13
* (null), Energy   -1000.0000000
C    -1.640012    0.236814   -0.090605    0.001040    0.066958   -0.031748
C    -0.796791    1.232616   -0.573642    0.113370    0.040272   -0.020582
C     0.578356    1.085273   -0.521946    0.045782   -0.063662    0.029568
C     1.129092   -0.073363    0.019881   -0.043102   -0.063080    0.030464
C     0.295077   -1.073200    0.504709   -0.051922   -0.051458    0.025074
C    -1.084180   -0.912716    0.446839   -0.088474    0.066744   -0.030468
O     2.469658   -0.175262    0.050496    0.103646    0.082198   -0.040314
H    -2.713735    0.358622   -0.134174   -0.080962   -0.552178    0.262756
H    -1.216575    2.136425   -0.996430   -0.659650   -0.255590    0.129834
H     1.242244    1.852854   -0.894463   -0.428664    0.249278   -0.112516
H     0.721028   -1.975998    0.926937    0.539690    0.161948   -0.083892
H    -1.724129   -1.698334    0.827588    0.555868   -0.371798    0.168912
H     2.739967   -0.993730    0.434810   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639894    0.244423   -0.094213    0.001040    0.066958   -0.031748
C    -0.783907    1.237193   -0.575981    0.113370    0.040272   -0.020582
C     0.583559    1.078038   -0.518586    0.045782   -0.063662    0.029568
C     1.124194   -0.080532    0.023343   -0.043102   -0.063080    0.030464
C     0.289176   -1.079048    0.507559   -0.051922   -0.051458    0.025074
C    -1.094235   -0.905131    0.443376   -0.088474    0.066744   -0.030468
O     2.481437   -0.165921    0.045915    0.103646    0.082198   -0.040314
H    -2.722936    0.295870   -0.104313   -0.080962   -0.552178    0.262756
H    -1.291541    2.107379   -0.981675   -0.659650   -0.255590    0.129834
H     1.193529    1.881183   -0.907250   -0.428664    0.249278   -0.112516
H     0.782361   -1.957593    0.917403    0.539690    0.161948   -0.083892
H    -1.660957   -1.740587    0.846784    0.555868   -0.371798    0.168912
H     2.592949   -1.048955    0.462910   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639788    0.251208   -0.097430    0.001040    0.066958   -0.031748
C    -0.772419    1.241273   -0.578067    0.113370    0.040272   -0.020582
C     0.588198    1.071587   -0.515590    0.045782   -0.063662    0.029568
C     1.119826   -0.086924    0.026430   -0.043102   -0.063080    0.030464
C     0.283915   -1.084262    0.510099   -0.051922   -0.051458    0.025074
C    -1.103200   -0.898368    0.440289   -0.088474    0.066744   -0.030468
O     2.491939   -0.157592    0.041830    0.103646    0.082198   -0.040314
H    -2.731140    0.239918   -0.077688   -0.080962   -0.552178    0.262756
H    -1.358383    2.081480   -0.968519   -0.659650   -0.255590    0.129834
H     1.150092    1.906442   -0.918651   -0.428664    0.249278   -0.112516
H     0.837048   -1.941183    0.908902    0.539690    0.161948   -0.083892
H    -1.604632   -1.778261    0.863900    0.555868   -0.371798    0.168912
H     2.461862   -1.098196    0.487966   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639707    0.256433   -0.099907    0.001040    0.066958   -0.031748
C    -0.763573    1.244416   -0.579673    0.113370    0.040272   -0.020582
C     0.591771    1.066620   -0.513282    0.045782   -0.063662    0.029568
C     1.116463   -0.091846    0.028807   -0.043102   -0.063080    0.030464
C     0.279863   -1.088278    0.512056   -0.051922   -0.051458    0.025074
C    -1.110104   -0.893159    0.437912   -0.088474    0.066744   -0.030468
O     2.500027   -0.151177    0.038684    0.103646    0.082198   -0.040314
H    -2.737458    0.196829   -0.057184   -0.080962   -0.552178    0.262756
H    -1.409858    2.061535   -0.958388   -0.659650   -0.255590    0.129834
H     1.116642    1.925895   -0.927431   -0.428664    0.249278   -0.112516
H     0.879162   -1.928546    0.902356    0.539690    0.161948   -0.083892
H    -1.561255   -1.807274    0.877081    0.555868   -0.371798    0.168912
