13
* (null), Energy   -1000.0000000
C    -1.640012    0.236814   -0.090605    0.000938    0.032760    0.069102
C    -0.796791    1.232616   -0.573642    0.001118    0.039060    0.082480
C     0.578356    1.085273   -0.521946    0.000784    0.029600    0.062582
C     1.129092   -0.073363    0.019881   -0.001064   -0.037680   -0.079490
C     0.295077   -1.073200    0.504709   -0.001200   -0.043876   -0.092616
C    -1.084180   -0.912716    0.446839   -0.000594   -0.020946   -0.044262
O     2.469658   -0.175262    0.050496   -0.001162   -0.041256   -0.087102
H    -2.713735    0.358622   -0.134174   -0.003928   -0.142682   -0.301140
H    -1.216575    2.136425   -0.996430   -0.004930   -0.180162   -0.380168
H     1.242244    1.852854   -0.894463   -0.002684   -0.094464   -0.199230
H     0.721028   -1.975998    0.926937    0.007316    0.258976    0.546318
H    -1.724129   -1.698334    0.827588    0.001532    0.056258    0.118624
H     2.739967   -0.993730    0.434810    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639905    0.240537   -0.082752    0.000938    0.032760    0.069102
C    -0.796664    1.237055   -0.564269    0.001118    0.039060    0.082480
C     0.578445    1.088637   -0.514834    0.000784    0.029600    0.062582
C     1.128971   -0.077645    0.010847   -0.001064   -0.037680   -0.079490
C     0.294941   -1.078186    0.494184   -0.001200   -0.043876   -0.092616
C    -1.084248   -0.915096    0.441809   -0.000594   -0.020946   -0.044262
O     2.469526   -0.179951    0.040597   -0.001162   -0.041256   -0.087102
H    -2.714181    0.342407   -0.168397   -0.003928   -0.142682   -0.301140
H    -1.217135    2.115951   -1.039634   -0.004930   -0.180162   -0.380168
H     1.241939    1.842119   -0.917104   -0.002684   -0.094464   -0.199230
H     0.721859   -1.946567    0.989023    0.007316    0.258976    0.546318
H    -1.723955   -1.691941    0.841069    0.001532    0.056258    0.118624
H     2.742394   -0.906250    0.619411    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639810    0.243857   -0.075750    0.000938    0.032760    0.069102
C    -0.796551    1.241013   -0.555911    0.001118    0.039060    0.082480
C     0.578525    1.091636   -0.508492    0.000784    0.029600    0.062582
C     1.128863   -0.081463    0.002793   -0.001064   -0.037680   -0.079490
C     0.294819   -1.082632    0.484799   -0.001200   -0.043876   -0.092616
C    -1.084308   -0.917219    0.437324   -0.000594   -0.020946   -0.044262
O     2.469408   -0.184131    0.031771   -0.001162   -0.041256   -0.087102
H    -2.714579    0.327949   -0.198911   -0.003928   -0.142682   -0.301140
H    -1.217635    2.097695   -1.078156   -0.004930   -0.180162   -0.380168
H     1.241667    1.832547   -0.937292   -0.002684   -0.094464   -0.199230
H     0.722601   -1.920325    1.044381    0.007316    0.258976    0.546318
H    -1.723800   -1.686240    0.853089    0.001532    0.056258    0.118624
H     2.744559   -0.828250    0.784008    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639737    0.246413   -0.070358    0.000938    0.032760    0.069102
C    -0.796463    1.244061   -0.549475    0.001118    0.039060    0.082480
C     0.578586    1.093946   -0.503609    0.000784    0.029600    0.062582
C     1.128780   -0.084404   -0.003410   -0.001064   -0.037680   -0.079490
C     0.294725   -1.086056    0.477572   -0.001200   -0.043876   -0.092616
C    -1.084354   -0.918853    0.433870   -0.000594   -0.020946   -0.044262
O     2.469318   -0.187350    0.024974   -0.001162   -0.041256   -0.087102
H    -2.714886    0.316815   -0.222411   -0.003928   -0.142682   -0.301140
H    -1.218020    2.083636   -1.107822   -0.004930   -0.180162   -0.380168
H     1.241458    1.825175   -0.952839   -0.002684   -0.094464   -0.199230
H     0.723172   -1.900116    1.087013    0.007316    0.258976    0.546318
H    -1.723680   -1.681850    0.862346    0.001532    0.056258    0.118624
