%chk=000020641.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020641

0 1
 C   -3.403800     -0.7068000     -0.4197000    
 C   -2.139100      9.5500000E-02 -3.0900000E-02
 C  -0.8304000     -0.6413000     -0.3373000    
 C   0.3848000      0.2307000     -1.1100000E-02
 C    1.692900     -0.5128000     -0.2865000    
 C    2.906800      0.3463000      7.1400002E-02
 C    4.215200     -0.3843000     -0.2353000    
 C   -3.461800      -2.083000      0.2802000    
 C    5.429100      0.4611000      0.1534000    
 C   -4.644900      0.1322000     -0.1433000    
 C    6.737300     -0.2557000     -0.1842000    
 C    7.951400      0.5751000      0.2348000    
 C   -4.646800      -2.934500     -0.1634000    
 C   -5.065400       1.033400      -1.099000    
 C   -5.309500     -3.6200002E-02   1.053600    
 C    9.258100     -0.1559000     -7.2200000E-02
 C   -6.202000       1.801500     -0.8461000    
 C   -6.446100      0.7318000       1.306300    
 C    10.46650      0.6521000      0.3734000    
 C   -6.892300       1.650700      0.3563000    
 H   -3.362000     -0.9006000      -1.501300    
 H   -2.171500      0.3401000       1.039200    
 H   -2.138700       1.054500     -0.5659000    
 H  -0.8065000     -0.9297000      -1.394800    
 H  -0.7612000      -1.557700      0.2578000    
 H   0.3506000       1.149200     -0.6097000    
 H   0.3483000      0.5302000       1.043400    
 H    1.718600      -1.442300      0.2950000    
 H    1.738400     -0.7927000      -1.346000    
 H    2.871800       1.286700     -0.4920000    
 H    2.870600      0.6058000       1.136400    
 H    4.242200      -1.336000      0.3093000    
 H    4.259300     -0.6225000      -1.305100    
 H   -2.569400      -2.656300      3.1000001E-03
 H   -3.425800      -2.005300       1.372000    
 H    5.392400       1.422800     -0.3727000    
 H    5.394300      0.6788000       1.227800    
 H    6.781500     -0.4546000      -1.261900    
 H    6.764400      -1.226700      0.3253000    
 H    7.936500       1.539200     -0.2880000    
 H    7.895600      0.7894000       1.309100    
 H   -5.609000      -2.536200      0.1659000    
 H   -4.554400      -3.942000      0.2566000    
 H   -4.671100      -3.031400      -1.253800    
 H   -4.532800       1.157500      -2.037100    
 H   -4.984100     -0.7114000       1.835400    
 H    9.331300     -0.3512000      -1.148300    
 H    9.270100      -1.127300      0.4355000    
 H   -6.549100       2.517500      -1.585400    
 H   -6.979900      0.6204000       2.245600    
 H    10.44010      0.8349000       1.452400    
 H    11.38980      0.1114000      0.1431000    
 H    10.50220       1.618900     -0.1385000    
 H   -7.776300       2.250100      0.5539000    


%chk=000020641-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020641

0 1
C -3.477628 -0.736396 -0.406829
C -2.200665 -0.027677 0.143856
C -0.865276 -0.680057 -0.281726
C 0.368944 0.146841 0.146132
C 1.709503 -0.512706 -0.248615
C 2.948170 0.311406 0.169366
C 4.285842 -0.364982 -0.206688
C -3.634663 -2.180896 0.152591
C 5.528595 0.456438 0.204426
C -4.718227 0.121397 -0.140980
C 6.863576 -0.233839 -0.156431
C 8.109509 0.585651 0.248914
C -4.813488 -2.960470 -0.468885
C -5.441849 0.707808 -1.210141
C -5.166171 0.369383 1.184476
C 9.442740 -0.112530 -0.105143
C -6.576437 1.517362 -0.969538
C -6.298548 1.175700 1.431750
C 10.683077 0.712700 0.300987
C -7.009989 1.754926 0.354409
H -3.357276 -0.821584 -1.508528
H -2.255191 0.013005 1.251805
H -2.210132 1.025526 -0.203540
H -0.855555 -0.806420 -1.385215
H -0.779817 -1.697526 0.149654
H 0.308122 1.158306 -0.307276
H 0.345433 0.298200 1.245807
H 1.769739 -1.521302 0.211898
H 1.729599 -0.672254 -1.347238
H 2.898059 1.314815 -0.303097
H 2.920844 0.483210 1.265946
H 4.335275 -1.366227 0.270768
H 4.310889 -0.542862 -1.302400
H -2.696083 -2.738415 -0.029777
H -3.759910 -2.132440 1.253597
H 5.487413 1.453142 -0.282900
H 5.498137 0.644594 1.298258
H 6.892149 -0.426482 -1.249605
H 6.904567 -1.228862 0.334630
H 8.074321 1.578440 -0.246973
H 8.080254 0.783506 1.341125
H -5.776592 -2.458051 -0.267880
H -4.871476 -3.986391 -0.060764
H -4.699290 -3.040339 -1.566969
H -5.112583 0.526725 -2.241199
H -4.626476 -0.072563 2.031202
H 9.470326 -0.311505 -1.196147
H 9.477043 -1.103613 0.391858
H -7.120611 1.959214 -1.812389
H -6.627325 1.353256 2.462436
H 10.696243 0.896964 1.392001
H 11.622175 0.193307 0.034696
H 10.686067 1.697192 -0.204175
H -7.889151 2.380777 0.545158


