%chk=000025817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025817

0 1
 O   0.4368000      0.3013000      0.8129000    
 O  -0.6459000     -0.6450000     -0.9859000    
 O  -0.5935000       2.919100      0.2024000    
 N    4.441100      0.3174000     -0.2914000    
 C    4.141100     -0.3765000      0.9665000    
 C    3.534500     -0.3083000      -1.261100    
 C    4.254200      -1.830800      0.4899000    
 C    3.850600      -1.785500     -0.9911000    
 C    2.724300     -6.0899999E-02   1.484400    
 C    2.055700      1.4400000E-02 -0.9712000    
 C    1.634900     -0.3760000      0.4520000    
 C    4.408900       1.767100     -0.2384000    
 C  -0.6452000      7.8900002E-02  1.5000000E-03
 C   -1.845600      0.8725000      0.5096000    
 C   -3.146700      0.1356000      0.2340000    
 C   -1.834700       2.285300     -9.1600001E-02
 C   -3.805300      0.3651000     -0.9576000    
 C   -3.632000     -0.7420000       1.183000    
 C   -4.998900     -0.3110000      -1.210600    
 C   -4.825500      -1.418200      0.9297000    
 C   -5.508900      -1.202600     -0.2670000    
 H    4.885500     -0.1628000       1.741100    
 H    3.788400     -3.9099999E-02  -2.292100    
 H    3.625500      -2.518600       1.064700    
 H    5.290300      -2.182600      0.5714000    
 H    4.696500      -2.116500      -1.606400    
 H    3.006400      -2.449200      -1.205300    
 H    2.524500     -0.6383000       2.396400    
 H    2.656300      0.9895000       1.794200    
 H    1.854400       1.077800      -1.151100    
 H    1.468400     -0.5265000      -1.719700    
 H    1.434400      -1.455100      0.4900000    
 H    5.147500       2.132500      0.4834000    
 H    3.437400       2.187100      3.7200000E-02
 H    4.688600       2.184100      -1.212000    
 H   -1.732300      0.9668000       1.599200    
 H   -2.647600       2.903400      0.3043000    
 H   -1.899300       2.282000      -1.182600    
 H   -3.433800       1.026700      -1.730400    
 H   -3.105300     -0.9179000       2.116000    
 H  -0.5086000       2.960100       1.170200    
 H   -5.528400     -0.1485000      -2.144900    
 H   -5.222200      -2.113300       1.663900    
 H   -6.437300      -1.730300     -0.4648000    


%chk=000025817-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025817

0 1
O 0.364448 0.389965 0.398830
O -0.641860 -0.293083 -1.595046
O -1.135743 3.132214 -1.205240
N 4.601587 0.127539 0.318744
C 3.884827 -1.009540 0.964636
C 3.946963 0.208251 -1.020429
C 3.998993 -2.097966 -0.144171
C 4.034352 -1.276849 -1.483261
C 2.393296 -0.649046 1.278497
C 2.465879 0.698539 -0.906576
C 1.659025 -0.270376 -0.017932
C 4.767411 1.369213 1.086396
C -0.693949 0.314830 -0.499973
C -1.906185 1.084588 0.028507
C -3.119400 0.182765 0.269711
C -2.257278 2.211685 -0.988169
C -3.609052 -0.683080 -0.743003
C -3.803123 0.244231 1.510248
C -4.760660 -1.467991 -0.513466
C -4.956166 -0.540420 1.738794
C -5.440011 -1.398889 0.725277
H 4.396889 -1.301838 1.899125
H 4.512397 0.891063 -1.679791
H 3.158702 -2.814582 -0.105971
H 4.934400 -2.666949 -0.013896
H 4.984143 -1.447898 -2.016595
H 3.209146 -1.542036 -2.167971
H 1.885920 -1.500064 1.769607
H 2.357676 0.204238 1.982611
H 2.445761 1.709893 -0.456721
H 2.000043 0.770630 -1.905378
H 1.380841 -1.168531 -0.598804
H 5.329543 1.149736 2.012545
H 3.820118 1.882593 1.379766
H 5.364634 2.084259 0.491801
H -1.609221 1.551767 0.985528
H -3.162176 2.746844 -0.633611
H -2.459192 1.775006 -1.978996
H -3.071325 -0.755846 -1.694497
H -3.428704 0.904482 2.302633
H -0.921822 3.591001 -0.353616
H -5.126779 -2.135985 -1.301318
H -5.471961 -0.483947 2.704042
H -6.333184 -2.009215 0.899831


