13
* (null), Energy   -1000.0000000
C    -1.640012    0.236814   -0.090605    0.047130    0.150512   -0.072018
C    -0.796791    1.232616   -0.573642    0.234730    0.018794   -0.012090
C     0.578356    1.085273   -0.521946    0.088288   -0.360270    0.169710
C     1.129092   -0.073363    0.019881   -0.080944   -0.342804    0.163522
C     0.295077   -1.073200    0.504709   -0.169282   -0.358472    0.172042
C    -1.084180   -0.912716    0.446839   -0.207274    0.044240   -0.018100
O     2.469658   -0.175262    0.050496    0.026188    0.609802   -0.289346
H    -2.713735    0.358622   -0.134174    0.070372    0.327952   -0.156478
H    -1.216575    2.136425   -0.996430    0.502404    0.117850   -0.062654
H     1.242244    1.852854   -0.894463    0.420074   -0.591158    0.274802
H     0.721028   -1.975998    0.926937   -0.453748   -0.469466    0.228204
H    -1.724129   -1.698334    0.827588   -0.472932    0.221818   -0.098552
H     2.739967   -0.993730    0.434810    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.634656    0.253919   -0.098789    0.047130    0.150512   -0.072018
C    -0.770115    1.234752   -0.575016    0.234730    0.018794   -0.012090
C     0.588389    1.044330   -0.502659    0.088288   -0.360270    0.169710
C     1.119893   -0.112321    0.038464   -0.080944   -0.342804    0.163522
C     0.275839   -1.113938    0.524261   -0.169282   -0.358472    0.172042
C    -1.107736   -0.907688    0.444782   -0.207274    0.044240   -0.018100
O     2.472634   -0.105961    0.017613    0.026188    0.609802   -0.289346
H    -2.705738    0.395892   -0.151957    0.070372    0.327952   -0.156478
H    -1.159479    2.149818   -1.003550    0.502404    0.117850   -0.062654
H     1.289983    1.785672   -0.863233    0.420074   -0.591158    0.274802
H     0.669462   -2.029350    0.952871   -0.453748   -0.469466    0.228204
H    -1.777875   -1.673126    0.816388   -0.472932    0.221818   -0.098552
H     2.803498   -0.900690    0.389851    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.629880    0.269170   -0.106087    0.047130    0.150512   -0.072018
C    -0.746330    1.236656   -0.576241    0.234730    0.018794   -0.012090
C     0.597336    1.007824   -0.485463    0.088288   -0.360270    0.169710
C     1.111691   -0.147057    0.055034   -0.080944   -0.342804    0.163522
C     0.258686   -1.150262    0.541694   -0.169282   -0.358472    0.172042
C    -1.128739   -0.903206    0.442948   -0.207274    0.044240   -0.018100
O     2.475288   -0.044170   -0.011706    0.026188    0.609802   -0.289346
H    -2.698607    0.429123   -0.167813    0.070372    0.327952   -0.156478
H    -1.108571    2.161760   -1.009899    0.502404    0.117850   -0.062654
H     1.332549    1.725770   -0.835388    0.420074   -0.591158    0.274802
H     0.623484   -2.076921    0.975995   -0.453748   -0.469466    0.228204
H    -1.825797   -1.650649    0.806402   -0.472932    0.221818   -0.098552
H     2.860144   -0.817733    0.349764    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.626203    0.280915   -0.111707    0.047130    0.150512   -0.072018
C    -0.728013    1.238123   -0.577184    0.234730    0.018794   -0.012090
C     0.604225    0.979711   -0.472220    0.088288   -0.360270    0.169710
C     1.105375   -0.173807    0.067794   -0.080944   -0.342804    0.163522
C     0.245476   -1.178235    0.555119   -0.169282   -0.358472    0.172042
C    -1.144913   -0.899753    0.441536   -0.207274    0.044240   -0.018100
O     2.477331    0.003415   -0.034285    0.026188    0.609802   -0.289346
H    -2.693115    0.454715   -0.180023    0.070372    0.327952   -0.156478
H    -1.069366    2.170956   -1.014788    0.502404    0.117850   -0.062654
H     1.365329    1.679640   -0.813944    0.420074   -0.591158    0.274802
H     0.588076   -2.113555    0.993803   -0.453748   -0.469466    0.228204
H    -1.862702   -1.633339    0.798711   -0.472932    0.221818   -0.098552