H     2.360912   -1.136117    0.507261   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639659    0.259532   -0.101377    0.001040    0.066958   -0.031748
C    -0.758326    1.246280   -0.580625    0.113370    0.040272   -0.020582
C     0.593889    1.063673   -0.511914    0.045782   -0.063662    0.029568
C     1.114468   -0.094765    0.030217   -0.043102   -0.063080    0.030464
C     0.277460   -1.090659    0.513216   -0.051922   -0.051458    0.025074
C    -1.114198   -0.890070    0.436502   -0.088474    0.066744   -0.030468
O     2.504824   -0.147373    0.036818    0.103646    0.082198   -0.040314
H    -2.741205    0.171273   -0.045023   -0.080962   -0.552178    0.262756
H    -1.440388    2.049706   -0.952379   -0.659650   -0.255590    0.129834
H     1.096803    1.937432   -0.932639   -0.428664    0.249278   -0.112516
H     0.904139   -1.921051    0.898473    0.539690    0.161948   -0.083892
H    -1.535528   -1.824481    0.884898    0.555868   -0.371798    0.168912
H     2.301039   -1.158607    0.518705   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639649    0.260169   -0.101679    0.001040    0.066958   -0.031748
C    -0.757247    1.246663   -0.580821    0.113370    0.040272   -0.020582
C     0.594325    1.063067   -0.511633    0.045782   -0.063662    0.029568
C     1.114058   -0.095366    0.030507   -0.043102   -0.063080    0.030464
C     0.276966   -1.091149    0.513455   -0.051922   -0.051458    0.025074
C    -1.115040   -0.889435    0.436212   -0.088474    0.066744   -0.030468
O     2.505810   -0.146591    0.036434    0.103646    0.082198   -0.040314
H    -2.741975    0.166020   -0.042524   -0.080962   -0.552178    0.262756
H    -1.446664    2.047274   -0.951143   -0.659650   -0.255590    0.129834
H     1.092724    1.939803   -0.933709   -0.428664    0.249278   -0.112516
H     0.909274   -1.919510    0.897675    0.539690    0.161948   -0.083892
H    -1.530240   -1.828019    0.886505    0.555868   -0.371798    0.168912
H     2.288730   -1.163231    0.521058   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639679    0.258275   -0.100781    0.001040    0.066958   -0.031748
C    -0.760454    1.245524   -0.580239    0.113370    0.040272   -0.020582
C     0.593030    1.064868   -0.512469    0.045782   -0.063662    0.029568
C     1.115277   -0.093581    0.029645   -0.043102   -0.063080    0.030464
C     0.278435   -1.089693    0.512746   -0.051922   -0.051458    0.025074
C    -1.112538   -0.891323    0.437073   -0.088474    0.066744   -0.030468
O     2.502879   -0.148916    0.037575    0.103646    0.082198   -0.040314
H    -2.739685    0.181638   -0.049955   -0.080962   -0.552178    0.262756
H    -1.428006    2.054503   -0.954816   -0.659650   -0.255590    0.129834
H     1.104848    1.932753   -0.930527   -0.428664    0.249278   -0.112516
H     0.894010   -1.924090    0.900048    0.539690    0.161948   -0.083892
H    -1.545962   -1.817503    0.881728    0.555868   -0.371798    0.168912
H     2.325320   -1.149486    0.514064   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639744    0.254056   -0.098780    0.001040    0.066958   -0.031748
C    -0.767598    1.242986   -0.578942    0.113370    0.040272   -0.020582
C     0.590145    1.068880   -0.514332    0.045782   -0.063662    0.029568
C     1.117993   -0.089606    0.027726   -0.043102   -0.063080    0.030464
C     0.281707   -1.086451    0.511166   -0.051922   -0.051458    0.025074
C    -1.106962   -0.895529    0.438993   -0.088474    0.066744   -0.030468
O     2.496347   -0.154096    0.040115    0.103646    0.082198   -0.040314
H    -2.734583    0.216434   -0.066513   -0.080962   -0.552178    0.262756
H    -1.386437    2.070610   -0.962997   -0.659650   -0.255590    0.129834
H     1.131862    1.917044   -0.923436   -0.428664    0.249278   -0.112516
H     0.860000   -1.934296    0.905335    0.539690    0.161948   -0.083892
H    -1.580991   -1.794073    0.871083    0.555868   -0.371798    0.168912
