%chk=000064875.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064875

0 1
 O  -0.6580000      -2.263900       1.246300    
 O    1.184700       2.413700       1.528400    
 N   0.5926000       2.391800     -0.7166000    
 C    3.298300      0.4937000      0.4569000    
 C    2.855700       1.835100     -0.1249000    
 C    2.371400     -0.6228000      5.1100001E-02
 C    1.471000       2.241900      0.3466000    
 C  -0.7873000       2.776100     -0.5334000    
 C    1.277500     -0.9248000      0.8487000    
 C    2.626000      -1.330800      -1.114400    
 C   -1.730900       1.618200     -0.3488000    
 C   0.4190000      -1.958100      0.4727000    
 C    1.767800      -2.363800      -1.490400    
 C   0.6642000      -2.677400     -0.6971000    
 C   -2.331700       1.041900      -1.459700    
 C   -1.987200       1.141800      0.9296000    
 C   -3.206000     -3.1399999E-02  -1.288800    
 C   -2.861500      6.8300001E-02   1.100400    
 C   -3.470800     -0.5182000     -8.8000000E-03
 C   -1.494500      -3.331100      0.8023000    
 H    3.341800      0.5524000       1.552200    
 H    4.320600      0.2687000      0.1286000    
 H    2.904200       1.802000      -1.219700    
 H    3.549800       2.621200      0.1952000    
 H   -1.077900       3.360800      -1.414400    
 H  -0.8604000       3.457300      0.3234000    
 H   0.9054000       2.204300      -1.664400    
 H    1.084400     -0.3759000       1.766200    
 H    3.481400      -1.092600      -1.740200    
 H    1.959400      -2.923300      -2.401500    
 H   4.0100001E-02  -3.492400      -1.047300    
 H   -2.130000       1.411500      -2.461100    
 H   -1.519900       1.590500       1.801200    
 H   -3.679500     -0.4893000      -2.152400    
 H   -3.067400     -0.3113000       2.096900    
 H   -4.151400      -1.354000      0.1242000    
 H  -0.9571000      -4.285600      0.8053000    
 H   -1.946300      -3.118500     -0.1721000    
 H   -2.313400      -3.422600       1.523200    


%chk=000064875-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064875

0 1
O -0.305725 -2.407460 1.535918
O 1.408682 2.495552 1.409598
N 0.372028 2.361910 -0.670739
C 3.422302 0.579680 0.323398
C 2.757096 1.727664 -0.492232
C 2.698519 -0.749961 0.161855
C 1.463313 2.219440 0.169618
C -0.932114 2.861691 -0.197546
C 1.544748 -1.037408 0.925554
C 3.149156 -1.706214 -0.789249
C -2.079891 1.890818 -0.454410
C 0.840937 -2.251556 0.734125
C 2.451906 -2.919173 -0.965111
C 1.290787 -3.206657 -0.210233
C -3.243489 2.320781 -1.138795
C -2.013395 0.552782 0.013570
C -4.325824 1.435062 -1.350622
C -3.092061 -0.332340 -0.197607
C -4.252841 0.104445 -0.879825
C -1.040745 -3.669227 1.428943
H 3.434099 0.895472 1.382628
H 4.472045 0.477028 -0.008156
H 2.584645 1.406311 -1.537034
H 3.451756 2.590195 -0.519113
H -1.153592 3.837919 -0.671638
H -0.796612 3.039415 0.886149
H 0.451205 2.061436 -1.643801
H 1.183993 -0.329669 1.680233
H 4.049020 -1.499676 -1.380594
H 2.811068 -3.655362 -1.693454
H 0.763007 -4.152853 -0.361320
H -3.305523 3.353695 -1.504933
H -1.122447 0.202151 0.545527
H -5.220092 1.782019 -1.880751
H -3.026189 -1.359727 0.177835
H -5.090444 -0.583584 -1.041625
H -0.401152 -4.531635 1.700270
H -1.445922 -3.817944 0.408331
H -1.868158 -3.581622 2.148635


