%chk=000063144.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063144

0 1
 O    1.513300       2.472200     -0.4995000    
 N   0.1985000      0.5418000     -0.1896000    
 N    1.295600      -1.549200      0.1755000    
 N   -3.438900      -3.069000     -4.4500001E-02
 C   -1.020500       1.308600     -0.1859000    
 C   0.2099000     -0.8541000      2.2500001E-02
 C    2.640200      0.4609000     -0.1878000    
 C    1.404600       1.259800     -0.3308000    
 C    2.532000     -0.9021000      8.8799998E-02
 C   -1.500600       1.864600      0.9938000    
 C   -1.057100      -1.624300     -6.9999998E-04
 C   -1.705900       1.481800      -1.382700    
 C    3.896700       1.069400     -0.2959000    
 C    3.700800      -1.654500      0.2564000    
 C   -2.682900       2.604600      0.9767000    
 C  -0.7777000       1.690700       2.290000    
 C   -2.888200       2.221600      -1.399800    
 C   -3.376700       2.783100     -0.2201000    
 C    5.052600      0.3084000     -0.1270000    
 C    4.955300      -1.052700      0.1503000    
 C   -1.738600      -1.864800       1.181800    
 C   -1.553100      -2.098100      -1.204800    
 C   -2.918100      -2.587900       1.106700    
 C   -2.741000      -2.810800      -1.173300    
 H   -1.332400       1.051200      -2.308000    
 H    3.995400       2.130600     -0.5066000    
 H    3.639900      -2.719600      0.4676000    
 H   -3.076300       3.050100       1.886600    
 H   0.1162000       2.322600       2.309000    
 H   -1.405600       1.976300       3.141300    
 H  -0.4814000      0.6520000       2.455800    
 H   -3.428000       2.361000      -2.331800    
 H   -4.297100       3.359600     -0.2337000    
 H    6.028600      0.7775000     -0.2098000    
 H    5.855000      -1.646500      0.2818000    
 H   -1.370500      -1.515400       2.139400    
 H   -1.039000      -1.923500      -2.143600    
 H   -3.492500      -2.807900       2.000500    
 H   -3.176200      -3.205200      -2.085500    


%chk=000063144-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000063144

0 1
O 1.424971 2.525573 0.351749
N 0.199423 0.529717 0.086350
N 1.303186 -1.586132 -0.291511
N -3.435995 -3.280725 -0.071859
C -1.029664 1.320817 0.019044
C 0.197225 -0.874998 -0.106655
C 2.656200 0.463684 0.008535
C 1.437744 1.274526 0.175451
C 2.545798 -0.938231 -0.252497
C -1.504838 2.020614 1.160572
C -1.087358 -1.642322 -0.090061
C -1.700212 1.387276 -1.222242
C 3.932776 1.080791 0.066185
C 3.726719 -1.705394 -0.457144
C -2.693195 2.778684 1.008674
C -0.781996 1.974887 2.490664
C -2.882118 2.146033 -1.347131
C -3.379203 2.845325 -0.224271
C 5.091153 0.312196 -0.135477
C 4.984485 -1.083704 -0.399573
C -2.143218 -1.399750 0.825225
C -1.228567 -2.736534 -0.981800
C -3.278600 -2.239191 0.798565
C -2.407184 -3.510566 -0.943699
H -1.291869 0.846666 -2.082808
H 3.980835 2.156691 0.262542
H 3.619232 -2.776896 -0.649985
H -3.081088 3.326111 1.875664
H 0.121991 2.609339 2.446976
H -1.427243 2.341959 3.306435
H -0.445069 0.953222 2.748295
H -3.403387 2.193689 -2.308720
H -4.295116 3.440413 -0.308106
H 6.078021 0.784542 -0.090968
H 5.892159 -1.676721 -0.556021
H -2.092860 -0.590908 1.557419
H -0.419115 -2.976756 -1.676161
H -4.103640 -2.077165 1.500949
H -2.544085 -4.353962 -1.629503


