185000     -1.960432025000
Si      
      1.693141650000     -8.943175349000     -4.654761354000
      7.083426573000     -4.570918566000      2.500539072000
Si      
      4.000973882000     -0.802704831600     -2.709266744000
      1.061561939000     -3.270295973000     -1.142896058000
Si      
     -6.268601764000     -9.519059868000     -4.234233741000
     -1.609568815000      1.210354315000     -1.791583618000
Si      
     -6.301718777000     -0.484135845900     -4.584611266000
      6.977669917000      1.956989457000      1.056652394000
Si      
      3.863358814000     -9.368902992000     -2.457722810000
      3.236603725000      1.056716086000     -4.188732161000
Si      
      5.622672639000      1.365896674000     -6.203887998500
     -4.576751487000     -4.957091829000     -5.432390782000
Si      
     -4.335269981000      8.793220519000     -0.449351760000
      0.782544370600     -2.476090653000      1.305662514000
Si      
     -4.457092439000      1.112712173000     -0.489133602000
      3.633277227000     -2.688676312000      0.636085950200
Si      
      5.587913790000      8.680064535000     -6.322306150900
     -4.820361009000      0.657430783100     -2.479035428000
Si      
      2.434021927000      1.369223443000     -6.332940196200
      3.537386220000     -0.630963479600     -6.774547707000
Si      
     -7.547701039000      8.854280033000     -0.353958764000
      3.485607073000      0.319436444800      1.599140106000
Si      
     -7.620141090000      1.263702463000     -0.303637106000
     -2.428397218000      2.931403117000      2.293355428000
Si      
      2.471287675000      8.704926210000     -6.409195467700
     -1.393076582000      2.343552319000      0.751458638700
Si      
      8.762984801000     -0.539096797900     -2.434909055000
     -0.855351566000      4.990226737000    -10.290693560000
Si      
     -1.257429702000     -9.583098093000     -4.385147425000
      9.162074790000      3.313240846000      0.268464358800
Si      
     -1.563187092000     -0.487212795100     -4.390444301000
     -5.211991069000      0.603673011600     -1.706420771000
Si      
      8.752971062000     -9.452884724000     -2.553642705000
      2.808620938000      7.222868762000     -0.420751578800
Si      
      6.526916178000     -1.256950454000     -4.441259133000
     -2.127721989000     10.117226470000     -0.443117888000
Si      
     -3.620798433000     -8.930209821000     -2.478173485000
     -5.206167174000     -1.698686835000     -3.518294174000
Si      
     -4.012110247000     -1.277528146000     -2.567562706000
     -3.493500602000     -5.188163507000     -0.935875281100
Si      
      6.320008725000     -8.994241568000     -4.346307765000
     -3.009490215000      3.255470641000      4.405556538000
Si      
      1.553590256000      3.471574450000     -4.338967228000
     -6.203547999000     -1.541343767000      0.676410046900
Si      
     -8.504989382000      6.588634383000     -2.287025844000
     -0.223715338500     -2.142974615000     -2.903017841000
Si      
     -8.466056810000      3.488695156000     -2.314371140000
     -8.747783855000      5.071882833000      0.939864406500
Si      
      1.657200428000      6.626587998000     -4.255511196000
      1.385647140000     -8.266435934000     -2.231565487000
Si      
      3.964130693000      2.364341844000     -2.543848526000
     -2.103466330000     -8.604042984000      2.619114913000
Si      
     -6.262641235000      7.523603368000     -4.282416305000
      2.417306895000     -3.876783337000      3.669493124000
Si      
     -6.274089918000      2.646770568000     -4.480999673000
      4.249213627000      0.515510007900     -1.385771801000
Si      
      3.810297741000      7.631614278000     -2.219412666000
      1.668661486000      0.706409408900     -2.232084444000
Si      
      5.652503788000     -3.446733782000     -6.374899953200
     -1.020544578000      4.768877198000     -3.694434840000
Si      
     -4.390880954000     -6.725815763000     -0.515928353000
     -0.533244293800      4.618472695000      9.285554574000
Si      