H     2.903767   -0.753847    0.318893    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.624021    0.287881   -0.115040    0.047130    0.150512   -0.072018
C    -0.717149    1.238993   -0.577744    0.234730    0.018794   -0.012090
C     0.608311    0.963037   -0.464365    0.088288   -0.360270    0.169710
C     1.101629   -0.189673    0.075362   -0.080944   -0.342804    0.163522
C     0.237641   -1.194826    0.563081   -0.169282   -0.358472    0.172042
C    -1.154506   -0.897706    0.440698   -0.207274    0.044240   -0.018100
O     2.478543    0.031638   -0.047676    0.026188    0.609802   -0.289346
H    -2.689858    0.469893   -0.187265    0.070372    0.327952   -0.156478
H    -1.046114    2.176410   -1.017688    0.502404    0.117850   -0.062654
H     1.384771    1.652280   -0.801225    0.420074   -0.591158    0.274802
H     0.567076   -2.135283    1.004364   -0.453748   -0.469466    0.228204
H    -1.884590   -1.623073    0.794150   -0.472932    0.221818   -0.098552
H     2.929640   -0.715957    0.300583    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.623573    0.289313   -0.115725    0.047130    0.150512   -0.072018
C    -0.714916    1.239171   -0.577859    0.234730    0.018794   -0.012090
C     0.609151    0.959609   -0.462750    0.088288   -0.360270    0.169710
C     1.100858   -0.192935    0.076918   -0.080944   -0.342804    0.163522
C     0.236031   -1.198237    0.564718   -0.169282   -0.358472    0.172042
C    -1.156478   -0.897285    0.440526   -0.207274    0.044240   -0.018100
O     2.478792    0.037440   -0.050429    0.026188    0.609802   -0.289346
H    -2.689189    0.473013   -0.188754    0.070372    0.327952   -0.156478
H    -1.041334    2.177532   -1.018284    0.502404    0.117850   -0.062654
H     1.388768    1.646655   -0.798611    0.420074   -0.591158    0.274802
H     0.562759   -2.139750    1.006536   -0.453748   -0.469466    0.228204
H    -1.889090   -1.620963    0.793213   -0.472932    0.221818   -0.098552
H     2.934959   -0.708167    0.296819    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.624906    0.285056   -0.113688    0.047130    0.150512   -0.072018
C    -0.721555    1.238640   -0.577517    0.234730    0.018794   -0.012090
C     0.606654    0.969799   -0.467550    0.088288   -0.360270    0.169710
C     1.103148   -0.183239    0.072293   -0.080944   -0.342804    0.163522
C     0.240819   -1.188098    0.559852   -0.169282   -0.358472    0.172042
C    -1.150616   -0.898536    0.441038   -0.207274    0.044240   -0.018100
O     2.478052    0.020192   -0.042245    0.026188    0.609802   -0.289346
H    -2.691179    0.463737   -0.184328    0.070372    0.327952   -0.156478
H    -1.055544    2.174198   -1.016512    0.502404    0.117850   -0.062654
H     1.376886    1.663376   -0.806383    0.420074   -0.591158    0.274802
H     0.575592   -2.126472    1.000081   -0.453748   -0.469466    0.228204
H    -1.875713   -1.627237    0.796000   -0.472932    0.221818   -0.098552
H     2.919147   -0.731323    0.308009    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.627876    0.275571   -0.109150    0.047130    0.150512   -0.072018
C    -0.736347    1.237456   -0.576755    0.234730    0.018794   -0.012090
C     0.601090    0.992502   -0.478245    0.088288   -0.360270    0.169710
C     1.108249   -0.161636    0.061988   -0.080944   -0.342804    0.163522
C     0.251486   -1.165508    0.549010   -0.169282   -0.358472    0.172042
C    -1.137554   -0.901324    0.442178   -0.207274    0.044240   -0.018100
O     2.476401   -0.018236   -0.024012    0.026188    0.609802   -0.289346
H    -2.695614    0.443071   -0.174468    0.070372    0.327952   -0.156478
H    -1.087204    2.166772   -1.012564    0.502404    0.117850   -0.062654
H     1.350414    1.700629   -0.823701    0.420074   -0.591158    0.274802
H     0.604186   -2.096887    0.985700   -0.453748   -0.469466    0.228204
H    -1.845911   -1.641215    0.802211   -0.472932    0.221818   -0.098552
