%chk=000119276.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119276

0 1
 O    3.622900       1.813200     -0.6284000    
 O    3.265200      -1.508500      0.5415000    
 N    2.885800      0.6763000     -0.1953000    
 C   -1.534300      -1.686300     -0.3775000    
 C  -0.5732000     -0.5274000     -0.2151000    
 C   -1.279000      0.6661000      5.7000000E-02
 C   -2.872400      -1.009900     -0.1656000    
 C   -2.694900      0.3690000      8.7399997E-02
 C   0.8077000     -0.5466000     -0.3036000    
 C  -0.5995000       1.858300      0.2438000    
 C    1.492500      0.6553000     -0.1151000    
 C   -4.131600      -1.583000     -0.1969000    
 C   -3.787800       1.189300      0.3126000    
 C   0.7960000       1.845700      0.1562000    
 C   -5.233000     -0.7559000      2.9999999E-02
 C   -5.063000      0.6164000      0.2822000    
 C    3.692000     -0.4242000      0.1445000    
 C    5.197100     -0.2077000     -9.3000000E-03
 C    6.009700      -1.440200      0.3516000    
 H   -1.358200      -2.445900      0.3896000    
 H   -1.467800      -2.106600      -1.385200    
 H    1.288300      -1.478800     -0.5732000    
 H   -1.123200       2.784600      0.4549000    
 H   -4.264400      -2.641400     -0.3911000    
 H   -3.672400       2.250000      0.5088000    
 H    1.334100       2.778900      0.3075000    
 H   -6.235000      -1.176300      1.1900000E-02
 H   -5.936200       1.239900      0.4561000    
 H    5.499000      0.6232000      0.6379000    
 H    5.408400      6.4400002E-02  -1.049400    
 H    5.741700      -2.288800     -0.2865000    
 H    7.078500      -1.241800      0.2254000    
 H    5.837400      -1.734100       1.392300    
 H    3.541100       1.709400      -1.592200    


%chk=000119276-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000119276

0 1
O 3.553300 1.849386 -0.243376
O 3.427345 -1.708603 0.250176
N 2.941598 0.530876 -0.152778
C -1.642213 -1.753766 -0.229619
C -0.633282 -0.614650 -0.132844
C -1.317681 0.627719 0.031583
C -2.981690 -1.033727 -0.112832
C -2.768958 0.371612 0.042417
C 0.765509 -0.684178 -0.186537
C -0.575091 1.821143 0.155679
C 1.506906 0.528418 -0.065556
C -4.284935 -1.559259 -0.139579
C -3.866215 1.252525 0.172095
C 0.833465 1.770791 0.110015
C -5.385835 -0.674591 -0.009514
C -5.175736 0.718778 0.145022
C 3.847628 -0.531727 0.049613
C 5.331485 -0.161930 -0.003273
C 6.230146 -1.394926 0.196187
H -1.498853 -2.496051 0.579978
H -1.550079 -2.308281 -1.183967
H 1.292454 -1.632797 -0.294760
H -1.074998 2.785646 0.297492
H -4.454470 -2.635824 -0.258039
H -3.712244 2.331089 0.291539
H 1.420816 2.682787 0.239754
H -6.407741 -1.069769 -0.027709
H -6.038243 1.387539 0.244374
H 5.533314 0.608404 0.764606
H 5.550082 0.330114 -0.971352
H 6.053881 -2.148971 -0.589643
H 7.293697 -1.097707 0.168645
H 6.025395 -1.880591 1.165126
H 3.432743 2.127120 -1.196123


