%chk=000065856.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065856

0 1
 O   -2.581700      0.1643000      0.8437000    
 O   7.9000004E-02  0.7812000      0.1203000    
 O    2.315400     -0.3754000       1.298300    
 N   -3.703500       2.595000     -0.1195000    
 C   -2.253600      0.6411000     -0.4668000    
 C  -0.8396000      0.1782000     -0.7896000    
 C   -2.355500       2.168400     -0.5028000    
 C   -4.044800       2.063700       1.201000    
 C   -3.908500      0.5463000       1.210300    
 C  -0.7007000      -1.324400     -0.7125000    
 C  -0.3435000      -1.911300      0.4904000    
 C  -0.9336000      -2.086000      -1.845900    
 C    1.332800       1.045000     -0.3596000    
 C  -0.2154000      -3.298400      0.5620000    
 C  -0.8056000      -3.473200      -1.774300    
 C    2.449800      0.4641000      0.2342000    
 C  -0.4465000      -4.079300     -0.5704000    
 C    1.478100       1.901100      -1.447600    
 C    3.722600      0.7415000     -0.2645000    
 C    2.750900       2.178400      -1.946200    
 C    3.873100       1.598600      -1.354700    
 C    2.963900      5.4000001E-03   2.510400    
 C    2.166900     -0.5240000       3.683500    
 H   -2.956700      0.1937000      -1.183300    
 H  -0.6209000      0.4889000      -1.819900    
 H   -1.641000       2.636200      0.1848000    
 H   -2.132500       2.542800      -1.507800    
 H   -5.068900       2.352300       1.458700    
 H   -3.379900       2.509000       1.950500    
 H   -4.098000      0.1613000       2.217300    
 H   -4.627000      6.9300003E-02  0.5328000    
 H   -4.370000       2.234200     -0.8027000    
 H  -0.1877000      -1.331200       1.394500    
 H   -1.215800      -1.624000      -2.787400    
 H   5.7700001E-02  -3.770800       1.501000    
 H  -0.9864000      -4.081500      -2.655700    
 H  -0.3484000      -5.159500     -0.5143000    
 H   0.6184000       2.380000      -1.907700    
 H    4.605500      0.2909000      0.1807000    
 H    2.868700       2.849500      -2.791900    
 H    4.864100       1.813900      -1.743500    
 H    3.972600     -0.4216000       2.522100    
 H    3.040700       1.096900       2.590500    
 H    2.644400     -0.2618000       4.631600    
 H    1.150900     -0.1153000       3.674100    
 H    2.071400      -1.613300       3.624700    


%chk=000065856-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065856

0 1
O -2.543635 -0.443044 0.807149
O 0.202114 0.268838 0.106392
O 1.905476 1.143223 1.917306
N -3.342588 2.353128 1.027698
C -2.170461 0.520347 -0.245031
C -0.854445 0.047394 -0.901663
C -2.082206 1.949827 0.353316
C -3.766417 1.341565 2.029206
C -3.831016 -0.081506 1.429947
C -0.911823 -1.395924 -1.389842
C -0.685143 -2.471018 -0.497084
C -1.233033 -1.669196 -2.741561
C 1.527413 0.403478 -0.333031
C -0.775775 -3.802429 -0.956707
C -1.334057 -3.002476 -3.200190
C 2.451483 0.874400 0.654708
C -1.102960 -4.073538 -2.306855
C 1.984732 0.119609 -1.637884
C 3.810834 1.047401 0.309655
C 3.349173 0.300354 -1.973315
C 4.258896 0.761637 -1.003402
C 2.823103 1.628158 2.965870
C 1.980115 1.832761 4.221816
H -2.957512 0.501274 -1.038729
H -0.671871 0.724691 -1.765926
H -1.262681 1.962100 1.092399
H -1.842727 2.684989 -0.438273
H -4.748769 1.629488 2.448712
H -3.027834 1.349472 2.852855
H -4.002789 -0.852123 2.201278
H -4.642726 -0.139777 0.667615
H -4.092360 2.546553 0.346176
H -0.444304 -2.249462 0.546535
H -1.401736 -0.839080 -3.441055
H -0.596247 -4.630986 -0.262170
H -1.581685 -3.204118 -4.248604
H -1.172918 -5.108810 -2.659792
H 1.294739 -0.274689 -2.388542
H 4.526399 1.408837 1.053865
H 3.689295 0.069085 -2.988138
H 5.315764 0.899786 -1.255123
H 3.623218 0.877522 3.134299
H 3.294254 2.578053 2.637044
H 2.613686 2.198257 5.050610
H 1.181853 2.571721 4.037053
H 1.508371 0.884427 4.530211