H     2.883919   -0.782915    0.332939    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.632161    0.261887   -0.102602    0.047130    0.150512   -0.072018
C    -0.757689    1.235747   -0.575656    0.234730    0.018794   -0.012090
C     0.593063    1.025259   -0.493675    0.088288   -0.360270    0.169710
C     1.115608   -0.130468    0.047121   -0.080944   -0.342804    0.163522
C     0.266878   -1.132915    0.533368   -0.169282   -0.358472    0.172042
C    -1.118708   -0.905346    0.443824   -0.207274    0.044240   -0.018100
O     2.474020   -0.073680    0.002296    0.026188    0.609802   -0.289346
H    -2.702012    0.413253   -0.160240    0.070372    0.327952   -0.156478
H    -1.132884    2.156057   -1.006867    0.502404    0.117850   -0.062654
H     1.312221    1.754378   -0.848686    0.420074   -0.591158    0.274802
H     0.645442   -2.054202    0.964952   -0.453748   -0.469466    0.228204
H    -1.802911   -1.661383    0.811171   -0.472932    0.221818   -0.098552
H     2.833091   -0.857351    0.368909    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.637297    0.245485   -0.094754    0.047130    0.150512   -0.072018
C    -0.783269    1.233699   -0.574338    0.234730    0.018794   -0.012090
C     0.583442    1.064519   -0.512169    0.088288   -0.360270    0.169710
C     1.124429   -0.093111    0.029301   -0.080944   -0.342804    0.163522
C     0.285325   -1.093851    0.514620   -0.169282   -0.358472    0.172042
C    -1.096121   -0.910167    0.445796   -0.207274    0.044240   -0.018100
O     2.471167   -0.140132    0.033827    0.026188    0.609802   -0.289346
H    -2.709681    0.377515   -0.143188    0.070372    0.327952   -0.156478
H    -1.187632    2.143214   -1.000039    0.502404    0.117850   -0.062654
H     1.266444    1.818799   -0.878632    0.420074   -0.591158    0.274802
H     0.694888   -2.003043    0.940083   -0.453748   -0.469466    0.228204
H    -1.751374   -1.685555    0.821911   -0.472932    0.221818   -0.098552
H     2.772172   -0.946567    0.412020    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.642727    0.228143   -0.086456    0.047130    0.150512   -0.072018
C    -0.810313    1.231533   -0.572946    0.234730    0.018794   -0.012090
C     0.573270    1.106027   -0.531723    0.088288   -0.360270    0.169710
C     1.133755   -0.053615    0.010461   -0.080944   -0.342804    0.163522
C     0.304829   -1.052549    0.494798   -0.169282   -0.358472    0.172042
C    -1.072239   -0.915265    0.447882   -0.207274    0.044240   -0.018100
O     2.468149   -0.210392    0.067165    0.026188    0.609802   -0.289346
H    -2.717789    0.339729   -0.125160    0.070372    0.327952   -0.156478
H    -1.245518    2.129636   -0.992821    0.502404    0.117850   -0.062654
H     1.218044    1.886909   -0.910294    0.420074   -0.591158    0.274802
H     0.747168   -1.948953    0.913791   -0.453748   -0.469466    0.228204
H    -1.696884   -1.711113    0.833265   -0.472932    0.221818   -0.098552
H     2.707762   -1.040893    0.457600    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.647863    0.211741   -0.078608    0.047130    0.150512   -0.072018
C    -0.835893    1.229485   -0.571628    0.234730    0.018794   -0.012090
C     0.563649    1.145287   -0.550217    0.088288   -0.360270    0.169710
C     1.142576   -0.016258   -0.007359   -0.080944   -0.342804    0.163522
C     0.323276   -1.013485    0.476050   -0.169282   -0.358472    0.172042
C    -1.049652   -0.920086    0.449854   -0.207274    0.044240   -0.018100
O     2.465296   -0.276844    0.098696    0.026188    0.609802   -0.289346
H    -2.725458    0.303991   -0.108108    0.070372    0.327952   -0.156478
H    -1.300266    2.116793   -0.985993    0.502404    0.117850   -0.062654
H     1.172267    1.951330   -0.940240    0.420074   -0.591158    0.274802
H     0.796614   -1.897794    0.888922   -0.453748   -0.469466    0.228204
H    -1.645347   -1.735285    0.844005   -0.472932    0.221818   -0.098552
