%chk=000060399.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060399

0 1
 O  -0.2991000      -1.391200       1.893900    
 O   -5.004700     -0.9988000      -1.306100    
 O   -5.354100       1.554800     -0.2669000    
 N    1.962100      -1.081100      0.1399000    
 C    3.083700     -0.3296000     -0.4201000    
 C    3.176800       1.045000      0.2515000    
 C    4.383300      -1.121900     -0.2400000    
 C    4.385400       1.830800     -0.2541000    
 C    5.590200     -0.3334000     -0.7457000    
 C    5.680400       1.040600     -8.7800004E-02
 C   0.7103000     -0.3689000     -6.5700002E-02
 C  -0.4713000      -1.169800      0.4948000    
 C   -1.781700     -0.4419000      0.2889000    
 C   -2.795400      -1.063100     -0.4199000    
 C   -1.938100      0.8295000      0.8133000    
 C   -4.003400     -0.3918000     -0.6102000    
 C   -3.145900       1.500700      0.6230000    
 C   -4.178500      0.8900000     -8.8699996E-02
 H    2.922600     -0.1900000      -1.498100    
 H    3.244900      0.9372000       1.341900    
 H    2.308000       1.674300      3.5700001E-02
 H    4.324300      -2.075300     -0.7793000    
 H    4.533700      -1.365300      0.8203000    
 H    4.461900       2.780100      0.2882000    
 H    4.243600       2.078600      -1.313400    
 H    5.517600     -0.2134000      -1.833700    
 H    6.508200     -0.8979000     -0.5473000    
 H    6.514300       1.603400     -0.5221000    
 H    5.898300      0.9193000      0.9805000    
 H    1.912000      -2.000100     -0.2988000    
 H   0.7328000      0.5791000      0.4744000    
 H   0.5465000     -0.1621000      -1.130600    
 H  -0.5096000      -2.155600      1.4400000E-02
 H   -2.657600      -2.061700     -0.8256000    
 H   0.5639000      -1.822700       2.015300    
 H   -1.154900       1.316600       1.385900    
 H   -3.277800       2.497400       1.035200    
 H   -4.705200      -1.879500      -1.590000    
 H   -5.953200      0.9848000     -0.7796000    


%chk=000060399-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060399

0 1
O 0.094781 -0.743837 1.973116
O -4.956925 -0.794608 -1.600422
O -5.530950 1.473956 -0.249523
N 1.925835 -1.078314 0.029403
C 3.092702 -0.290744 -0.464453
C 3.241074 1.042013 0.310197
C 4.377284 -1.138591 -0.315241
C 4.480396 1.833432 -0.172438
C 5.628396 -0.362415 -0.789725
C 5.769981 0.987306 -0.046003
C 0.577112 -0.642128 -0.410228
C -0.458167 -1.095233 0.669583
C -1.812664 -0.436615 0.466382
C -2.730026 -0.987587 -0.465715
C -2.158052 0.748210 1.158064
C -3.958194 -0.344764 -0.699233
C -3.395719 1.388426 0.922438
C -4.300217 0.849032 -0.011348
H 2.971903 -0.045720 -1.549196
H 3.340174 0.803389 1.388337
H 2.328039 1.657786 0.199424
H 4.275416 -2.081557 -0.891979
H 4.490992 -1.418386 0.752277
H 4.576465 2.769503 0.410023
H 4.339415 2.130926 -1.232512
H 5.549755 -0.171878 -1.880019
H 6.533596 -0.981030 -0.637976
H 6.638008 1.549785 -0.440695
H 5.972716 0.792633 1.027289
H 2.066796 -2.085800 -0.137746
H 0.566636 0.461003 -0.454724
H 0.284406 -1.024580 -1.412838
H -0.575338 -2.202684 0.593846
H -2.487325 -1.920626 -0.993889
H 1.089996 -0.825288 1.821454
H -1.457023 1.139204 1.900331
H -3.678977 2.299001 1.458832
H -4.707345 -1.647599 -2.028614
H -6.030652 0.941482 -0.923080


