%chk=000116883.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116883

0 1
 O   -2.930200      -3.727700      -1.332900    
 O   -3.025400       4.101400      -1.507900    
 O   -1.723900       4.300700      0.3576000    
 N   -1.889800      0.1145000      0.8668000    
 N   -1.529200      -2.033400      0.4315000    
 C   -1.123600     -0.7832000      0.2646000    
 C   -2.986200     -0.5679000       1.568500    
 C   -2.733000      -2.051100       1.274100    
 C   6.1500002E-02 -0.4228000     -0.5288000    
 C    1.337100     -0.4643000      0.3099000    
 C   -1.738400       1.563800      0.8687000    
 C  -0.9300000      -3.247900     -0.1062000    
 C    2.610600     -3.8800001E-02 -0.4298000    
 C    3.870900     -0.1144000      0.4345000    
 C   -2.454000       2.142100     -0.3386000    
 C   -1.529900      -3.525200      -1.469800    
 C    5.113900      0.2898000     -0.3617000    
 C    6.378500      0.1836000      0.4903000    
 C   -2.390700       3.665100     -0.5040000    
 C    7.611800      0.6156000     -0.2867000    
 H   -3.948600     -0.2351000       1.168700    
 H   -2.932900     -0.3533000       2.639900    
 H   -3.576500      -2.497900      0.7429000    
 H   -2.533400      -2.613700       2.191100    
 H   0.1708000      -1.095100      -1.386300    
 H  -4.8200000E-02  0.5735000     -0.9684000    
 H    1.479600      -1.475600      0.7090000    
 H    1.208700      0.1848000       1.185700    
 H   -2.166700       1.962200       1.795900    
 H  -0.6764000       1.830000      0.8735000    
 H   0.1563000      -3.146700     -0.1679000    
 H   -1.149300      -4.071600      0.5824000    
 H    2.483700      0.9867000     -0.7982000    
 H    2.737300     -0.6792000      -1.311500    
 H    3.758600      0.5425000       1.305400    
 H    3.992600      -1.136400      0.8132000    
 H   -3.514500       1.862000     -0.2955000    
 H   -2.056700       1.696100      -1.258200    
 H   -1.371200      -2.689400      -2.157200    
 H   -1.089100      -4.428800      -1.901700    
 H    4.998100       1.318700     -0.7235000    
 H    5.212400     -0.3539000      -1.244300    
 H    6.511200     -0.8492000      0.8328000    
 H    6.279500      0.8115000       1.383500    
 H    7.524600       1.656400     -0.6144000    
 H    8.504300      0.5308000      0.3412000    
 H    7.757800     -1.2400000E-02  -1.171400    
 H   -3.280800      -3.906700      -2.222000    


%chk=000116883-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116883

0 1
O -3.578879 -2.413061 -1.753051
O -3.715744 0.093270 -1.102326
O -1.732964 0.875699 -2.050256
N -1.567227 -0.019532 1.144423
N -1.581903 -2.125270 0.356912
C -0.953160 -0.928152 0.332966
C -2.810050 -0.607903 1.743222
C -2.800563 -2.075136 1.226194
C 0.314470 -0.649401 -0.426047
C 1.532769 -0.412387 0.512063
C -1.477054 1.449905 0.945197
C -1.474153 -3.180576 -0.676797
C 2.821130 -0.128031 -0.291467
C 4.041898 0.149685 0.614329
C -2.582481 1.956829 -0.037516
C -2.193892 -2.742264 -1.992192
C 5.336435 0.437574 -0.179390
C 6.553616 0.730537 0.727482
C -2.700664 0.925368 -1.196520
C 7.843229 1.020371 -0.070429
H -3.687807 -0.066274 1.355681
H -2.763296 -0.539563 2.843553
H -3.677369 -2.312842 0.601862
H -2.698149 -2.813770 2.040819
H 0.529426 -1.498736 -1.095526
H 0.129562 0.219483 -1.087078
H 1.685278 -1.299109 1.159878
H 1.328180 0.438943 1.191099
H -1.559101 1.945058 1.929696
H -0.482549 1.677881 0.530714
H -0.413306 -3.427846 -0.867009
H -1.964391 -4.081316 -0.268673
H 2.651507 0.740761 -0.959960
H 3.042495 -0.990678 -0.953422
H 3.819328 1.013968 1.274645
H 4.209472 -0.719168 1.284938
H -2.265300 2.941226 -0.425086
H -3.553381 2.070105 0.473486
H -1.650135 -1.883716 -2.441640
H -2.147106 -3.599292 -2.693600
H 5.168598 1.301553 -0.855799
H 5.568308 -0.428483 -0.833874
H 6.721726 -0.133629 1.402554
H 6.319702 1.595076 1.381942
H 7.715096 1.903100 -0.724909
H 8.698918 1.219218 0.600646
H 8.111582 0.162197 -0.715126
H -3.680899 -1.381574 -1.631806