     -4.493909494000     -3.529927017000     -0.448692058000
     -1.058543698000     -0.711667333300      3.404995017000
Si      
      5.619250766000     -6.512016211000     -6.230213019000
      0.671733274400      2.002035254000     -0.593427387100
Si      
      2.524170087000     -3.321994701000     -6.385023329000
     -5.621325883000     -3.084649243000      3.589300200000
Si      
     -7.488162107000     -6.659840816000     -0.515860920000
     -9.400131746000     -2.079584157000      5.670614036000
Si      
     -7.617365523000     -3.461915182000     -0.681301847000
      0.394569570900      2.023993506000     -0.503309973000
Si      
      2.425845160000     -6.415353695000     -6.428692000900
     -2.278463540000     -2.305738393000     -5.762069018000
Si      
      8.812357400000      2.627478223000     -2.546578826000
     -2.209313481000      1.583857402000     -1.539126692000
Si      
     -1.430048843000      7.353346611000     -4.386933721000
     -2.590779905000      9.779183103000     -2.209531581000
Si      
     -1.421460070000      2.694163816000     -4.398415929000
     -2.528990265000      1.838681209000      8.347807882000
Si      
      8.916023915000      7.517872037000     -2.537621045000
      2.536473545000      1.414511780000     -1.451021317000
Si      
      6.375802701000      3.564144884000     -4.241426971000
     -0.238928632400      3.609998837000      3.355657833000
Si      
     -3.739824143000      6.548557167000     -2.471771922000
     -1.075413546000      2.376970069000     -2.392403939000
Si      
     -3.928214948000      3.449558384000     -2.546010030000
      3.363027406000      1.197135921000     -0.392942923400
Si      
      6.284415334000      6.687878271000     -4.066274412000
      3.595495425000      4.948845791000      0.156563288700
Si      
      8.598019665000      1.288030026000      2.379793299000
     -6.991582417000     -3.466384508000      2.122772782000
Si      
     -1.543250109000      8.868461176000      4.669310205000
     -6.191265771000      0.483604607600      1.204527604000
Si      
     -1.584017280000      1.109151457000      4.508809745000
     -5.990688918000      0.497402407300     -2.444066884000
Si      
      8.509361481000      9.063607401000      2.203479575000
     -0.147290418700     -4.665962340000     -1.268127294000
Si      
      6.400896778000      0.370047841000      4.241686335000
      5.884992662000      3.490269351000     -3.189033869000
Si      
     -3.836473990000      9.453624322000      2.607768881000
      4.917037232000      0.425846081400      5.270157789000
Si      
     -3.849949853000      0.446122631100      2.511912462000
     -2.434563473000     -1.171622907000     -3.961955603000
Si      
      6.214452576000      9.611577178000      4.319692985000
     -7.270019346000     -0.511012475500     -0.885850038400
Si      
      4.482198510000     -1.265528365000      0.380077552000
      0.054257560200     -2.472789427000     -0.590653850100
Si      
     -5.795454505000     -8.649701106000      6.293697725000
      6.156276125000     -2.512964524000      4.593462138000
Si      
     -5.521724101000     -1.275075771000      6.261195185000
     -6.012822513000     -4.346471997000      7.609012992000
Si      
      4.418775107000     -8.845265071000      0.510754978000
      3.296933718000      4.679873230000     -2.617362022000
Si      
      7.714468477000     -1.133297228000      0.515118499000
      1.126954669000     -1.857165636000     -0.434248373300
Si      
     -2.616110589000     -8.786850515000      6.444083065000
      1.585185943000      3.039638201000     -5.033605194000
Si      
     -2.343416454000     -1.479857436000      6.280403505000
      5.703392662000      3.762268928000     -2.442683919000
Si      
      7.620540353000     -8.774715909000      0.329398039000
      1.230878333000     -4.246384284000     -4.472939692000
Si      
      1.460936196000      0.718938479600      4.287396315000
     -2.120504341000     -4.378250842000      1.106150823000
Si      
     -8.740262072000      9.543140173000      2.491473500000