H     2.406844   -1.118863    0.498482   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639839    0.247968   -0.095894    0.001040    0.066958   -0.031748
C    -0.777906    1.239325   -0.577071    0.113370    0.040272   -0.020582
C     0.585982    1.074668   -0.517021    0.045782   -0.063662    0.029568
C     1.121912   -0.083871    0.024956   -0.043102   -0.063080    0.030464
C     0.286428   -1.081772    0.508886   -0.051922   -0.051458    0.025074
C    -1.098918   -0.901598    0.441764   -0.088474    0.066744   -0.030468
O     2.486924   -0.161569    0.043780    0.103646    0.082198   -0.040314
H    -2.727222    0.266639   -0.090404   -0.080962   -0.552178    0.262756
H    -1.326461    2.093848   -0.974802   -0.659650   -0.255590    0.129834
H     1.170836    1.894379   -0.913206   -0.428664    0.249278   -0.112516
H     0.810930   -1.949020    0.912962    0.539690    0.161948   -0.083892
H    -1.631532   -1.760269    0.855726    0.555868   -0.371798    0.168912
H     2.524466   -1.074680    0.476000   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.639952    0.240671   -0.092434    0.001040    0.066958   -0.031748
C    -0.790260    1.234936   -0.574828    0.113370    0.040272   -0.020582
C     0.580993    1.081606   -0.520243    0.045782   -0.063662    0.029568
C     1.126609   -0.076997    0.021636   -0.043102   -0.063080    0.030464
C     0.292086   -1.076164    0.506153   -0.051922   -0.051458    0.025074
C    -1.089277   -0.908871    0.445084   -0.088474    0.066744   -0.030468
O     2.475629   -0.170527    0.048174    0.103646    0.082198   -0.040314
H    -2.718399    0.326812   -0.119037   -0.080962   -0.552178    0.262756
H    -1.254576    2.121701   -0.988951   -0.659650   -0.255590    0.129834
H     1.217549    1.867214   -0.900945   -0.428664    0.249278   -0.112516
H     0.752119   -1.966668    0.922104    0.539690    0.161948   -0.083892
H    -1.692106   -1.719753    0.837319    0.555868   -0.371798    0.168912
H     2.665441   -1.021725    0.449055   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640072    0.232957   -0.088776    0.001040    0.066958   -0.031748
C    -0.803322    1.230296   -0.572456    0.113370    0.040272   -0.020582
C     0.575719    1.088940   -0.523649    0.045782   -0.063662    0.029568
C     1.131575   -0.069729    0.018126   -0.043102   -0.063080    0.030464
C     0.298068   -1.070236    0.503265   -0.051922   -0.051458    0.025074
C    -1.079083   -0.916561    0.448594   -0.088474    0.066744   -0.030468
O     2.463687   -0.179997    0.052818    0.103646    0.082198   -0.040314
H    -2.709071    0.390432   -0.149311   -0.080962   -0.552178    0.262756
H    -1.178574    2.151149   -1.003909   -0.659650   -0.255590    0.129834
H     1.266939    1.838494   -0.887981   -0.428664    0.249278   -0.112516
H     0.689937   -1.985328    0.931770    0.539690    0.161948   -0.083892
H    -1.756152   -1.676915    0.817857    0.555868   -0.371798    0.168912
H     2.814493   -0.965735    0.420565   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640185    0.225660   -0.085316    0.001040    0.066958   -0.031748
C    -0.815676    1.225907   -0.570213    0.113370    0.040272   -0.020582
C     0.570730    1.095878   -0.526871    0.045782   -0.063662    0.029568
C     1.136272   -0.062855    0.014806   -0.043102   -0.063080    0.030464
C     0.303726   -1.064628    0.500532   -0.051922   -0.051458    0.025074
C    -1.069442   -0.923834    0.451914   -0.088474    0.066744   -0.030468
O     2.452392   -0.188955    0.057212    0.103646    0.082198   -0.040314
H    -2.700248    0.450605   -0.177944   -0.080962   -0.552178    0.262756
H    -1.106689    2.179002   -1.018058   -0.659650   -0.255590    0.129834
H     1.313652    1.811329   -0.875720   -0.428664    0.249278   -0.112516
H     0.631126   -2.002976    0.940912    0.539690    0.161948   -0.083892
H    -1.816726   -1.636399    0.799450    0.555868   -0.371798    0.168912
