13
* (null), Energy   -1000.0000000
C    -1.640012    0.236814   -0.090605   -0.018620   -0.090520    0.042930
C    -0.796791    1.232616   -0.573642    0.268406    0.022980   -0.014254
C     0.578356    1.085273   -0.521946   -0.293642    0.062858   -0.025936
C     1.129092   -0.073363    0.019881    0.011126   -0.130192    0.061550
C     0.295077   -1.073200    0.504709    0.306920    0.009586   -0.008638
C    -1.084180   -0.912716    0.446839   -0.273124    0.029124   -0.009976
O     2.469658   -0.175262    0.050496   -0.018674   -0.019442    0.009470
H    -2.713735    0.358622   -0.134174    0.014424    0.176834   -0.082816
H    -1.216575    2.136425   -0.996430    0.860868    0.238180   -0.125504
H     1.242244    1.852854   -0.894463   -0.916332    0.471790   -0.211398
H     0.721028   -1.975998    0.926937    0.986942    0.255362   -0.133678
H    -1.724129   -1.698334    0.827588   -0.708300    0.308852   -0.138560
H     2.739967   -0.993730    0.434810    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.642128    0.226527   -0.085726   -0.018620   -0.090520    0.042930
C    -0.766288    1.235228   -0.575262    0.268406    0.022980   -0.014254
C     0.544985    1.092416   -0.524893   -0.293642    0.062858   -0.025936
C     1.130356   -0.088159    0.026876    0.011126   -0.130192    0.061550
C     0.329957   -1.072111    0.503727    0.306920    0.009586   -0.008638
C    -1.115219   -0.909406    0.445705   -0.273124    0.029124   -0.009976
O     2.467536   -0.177471    0.051572   -0.018674   -0.019442    0.009470
H    -2.712096    0.378718   -0.143586    0.014424    0.176834   -0.082816
H    -1.118742    2.163493   -1.010693    0.860868    0.238180   -0.125504
H     1.138108    1.906470   -0.918487   -0.916332    0.471790   -0.211398
H     0.833189   -1.946977    0.911745    0.986942    0.255362   -0.133678
H    -1.804624   -1.663235    0.811841   -0.708300    0.308852   -0.138560
H     2.745205   -0.993338    0.434513    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.644015    0.217355   -0.081376   -0.018620   -0.090520    0.042930
C    -0.739091    1.237556   -0.576706    0.268406    0.022980   -0.014254
C     0.515230    1.098786   -0.527522   -0.293642    0.062858   -0.025936
C     1.131484   -0.101351    0.033113    0.011126   -0.130192    0.061550
C     0.361057   -1.071139    0.502852    0.306920    0.009586   -0.008638
C    -1.142895   -0.906455    0.444694   -0.273124    0.029124   -0.009976
O     2.465644   -0.179442    0.052532   -0.018674   -0.019442    0.009470
H    -2.710634    0.396637   -0.151977    0.014424    0.176834   -0.082816
H    -1.031510    2.187628   -1.023410    0.860868    0.238180   -0.125504
H     1.045256    1.954277   -0.939908   -0.916332    0.471790   -0.211398
H     0.933195   -1.921102    0.898200    0.986942    0.255362   -0.133678
H    -1.876395   -1.631939    0.797801   -0.708300    0.308852   -0.138560
H     2.749876   -0.992989    0.434249    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.645468    0.210291   -0.078026   -0.018620   -0.090520    0.042930
C    -0.718146    1.239349   -0.577819    0.268406    0.022980   -0.014254
C     0.492316    1.103691   -0.529545   -0.293642    0.062858   -0.025936
C     1.132352   -0.111510    0.037916    0.011126   -0.130192    0.061550
C     0.385007   -1.070391    0.502178    0.306920    0.009586   -0.008638
C    -1.164208   -0.904182    0.443916   -0.273124    0.029124   -0.009976
O     2.464186   -0.180959    0.053271   -0.018674   -0.019442    0.009470
H    -2.709509    0.410436   -0.158440    0.014424    0.176834   -0.082816
H    -0.964334    2.206214   -1.033204    0.860868    0.238180   -0.125504
H     0.973751    1.991092   -0.956404   -0.916332    0.471790   -0.211398
H     1.010210   -1.901175    0.887768    0.986942    0.255362   -0.133678
H    -1.931667   -1.607838    0.786989   -0.708300    0.308852   -0.138560