H     2.746226   -0.768183    0.910764    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639694    0.247929   -0.067159    0.000938    0.032760    0.069102
C    -0.796412    1.245869   -0.545657    0.001118    0.039060    0.082480
C     0.578622    1.095316   -0.500713    0.000784    0.029600    0.062582
C     1.128731   -0.086147   -0.007089   -0.001064   -0.037680   -0.079490
C     0.294670   -1.088087    0.473285   -0.001200   -0.043876   -0.092616
C    -1.084382   -0.919823    0.431821   -0.000594   -0.020946   -0.044262
O     2.469264   -0.189260    0.020943   -0.001162   -0.041256   -0.087102
H    -2.715068    0.310211   -0.236348   -0.003928   -0.142682   -0.301140
H    -1.218248    2.075298   -1.125417   -0.004930   -0.180162   -0.380168
H     1.241333    1.820803   -0.962060   -0.002684   -0.094464   -0.199230
H     0.723510   -1.888130    1.112297    0.007316    0.258976    0.546318
H    -1.723609   -1.679246    0.867836    0.001532    0.056258    0.118624
H     2.747214   -0.732557    0.985943    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639685    0.248241   -0.066502    0.000938    0.032760    0.069102
C    -0.796401    1.246240   -0.544873    0.001118    0.039060    0.082480
C     0.578629    1.095598   -0.500117    0.000784    0.029600    0.062582
C     1.128721   -0.086506   -0.007845   -0.001064   -0.037680   -0.079490
C     0.294658   -1.088504    0.472404   -0.001200   -0.043876   -0.092616
C    -1.084387   -0.920022    0.431400   -0.000594   -0.020946   -0.044262
O     2.469253   -0.189652    0.020114   -0.001162   -0.041256   -0.087102
H    -2.715105    0.308854   -0.239213   -0.003928   -0.142682   -0.301140
H    -1.218295    2.073584   -1.129034   -0.004930   -0.180162   -0.380168
H     1.241308    1.819905   -0.963955   -0.002684   -0.094464   -0.199230
H     0.723580   -1.885666    1.117495    0.007316    0.258976    0.546318
H    -1.723595   -1.678711    0.868965    0.001532    0.056258    0.118624
H     2.747417   -0.725233    1.001398    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639711    0.247314   -0.068456    0.000938    0.032760    0.069102
C    -0.796433    1.245136   -0.547205    0.001118    0.039060    0.082480
C     0.578607    1.094760   -0.501887    0.000784    0.029600    0.062582
C     1.128751   -0.085440   -0.005597   -0.001064   -0.037680   -0.079490
C     0.294692   -1.087263    0.475024   -0.001200   -0.043876   -0.092616
C    -1.084370   -0.919430    0.432652   -0.000594   -0.020946   -0.044262
O     2.469286   -0.188485    0.022578   -0.001162   -0.041256   -0.087102
H    -2.714994    0.312889   -0.230696   -0.003928   -0.142682   -0.301140
H    -1.218155    2.078679   -1.118282   -0.004930   -0.180162   -0.380168
H     1.241384    1.822576   -0.958320   -0.002684   -0.094464   -0.199230
H     0.723373   -1.892991    1.102043    0.007316    0.258976    0.546318
H    -1.723638   -1.680302    0.865609    0.001532    0.056258    0.118624
H     2.746813   -0.747005    0.955455    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639770    0.245250   -0.072811    0.000938    0.032760    0.069102
C    -0.796503    1.242674   -0.552403    0.001118    0.039060    0.082480
C     0.578558    1.092895   -0.505831    0.000784    0.029600    0.062582
C     1.128818   -0.083066   -0.000588   -0.001064   -0.037680   -0.079490
C     0.294768   -1.084498    0.480860   -0.001200   -0.043876   -0.092616
C    -1.084333   -0.918110    0.435441   -0.000594   -0.020946   -0.044262
O     2.469359   -0.185886    0.028067   -0.001162   -0.041256   -0.087102
H    -2.714746    0.321881   -0.211719   -0.003928   -0.142682   -0.301140
H    -1.217844    2.090033   -1.094325   -0.004930   -0.180162   -0.380168
H     1.241553    1.828529   -0.945765   -0.002684   -0.094464   -0.199230
H     0.722912   -1.909311    1.067616    0.007316    0.258976    0.546318
H    -1.723735   -1.683847    0.858134    0.001532    0.056258    0.118624
