%chk=000121184.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121184

0 1
 O   -4.157000       1.353800       1.147600    
 O   0.6692000       1.431600     -0.9132000    
 O   -1.264500      -1.010200      -2.084500    
 N   -2.203600     -0.2639000     -7.9200000E-02
 C   -2.086000      0.1007000       1.337900    
 C   -3.566300     -0.2066000     -0.6058000    
 C   0.1772000     -0.8300000     -0.3063000    
 C    3.277900       1.290700      0.1991000    
 C    2.325500      0.1407000      0.2221000    
 C   -1.162100     -0.7054000     -0.8970000    
 C   -2.803700       1.418600       1.604200    
 C   -4.212000       1.128100     -0.2636000    
 C    1.052700      0.2554000     -0.3369000    
 C   0.5744000      -2.030000      0.2834000    
 C    2.722900      -1.059400      0.8117000    
 C    1.847300      -2.144700      0.8424000    
 C    4.554200      0.9799000     -0.6039000    
 C    3.652400       1.771100       1.613200    
 C  -0.3415000      -3.209700      0.3316000    
 C   0.9430000       1.589200      -2.302900    
 H   -1.045900      0.1682000       1.661900    
 H   -2.564900     -0.7077000       1.902800    
 H   -4.117200      -1.026100     -0.1294000    
 H   -3.578800     -0.3728000      -1.687200    
 H    2.819000       2.157700     -0.2898000    
 H   -2.820700       1.626200       2.678600    
 H   -2.295600       2.254900       1.109200    
 H   -3.716800       1.957600     -0.7823000    
 H   -5.264500       1.125100     -0.5632000    
 H    3.708800      -1.173000       1.253600    
 H    2.172900      -3.072100       1.306300    
 H    5.152000      0.1904000     -0.1357000    
 H    5.185400       1.871900     -0.6810000    
 H    4.306800      0.6550000      -1.620400    
 H    2.754500       2.018800       2.190300    
 H    4.276300       2.670100       1.560600    
 H    4.211100       1.011800       2.170900    
 H   -1.229100      -2.983400      0.9310000    
 H  -0.6495000      -3.500800     -0.6780000    
 H   0.1427000      -4.082100      0.7839000    
 H   0.1871000       1.070900      -2.898700    
 H    1.939000       1.218300      -2.565200    
 H   0.8969000       2.655800      -2.539900    


%chk=000121184-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121184

0 1
O -3.891462 1.813042 0.837825
O 0.455769 1.402372 -0.646501
O -1.426871 -1.236117 -2.004300
N -2.256413 -0.394883 0.003036
C -2.098146 0.172789 1.358714
C -3.614664 -0.225660 -0.559951
C 0.151631 -0.970278 -0.179972
C 3.228595 1.357514 0.312356
C 2.330127 0.119338 0.308826
C -1.229019 -0.868127 -0.796946
C -2.513656 1.660246 1.342294
C -3.999727 1.267110 -0.527786
C 0.999647 0.166504 -0.184488
C 0.632369 -2.219501 0.299494
C 2.786131 -1.130248 0.798389
C 1.959702 -2.273709 0.790871
C 4.430206 1.184041 -0.656010
C 3.721298 1.700633 1.743176
C -0.248727 -3.455598 0.272229
C 0.590407 1.604912 -2.109481
H -1.053610 0.066657 1.691618
H -2.754069 -0.383329 2.058120
H -4.332237 -0.808514 0.049834
H -3.606978 -0.617809 -1.590815
H 2.616463 2.207452 -0.042255
H -2.528254 2.079344 2.361824
H -1.804908 2.230468 0.706912
H -3.340289 1.839048 -1.215371
H -5.053046 1.412207 -0.818714
H 3.807370 -1.210997 1.189633
H 2.347474 -3.226572 1.169369
H 5.085500 0.353361 -0.333122
H 5.041359 2.105447 -0.685329
H 4.090949 0.961270 -1.684259
H 2.870564 1.856587 2.430466
H 4.328917 2.624466 1.729614
H 4.350229 0.891265 2.158948
H -1.179512 -3.306453 0.851879
H -0.552625 -3.695318 -0.763257
H 0.277946 -4.328892 0.692289
H 0.086454 0.790639 -2.661871
H 1.658680 1.649100 -2.398079
H 0.105926 2.570794 -2.321007