H     2.753472   -0.992720    0.434045    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.646330    0.206101   -0.076039   -0.018620   -0.090520    0.042930
C    -0.705724    1.240413   -0.578478    0.268406    0.022980   -0.014254
C     0.478726    1.106600   -0.530746   -0.293642    0.062858   -0.025936
C     1.132867   -0.117536    0.040764    0.011126   -0.130192    0.061550
C     0.399212   -1.069948    0.501778    0.306920    0.009586   -0.008638
C    -1.176848   -0.902835    0.443454   -0.273124    0.029124   -0.009976
O     2.463322   -0.181858    0.053709   -0.018674   -0.019442    0.009470
H    -2.708841    0.418620   -0.162273    0.014424    0.176834   -0.082816
H    -0.924491    2.217237   -1.039012    0.860868    0.238180   -0.125504
H     0.931342    2.012928   -0.966188   -0.916332    0.471790   -0.211398
H     1.055888   -1.889356    0.881581    0.986942    0.255362   -0.133678
H    -1.964448   -1.593544    0.780576   -0.708300    0.308852   -0.138560
H     2.755606   -0.992561    0.433924    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.646507    0.205240   -0.075631   -0.018620   -0.090520    0.042930
C    -0.703170    1.240632   -0.578614    0.268406    0.022980   -0.014254
C     0.475932    1.107198   -0.530993   -0.293642    0.062858   -0.025936
C     1.132973   -0.118775    0.041350    0.011126   -0.130192    0.061550
C     0.402132   -1.069856    0.501696    0.306920    0.009586   -0.008638
C    -1.179447   -0.902557    0.443359   -0.273124    0.029124   -0.009976
O     2.463144   -0.182043    0.053799   -0.018674   -0.019442    0.009470
H    -2.708704    0.420303   -0.163061    0.014424    0.176834   -0.082816
H    -0.916300    2.219503   -1.040206    0.860868    0.238180   -0.125504
H     0.922623    2.017417   -0.968200   -0.916332    0.471790   -0.211398
H     1.065278   -1.886927    0.880310    0.986942    0.255362   -0.133678
H    -1.971187   -1.590605    0.779258   -0.708300    0.308852   -0.138560
H     2.756044   -0.992528    0.433900    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.645980    0.207800   -0.076845   -0.018620   -0.090520    0.042930
C    -0.710761    1.239982   -0.578211    0.268406    0.022980   -0.014254
C     0.484238    1.105420   -0.530259   -0.293642    0.062858   -0.025936
C     1.132658   -0.115092    0.039609    0.011126   -0.130192    0.061550
C     0.393451   -1.070127    0.501940    0.306920    0.009586   -0.008638
C    -1.171722   -0.903381    0.443641   -0.273124    0.029124   -0.009976
O     2.463673   -0.181494    0.053531   -0.018674   -0.019442    0.009470
H    -2.709112    0.415301   -0.160718    0.014424    0.176834   -0.082816
H    -0.940649    2.212767   -1.036657    0.860868    0.238180   -0.125504
H     0.948541    2.004072   -0.962220   -0.916332    0.471790   -0.211398
H     1.037363   -1.894149    0.884090    0.986942    0.255362   -0.133678
H    -1.951154   -1.599341    0.783177   -0.708300    0.308852   -0.138560
H     2.754740   -0.992625    0.433973    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.644807    0.213505   -0.079550   -0.018620   -0.090520    0.042930
C    -0.727676    1.238533   -0.577312    0.268406    0.022980   -0.014254
C     0.502742    1.101459   -0.528625   -0.293642    0.062858   -0.025936
C     1.131957   -0.106888    0.035730    0.011126   -0.130192    0.061550
C     0.374110   -1.070732    0.502485    0.306920    0.009586   -0.008638
C    -1.154510   -0.905216    0.444270   -0.273124    0.029124   -0.009976
O     2.464849   -0.180268    0.052935   -0.018674   -0.019442    0.009470
H    -2.710021    0.404157   -0.155499    0.014424    0.176834   -0.082816
H    -0.994899    2.197757   -1.028748    0.860868    0.238180   -0.125504
H     1.006285    1.974342   -0.948899   -0.916332    0.471790   -0.211398
H     0.975169   -1.910241    0.892514    0.986942    0.255362   -0.133678
H    -1.906519   -1.618804    0.791908   -0.708300    0.308852   -0.138560