      5.572483444000      1.110679961000     -0.217883188200
Si      
     -8.680449287000      0.535635641100      2.618161879000
     -4.588923522000      3.968934750000     -0.062947143300
Si      
      1.619209639000      9.562983683000      4.417915925000
     -0.208895917200      0.033680844500     -0.372648279600
Si      
      3.900877374000      1.118096248000      2.358319156000
     -5.401896965000      1.779978606000      1.451968364000
Si      
     -6.461440179000      9.045587917000      4.474165665000
      8.383043158000      1.444452431000     -1.859366247000
Si      
     -6.168514335000      1.300765021000      4.410249155000
      5.123257284000      1.640493899000     -0.292172164700
Si      
      3.827245741000      8.856863779000      2.410498009000
      2.987367061000      1.129746872000     -2.859833225000
Si      
      8.773214922000     -3.554165219000      2.355227642000
      1.315732135000      3.206677176000      1.376849937000
Si      
     -1.492703013000     -6.798715174000      4.353923075000
     -4.780981651000     -0.369521515000     -2.613113315000
Si      
     -1.367132997000     -3.570562825000      4.148851375000
     -0.878621841200     -0.331023852200     -2.508876921000
Si      
      8.545301337000     -6.588234364000      2.289352217000
      0.050765431200     -2.322432966000      3.122305502000
Si      
      6.675370731000     -2.743416447000      4.395850745000
     -0.621202667700      4.049865608000     -5.116515998000
Si      
     -3.896835316000     -7.563362097000      2.447744609000
      3.196166513000     -3.147283331000      2.751835317000
Si      
     -3.872763060000     -2.634171009000      2.495086600000
      5.634582179000      2.655097844000     -1.874042460000
Si      
      6.414346961000     -7.341823391000      4.460270355000
     -4.552519489000     -0.656875026000      1.072407862000
Si      
      4.733439722000      3.332117524000      0.352941679000
      0.699039426800     -4.589246617000      0.166818585800
Si      
     -5.584210463000      6.671838595000      6.339798855000
     -0.409947582700      2.573874693000      1.522592134000
Si      
     -5.796409237000      3.663175346000      6.415473935000
     -0.448379390000     -5.397540404000     -0.771907486600
Si      
      4.659909699000      6.421131599000      0.552896604000
     -0.391950486100     -0.867524428200      3.653361578000
Si      
      7.844128063000      3.566339966000      0.336830417000
     -1.817167013000      6.375267844000      1.540758380000
Si      
     -2.378849364000      6.446490105000      6.410669635000
     -0.139283604600     -0.155099031400     -4.282975596000
Si      
     -2.655610117000      3.352916064000      6.292603075000
      0.089729495800      1.960636016000     -0.191871371500
Si      
      7.757714989000      6.659435820000      0.316531752000
     -0.973547272900     -2.940447659000     -2.019867142000
Si      
      1.465357100000     -2.508709516000      4.360034625000
      6.595523517000     -0.546599242400     -1.592608048000
Si      
     -8.753993340000     -7.462100682000      2.314101823000
     -4.923907146000     -1.797257652000      2.391230408000
Si      
     -8.596489543000     -2.594703376000      2.161832610000
     -1.570282379000     -5.574073974000     -0.930700913600
Si      
      1.554622218000     -7.475082968000      4.318808055000
      1.786583440000      0.876782686500      3.297964064000
Si      
      4.048109506000     -3.377314286000      2.581505124000
      2.179619785000      0.638842130900     -0.322017967200
Si      
     -6.378272323000     -6.481558261000      4.052101385000
      2.551039064000     -2.985438307000     -0.690013557000
Si      
     -6.304962032000     -3.447741796000      4.207484495000
      0.050582937900      4.648995853000      4.713441066000
Si      
      3.930315691000     -6.555512070000      2.533502135000
      6.285117805000      0.272801202800      1.167403765000
O       
      2.625561730000     -1.178654964000     -3.438228913000
      2.118574977000     -1.213448654000      3.581582392000
O       
