%chk=000028938.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028938

0 1
 O    1.360600      0.2887000       1.351700    
 O   -2.129800      -1.659300      0.1760000    
 O  -6.5399997E-02  -2.588800     -0.1138000    
 N    3.323900      0.2499000      0.1347000    
 C    5.600700      0.2861000      0.7298000    
 C    5.478700      0.5867000     -0.7589000    
 C    4.201200      0.5771000       1.249000    
 C    4.086100      7.3700003E-02  -1.097600    
 C    1.954000      0.1315000      0.2836000    
 C    1.190400     -0.2052000     -0.9721000    
 C  -0.2604000     -0.2732000     -0.6028000    
 C   -1.064000      0.7974000     -0.6551000    
 C   -2.466900      0.6998000     -0.2899000    
 C  -0.7825000      -1.595000     -0.1687000    
 C   -2.968700     -0.5304000      0.1189000    
 C   -3.328300       1.798500     -0.3345000    
 C   -4.303500     -0.6942000      0.4838000    
 C   -4.670000       1.650300      2.8800000E-02
 C   -5.156200      0.4064000      0.4371000    
 H    5.843000     -0.7736000      0.8747000    
 H    6.368300      0.8856000       1.226700    
 H    5.530000       1.670000     -0.9228000    
 H    6.260200      0.1115000      -1.357700    
 H    3.940600     -8.0000004E-03   2.136000    
 H    4.068800       1.640800       1.475300    
 H    3.631200      0.6189000      -1.928500    
 H    4.098300     -0.9959000      -1.333300    
 H    1.354700      0.5832000      -1.715400    
 H    1.549500      -1.146800      -1.398900    
 H  -0.6856000       1.764700     -0.9703000    
 H   -2.969700       2.775500     -0.6492000    
 H   -4.679500      -1.662000      0.8009000    
 H   -5.337400       2.506800     -6.6999998E-03
 H   -6.199700      0.2977000      0.7180000    


%chk=000028938-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028938

0 1
O 1.793314 2.525234 0.111395
O -1.437653 -1.501238 -0.359008
O 0.691510 -1.871317 -1.136855
N 3.251292 0.747121 -0.209946
C 4.880273 -0.160195 1.265194
C 5.069668 -0.807810 -0.131138
C 4.100454 1.134602 0.950739
C 3.740551 -0.503316 -0.868730
C 2.125675 1.468617 -0.521555
C 1.225326 0.951179 -1.672531
C -0.088461 0.435200 -1.121210
C -1.125489 1.276499 -0.766423
C -2.357677 0.772442 -0.199856
C -0.192114 -1.016141 -0.902397
C -2.483896 -0.635158 -0.012828
C -3.452583 1.600861 0.178597
C -3.650660 -1.214796 0.525591
C -4.621435 1.036928 0.716881
C -4.719205 -0.371508 0.888790
H 4.272818 -0.818915 1.912237
H 5.836095 0.040678 1.777580
H 5.916532 -0.328750 -0.656476
H 5.268731 -1.891214 -0.080815
H 3.460076 1.493037 1.773459
H 4.777242 1.965184 0.668342
H 3.904250 -0.343961 -1.950351
H 2.998711 -1.313487 -0.749907
H 1.037455 1.822043 -2.324182
H 1.714705 0.162149 -2.263081
H -1.004289 2.356760 -0.903241
H -3.367767 2.685404 0.045236
H -3.700396 -2.300153 0.650536
H -5.458717 1.679953 1.005985
H -5.631736 -0.807534 1.308769


