%chk=000131939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131939

0 1
 O   3.0500000E-02   4.248300       1.230300    
 O  -0.4559000       4.038200     -0.9780000    
 O    5.212300      -1.053800      -1.760500    
 O    4.724100      -2.891000      0.2741000    
 O    3.702800       1.230000      -1.793600    
 O    2.792000      -2.294700       2.084600    
 C   -4.371900      0.4109000     -0.2232000    
 C   -5.388600     -0.7049000      4.1999999E-02
 C   -2.992800      0.2177000      0.4152000    
 C   -6.788900     -0.4827000     -0.5379000    
 C   -2.004500       1.337000      7.2999999E-02
 C   -7.780100      -1.590000     -0.1748000    
 C  -0.6020000       1.095700      0.6498000    
 C   -9.160400      -1.314100     -0.7724000    
 C   0.4073000       2.150400      0.2558000    
 C   -10.15930      -2.394300     -0.3892000    
 C    1.721900       1.953300      4.1999999E-02
 C    2.439300      0.7134000      0.1653000    
 C  -5.2999999E-02   3.556800      7.0000000E-02
 C    2.218300     -0.1817000       1.149200    
 C    3.479100      0.4400000     -0.8790000    
 C    2.994300      -1.460100       1.205600    
 C    4.250100     -0.8192000     -0.7978000    
 C    4.023500      -1.705600      0.1742000    
 C    1.223500     -4.0399998E-02   2.274200    
 C    6.464500     -0.5398000      -1.352300    
 C    4.074000      -3.919600     -0.4462000    
 H   -4.792100       1.359800      0.1336000    
 H   -4.249600      0.5162000      -1.308600    
 H   -4.987400      -1.647100     -0.3520000    
 H   -5.477600     -0.8378000       1.127800    
 H   -3.105100      0.1518000       1.504200    
 H   -2.580900     -0.7423000      8.0600001E-02
 H   -6.713100     -0.4023000      -1.629200    
 H   -7.174000      0.4787000     -0.1760000    
 H   -2.410000       2.285600      0.4468000    
 H   -1.935800       1.428500      -1.018700    
 H   -7.404500      -2.553300     -0.5403000    
 H   -7.859000      -1.666200      0.9164000    
 H  -0.3031000      0.1070000      0.2918000    
 H  -0.7720000       1.124900       1.728200    
 H   -9.530800     -0.3434000     -0.4227000    
 H   -9.089000      -1.259900      -1.864900    
 H   -11.13840      -2.177900     -0.8277000    
 H   -10.27870      -2.450500      0.6976000    
 H   -9.834200      -3.375000     -0.7507000    
 H    2.333600       2.806000     -0.2522000    
 H    1.021600      0.9953000       2.553700    
 H    1.692000     -0.4167000       3.195900    
 H   0.3399000     -0.6699000       2.146400    
 H  -0.2698000       5.176500       1.127000    
 H    6.419300      0.5426000      -1.188300    
 H    7.186700     -0.7279000      -2.152600    
 H    6.828100      -1.040700     -0.4483000    
 H    3.064600      -4.103800     -6.2100001E-02
 H    4.031100      -3.692200      -1.517100    
 H    4.652900      -4.839700     -0.3224000    


%chk=000131939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131939

0 1
O -0.939493 4.224779 1.654787
O 1.089892 4.784299 0.684851
O 4.055107 -1.405923 -2.291404
O 4.125790 -3.164072 -0.344043
O 2.807209 1.180003 -1.811934
O 3.219262 -2.370025 2.299430
C -3.983789 0.392619 -0.279317
C -5.167570 -0.505565 0.146568
C -2.886709 0.509673 0.802298
C -6.252079 -0.644695 -0.945350
C -1.721826 1.432708 0.380327
C -7.444627 -1.529156 -0.515735
C -0.600656 1.488461 1.459159
C -8.523318 -1.677688 -1.612920
C 0.533981 2.410790 1.059357
C -9.715566 -2.553979 -1.171003
C 1.760489 2.023523 0.576113
C 2.314044 0.659476 0.485223
C 0.302489 3.890817 1.083153
C 2.423942 -0.234764 1.531072
C 2.900714 0.325892 -0.866284
C 3.070502 -1.577209 1.306192
C 3.534486 -0.998073 -1.078719
C 3.549421 -1.943804 -0.048175
C 2.008313 0.040372 2.954183
C 4.405624 -0.456651 -3.374114
C 3.897754 -4.369314 0.486873
H -4.364255 1.405352 -0.527502
H -3.536241 -0.008438 -1.212570
H -4.785636 -1.513245 0.413847
H -5.627062 -0.092945 1.069131
H -3.335747 0.894584 1.741592
H -2.492874 -0.502154 1.035216
H -5.794019 -1.068168 -1.863790
H -6.625987 0.363499 -1.221805
H -2.108175 2.453053 0.199193
H -1.285775 1.074815 -0.573798
H -7.071991 -2.535646 -0.231137
H -7.909481 -1.101110 0.397239
H -0.219196 0.465149 1.611517
H -1.048508 1.828172 2.412061
H -8.889724 -0.671312 -1.901750
H -8.059966 -2.112014 -2.522327
H -10.470797 -2.647983 -1.973020
H -10.216428 -2.122192 -0.283786
H -9.379290 -3.573252 -0.901808
H 2.392767 2.819487 0.157356
H 1.804697 1.109589 3.117272
H 2.796527 -0.304327 3.645309
H 1.101510 -0.533142 3.226781
H -1.026380 5.216144 1.658213
H 3.501185 -0.046405 -3.847848
H 4.979905 -1.077040 -4.079047
H 5.022249 0.373388 -2.990792
H 4.450173 -4.303714 1.435661
H 2.823622 -4.507352 0.699087
H 4.276313 -5.189184 -0.142485