H     2.745467   -0.795513    0.853091    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639856    0.242271   -0.079094    0.000938    0.032760    0.069102
C    -0.796605    1.239123   -0.559902    0.001118    0.039060    0.082480
C     0.578487    1.090204   -0.511521    0.000784    0.029600    0.062582
C     1.128915   -0.079640    0.006639   -0.001064   -0.037680   -0.079490
C     0.294877   -1.080509    0.489281   -0.001200   -0.043876   -0.092616
C    -1.084279   -0.916205    0.439466   -0.000594   -0.020946   -0.044262
O     2.469464   -0.182134    0.035986   -0.001162   -0.041256   -0.087102
H    -2.714389    0.334854   -0.184338   -0.003928   -0.142682   -0.301140
H    -1.217396    2.106413   -1.059759   -0.004930   -0.180162   -0.380168
H     1.241797    1.837118   -0.927651   -0.002684   -0.094464   -0.199230
H     0.722247   -1.932857    1.017944    0.007316    0.258976    0.546318
H    -1.723874   -1.688962    0.847349    0.001532    0.056258    0.118624
H     2.743525   -0.865501    0.705400    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.639958    0.238701   -0.086624    0.000938    0.032760    0.069102
C    -0.796727    1.234866   -0.568890    0.001118    0.039060    0.082480
C     0.578401    1.086978   -0.518341    0.000784    0.029600    0.062582
C     1.129031   -0.075534    0.015302   -0.001064   -0.037680   -0.079490
C     0.295008   -1.075728    0.499374   -0.001200   -0.043876   -0.092616
C    -1.084214   -0.913923    0.444289   -0.000594   -0.020946   -0.044262
O     2.469591   -0.177639    0.045478   -0.001162   -0.041256   -0.087102
H    -2.713961    0.350402   -0.151522   -0.003928   -0.142682   -0.301140
H    -1.216859    2.126046   -1.018331   -0.004930   -0.180162   -0.380168
H     1.242089    1.847412   -0.905940   -0.002684   -0.094464   -0.199230
H     0.721449   -1.961079    0.958409    0.007316    0.258976    0.546318
H    -1.724041   -1.695093    0.834422    0.001532    0.056258    0.118624
H     2.741198   -0.949385    0.528387    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640066    0.234927   -0.094586    0.000938    0.032760    0.069102
C    -0.796855    1.230366   -0.578394    0.001118    0.039060    0.082480
C     0.578311    1.083568   -0.525551    0.000784    0.029600    0.062582
C     1.129153   -0.071192    0.024460   -0.001064   -0.037680   -0.079490
C     0.295146   -1.070672    0.510044   -0.001200   -0.043876   -0.092616
C    -1.084146   -0.911509    0.449389   -0.000594   -0.020946   -0.044262
O     2.469725   -0.172885    0.055514   -0.001162   -0.041256   -0.087102
H    -2.713509    0.366842   -0.116826   -0.003928   -0.142682   -0.301140
H    -1.216291    2.146804   -0.974529   -0.004930   -0.180162   -0.380168
H     1.242399    1.858296   -0.882986   -0.002684   -0.094464   -0.199230
H     0.720607   -1.990917    0.895465    0.007316    0.258976    0.546318
H    -1.724217   -1.701575    0.820754    0.001532    0.056258    0.118624
H     2.738736   -1.038075    0.341233    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640168    0.231357   -0.102116    0.000938    0.032760    0.069102
C    -0.796977    1.226109   -0.587382    0.001118    0.039060    0.082480
C     0.578225    1.080342   -0.532371    0.000784    0.029600    0.062582
C     1.129269   -0.067086    0.033123   -0.001064   -0.037680   -0.079490
C     0.295277   -1.065891    0.520137   -0.001200   -0.043876   -0.092616
C    -1.084081   -0.909227    0.454212   -0.000594   -0.020946   -0.044262
O     2.469852   -0.168390    0.065006   -0.001162   -0.041256   -0.087102
H    -2.713081    0.382390   -0.084010   -0.003928   -0.142682   -0.301140
H    -1.215754    2.166437   -0.933101   -0.004930   -0.180162   -0.380168
H     1.242691    1.868590   -0.861275   -0.002684   -0.094464   -0.199230
H     0.719809   -2.019139    0.835930    0.007316    0.258976    0.546318
H    -1.724384   -1.707706    0.807827    0.001532    0.056258    0.118624
