%chk=000113404.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113404

0 1
 O   2.7100001E-02 -0.3027000       2.341500    
 C    2.227000     -0.3664000      0.5051000    
 C    2.428300      -1.548700       1.399500    
 C    3.370700     -0.1228000     -0.2643000    
 C    3.628500      -2.230200      0.7253000    
 C    4.442700      -1.119700      4.4300001E-02
 C    1.118600      0.4589000      0.4182000    
 C    3.429900      0.9512000      -1.136000    
 C    1.164600       1.537400     -0.4678000    
 C    2.311800       1.781600      -1.239400    
 C  -6.8599999E-02  0.2293000       1.225300    
 C    4.647300       1.230400      -1.946700    
 C   -1.437400      0.6133000      0.7645000    
 C   -2.227500     -0.2681000      4.2800002E-02
 C   -3.512100      0.1666000     -0.3617000    
 C   -1.844700       1.887600       1.103600    
 C   -1.802000      -1.562700     -0.2967000    
 C   -3.937400       1.461200     -2.1700000E-02
 C   -3.108100       2.314900      0.7062000    
 C   -4.333400     -0.7061000      -1.094000    
 C   -2.631000      -2.416300      -1.025000    
 C   -3.894200      -1.988800      -1.422900    
 H    2.682100      -1.221200       2.412900    
 H    1.568300      -2.223800       1.421000    
 H    4.227600      -2.814600       1.430600    
 H    3.261500      -2.927100     -4.1299999E-02
 H    4.946200      -1.494700     -0.8510000    
 H    5.173900     -0.6865000      0.7344000    
 H   0.3307000       2.223400     -0.5820000    
 H    2.316600       2.634100      -1.914400    
 H    5.525500       1.325400      -1.299600    
 H    4.817700      0.4234000      -2.666500    
 H    4.555300       2.165000      -2.510300    
 H   -1.207900       2.558700       1.672700    
 H  -0.8246000      -1.938100     -4.1999999E-03
 H   -4.921000       1.816500     -0.3218000    
 H   -3.449500       3.313500      0.9630000    
 H   -5.324600     -0.3931000      -1.415400    
 H   -2.290300      -3.415400      -1.281000    
 H   -4.539200      -2.654000      -1.989700    


%chk=000113404-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113404

0 1
O 0.213138 0.082251 2.670099
C 2.299705 -0.331984 0.672754
C 2.732478 -1.163730 1.871485
C 3.351421 -0.254306 -0.274518
C 3.983717 -1.931487 1.347498
C 4.566428 -1.035711 0.211067
C 1.059856 0.321951 0.427494
C 3.222261 0.495638 -1.470030
C 0.923177 1.063081 -0.782484
C 1.983981 1.154166 -1.703473
C -0.040066 0.295509 1.439700
C 4.363170 0.591442 -2.464083
C -1.467290 0.595861 1.032834
C -2.156000 -0.059136 -0.059965
C -3.531657 0.317804 -0.337943
C -2.151755 1.532601 1.824387
C -1.570194 -1.105569 -0.851567
C -4.172134 1.313959 0.469292
C -3.497657 1.904539 1.539453
C -4.239025 -0.327783 -1.406891
C -2.288124 -1.721876 -1.878828
C -3.631560 -1.325921 -2.168918
H 2.988754 -0.490437 2.712545
H 1.934350 -1.822048 2.254127
H 4.718349 -2.139219 2.144533
H 3.668379 -2.902563 0.921388
H 5.053028 -1.622872 -0.589622
H 5.335609 -0.340304 0.607503
H -0.019763 1.579680 -0.988645
H 1.855164 1.742804 -2.619319
H 5.275901 0.999777 -1.989761
H 4.632101 -0.405234 -2.864054
H 4.102964 1.240383 -3.317271
H -1.625472 1.982451 2.672516
H -0.546961 -1.429000 -0.641983
H -5.207437 1.594072 0.240374
H -3.994653 2.654927 2.163182
H -5.274740 -0.027952 -1.607525
H -1.820458 -2.518996 -2.467103
H -4.180583 -1.815367 -2.980748