H     2.955468   -0.912780    0.393620   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640280    0.219572   -0.082430    0.001040    0.066958   -0.031748
C    -0.825984    1.222246   -0.568342    0.113370    0.040272   -0.020582
C     0.566567    1.101666   -0.529560    0.045782   -0.063662    0.029568
C     1.140191   -0.057120    0.012036   -0.043102   -0.063080    0.030464
C     0.308447   -1.059949    0.498252   -0.051922   -0.051458    0.025074
C    -1.061398   -0.929903    0.454685   -0.088474    0.066744   -0.030468
O     2.442969   -0.196428    0.060877    0.103646    0.082198   -0.040314
H    -2.692887    0.500810   -0.201835   -0.080962   -0.552178    0.262756
H    -1.046713    2.202240   -1.029863   -0.659650   -0.255590    0.129834
H     1.352626    1.788664   -0.865490   -0.428664    0.249278   -0.112516
H     0.582056   -2.017700    0.948539    0.539690    0.161948   -0.083892
H    -1.867267   -1.602595    0.784093    0.555868   -0.371798    0.168912
H     3.073090   -0.868597    0.371138   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640345    0.215353   -0.080429    0.001040    0.066958   -0.031748
C    -0.833128    1.219708   -0.567045    0.113370    0.040272   -0.020582
C     0.563682    1.105678   -0.531423    0.045782   -0.063662    0.029568
C     1.142907   -0.053145    0.010117   -0.043102   -0.063080    0.030464
C     0.311719   -1.056707    0.496672   -0.051922   -0.051458    0.025074
C    -1.055822   -0.934109    0.456605   -0.088474    0.066744   -0.030468
O     2.436437   -0.201608    0.063417    0.103646    0.082198   -0.040314
H    -2.687785    0.535606   -0.218393   -0.080962   -0.552178    0.262756
H    -1.005144    2.218347   -1.038044   -0.659650   -0.255590    0.129834
H     1.379640    1.772955   -0.858399   -0.428664    0.249278   -0.112516
H     0.548046   -2.027906    0.953826    0.539690    0.161948   -0.083892
H    -1.902296   -1.579165    0.773448    0.555868   -0.371798    0.168912
H     3.154614   -0.837974    0.355556   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640375    0.213459   -0.079531    0.001040    0.066958   -0.031748
C    -0.836335    1.218569   -0.566463    0.113370    0.040272   -0.020582
C     0.562387    1.107479   -0.532259    0.045782   -0.063662    0.029568
C     1.144126   -0.051360    0.009255   -0.043102   -0.063080    0.030464
C     0.313188   -1.055251    0.495963   -0.051922   -0.051458    0.025074
C    -1.053320   -0.935997    0.457466   -0.088474    0.066744   -0.030468
O     2.433506   -0.203933    0.064558    0.103646    0.082198   -0.040314
H    -2.685495    0.551224   -0.225824   -0.080962   -0.552178    0.262756
H    -0.986486    2.225576   -1.041717   -0.659650   -0.255590    0.129834
H     1.391764    1.765905   -0.855217   -0.428664    0.249278   -0.112516
H     0.532782   -2.032486    0.956199    0.539690    0.161948   -0.083892
H    -1.918018   -1.568649    0.768671    0.555868   -0.371798    0.168912
H     3.191204   -0.824229    0.348562   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640365    0.214096   -0.079833    0.001040    0.066958   -0.031748
C    -0.835256    1.218952   -0.566659    0.113370    0.040272   -0.020582
C     0.562823    1.106873   -0.531978    0.045782   -0.063662    0.029568
C     1.143716   -0.051961    0.009545   -0.043102   -0.063080    0.030464
C     0.312694   -1.055741    0.496202   -0.051922   -0.051458    0.025074
C    -1.054162   -0.935362    0.457176   -0.088474    0.066744   -0.030468
O     2.434492   -0.203151    0.064174    0.103646    0.082198   -0.040314
H    -2.686265    0.545971   -0.223325   -0.080962   -0.552178    0.262756
H    -0.992762    2.223144   -1.040481   -0.659650   -0.255590    0.129834
H     1.387685    1.768276   -0.856287   -0.428664    0.249278   -0.112516
H     0.537917   -2.030945    0.955401    0.539690    0.161948   -0.083892
H    -1.912730   -1.572187    0.770278    0.555868   -0.371798    0.168912
H     3.178895   -0.828853    0.350915   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640317    0.217195   -0.081303    0.001040    0.066958   -0.031748
