%chk=000037923.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037923

0 1
 O  -0.3120000      0.3619000     -0.1456000    
 O    4.429700      0.2378000     -0.5078000    
 O  -0.4797000      -3.646200      0.5427000    
 N    3.077000       2.460300      0.2035000    
 C    2.039600      0.2978000     -0.3243000    
 C   0.8382000     -0.3794000     -0.1132000    
 C   0.8423000      -1.751200      0.1170000    
 C   -1.670400      -1.599200      0.2992000    
 C    2.044300       1.772900     -0.5710000    
 C   -1.521000     -0.2812000      5.6600001E-02
 C  -0.4385000      -2.439400      0.3384000    
 C    3.244800     -0.4038000     -0.3038000    
 C   -2.960900      -2.324500      0.5506000    
 C    2.047600      -2.458200      0.1376000    
 C    3.248500      -1.779700     -7.3500000E-02
 C   -2.657400      0.6481000     -1.7400000E-02
 C   -3.576100      -2.833500     -0.7377000    
 C    2.864300       2.253500       1.635600    
 C    3.086300       3.888500     -0.1108000    
 C   -3.104000       1.297200       1.134000    
 C   -3.289800      0.8817000      -1.238800    
 C   -4.182500       2.179000       1.064100    
 C   -4.368200       1.763500      -1.308600    
 C    5.612200     -0.5583000     -0.4695000    
 C   -4.814500       2.412200     -0.1572000    
 H    2.227300       1.919400      -1.644000    
 H    1.069000       2.228300     -0.3602000    
 H   -2.810700      -3.159100       1.245400    
 H   -3.680800      -1.667600       1.052600    
 H    2.070200      -3.529700      0.3159000    
 H    4.145200      -2.389100     -4.3699998E-02
 H   -4.510600      -3.362700     -0.5239000    
 H   -2.906800      -3.533500      -1.249300    
 H   -3.807700      -2.019700      -1.431000    
 H    2.987500       1.210100       1.941300    
 H    1.873300       2.593900       1.959200    
 H    3.611700       2.813100       2.211100    
 H    3.893300       4.395900      0.4294000    
 H    2.139300       4.377200      0.1462000    
 H    3.277700       4.046600      -1.178000    
 H   -2.621100       1.126100       2.093000    
 H   -2.951700      0.3860000      -2.145600    
 H   -4.530100       2.684200       1.960500    
 H   -4.860100       1.945700      -2.259700    
 H    5.623400      -1.304600      -1.271200    
 H    5.767800      -1.003400      0.5191000    
 H    6.457800      0.1137000     -0.6506000    
 H   -5.654100       3.098800     -0.2118000    


%chk=000037923-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037923

0 1
O -0.236980 0.309928 -0.169237
O 4.510961 0.190762 -0.670848
O -0.507548 -3.803871 0.378675
N 2.670186 2.444891 0.711754
C 2.151956 0.251571 -0.368513
C 0.941451 -0.456629 -0.181420
C 0.875726 -1.866161 -0.019172
C -1.627335 -1.674467 0.184279
C 2.209712 1.761053 -0.528625
C -1.499389 -0.307948 -0.008413
C -0.422470 -2.540077 0.189183
C 3.340742 -0.528034 -0.419759
C -2.944687 -2.378363 0.452935
C 2.089833 -2.594344 -0.049303
C 3.313915 -1.943791 -0.250769
C -2.561361 0.728936 -0.043852
C -3.465086 -3.185416 -0.767202
C 1.694607 2.389623 1.812624
C 3.145817 3.814511 0.444821
C -2.307751 2.010621 0.520624
C -3.821478 0.491607 -0.657837
C -3.297282 3.014341 0.497369
C -4.808314 1.499730 -0.682507
C 5.781839 -0.539653 -0.699479
C -4.554467 2.762935 -0.100622
H 2.947862 1.995771 -1.315884
H 1.215001 2.138347 -0.864987
H -2.763445 -3.100537 1.271197
H -3.709672 -1.662558 0.799546
H 2.031319 -3.679059 0.085495
H 4.238277 -2.526536 -0.283004
H -4.417774 -3.687648 -0.518260
H -2.730321 -3.959071 -1.045291
H -3.636823 -2.540433 -1.649306
H 1.427594 1.341279 2.029016
H 0.747465 2.951184 1.594621
H 2.143276 2.822889 2.724845
H 3.554591 4.250263 1.374509
H 2.345937 4.503574 0.067541
H 3.956296 3.786815 -0.305053
H -1.334314 2.207715 0.979286
H -4.019870 -0.467451 -1.143892
H -3.088700 3.992246 0.945204
H -5.771283 1.301182 -1.165549
H 5.797891 -1.291609 -1.511818
H 5.981615 -1.031385 0.271247
H 6.544875 0.228965 -0.889506
H -5.322792 3.543702 -0.119862