H     2.646843   -1.130109    0.500711    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.652148    0.198057   -0.072060    0.047130    0.150512   -0.072018
C    -0.857235    1.227776   -0.570529    0.234730    0.018794   -0.012090
C     0.555622    1.178044   -0.565647    0.088288   -0.360270    0.169710
C     1.149935    0.014910   -0.022226   -0.080944   -0.342804    0.163522
C     0.338668   -0.980892    0.460408   -0.169282   -0.358472    0.172042
C    -1.030806   -0.924108    0.451500   -0.207274    0.044240   -0.018100
O     2.462915   -0.332288    0.125004    0.026188    0.609802   -0.289346
H    -2.731856    0.274173   -0.093880    0.070372    0.327952   -0.156478
H    -1.345946    2.106078   -0.980296    0.502404    0.117850   -0.062654
H     1.134074    2.005079   -0.965225    0.420074   -0.591158    0.274802
H     0.837870   -1.855109    0.868174   -0.453748   -0.469466    0.228204
H    -1.602347   -1.755453    0.852965   -0.472932    0.221818   -0.098552
H     2.596015   -1.204545    0.536681    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.655118    0.188572   -0.067522    0.047130    0.150512   -0.072018
C    -0.872027    1.226592   -0.569767    0.234730    0.018794   -0.012090
C     0.550058    1.200747   -0.576342    0.088288   -0.360270    0.169710
C     1.155036    0.036513   -0.032531   -0.080944   -0.342804    0.163522
C     0.349335   -0.958302    0.449566   -0.169282   -0.358472    0.172042
C    -1.017744   -0.926896    0.452640   -0.207274    0.044240   -0.018100
O     2.461264   -0.370716    0.143237    0.026188    0.609802   -0.289346
H    -2.736291    0.253507   -0.084020    0.070372    0.327952   -0.156478
H    -1.377606    2.098652   -0.976348    0.502404    0.117850   -0.062654
H     1.107602    2.042332   -0.982543    0.420074   -0.591158    0.274802
H     0.866464   -1.825524    0.853793   -0.453748   -0.469466    0.228204
H    -1.572545   -1.769431    0.859176   -0.472932    0.221818   -0.098552
H     2.560787   -1.256137    0.561611    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.656451    0.184315   -0.065485    0.047130    0.150512   -0.072018
C    -0.878666    1.226061   -0.569425    0.234730    0.018794   -0.012090
C     0.547561    1.210937   -0.581142    0.088288   -0.360270    0.169710
C     1.157326    0.046209   -0.037156   -0.080944   -0.342804    0.163522
C     0.354123   -0.948163    0.444700   -0.169282   -0.358472    0.172042
C    -1.011882   -0.928147    0.453152   -0.207274    0.044240   -0.018100
O     2.460524   -0.387964    0.151421    0.026188    0.609802   -0.289346
H    -2.738281    0.244231   -0.079594    0.070372    0.327952   -0.156478
H    -1.391816    2.095318   -0.974576    0.502404    0.117850   -0.062654
H     1.095720    2.059053   -0.990315    0.420074   -0.591158    0.274802
H     0.879297   -1.812246    0.847338   -0.453748   -0.469466    0.228204
H    -1.559168   -1.775705    0.861963   -0.472932    0.221818   -0.098552
H     2.544975   -1.279293    0.572801    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.656003    0.185747   -0.066170    0.047130    0.150512   -0.072018
C    -0.876433    1.226239   -0.569540    0.234730    0.018794   -0.012090
C     0.548401    1.207509   -0.579527    0.088288   -0.360270    0.169710
C     1.156555    0.042947   -0.035600   -0.080944   -0.342804    0.163522
C     0.352513   -0.951574    0.446337   -0.169282   -0.358472    0.172042
C    -1.013854   -0.927726    0.452980   -0.207274    0.044240   -0.018100
O     2.460773   -0.382162    0.148668    0.026188    0.609802   -0.289346
H    -2.737612    0.247351   -0.081083    0.070372    0.327952   -0.156478
H    -1.387036    2.096440   -0.975172    0.502404    0.117850   -0.062654
H     1.099717    2.053428   -0.987701    0.420074   -0.591158    0.274802
H     0.874980   -1.816713    0.849510   -0.453748   -0.469466    0.228204
H    -1.563668   -1.773595    0.861026   -0.472932    0.221818   -0.098552
H     2.550294   -1.271503    0.569037    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.653821    0.192713   -0.069503    0.047130    0.150512   -0.072018
