%chk=000037015.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037015

0 1
 O   -1.963900       2.623300     -0.1701000    
 O   -2.630700      0.8726000       1.167800    
 N   -1.027700      -1.333200      0.6189000    
 N    3.448100     -0.2249000      6.2700003E-02
 N    3.413100      -1.567000      0.1506000    
 N    1.957100       1.679100      0.1045000    
 C  -5.5700000E-02 -0.3591000      0.4523000    
 C    1.314200     -0.6735000      0.3229000    
 C  -0.8395000      -2.721100      0.2714000    
 C   -2.182100      -3.438800      0.1624000    
 C    2.220900      0.3619000      0.1589000    
 C  -0.3773000       1.008300      0.4005000    
 C   -3.075300      -2.856000     -0.9358000    
 C    2.112600      -1.834400      0.3088000    
 C    4.715700      0.4435000     -0.1138000    
 C   0.6349000       1.947000      0.2314000    
 C   -4.376600      -3.632800      -1.063600    
 C   -1.755900       1.461700      0.5210000    
 C    5.070700      0.6253000      -1.579500    
 C   -3.285400       3.172000     -0.1270000    
 C   -3.317300       4.445900     -0.9443000    
 H  -0.3220000      -2.820500     -0.6900000    
 H  -0.2529000      -3.221800       1.048600    
 H   -1.997400      -4.500300     -4.2500000E-02
 H   -2.708200      -3.385700       1.124000    
 H   -1.836300      -1.088600       1.180200    
 H   -2.547200      -2.880900      -1.896100    
 H   -3.311000      -1.807400     -0.7220000    
 H    1.834800      -2.872000      0.4090000    
 H    4.662500       1.413900      0.3913000    
 H    5.483200     -0.1499000      0.3960000    
 H   0.4200000       3.012800      0.2026000    
 H   -4.185100      -4.680500      -1.316400    
 H   -4.999400      -3.201400      -1.853400    
 H   -4.944500      -3.602600     -0.1283000    
 H    5.136600     -0.3401000      -2.092200    
 H    6.036500       1.130700      -1.676700    
 H    4.316300       1.227300      -2.097000    
 H   -3.554700       3.390400      0.9122000    
 H   -3.994000       2.446500     -0.5416000    
 H   -4.315100       4.893200     -0.9328000    
 H   -2.598900       5.173200     -0.5520000    
 H   -3.031500       4.245000      -1.982100    


%chk=000037015-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037015

0 1
O -1.991373 2.901773 -0.093537
O -2.839750 0.741894 0.047292
N -1.094005 -1.265196 0.163734
N 3.495850 -0.094184 0.016373
N 3.456310 -1.491119 0.097755
N 1.948003 1.793965 -0.074384
C -0.105030 -0.328518 0.085048
C 1.299999 -0.640762 0.078751
C -0.901229 -2.720099 0.248966
C -2.258288 -3.447231 0.325673
C 2.226927 0.453628 -0.000807
C -0.426682 1.087740 0.002401
C -3.132470 -3.300930 -0.943478
C 2.134643 -1.812463 0.136880
C 4.778800 0.616191 -0.069557
C 0.623523 2.062230 -0.070047
C -4.442332 -4.111692 -0.846473
C -1.826967 1.519722 -0.009573
C 5.489687 0.378374 -1.415900
C -3.400527 3.396418 -0.111108
C -3.325784 4.916708 -0.209212
H -0.337702 -3.079273 -0.637614
H -0.296514 -2.965196 1.146160
H -2.056793 -4.522104 0.502752
H -2.820586 -3.083211 1.209723
H -2.054603 -0.873907 0.158997
H -2.549487 -3.637446 -1.824754
H -3.375343 -2.234652 -1.119678
H 1.863673 -2.862862 0.206253
H 4.544663 1.684850 0.072906
H 5.413864 0.276728 0.767940
H 0.341104 3.117006 -0.127643
H -4.234470 -5.189885 -0.710244
H -5.052787 -3.997648 -1.760384
H -5.054734 -3.776006 0.011549
H 5.676195 -0.698209 -1.568694
H 6.459060 0.908503 -1.427131
H 4.878728 0.753732 -2.255191
H -3.902275 3.054544 0.812158
H -3.920307 2.940182 -0.972960
H -4.346589 5.340440 -0.224364
H -2.785949 5.341516 0.654246
H -2.806851 5.227552 -1.132021


