%chk=000107945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107945

0 1
 O    4.539600      -1.304600      0.1523000    
 O    4.180900       1.053000       1.494200    
 C    3.696700     -0.3322000     -0.4597000    
 C    2.225300     -0.6581000     -0.2688000    
 C    1.260700      0.3809000     -0.3024000    
 C  -0.1318000      7.7100001E-02 -0.1743000    
 C    4.066100       1.061500      7.1999997E-02
 C  -0.5181000      -1.278600     -3.5200000E-02
 C    1.750400       1.764200     -0.4901000    
 C    1.804400      -1.984700     -0.1474000    
 C    3.037400       2.082600     -0.2928000    
 C   -1.171800       1.042800     -0.1668000    
 C   0.4522000      -2.287500     -2.6799999E-02
 C   -2.531000      0.6995000     -3.7999999E-02
 C   -1.874500      -1.625000      9.2699997E-02
 C   -2.886500     -0.6553000      9.2500001E-02
 C   -3.541700       1.676500     -3.5399999E-02
 C   -4.241700      -1.004600      0.2211000    
 C   -4.883300       1.316300      9.2600003E-02
 C   -5.233200     -2.3700001E-02  0.2205000    
 H    3.885000     -0.3691000      -1.541200    
 H    5.043900       1.354100     -0.3271000    
 H    1.057100       2.547300     -0.7700000    
 H    2.521800      -2.801000     -0.1530000    
 H    3.355200       3.115600     -0.3996000    
 H  -0.9316000       2.100700     -0.2564000    
 H   0.1636000      -3.332700      7.0799999E-02
 H   -2.150000      -2.675300      0.1961000    
 H    5.459400      -1.066400     -5.5100001E-02
 H   -3.290600       2.730600     -0.1344000    
 H   -4.536400      -2.047000      0.3232000    
 H    4.818000      0.3575000       1.730300    
 H   -5.653300       2.082100      9.2399999E-02
 H   -6.276900     -0.3065000      0.3205000    


%chk=000107945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107945

0 1
O 4.558200 -1.317775 0.081245
O 4.320765 1.052529 1.498505
C 3.694827 -0.269583 -0.513611
C 2.240672 -0.620588 -0.235530
C 1.282542 0.410598 -0.267432
C -0.130606 0.082801 -0.141050
C 4.121099 1.112292 0.037327
C -0.514434 -1.319064 0.022111
C 1.751298 1.801193 -0.404919
C 1.853413 -1.985249 -0.055236
C 3.062772 2.152686 -0.264103
C -1.160066 1.057615 -0.165948
C 0.511172 -2.326221 0.072259
C -2.530217 0.711640 -0.053929
C -1.883782 -1.665655 0.134570
C -2.906447 -0.689244 0.096852
C -3.572134 1.707469 -0.084925
C -4.303346 -1.028061 0.206021
C -4.910894 1.344452 0.023123
C -5.281094 -0.039228 0.169606
H 3.838608 -0.246479 -1.618455
H 5.085647 1.391880 -0.443702
H 1.013738 2.591102 -0.579106
H 2.638871 -2.744288 -0.013385
H 3.368728 3.203409 -0.294487
H -0.912357 2.119171 -0.268953
H 0.215066 -3.372285 0.212920
H -2.154007 -2.722279 0.256512
H 5.437979 -1.311699 -0.373407
H -3.290505 2.761547 -0.195856
H -4.582376 -2.082517 0.319476
H 4.636770 0.125618 1.688726
H -5.694189 2.109944 -0.001859
H -6.340412 -0.305732 0.253340