H     2.736409   -1.121959    0.164220    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640254    0.228378   -0.108399    0.000938    0.032760    0.069102
C    -0.797079    1.222558   -0.594881    0.001118    0.039060    0.082480
C     0.578154    1.077651   -0.538061    0.000784    0.029600    0.062582
C     1.129366   -0.063660    0.040350   -0.001064   -0.037680   -0.079490
C     0.295386   -1.061902    0.528558   -0.001200   -0.043876   -0.092616
C    -1.084027   -0.907322    0.458237   -0.000594   -0.020946   -0.044262
O     2.469957   -0.164638    0.072925   -0.001162   -0.041256   -0.087102
H    -2.712724    0.395363   -0.056629   -0.003928   -0.142682   -0.301140
H    -1.215306    2.182817   -0.898535   -0.004930   -0.180162   -0.380168
H     1.242935    1.877179   -0.843161   -0.002684   -0.094464   -0.199230
H     0.719144   -2.042685    0.786258    0.007316    0.258976    0.546318
H    -1.724523   -1.712821    0.797042    0.001532    0.056258    0.118624
H     2.734467   -1.191947    0.016529    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640313    0.226314   -0.112754    0.000938    0.032760    0.069102
C    -0.797149    1.220096   -0.600079    0.001118    0.039060    0.082480
C     0.578105    1.075786   -0.542005    0.000784    0.029600    0.062582
C     1.129433   -0.061286    0.045359   -0.001064   -0.037680   -0.079490
C     0.295462   -1.059137    0.534394   -0.001200   -0.043876   -0.092616
C    -1.083990   -0.906002    0.461026   -0.000594   -0.020946   -0.044262
O     2.470030   -0.162039    0.078414   -0.001162   -0.041256   -0.087102
H    -2.712476    0.404355   -0.037652   -0.003928   -0.142682   -0.301140
H    -1.214995    2.194171   -0.874578   -0.004930   -0.180162   -0.380168
H     1.243104    1.883132   -0.830606   -0.002684   -0.094464   -0.199230
H     0.718683   -2.059005    0.751831    0.007316    0.258976    0.546318
H    -1.724620   -1.716366    0.789567    0.001532    0.056258    0.118624
H     2.733121   -1.240455   -0.085835    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640339    0.225387   -0.114708    0.000938    0.032760    0.069102
C    -0.797181    1.218992   -0.602411    0.001118    0.039060    0.082480
C     0.578083    1.074948   -0.543775    0.000784    0.029600    0.062582
C     1.129463   -0.060220    0.047607   -0.001064   -0.037680   -0.079490
C     0.295496   -1.057896    0.537014   -0.001200   -0.043876   -0.092616
C    -1.083973   -0.905410    0.462278   -0.000594   -0.020946   -0.044262
O     2.470063   -0.160872    0.080878   -0.001162   -0.041256   -0.087102
H    -2.712365    0.408390   -0.029135   -0.003928   -0.142682   -0.301140
H    -1.214855    2.199266   -0.863826   -0.004930   -0.180162   -0.380168
H     1.243180    1.885803   -0.824971   -0.002684   -0.094464   -0.199230
H     0.718476   -2.066330    0.736379    0.007316    0.258976    0.546318
H    -1.724663   -1.717957    0.786211    0.001532    0.056258    0.118624
H     2.732517   -1.262227   -0.131778    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640330    0.225699   -0.114051    0.000938    0.032760    0.069102
C    -0.797170    1.219363   -0.601627    0.001118    0.039060    0.082480
C     0.578090    1.075230   -0.543179    0.000784    0.029600    0.062582
C     1.129453   -0.060579    0.046851   -0.001064   -0.037680   -0.079490
C     0.295484   -1.058313    0.536133   -0.001200   -0.043876   -0.092616
C    -1.083978   -0.905609    0.461857   -0.000594   -0.020946   -0.044262
O     2.470052   -0.161264    0.080049   -0.001162   -0.041256   -0.087102
H    -2.712402    0.407033   -0.032000   -0.003928   -0.142682   -0.301140
H    -1.214902    2.197552   -0.867443   -0.004930   -0.180162   -0.380168
H     1.243155    1.884905   -0.826866   -0.002684   -0.094464   -0.199230
H     0.718546   -2.063866    0.741577    0.007316    0.258976    0.546318
H    -1.724649   -1.717422    0.787340    0.001532    0.056258    0.118624
H     2.732720   -1.254903   -0.116323    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640287    0.227215   -0.110852    0.000938    0.032760    0.069102