H     2.751836   -0.992843    0.434138    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.643114    0.221735   -0.083454   -0.018620   -0.090520    0.042930
C    -0.752080    1.236444   -0.576016    0.268406    0.022980   -0.014254
C     0.529441    1.095744   -0.526266   -0.293642    0.062858   -0.025936
C     1.130945   -0.095051    0.030134    0.011126   -0.130192    0.061550
C     0.346204   -1.071603    0.503270    0.306920    0.009586   -0.008638
C    -1.129677   -0.907864    0.445177   -0.273124    0.029124   -0.009976
O     2.466547   -0.178501    0.052074   -0.018674   -0.019442    0.009470
H    -2.711332    0.388079   -0.147970    0.014424    0.176834   -0.082816
H    -1.073170    2.176101   -1.017337    0.860868    0.238180   -0.125504
H     1.089600    1.931446   -0.929678   -0.916332    0.471790   -0.211398
H     0.885434   -1.933459    0.904669    0.986942    0.255362   -0.133678
H    -1.842119   -1.646885    0.804506   -0.708300    0.308852   -0.138560
H     2.747645   -0.993156    0.434375    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.641085    0.231599   -0.088132   -0.018620   -0.090520    0.042930
C    -0.781329    1.233940   -0.574463    0.268406    0.022980   -0.014254
C     0.561440    1.088894   -0.523440   -0.293642    0.062858   -0.025936
C     1.129733   -0.080863    0.023427    0.011126   -0.130192    0.061550
C     0.312758   -1.072648    0.504211    0.306920    0.009586   -0.008638
C    -1.099914   -0.911038    0.446264   -0.273124    0.029124   -0.009976
O     2.468582   -0.176382    0.051042   -0.018674   -0.019442    0.009470
H    -2.712904    0.368809   -0.138945    0.014424    0.176834   -0.082816
H    -1.166982    2.150146   -1.003660    0.860868    0.238180   -0.125504
H     1.189456    1.880033   -0.906641   -0.916332    0.471790   -0.211398
H     0.777884   -1.961287    0.919236    0.986942    0.255362   -0.133678
H    -1.764933   -1.680542    0.819606   -0.708300    0.308852   -0.138560
H     2.742622   -0.993531    0.434660    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.638939    0.242029   -0.093078   -0.018620   -0.090520    0.042930
C    -0.812253    1.231292   -0.572821    0.268406    0.022980   -0.014254
C     0.595272    1.081652   -0.520452   -0.293642    0.062858   -0.025936
C     1.128451   -0.065863    0.016335    0.011126   -0.130192    0.061550
C     0.277396   -1.073752    0.505207    0.306920    0.009586   -0.008638
C    -1.068446   -0.914394    0.447414   -0.273124    0.029124   -0.009976
O     2.470734   -0.174142    0.049950   -0.018674   -0.019442    0.009470
H    -2.714566    0.348435   -0.129403    0.014424    0.176834   -0.082816
H    -1.266168    2.122704   -0.989200    0.860868    0.238180   -0.125504
H     1.295032    1.825675   -0.882285   -0.916332    0.471790   -0.211398
H     0.664172   -1.990709    0.934638    0.986942    0.255362   -0.133678
H    -1.683325   -1.716126    0.835570   -0.708300    0.308852   -0.138560
H     2.737312   -0.993929    0.434960    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.636910    0.251893   -0.097756   -0.018620   -0.090520    0.042930
C    -0.841502    1.228788   -0.571268    0.268406    0.022980   -0.014254
C     0.627271    1.074802   -0.517626   -0.293642    0.062858   -0.025936
C     1.127239   -0.051675    0.009628    0.011126   -0.130192    0.061550
C     0.243950   -1.074797    0.506148    0.306920    0.009586   -0.008638
C    -1.038683   -0.917568    0.448501   -0.273124    0.029124   -0.009976
O     2.472769   -0.172023    0.048918   -0.018674   -0.019442    0.009470
H    -2.716138    0.329165   -0.120378    0.014424    0.176834   -0.082816
H    -1.359980    2.096749   -0.975523    0.860868    0.238180   -0.125504
H     1.394888    1.774262   -0.859248   -0.916332    0.471790   -0.211398
H     0.556622   -2.018537    0.949205    0.986942    0.255362   -0.133678
H    -1.606139   -1.749783    0.850670   -0.708300    0.308852   -0.138560
