%chk=000128058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128058

0 1
 O   0.3622000       2.354200      0.5201000    
 O    4.113400     -0.5734000      0.2537000    
 N   -3.703400     -0.3108000     -4.6000000E-02
 C   -2.297900     -0.5929000      0.2600000    
 C   -1.395100      0.3657000     -0.5377000    
 C   8.0100000E-02  0.1279000     -0.3212000    
 C   -2.099200     -0.4639000       1.770400    
 C   0.8790000       1.135900      0.1961000    
 C   -4.573900      -1.258700      0.6461000    
 C   -3.929700     -0.3643000      -1.488600    
 C   0.6090000      -1.111400     -0.6492000    
 C    2.239900      0.8993000      0.3902000    
 C    1.969900      -1.347800     -0.4551000    
 C    2.785400     -0.3424000      6.4499997E-02
 C   0.3557000       3.348000     -0.5027000    
 C    4.604700      -1.865100     -0.1005000    
 H   -2.058700      -1.627600     -2.1199999E-02
 H   -1.678800       1.397900     -0.3019000    
 H   -1.529400      0.2552000      -1.620300    
 H   -2.582100      -1.272100       2.329100    
 H   -2.473900      0.4948000       2.147700    
 H   -1.039200     -0.5227000       2.039000    
 H   -5.613600      -1.131700      0.3198000    
 H   -4.295100      -2.302000      0.4572000    
 H   -4.602500      -1.082300       1.725700    
 H   -3.520200      -1.271100      -1.949000    
 H   -5.004500     -0.3446000      -1.709000    
 H   -3.536100      0.5202000      -1.999100    
 H  -9.8000001E-03  -1.899900      -1.067500    
 H    2.876400       1.681700      0.7960000    
 H    2.328400      -2.333300     -0.7321000    
 H  -0.1941000       4.217300     -0.1319000    
 H  -0.1380000       2.981900      -1.408600    
 H    1.380100       3.655300     -0.7354000    
 H    4.149300      -2.650800      0.5119000    
 H    5.678000      -1.873200      0.1160000    
 H    4.493500      -2.057800      -1.173000    


%chk=000128058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128058

0 1
O 0.103404 2.301272 0.116233
O 4.137934 -0.393264 0.012099
N -3.850771 -0.557810 -0.309300
C -2.424271 -0.545495 0.147103
C -1.539726 0.210735 -0.899176
C -0.047819 0.035614 -0.663917
C -2.256704 0.113160 1.531967
C 0.769745 1.091337 -0.153274
C -4.842373 -0.853326 0.748439
C -4.067449 -1.452516 -1.467756
C 0.593835 -1.188705 -0.947856
C 2.153718 0.915121 0.058477
C 1.978695 -1.399600 -0.745227
C 2.753933 -0.332794 -0.237257
C 0.901173 3.422475 0.614340
C 4.814461 -1.657404 -0.281025
H -2.042869 -1.600318 0.219389
H -1.816255 1.277236 -0.864439
H -1.779542 -0.157944 -1.913089
H -2.714655 -0.481993 2.340792
H -2.700521 1.125380 1.532291
H -1.181578 0.215564 1.756463
H -5.854883 -0.808235 0.307487
H -4.718069 -1.865816 1.213079
H -4.794373 -0.099185 1.549183
H -3.858461 -2.529060 -1.233280
H -5.117863 -1.374555 -1.801006
H -3.428856 -1.161273 -2.317800
H -0.010989 -2.009098 -1.354202
H 2.794724 1.710877 0.445937
H 2.423635 -2.368870 -0.985914
H 0.186899 4.249894 0.738514
H 1.686637 3.711173 -0.111041
H 1.369625 3.184226 1.589279
H 4.405294 -2.485480 0.330473
H 5.869043 -1.487852 -0.017727
H 4.735074 -1.917971 -1.354763