C    -0.797119    1.221171   -0.597809    0.001118    0.039060    0.082480
C     0.578126    1.076600   -0.540283    0.000784    0.029600    0.062582
C     1.129404   -0.062322    0.043172   -0.001064   -0.037680   -0.079490
C     0.295429   -1.060344    0.531846   -0.001200   -0.043876   -0.092616
C    -1.084006   -0.906579    0.459808   -0.000594   -0.020946   -0.044262
O     2.469998   -0.163174    0.076018   -0.001162   -0.041256   -0.087102
H    -2.712584    0.400429   -0.045937   -0.003928   -0.142682   -0.301140
H    -1.215130    2.189214   -0.885038   -0.004930   -0.180162   -0.380168
H     1.243030    1.880533   -0.836087   -0.002684   -0.094464   -0.199230
H     0.718884   -2.051880    0.766861    0.007316    0.258976    0.546318
H    -1.724578   -1.714818    0.792830    0.001532    0.056258    0.118624
H     2.733708   -1.219277   -0.041144    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640214    0.229771   -0.105460    0.000938    0.032760    0.069102
C    -0.797031    1.224219   -0.591373    0.001118    0.039060    0.082480
C     0.578187    1.078910   -0.535400    0.000784    0.029600    0.062582
C     1.129321   -0.065263    0.036969   -0.001064   -0.037680   -0.079490
C     0.295335   -1.063768    0.524619   -0.001200   -0.043876   -0.092616
C    -1.084052   -0.908213    0.456354   -0.000594   -0.020946   -0.044262
O     2.469908   -0.166393    0.069221   -0.001162   -0.041256   -0.087102
H    -2.712891    0.389295   -0.069437   -0.003928   -0.142682   -0.301140
H    -1.215515    2.175155   -0.914704   -0.004930   -0.180162   -0.380168
H     1.242821    1.873161   -0.851634   -0.002684   -0.094464   -0.199230
H     0.719455   -2.031671    0.809493    0.007316    0.258976    0.546318
H    -1.724458   -1.710428    0.802087    0.001532    0.056258    0.118624
H     2.735375   -1.159210    0.085612    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640119    0.233091   -0.098458    0.000938    0.032760    0.069102
C    -0.796918    1.228177   -0.583015    0.001118    0.039060    0.082480
C     0.578267    1.081909   -0.529058    0.000784    0.029600    0.062582
C     1.129213   -0.069081    0.028915   -0.001064   -0.037680   -0.079490
C     0.295213   -1.068214    0.515234   -0.001200   -0.043876   -0.092616
C    -1.084112   -0.910336    0.451869   -0.000594   -0.020946   -0.044262
O     2.469790   -0.170573    0.060395   -0.001162   -0.041256   -0.087102
H    -2.713289    0.374837   -0.099951   -0.003928   -0.142682   -0.301140
H    -1.216015    2.156899   -0.953226   -0.004930   -0.180162   -0.380168
H     1.242549    1.863589   -0.871822   -0.002684   -0.094464   -0.199230
H     0.720197   -2.005429    0.864851    0.007316    0.258976    0.546318
H    -1.724303   -1.704727    0.814107    0.001532    0.056258    0.118624
H     2.737540   -1.081210    0.250209    0.021360    0.769764    1.624372
13
* Frequency(16)  937.8100
C    -1.640012    0.236814   -0.090605    0.000938    0.032760    0.069102
C    -0.796791    1.232616   -0.573642    0.001118    0.039060    0.082480
C     0.578356    1.085273   -0.521946    0.000784    0.029600    0.062582
C     1.129092   -0.073363    0.019881   -0.001064   -0.037680   -0.079490
C     0.295077   -1.073200    0.504709   -0.001200   -0.043876   -0.092616
C    -1.084180   -0.912716    0.446839   -0.000594   -0.020946   -0.044262
O     2.469658   -0.175262    0.050496   -0.001162   -0.041256   -0.087102
H    -2.713735    0.358622   -0.134174   -0.003928   -0.142682   -0.301140
H    -1.216575    2.136425   -0.996430   -0.004930   -0.180162   -0.380168
H     1.242244    1.852854   -0.894463   -0.002684   -0.094464   -0.199230
H     0.721028   -1.975998    0.926937    0.007316    0.258976    0.546318
H    -1.724129   -1.698334    0.827588    0.001532    0.056258    0.118624
H     2.739967   -0.993730    0.434810    0.021360    0.769764    1.624372