     -7.559498659000     -9.005268002000     -3.502365170000
     -3.461889269000      5.594152288000      0.202812434200
O       
     -7.607220267000     -0.587709400500     -3.767234346000
      0.334579871300     -2.239935028000     -1.195396537000
O       
      2.718378566000     -8.831892542000     -3.434780881000
     -0.391945890000     -2.690483298000     -3.355565278000
O       
      4.043287248000     -1.303801629000     -1.153850255000
      4.234320883000      1.230744271000      2.709824423000
O       
     -6.261339239000     -9.193938345000     -5.818706627000
     -2.339558589000     -7.560303423000      2.927556799000
O       
     -6.064074209000     -0.952861627100     -6.091705511000
     -0.417153100500     -0.285069823000      1.518662766000
O       
      3.792632575000     -8.866924109000     -0.936013300000
      6.093624633000     -3.917282651000      0.259943899500
O       
      4.023550889000      1.325160836000     -6.185610938000
     -3.719779057000      2.613912152000     -5.096039635000
O       
     -5.934040298000      8.889489817000     -0.421660824000
     -1.874800428000     -8.935257460000      6.053284504000
O       
     -6.046019693000      0.971944666300     -0.290442254000
     -3.542910155000     -3.145231569000     -4.371999452000
O       
      4.060319318000      8.789054082000     -6.483676618900
      3.356148583000     -0.043363015900     -2.645619135000
O       
      8.348035529000     -0.908421622000     -0.951802908000
     -2.692752953000      1.129334697000      6.715220441000
O       
     -1.595805325000     -8.986941446000     -5.852248748900
      3.896182690000     -0.541678814300      3.884852825000
O       
     -2.143383764000     -1.081943241000     -5.791147896000
      1.173443998000      1.496075237000     -2.322209644000
O       
      8.112989147000     -8.905663447000     -1.147738377000
     -2.976076095000      0.736933334900      0.272583602300
O       
      7.816180427000     -1.193177647000     -3.515366698000
      2.768336958000      4.074492224000      1.618571090000
O       
     -2.324931010000     -9.001413409000     -3.359093064000
      8.778081674000      2.229707726000     -3.518090425000
O       
     -2.621341429000     -0.968341174200     -3.328667752000
      0.121049016500      1.140581710000     -8.634957536000
O       
      7.768056837000     -9.037136705000     -3.735560194000
     -0.231477795800     -1.692597788000      1.557069997000
O       
      5.281736039000     -1.295624290000     -3.475474394000
      3.663308121000     -2.854048656000      4.242686668000
O       
     -4.905715209000     -9.148660024000     -3.451152320000
      9.410622721000      3.533825360000      5.056333465000
O       
     -5.222785902000     -1.262752680000     -3.656266163000
     -1.594987785000      4.943021420000     -0.967348804700
O       
      5.195840345000     -9.029081584000     -3.190191309000
     -1.801128046000     -0.994411960000      1.449841356000
O       
      2.669341554000      2.907780174000     -3.259208554000
      4.834141498000     -5.527758269000      1.734438436000
O       
     -7.493392733000      6.808768321000     -3.529313715000
      4.416088034000     -0.171072343700     -1.924496299000
O       
     -7.523059502000      3.164818843000     -3.608137113000
      2.110444333000      0.023426572400     -3.897300074000
O       
      2.570001565000      7.124895341000     -3.034785229000
      6.872432969000      2.429612073000     -1.986527098000
O       
      4.030859285000      2.816395981000     -0.993520038000
      1.604865167000     -1.411436202000      4.204769246000
O       
     -6.141007082000      6.965006618000     -5.791640157000
     -1.941836302000      2.647597679000      2.863511131000
O       
     -6.274567885000      3.061406562000     -6.027585008100
     -1.668874342000      3.403715256000      3.694771502000
O       
      3.891031469000      6.937922549000     -0.778704551000
      4.619999708000      3.146510966000      3.699951422000
O       
      4.099005168000     -3.031304580000     -6.331669960300
