%chk=000025767.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025767

0 1
 O   -3.975200      0.1100000      0.3939000    
 N    3.616900     -0.4295000      0.2689000    
 N    1.454800     -9.0800002E-02 -0.7415000    
 C  -0.5156000       1.186400     -0.1157000    
 C   8.1200004E-02 -2.5800001E-02 -0.4521000    
 C   -1.880400       1.232300      0.1690000    
 C   -2.643400      6.5700002E-02  0.1164000    
 C  -0.6768000      -1.192400     -0.5057000    
 C   -2.041500      -1.146600     -0.2211000    
 C   0.2810000       2.448300     -5.2600000E-02
 C    2.238100     -0.3168000      0.2662000    
 C    4.384200     -0.2919000     -0.9609000    
 C    4.371500     -0.4292000       1.514200    
 C   -4.694900      -1.119700      0.3209000    
 H   -2.359300       2.171700      0.4343000    
 H  -0.2161000      -2.141200     -0.7683000    
 H   -2.574200      -2.089600     -0.2808000    
 H   0.9764000       2.417900      0.7923000    
 H   0.8449000       2.597200     -0.9795000    
 H  -0.3598000       3.327400      7.6300003E-02
 H    1.823500     -0.4283000       1.285800    
 H    4.495500      0.7664000      -1.217400    
 H    3.886400     -0.8028000      -1.791800    
 H    5.382900     -0.7301000     -0.8624000    
 H    5.322500     -0.9605000       1.403400    
 H    3.813300     -0.9271000       2.314100    
 H    4.581000      0.5991000       1.825100    
 H   -5.737800     -0.8992000      0.5712000    
 H   -4.334300      -1.841700       1.061500    
 H   -4.689900      -1.529200     -0.6949000    


%chk=000025767-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025767

0 1
O -4.100147 0.052914 0.052092
N 3.730836 -0.474465 0.339632
N 1.557322 0.293650 -0.205732
C -0.647602 1.354755 -0.265438
C 0.148263 0.170126 -0.099155
C -2.049962 1.252008 -0.200214
C -2.690787 0.006233 0.016436
C -0.509970 -1.073951 0.098021
C -1.918527 -1.168753 0.160753
C 0.028074 2.691411 -0.494478
C 2.359503 -0.443145 0.525144
C 4.362359 0.311550 -0.727243
C 4.609805 -1.169586 1.282955
C -4.801954 -1.210219 0.269814
H -2.677263 2.141888 -0.318619
H 0.088386 -1.991197 0.160773
H -2.388625 -2.146887 0.301196
H 0.629346 2.991054 0.384429
H 0.734225 2.628456 -1.341972
H -0.711772 3.484900 -0.697135
H 2.014209 -1.088490 1.357128
H 4.949640 1.154889 -0.310617
H 3.563976 0.716830 -1.367714
H 5.040387 -0.325971 -1.326802
H 5.296507 -1.853143 0.746432
H 4.008522 -1.767881 1.988749
H 5.225032 -0.456667 1.869900
H -5.871492 -0.951688 0.270552
H -4.528123 -1.664094 1.243190
H -4.595268 -1.934525 -0.543275