H     2.732289   -0.994304    0.435245    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.635217    0.260123   -0.101660   -0.018620   -0.090520    0.042930
C    -0.865906    1.226699   -0.569972    0.268406    0.022980   -0.014254
C     0.653970    1.069087   -0.515267   -0.293642    0.062858   -0.025936
C     1.126227   -0.039838    0.004032    0.011126   -0.130192    0.061550
C     0.216044   -1.075668    0.506933    0.306920    0.009586   -0.008638
C    -1.013850   -0.920216    0.449408   -0.273124    0.029124   -0.009976
O     2.474467   -0.170256    0.048057   -0.018674   -0.019442    0.009470
H    -2.717449    0.313087   -0.112849    0.014424    0.176834   -0.082816
H    -1.438251    2.075093   -0.964112    0.860868    0.238180   -0.125504
H     1.478203    1.731366   -0.840027   -0.916332    0.471790   -0.211398
H     0.466887   -2.041755    0.961360    0.986942    0.255362   -0.133678
H    -1.541739   -1.777864    0.863268   -0.708300    0.308852   -0.138560
H     2.728098   -0.994617    0.435482    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.634044    0.265828   -0.104365   -0.018620   -0.090520    0.042930
C    -0.882821    1.225250   -0.569073    0.268406    0.022980   -0.014254
C     0.672474    1.065126   -0.513633   -0.293642    0.062858   -0.025936
C     1.125526   -0.031634    0.000153    0.011126   -0.130192    0.061550
C     0.196703   -1.076273    0.507478    0.306920    0.009586   -0.008638
C    -0.996638   -0.922051    0.450037   -0.273124    0.029124   -0.009976
O     2.475643   -0.169030    0.047461   -0.018674   -0.019442    0.009470
H    -2.718358    0.301943   -0.107630    0.014424    0.176834   -0.082816
H    -1.492501    2.060083   -0.956203    0.860868    0.238180   -0.125504
H     1.535947    1.701636   -0.826706   -0.916332    0.471790   -0.211398
H     0.404693   -2.057847    0.969784    0.986942    0.255362   -0.133678
H    -1.497104   -1.797327    0.871999   -0.708300    0.308852   -0.138560
H     2.725194   -0.994835    0.435647    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.633517    0.268388   -0.105579   -0.018620   -0.090520    0.042930
C    -0.890412    1.224600   -0.568670    0.268406    0.022980   -0.014254
C     0.680780    1.063348   -0.512899   -0.293642    0.062858   -0.025936
C     1.125211   -0.027951   -0.001588    0.011126   -0.130192    0.061550
C     0.188022   -1.076544    0.507722    0.306920    0.009586   -0.008638
C    -0.988913   -0.922875    0.450319   -0.273124    0.029124   -0.009976
O     2.476172   -0.168481    0.047193   -0.018674   -0.019442    0.009470
H    -2.718766    0.296941   -0.105287    0.014424    0.176834   -0.082816
H    -1.516850    2.053347   -0.952654    0.860868    0.238180   -0.125504
H     1.561865    1.688291   -0.820726   -0.916332    0.471790   -0.211398
H     0.376778   -2.065069    0.973564    0.986942    0.255362   -0.133678
H    -1.477071   -1.806063    0.875918   -0.708300    0.308852   -0.138560
H     2.723890   -0.994932    0.435720    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.633694    0.267527   -0.105171   -0.018620   -0.090520    0.042930
C    -0.887858    1.224819   -0.568806    0.268406    0.022980   -0.014254
C     0.677986    1.063946   -0.513146   -0.293642    0.062858   -0.025936
C     1.125317   -0.029190   -0.001002    0.011126   -0.130192    0.061550
C     0.190942   -1.076452    0.507640    0.306920    0.009586   -0.008638
C    -0.991512   -0.922597    0.450224   -0.273124    0.029124   -0.009976
O     2.475994   -0.168666    0.047283   -0.018674   -0.019442    0.009470
H    -2.718629    0.298624   -0.106075    0.014424    0.176834   -0.082816
H    -1.508659    2.055613   -0.953848    0.860868    0.238180   -0.125504
H     1.553146    1.692780   -0.822738   -0.916332    0.471790   -0.211398
H     0.386168   -2.062640    0.972293    0.986942    0.255362   -0.133678
H    -1.483810   -1.803124    0.874600   -0.708300    0.308852   -0.138560
H     2.724328   -0.994899    0.435696    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.634556    0.263337   -0.103184   -0.018620   -0.090520    0.042930
