%chk=000032481.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032481

0 1
 O  -0.6289000       2.493200     -0.5883000    
 N   0.2071000     -0.3359000     -0.4855000    
 N   -3.501100     -0.3894000     -3.2099999E-02
 C    2.244600      0.3699000      5.4200001E-02
 C   0.9610000      0.7814000     -0.2488000    
 C    1.577400       3.197100      8.7800004E-02
 C    3.338100       1.332400      0.3641000    
 C    3.011100       2.713900     -0.2273000    
 C    2.266300      -1.053000      1.0100000E-02
 C   0.5181000       2.155900     -0.3039000    
 C   0.9762000      -1.468400     -0.3313000    
 C   -1.195300     -0.3469000     -0.8495000    
 C   -2.102000     -0.4060000      0.3765000    
 C    1.401300       3.567100       1.558300    
 C    3.257100      -2.032000      0.2269000    
 C   0.6291000      -2.817500     -0.4673000    
 C    2.923500      -3.384600      9.3999997E-02
 C    1.628900      -3.769100     -0.2478000    
 C   -3.806300      0.8328000     -0.7782000    
 C   -4.380400     -0.5054000       1.132900    
 C   -5.244500      0.8326000      -1.267700    
 C   -4.081200      -1.768000       1.923000    
 H    1.389000       4.090600     -0.5214000    
 H    3.458900       1.406300       1.451000    
 H    4.289500      0.9776000     -4.7699999E-02
 H    3.746500       3.447600      0.1232000    
 H    3.120400       2.657100      -1.319300    
 H   -1.340000      0.5124000      -1.502700    
 H   -1.369600      -1.218800      -1.492200    
 H   -1.847900      -1.331600      0.9036000    
 H   -1.876300      0.4237000       1.059800    
 H    1.514500       2.698100       2.214800    
 H    2.132300       4.323800       1.860600    
 H   0.4002000       3.975800       1.734900    
 H    4.270900      -1.747800      0.4942000    
 H  -0.3757000      -3.132100     -0.7272000    
 H    3.684300      -4.142700      0.2604000    
 H   -3.613800       1.735900     -0.1856000    
 H   -3.216400      0.9055000      -1.694300    
 H   -4.304100      0.3681000       1.792700    
 H   -5.425600     -0.5938000      0.8192000    
 H    1.391000      -4.825400     -0.3441000    
 H   -5.960400       1.029400     -0.4638000    
 H   -5.507700     -0.1119000      -1.756400    
 H   -5.381400       1.630500      -2.006600    
 H   -3.169500      -1.681900       2.522100    
 H   -4.002800      -2.647000       1.273800    
 H   -4.897400      -1.958600       2.629200    


%chk=000032481-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000032481

0 1
O -0.612083 2.509006 -0.800588
N 0.201015 -0.381940 -0.416094
N -3.550089 -0.205055 0.173488
C 2.325498 0.399448 0.045587
C 1.008941 0.775223 -0.308521
C 1.664448 3.224065 -0.241244
C 3.436960 1.401124 0.218125
C 3.095722 2.706154 -0.545799
C 2.333176 -1.030408 0.181719
C 0.578888 2.158846 -0.500724
C 0.991664 -1.488872 -0.107887
C -1.242590 -0.428078 -0.719409
C -2.120628 -0.279995 0.549567
C 1.509223 3.742510 1.217244
C 3.339783 -1.980144 0.513856
C 0.650587 -2.862971 -0.064633
C 3.000359 -3.342159 0.554829
C 1.667075 -3.776225 0.268259
C -3.978847 1.183794 -0.162021
C -4.461368 -0.891499 1.125067
C -5.138363 1.223873 -1.175183
C -4.386172 -2.427327 1.027194
H 1.430069 4.064423 -0.922818
H 3.591866 1.620689 1.295095
H 4.395497 0.986724 -0.148954
H 3.829942 3.495834 -0.294561
H 3.182467 2.512939 -1.633128
H -1.476182 0.390129 -1.416249
H -1.474213 -1.385770 -1.216479
H -1.954339 -1.152079 1.207978
H -1.786291 0.623193 1.111793
H 1.696099 2.942847 1.956908
H 2.223784 4.563753 1.409512
H 0.487176 4.126658 1.379962
H 4.361795 -1.653127 0.735858
H -0.365056 -3.210798 -0.279317
H 3.760639 -4.088400 0.809759
H -4.264429 1.746089 0.762649
H -3.108046 1.715525 -0.586798
H -4.271741 -0.570277 2.181190
H -5.492749 -0.575204 0.884369
H 1.434173 -4.846264 0.310451
H -6.042581 0.715588 -0.792343
H -4.840324 0.724642 -2.113717
H -5.413142 2.270838 -1.403064
H -3.375973 -2.805949 1.269961
H -4.636777 -2.754374 0.002895
H -5.095863 -2.896099 1.734513


