%chk=000158790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158790

0 1
 O  -0.2760000       1.654000     -0.2754000    
 O   -5.401800     -0.3604000     -5.4400001E-02
 N    3.766500       2.741300      6.8599999E-02
 C    2.211000      0.2858000      0.4641000    
 C    2.013200       1.191600     -0.7796000    
 C    3.624300      0.4828000       1.044300    
 C    2.401800       2.644700     -0.4493000    
 C    3.925600       1.958400       1.292100    
 C   0.5692000       1.154300      -1.292500    
 C    1.946900      -1.187200      0.1994000    
 C    2.269000      -1.736500      -1.038800    
 C    1.384700      -1.979900       1.196400    
 C    2.026800      -3.088500      -1.281900    
 C    1.142700      -3.332000      0.9533000    
 C   -1.553700       1.151500     -0.2205000    
 C    1.463900      -3.886200     -0.2859000    
 C   -2.206700       1.074800       1.002300    
 C   -2.173600      0.7277000      -1.388400    
 C   -3.503600      0.5645000       1.058500    
 C   -3.470700      0.2175000      -1.332100    
 C   -4.135500      0.1359000     -0.1086000    
 C   -6.023900     -0.4140000       1.228400    
 H    1.497900      0.6169000       1.233300    
 H    2.674500      0.8763000      -1.595500    
 H    4.374800      6.7800000E-02  0.3577000    
 H    3.727100     -6.9700003E-02   1.986600    
 H    2.336000       3.252700      -1.359300    
 H    1.710100       3.089300      0.2768000    
 H    3.277300       2.353100       2.083900    
 H    4.958000       2.058600       1.644500    
 H   0.3144000      0.1300000      -1.585800    
 H   0.4756000       1.795200      -2.177800    
 H    3.982300       3.718300      0.2650000    
 H    2.733600      -1.162900      -1.832400    
 H    1.131400      -1.560200       2.166000    
 H    2.282400      -3.522100      -2.244300    
 H   0.7048000      -3.953400       1.728900    
 H    1.276800      -4.939300     -0.4746000    
 H   -1.715700       1.407100       1.912500    
 H   -1.702600      0.8031000      -2.363500    
 H   -3.961400      0.5292000       2.041200    
 H   -3.961000     -0.1086000      -2.245400    
 H   -6.155300      0.5866000       1.654000    
 H   -5.489000      -1.086800       1.907300    
 H   -7.024800     -0.8343000       1.085000    


%chk=000158790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000158790

0 1
O -0.344071 1.017192 0.152632
O -5.912615 0.116651 -0.060271
N 3.537672 2.874862 -0.005598
C 2.482555 0.181430 0.466321
C 1.942055 1.099757 -0.680348
C 3.936775 0.594531 0.832562
C 2.116726 2.592600 -0.307801
C 4.027744 2.098922 1.155519
C 0.485902 0.782924 -1.045400
C 2.379885 -1.302429 0.114390
C 3.165842 -1.867936 -0.925805
C 1.480118 -2.150066 0.810209
C 3.058685 -3.237018 -1.255477
C 1.369902 -3.521740 0.485509
C -1.726161 0.776980 0.047201
C 2.159998 -4.071459 -0.549748
C -2.484802 1.032522 1.212359
C -2.376291 0.309603 -1.124737
C -3.880093 0.826321 1.221151
C -3.770283 0.103391 -1.116752
C -4.528542 0.358571 0.049458
C -6.729987 0.365150 1.126294
H 1.841723 0.369866 1.351144
H 2.550390 0.911399 -1.589817
H 4.615364 0.379461 -0.014619
H 4.282309 -0.002031 1.698485
H 1.803833 3.223945 -1.161343
H 1.437304 2.820346 0.549229
H 3.437770 2.304308 2.086436
H 5.078014 2.380676 1.355926
H 0.385284 -0.274075 -1.363624
H 0.136662 1.443851 -1.867293
H 3.719581 3.882140 0.090994
H 3.868713 -1.234932 -1.481112
H 0.856056 -1.725623 1.606259
H 3.675122 -3.654545 -2.060190
H 0.666969 -4.157620 1.035841
H 2.076851 -5.134117 -0.804439
H -1.967462 1.394770 2.106363
H -1.814345 0.100760 -2.039209
H -4.442130 1.032881 2.136738
H -4.288844 -0.257852 -2.010115
H -6.681945 1.427850 1.437145
H -6.422499 -0.280099 1.973298
H -7.758434 0.114882 0.826332