C    -0.875436    1.225883   -0.569465    0.268406    0.022980   -0.014254
C     0.664396    1.066855   -0.514347   -0.293642    0.062858   -0.025936
C     1.125832   -0.035216    0.001846    0.011126   -0.130192    0.061550
C     0.205147   -1.076009    0.507240    0.306920    0.009586   -0.008638
C    -1.004152   -0.921250    0.449762   -0.273124    0.029124   -0.009976
O     2.475130   -0.169565    0.047721   -0.018674   -0.019442    0.009470
H    -2.717961    0.306808   -0.109908    0.014424    0.176834   -0.082816
H    -1.468816    2.066636   -0.959656    0.860868    0.238180   -0.125504
H     1.510737    1.714616   -0.832522   -0.916332    0.471790   -0.211398
H     0.431846   -2.050821    0.966106    0.986942    0.255362   -0.133678
H    -1.516591   -1.788830    0.868187   -0.708300    0.308852   -0.138560
H     2.726462   -0.994740    0.435575    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.636009    0.256273   -0.099834   -0.018620   -0.090520    0.042930
C    -0.854491    1.227676   -0.570578    0.268406    0.022980   -0.014254
C     0.641482    1.071760   -0.516370   -0.293642    0.062858   -0.025936
C     1.126700   -0.045375    0.006649    0.011126   -0.130192    0.061550
C     0.229097   -1.075261    0.506566    0.306920    0.009586   -0.008638
C    -1.025465   -0.918977    0.448984   -0.273124    0.029124   -0.009976
O     2.473672   -0.171082    0.048460   -0.018674   -0.019442    0.009470
H    -2.716836    0.320607   -0.116371    0.014424    0.176834   -0.082816
H    -1.401640    2.085222   -0.969450    0.860868    0.238180   -0.125504
H     1.439232    1.751431   -0.849018   -0.916332    0.471790   -0.211398
H     0.508861   -2.030894    0.955674    0.986942    0.255362   -0.133678
H    -1.571863   -1.764729    0.857375   -0.708300    0.308852   -0.138560
H     2.730058   -0.994471    0.435371    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.637896    0.247101   -0.095484   -0.018620   -0.090520    0.042930
C    -0.827294    1.230004   -0.572022    0.268406    0.022980   -0.014254
C     0.611727    1.078130   -0.518999   -0.293642    0.062858   -0.025936
C     1.127828   -0.058567    0.012886    0.011126   -0.130192    0.061550
C     0.260197   -1.074289    0.505691    0.306920    0.009586   -0.008638
C    -1.053141   -0.916026    0.447973   -0.273124    0.029124   -0.009976
O     2.471780   -0.173053    0.049420   -0.018674   -0.019442    0.009470
H    -2.715374    0.338526   -0.124762    0.014424    0.176834   -0.082816
H    -1.314408    2.109357   -0.982167    0.860868    0.238180   -0.125504
H     1.346380    1.799238   -0.870439   -0.916332    0.471790   -0.211398
H     0.608867   -2.005019    0.942129    0.986942    0.255362   -0.133678
H    -1.643634   -1.733433    0.843335   -0.708300    0.308852   -0.138560
H     2.734729   -0.994122    0.435107    0.046092    0.003446   -0.002610
13
* Frequency(22) 1138.6700
C    -1.640012    0.236814   -0.090605   -0.018620   -0.090520    0.042930
C    -0.796791    1.232616   -0.573642    0.268406    0.022980   -0.014254
C     0.578356    1.085273   -0.521946   -0.293642    0.062858   -0.025936
C     1.129092   -0.073363    0.019881    0.011126   -0.130192    0.061550
C     0.295077   -1.073200    0.504709    0.306920    0.009586   -0.008638
C    -1.084180   -0.912716    0.446839   -0.273124    0.029124   -0.009976
O     2.469658   -0.175262    0.050496   -0.018674   -0.019442    0.009470
H    -2.713735    0.358622   -0.134174    0.014424    0.176834   -0.082816
H    -1.216575    2.136425   -0.996430    0.860868    0.238180   -0.125504
H     1.242244    1.852854   -0.894463   -0.916332    0.471790   -0.211398
H     0.721028   -1.975998    0.926937    0.986942    0.255362   -0.133678
H    -1.724129   -1.698334    0.827588   -0.708300    0.308852   -0.138560
H     2.739967   -0.993730    0.434810    0.046092    0.003446   -0.002610