      2.654254672000      0.129556263600      1.137800234000
O       
     -5.938131391000     -6.975782750000     -0.603469248000
      1.783384412000     -1.316260660000      6.917584910000
O       
     -6.086563811000     -3.301409372000     -0.408665596000
      2.672970501000     -1.926885860000     -6.094239472000
O       
      4.011834032000     -6.559462282000     -6.132254635300
      4.466341910000     -0.542077245800     -4.808758928000
O       
      8.336310827000      3.228727575000     -1.134684727000
      3.608346013000      0.073512057500     -2.642649817000
O       
     -2.124087263000      6.673397185000     -5.658319711000
     -0.145504949000      2.302041575000      7.372917834000
O       
     -1.732650022000      3.332301869000     -5.881404673900
      5.028474632000     -4.182387332000      2.622107766000
O       
      8.536265956000      7.006774412000     -1.045858656000
      2.282813753000      0.751316757900     -0.477569019100
O       
      7.777772050000      3.222136947000     -3.577994847000
      3.757498056000      1.709379170000     -2.103096631000
O       
     -2.347008266000      6.874365134000     -3.181712579000
     -0.808208948500     -0.388394884300     -1.135823159000
O       
     -2.511618468000      3.117909908000     -3.320082399000
      5.655277087000     -2.073256642000     -3.424834774000
O       
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      5.945274456000     -4.707823253000     -4.342657190000
O       
      8.351015425000     -5.071863589000      2.010239270000
     -1.775403643000     -0.739771311900      2.719309324000
O       
     -1.501147468000     -5.171719293000      4.467427255000
      4.468950356000     -7.645849623000      0.069131568500
O       
      3.957889808000     -4.966046511000      2.276524181000
      3.176173445000      0.689120910300     -0.105226716000
O       
     -6.495679803000     -4.964528771000      4.494183325000
      7.716505987000      1.925557710000     -1.025539677000
O       
      4.450674682000      4.892533006000      0.746800344000
      1.551955181000     -1.559046479000     -6.948223359000
O       
     -6.067798077000      5.197218263000      6.104451505000
     -1.026487995000      2.962139491000      4.167305531000
O       
      8.121117444000      5.130714912000      0.564622969000
     -0.830468276000     -0.104097518000     -0.274577155900
O       
     -2.256815609000      4.898703287000      6.267951365000
     -1.066479645000      0.364120901100      3.020835947000
C       
        -.3710777830        3.0633826870       -0.4759980960
       -3.2184701840        -.8415796328        1.5946426410
C       
         .8534178118        2.7591441270       -1.0825977950
       -3.7432291590        1.9240163480        -.8517251922
C       
        1.3377630610        1.4457614400       -1.0617268940
       -1.3697085020        2.7655959810       -2.9736907790
C       
         .5976127166         .4366173122       -0.4342562930
        1.5285711310         .8415796343       -2.6492885340
C       
        -.6268828795         .7408558737        0.1723434070
        2.0533301040       -1.9240163490        -.2029206969
C       
       -1.1112281290        2.0542385600        0.1514725050
        -.3201905516       -2.7655959820        1.9190448890
H       
        -.7447155477        4.0765636180       -0.4920985060
       -5.0494718350       -1.4907982080        3.2315875240
H       
        1.4244071400        3.5376325540       -1.5666567240
       -5.9790731120        3.4082962120       -1.1020012070
H       
        2.2823901550        1.2110689360       -1.5296854130
       -1.7745508030        4.8990944220       -4.8609116780
H       
         .9712504807        -.5765636179       -0.4181558830
        3.3595727810        1.4907982090       -4.2862334160
H       
       -1.1978722070        -.0376325540        0.6564023350
        4.2891740560       -3.4082962120         .0473553162
H       
       -2.0558552220        2.2889310630        0.6194310240
         .0846517498       -4.8990944220        3.8062657880
