%chk=000178001.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178001

0 1
 O    7.041900     -0.8608000      9.2399999E-02
 O    5.967600       1.835900     -0.6737000    
 N    4.378000      0.2005000     -0.2176000    
 C   -1.877100     -0.2867000      0.4474000    
 C   -3.168100      4.7600001E-02 -0.3057000    
 C  -0.6099000      0.1287000     -0.3033000    
 C   -4.437300     -0.3008000      0.4767000    
 C   0.6485000     -0.2567000      0.4790000    
 C   -5.691900      0.1209000     -0.2931000    
 C    1.917700      0.1317000     -0.2852000    
 C   -6.995900     -0.2229000      0.4326000    
 C    3.190400     -0.1844000      0.4934000    
 C   -8.250300      0.1314000     -0.3692000    
 C   -9.518400     -0.2990000      0.3695000    
 C    4.960600     -0.8193000      -1.101200    
 C    4.949100       1.477200     -7.6600000E-02
 C    5.974300      -1.678800     -0.3683000    
 C   -10.76760      1.5300000E-02 -0.4381000    
 C    4.265600       2.443400      0.8583000    
 C    8.022500      -1.623200      0.7826000    
 H   -1.893400      0.2106000       1.425200    
 H   -1.848700      -1.366000      0.6420000    
 H   -3.173500     -0.4852000      -1.264600    
 H   -3.173500       1.119600     -0.5394000    
 H  -0.6229000       1.211800     -0.4742000    
 H  -0.5942000     -0.3547000      -1.287500    
 H   -4.420800      0.2027000       1.450700    
 H   -4.464800      -1.379800      0.6693000    
 H   0.6399000      0.2440000       1.454700    
 H   0.6527000      -1.336900      0.6682000    
 H   -5.660500       1.201700     -0.4784000    
 H   -5.690700     -0.3685000      -1.275100    
 H    1.879500       1.198400     -0.5333000    
 H    1.935000     -0.4000000      -1.245000    
 H   -7.003700      -1.297300      0.6554000    
 H   -7.020100      0.3001000       1.396700    
 H    3.238300      -1.259200      0.7075000    
 H    3.153600      0.3072000       1.470000    
 H   -8.210000     -0.3633000      -1.347200    
 H   -8.275300       1.212000     -0.5538000    
 H   -9.485100      -1.375900      0.5719000    
 H   -9.576200      0.2117000       1.337800    
 H    4.159700      -1.431200      -1.529100    
 H    5.462000     -0.2968000      -1.924100    
 H    6.367300      -2.439800      -1.052200    
 H    5.505600      -2.182000      0.4853000    
 H   -10.84840       1.089400     -0.6332000    
 H   -10.75580     -0.5088000      -1.399100    
 H   -11.66190     -0.2990000      0.1092000    
 H    4.364000       2.099600       1.891300    
 H    4.752800       3.420900      0.7816000    
 H    3.215000       2.577600      0.5979000    
 H    8.816000     -0.9465000       1.110800    
 H    8.458700      -2.377300      0.1204000    
 H    7.585600      -2.102300       1.664100    


%chk=000178001-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178001

0 1
O 5.746973 -1.800462 0.633276
O 6.402292 2.306726 -0.938983
N 4.739826 0.843104 -0.225350
C -1.606975 -0.042987 0.456155
C -2.914269 0.062011 -0.360964
C -0.341793 0.303112 -0.360870
C -4.175763 -0.290937 0.458986
C 0.956855 0.243227 0.474793
C -5.490200 -0.144725 -0.340113
C 2.223871 0.581653 -0.341811
C -6.748638 -0.502660 0.482626
C 3.505925 0.547773 0.526954
C -8.067712 -0.327933 -0.303050
C -9.324084 -0.689229 0.522171
C 5.298887 -0.186525 -1.134312
C 5.384258 2.079613 -0.207881
C 5.105715 -1.631066 -0.671259
C -10.639118 -0.499533 -0.264345
C 4.837460 3.160023 0.728344
C 5.698936 -3.185845 1.096934
H -1.671084 0.633857 1.333988
H -1.510637 -1.071052 0.864178
H -2.851692 -0.607266 -1.244539
H -3.013981 1.093354 -0.759639
H -0.451256 1.319499 -0.793207
H -0.258046 -0.392633 -1.221719
H -4.220980 0.360367 1.357198
H -4.089095 -1.331834 0.835479
H 0.871273 0.946417 1.329935
H 1.061630 -0.770049 0.916995
H -5.579226 0.898514 -0.709467
H -5.446396 -0.790141 -1.242478
H 2.120294 1.586693 -0.798397
H 2.324046 -0.135286 -1.181989
H -6.668939 -1.552131 0.836355
H -6.780479 0.129895 1.394754
H 3.614323 -0.443115 1.006722
H 3.405402 1.274762 1.349798
H -8.038461 -0.956972 -1.217601
H -8.150485 0.722730 -0.652458
H -9.244380 -1.741440 0.864389
H -9.347688 -0.065831 1.439553
H 4.856653 -0.089555 -2.149127
H 6.374103 0.036063 -1.236746
H 5.580759 -2.294626 -1.428610
H 4.029636 -1.914569 -0.607922
H -10.757181 0.551176 -0.590593
H -10.654675 -1.134327 -1.170589
H -11.520727 -0.764087 0.348279
H 4.937607 2.867718 1.789913
H 5.433197 4.068623 0.557486
H 3.774036 3.388871 0.533107
H 6.196786 -3.200309 2.078919
H 6.236417 -3.866139 0.402053
H 4.652701 -3.545718 1.208376


