%chk=000027235.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027235

0 1
 O   -2.738600      -1.258600     -0.8440000    
 O    7.723000      0.1338000      0.1324000    
 O   -2.813500       1.491800     -0.4508000    
 N   -7.471900       1.209500      0.7192000    
 C  -6.6600002E-02 -0.9459000      0.2135000    
 C    1.457600      -1.008300      0.1023000    
 C  -0.7041000      -2.293100     -0.1194000    
 C    2.091800      0.3512000      0.4037000    
 C   -2.218300      -2.250400      3.0300001E-02
 C    3.596200      0.2928000      0.3311000    
 C    4.230200      0.5479000     -0.8757000    
 C    4.322100     -1.4300000E-02   1.472200    
 C   -3.900100     -0.6415000     -0.4579000    
 C    5.622500      0.4947000     -0.9429000    
 C    5.714300     -6.7500003E-02   1.404900    
 C    6.364500      0.1869000      0.1973000    
 C   -3.931100      0.7352000     -0.2645000    
 C   -5.043300      -1.409600     -0.2648000    
 C   -5.119600       1.351500      0.1268000    
 C   -6.270000      0.5873000      0.3225000    
 C   -6.231800     -0.7933000      0.1267000    
 C    8.323700      0.4045000      -1.133100    
 C   -2.936900       2.895400     -0.2299000    
 H  -0.3483000     -0.6450000       1.229900    
 H  -0.4411000     -0.1736000     -0.4684000    
 H    1.843800      -1.764200      0.7979000    
 H    1.740200      -1.334300     -0.9068000    
 H  -0.4509000      -2.557700      -1.153300    
 H  -0.2974000      -3.075200      0.5318000    
 H    1.786900      0.6972000       1.399900    
 H    1.718300       1.106300     -0.3001000    
 H   -2.641900      -3.223800     -0.2411000    
 H   -2.478700      -2.035200       1.074800    
 H    3.659900      0.7866000      -1.769000    
 H    3.824900     -0.2159000       2.416800    
 H    6.062900      0.7023000      -1.912100    
 H    6.287000     -0.3084000       2.296300    
 H   -5.029800      -2.484300     -0.4224000    
 H   -5.209800       2.419900      0.2945000    
 H   -7.121900      -1.399500      0.2743000    
 H   -7.502300       2.210400      0.8608000    
 H   -8.305900      0.6551000      0.8600000    
 H    8.121600       1.429000      -1.463500    
 H    8.033200     -0.3385000      -1.883600    
 H    9.407300      0.3191000      -1.001500    
 H   -3.185400       3.119800      0.8130000    
 H   -3.637400       3.355400     -0.9352000    
 H   -1.954600       3.338900     -0.4240000    


%chk=000027235-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027235

0 1
O -2.641238 -0.576981 -0.264113
O 8.102799 -0.310946 -0.326536
O -3.431045 1.849923 -1.007176
N -8.065389 0.925376 0.414977
C 0.162200 -0.978727 0.657584
C 1.661041 -1.026984 0.290260
C -0.682612 -1.981801 -0.157990
C 2.515537 -0.032617 1.125222
C -2.180315 -1.910116 0.153397
C 3.989319 -0.056978 0.748596
C 4.522310 0.850313 -0.197640
C 4.871404 -1.024101 1.304388
C -4.001384 -0.278628 -0.061707
C 5.881222 0.807719 -0.589923
C 6.226362 -1.085232 0.930622
C 6.736132 -0.167585 -0.021729
C -4.428818 1.026436 -0.462862
C -4.954050 -1.156537 0.494934
C -5.774922 1.415434 -0.301658
C -6.731110 0.520424 0.262123
C -6.304585 -0.770478 0.658591
C 8.671579 0.613504 -1.307566
C -3.829293 3.187959 -1.439945
H 0.040219 -1.190060 1.741383
H -0.235317 0.039801 0.486706
H 2.054973 -2.053995 0.435824
H 1.787995 -0.794876 -0.786489
H -0.539675 -1.796748 -1.240370
H -0.337941 -3.017253 0.042636
H 2.392369 -0.279489 2.198982
H 2.103789 0.986204 0.984959
H -2.740602 -2.690410 -0.404692
H -2.367247 -2.048441 1.240872
H 3.866050 1.610729 -0.639491
H 4.489696 -1.736591 2.046429
H 6.253981 1.530155 -1.322584
H 6.907307 -1.825886 1.361630
H -4.654740 -2.160129 0.811007
H -6.098669 2.415044 -0.609742
H -7.021539 -1.475783 1.094445
H -8.367823 1.849995 0.126654
H -8.752661 0.296479 0.817313
H 8.599437 1.664225 -0.963443
H 8.174737 0.513752 -2.292886
H 9.729596 0.325250 -1.395762
H -4.215027 3.791036 -0.593744
H -4.594051 3.145153 -2.241081
H -2.909299 3.646864 -1.831505