C    -0.865569    1.227109   -0.570100    0.234730    0.018794   -0.012090
C     0.552487    1.190835   -0.571672    0.088288   -0.360270    0.169710
C     1.152809    0.027081   -0.028032   -0.080944   -0.342804    0.163522
C     0.344678   -0.968165    0.454299   -0.169282   -0.358472    0.172042
C    -1.023447   -0.925679    0.452142   -0.207274    0.044240   -0.018100
O     2.461985   -0.353939    0.135277    0.026188    0.609802   -0.289346
H    -2.734355    0.262529   -0.088325    0.070372    0.327952   -0.156478
H    -1.363784    2.101894   -0.978072    0.502404    0.117850   -0.062654
H     1.119159    2.026068   -0.974982    0.420074   -0.591158    0.274802
H     0.853980   -1.838441    0.860071   -0.453748   -0.469466    0.228204
H    -1.585556   -1.763329    0.856465   -0.472932    0.221818   -0.098552
H     2.576167   -1.233613    0.550727    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.650144    0.204458   -0.075123    0.047130    0.150512   -0.072018
C    -0.847252    1.228576   -0.571043    0.234730    0.018794   -0.012090
C     0.559376    1.162722   -0.558429    0.088288   -0.360270    0.169710
C     1.146493    0.000331   -0.015272   -0.080944   -0.342804    0.163522
C     0.331468   -0.996138    0.467724   -0.169282   -0.358472    0.172042
C    -1.039621   -0.922226    0.450730   -0.207274    0.044240   -0.018100
O     2.464028   -0.306354    0.112698    0.026188    0.609802   -0.289346
H    -2.728863    0.288121   -0.100535    0.070372    0.327952   -0.156478
H    -1.324579    2.111090   -0.982961    0.502404    0.117850   -0.062654
H     1.151939    1.979938   -0.953538    0.420074   -0.591158    0.274802
H     0.818572   -1.875075    0.877879   -0.453748   -0.469466    0.228204
H    -1.622461   -1.746019    0.848774   -0.472932    0.221818   -0.098552
H     2.619790   -1.169727    0.519856    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.645368    0.219709   -0.082421    0.047130    0.150512   -0.072018
C    -0.823467    1.230480   -0.572268    0.234730    0.018794   -0.012090
C     0.568323    1.126216   -0.541233    0.088288   -0.360270    0.169710
C     1.138291   -0.034405    0.001298   -0.080944   -0.342804    0.163522
C     0.314315   -1.032462    0.485157   -0.169282   -0.358472    0.172042
C    -1.060624   -0.917744    0.448896   -0.207274    0.044240   -0.018100
O     2.466682   -0.244563    0.083379    0.026188    0.609802   -0.289346
H    -2.721732    0.321352   -0.116391    0.070372    0.327952   -0.156478
H    -1.273671    2.123032   -0.989310    0.502404    0.117850   -0.062654
H     1.194505    1.920036   -0.925693    0.420074   -0.591158    0.274802
H     0.772594   -1.922646    0.901003   -0.453748   -0.469466    0.228204
H    -1.670383   -1.723542    0.838788   -0.472932    0.221818   -0.098552
H     2.676436   -1.086770    0.479769    0.559028    0.818690   -0.395610
13
* Frequency(8)  484.0500
C    -1.640012    0.236814   -0.090605    0.047130    0.150512   -0.072018
C    -0.796791    1.232616   -0.573642    0.234730    0.018794   -0.012090
C     0.578356    1.085273   -0.521946    0.088288   -0.360270    0.169710
C     1.129092   -0.073363    0.019881   -0.080944   -0.342804    0.163522
C     0.295077   -1.073200    0.504709   -0.169282   -0.358472    0.172042
C    -1.084180   -0.912716    0.446839   -0.207274    0.044240   -0.018100
O     2.469658   -0.175262    0.050496    0.026188    0.609802   -0.289346
H    -2.713735    0.358622   -0.134174    0.070372    0.327952   -0.156478
H    -1.216575    2.136425   -0.996430    0.502404    0.117850   -0.062654
H     1.242244    1.852854   -0.894463    0.420074   -0.591158    0.274802
H     0.721028   -1.975998    0.926937   -0.453748   -0.469466    0.228204
H    -1.724129   -1.698334    0.827588   -0.472932    0.221818   -0.098552
H     2.739967   -0.993730    0.434810    0.559028    0.818690   -0.395610