C    -0.830009    1.220816   -0.567611    0.113370    0.040272   -0.020582
C     0.564941    1.103926   -0.530610    0.045782   -0.063662    0.029568
C     1.141721   -0.054880    0.010955   -0.043102   -0.063080    0.030464
C     0.310291   -1.058122    0.497362   -0.051922   -0.051458    0.025074
C    -1.058256   -0.932273    0.455766   -0.088474    0.066744   -0.030468
O     2.439289   -0.199347    0.062308    0.103646    0.082198   -0.040314
H    -2.690012    0.520415   -0.211164   -0.080962   -0.552178    0.262756
H    -1.023292    2.211315   -1.034472   -0.659650   -0.255590    0.129834
H     1.367846    1.779813   -0.861495   -0.428664    0.249278   -0.112516
H     0.562894   -2.023450    0.951518    0.539690    0.161948   -0.083892
H    -1.887003   -1.589394    0.778095    0.555868   -0.371798    0.168912
H     3.119022   -0.851343    0.362359   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640236    0.222420   -0.083780    0.001040    0.066958   -0.031748
C    -0.821163    1.223959   -0.569217    0.113370    0.040272   -0.020582
C     0.568514    1.098959   -0.528302    0.045782   -0.063662    0.029568
C     1.138358   -0.059802    0.013332   -0.043102   -0.063080    0.030464
C     0.306239   -1.062138    0.499319   -0.051922   -0.051458    0.025074
C    -1.065160   -0.927064    0.453389   -0.088474    0.066744   -0.030468
O     2.447377   -0.192932    0.059162    0.103646    0.082198   -0.040314
H    -2.696330    0.477326   -0.190660   -0.080962   -0.552178    0.262756
H    -1.074767    2.191370   -1.024341   -0.659650   -0.255590    0.129834
H     1.334396    1.799266   -0.870275   -0.428664    0.249278   -0.112516
H     0.605008   -2.010813    0.944972    0.539690    0.161948   -0.083892
H    -1.843626   -1.618407    0.791276    0.555868   -0.371798    0.168912
H     3.018072   -0.889264    0.381654   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640130    0.229205   -0.086997    0.001040    0.066958   -0.031748
C    -0.809675    1.228039   -0.571303    0.113370    0.040272   -0.020582
C     0.573153    1.092508   -0.525306    0.045782   -0.063662    0.029568
C     1.133990   -0.066194    0.016419   -0.043102   -0.063080    0.030464
C     0.300978   -1.067352    0.501859   -0.051922   -0.051458    0.025074
C    -1.074125   -0.920301    0.450302   -0.088474    0.066744   -0.030468
O     2.457879   -0.184603    0.055077    0.103646    0.082198   -0.040314
H    -2.704534    0.421374   -0.164035   -0.080962   -0.552178    0.262756
H    -1.141609    2.165471   -1.011185   -0.659650   -0.255590    0.129834
H     1.290959    1.824525   -0.881676   -0.428664    0.249278   -0.112516
H     0.659695   -1.994403    0.936471    0.539690    0.161948   -0.083892
H    -1.787301   -1.656081    0.808392    0.555868   -0.371798    0.168912
H     2.886985   -0.938505    0.406710   -1.293666   -0.485948    0.247266
13
* Frequency(28) 1482.0400
C    -1.640012    0.236814   -0.090605    0.001040    0.066958   -0.031748
C    -0.796791    1.232616   -0.573642    0.113370    0.040272   -0.020582
C     0.578356    1.085273   -0.521946    0.045782   -0.063662    0.029568
C     1.129092   -0.073363    0.019881   -0.043102   -0.063080    0.030464
C     0.295077   -1.073200    0.504709   -0.051922   -0.051458    0.025074
C    -1.084180   -0.912716    0.446839   -0.088474    0.066744   -0.030468
O     2.469658   -0.175262    0.050496    0.103646    0.082198   -0.040314
H    -2.713735    0.358622   -0.134174   -0.080962   -0.552178    0.262756
H    -1.216575    2.136425   -0.996430   -0.659650   -0.255590    0.129834
H     1.242244    1.852854   -0.894463   -0.428664    0.249278   -0.112516
H     0.721028   -1.975998    0.926937    0.539690    0.161948   -0.083892
H    -1.724129   -1.698334    0.827588    0.555868   -0.371798    0.168912
H     2.739967   -0.993730    0.434810   -1.293666   -0.485948    0.247266
