%chk=000147817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147817

0 1
 O   -5.715200      -3.337800      5.5300001E-02
 O    8.442600      -2.428800      -1.493400    
 O    8.359500      -1.634500      0.6346000    
 N   -3.706900       1.769700     -0.5838000    
 N    2.473400       1.340100      0.6918000    
 C   -2.553500       1.703600      0.3109000    
 C   -2.218700      0.2155000      0.3605000    
 C   -1.407700       2.606500     -0.1073000    
 C  -0.9588000     -0.2520000      0.4417000    
 C   -3.492000     -0.4581000      9.0700001E-02
 C  -0.1266000       2.169700      4.1000000E-03
 C   0.1145000      0.7599000      0.4590000    
 C   -4.329300      0.5157000     -0.4755000    
 C    1.393000      0.4598000      0.7903000    
 C   -1.822400       4.005600     -0.4965000    
 C    1.037000       3.025600     -0.2606000    
 C  -0.5629000      -1.700800      0.3507000    
 C   -3.950400      -1.748800      0.2963000    
 C   -5.598100      0.1922000     -0.9304000    
 C    3.821500      0.9145000       1.053200    
 C    2.250300       2.582800      0.1077000    
 C    4.467000      0.1129000     -7.5199999E-02
 C   -5.241700      -2.073300     -0.1295000    
 C   -6.055300      -1.113500     -0.7485000    
 C    5.866600     -0.4007000      0.2858000    
 C    6.504600      -1.196400     -0.8498000    
 C    7.851700      -1.759800     -0.4723000    
 C   -4.842400      -4.269800      0.6903000    
 H   -2.879500       2.020500       1.313400    
 H   -4.262700       2.607000     -0.6984000    
 H    1.691700     -0.5225000       1.139900    
 H   -1.005700       4.729600     -0.4921000    
 H   -2.569600       4.386300      0.2090000    
 H   -2.262800       4.003700      -1.498800    
 H   0.9374000       3.996600     -0.7269000    
 H  -0.3187000      -2.093300       1.343200    
 H   0.3079000      -1.834300     -0.3017000    
 H   -1.339000      -2.330100     -8.6900003E-02
 H   -3.294500      -2.449700      0.7949000    
 H    4.446600       1.783300       1.296900    
 H    3.784600      0.3070000       1.966800    
 H   -6.232700      0.9349000      -1.402700    
 H    3.142200       3.179900     -4.5600001E-02
 H    3.830500     -0.7421000     -0.3355000    
 H    4.531200      0.7364000     -0.9760000    
 H   -7.053600      -1.382200      -1.084500    
 H    6.511600      0.4477000      0.5469000    
 H    5.798200      -1.028900       1.182900    
 H    5.855600      -2.034900      -1.125400    
 H    6.637600     -0.5487000      -1.723400    
 H   -3.941200      -4.449700      9.4200000E-02
 H   -5.378100      -5.222800      0.7525000    
 H   -4.609100      -3.968400       1.717200    
 H    9.316500      -2.792500      -1.235700    


%chk=000147817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147817

0 1
O -5.822419 -3.388039 -0.015449
O 8.603550 -2.281386 -1.690475
O 8.620950 -1.560428 0.516774
N -3.816837 1.834296 -0.562908
N 2.511183 1.287382 0.799001
C -2.575079 1.804485 0.276574
C -2.271301 0.304611 0.366442
C -1.410301 2.642142 -0.211798
C -0.986402 -0.166952 0.562058
C -3.537408 -0.388805 0.093751
C -0.128603 2.178603 0.020963
C 0.118567 0.800039 0.545017
C -4.437186 0.576151 -0.472875
C 1.406400 0.435770 0.916372
C -1.766381 4.004262 -0.763386
C 1.086274 2.970429 -0.201555
C -0.701116 -1.656725 0.679292
C -3.966137 -1.731577 0.263420
C -5.736559 0.206273 -0.888968
C 3.867266 0.795481 1.110182
C 2.328853 2.536733 0.190229
C 4.549664 0.084736 -0.084256
C -5.273319 -2.090675 -0.144900
C -6.147240 -1.131845 -0.720732
C 5.958676 -0.429062 0.279365
C 6.637057 -1.133739 -0.910317
C 8.023430 -1.651232 -0.577532
C -4.967508 -4.417617 0.567813
H -2.871071 2.165065 1.300770
H -4.383997 2.683430 -0.572442
H 1.629800 -0.546671 1.338717
H -0.885173 4.619956 -1.005125
H -2.383350 4.584165 -0.042137
H -2.366011 3.907461 -1.690232
H 1.015993 3.960549 -0.658257
H -0.883659 -2.040002 1.703099
H 0.340507 -1.899372 0.409690
H -1.351296 -2.225866 -0.008162
H -3.313217 -2.463845 0.741981
H 4.485765 1.653162 1.437082
H 3.799630 0.100495 1.968905
H -6.419217 0.939134 -1.332483
H 3.231265 3.141069 0.062835
H 3.909790 -0.757493 -0.414995
H 4.609260 0.790096 -0.937009
H -7.149145 -1.456863 -1.017934
H 6.595845 0.410628 0.618315
H 5.900098 -1.130874 1.133715
H 6.031370 -1.990140 -1.266090
H 6.728226 -0.453968 -1.780026
H -4.049467 -4.573322 -0.034242
H -5.572965 -5.336544 0.560492
H -4.683443 -4.169776 1.610592
H 9.510590 -2.611181 -1.444859


