%chk=000128087.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128087

0 1
 O  -0.1306000      -1.898300      -1.383200    
 O   -2.409500      -1.401500      -1.210600    
 O   -3.108000      0.7801000     -0.2706000    
 O   0.3567000       3.004400     -0.2449000    
 O    5.635700      0.3608000      0.4371000    
 O   -4.011300       2.262000       1.241900    
 N   -1.250300      -3.189100       1.012600    
 N    1.089900      -1.770600     -0.6932000    
 N   -5.359000      0.9727000     -0.1028000    
 C   -1.160600      -1.741900      0.8154000    
 C   1.9600000E-02  -2.540400       1.324800    
 C   -1.127600      -1.196700     -0.6039000    
 C    1.181800      -2.745100      0.3964000    
 C  -0.8021000      0.3294000     -0.7031000    
 C   0.6695000      0.6071000     -0.4138000    
 C    1.575800     -0.4756000     -0.4126000    
 C   -1.805300       1.150100      0.1277000    
 C    1.154200       1.901800     -0.1799000    
 C    2.930200     -0.2487000     -0.1284000    
 C    2.506200       2.115500      9.2600003E-02
 C    3.391400       1.041900      0.1247000    
 C    4.800000       1.268500      0.4069000    
 C   -4.146400       1.413400      0.3669000    
 H   -1.757900      -1.176000       1.514100    
 H   0.2833000      -2.485200       2.370800    
 H   -1.199200      -3.671100      0.1158000    
 H    2.125700      -2.659200      0.9465000    
 H    1.161400      -3.758300     -2.3300000E-02
 H  -0.9429000      0.6162000      -1.756900    
 H   -1.727100       2.220800     -5.4299999E-02
 H   -1.664900      0.9864000       1.202300    
 H   -2.515100     -0.7728000      -1.943400    
 H    3.620800      -1.089200     -0.1270000    
 H    2.863000       3.127500      0.2712000    
 H  -0.1753000       2.926400      -1.056100    
 H    5.105600       2.311400      0.5973000    
 H   -5.419200      0.2672000     -0.8292000    
 H   -6.231900       1.338800      0.2622000    


%chk=000128087-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128087

0 1
O 0.114214 -1.940380 -1.432048
O -2.146375 -1.568307 -1.815179
O -3.015509 0.884480 -0.065834
O 0.418285 3.008679 -1.145585
O 5.562418 0.697425 1.066335
O -3.537868 2.033179 1.928158
N -1.548686 -3.383232 0.525984
N 1.241906 -1.815632 -0.492856
N -5.197716 1.149422 0.511517
C -1.496709 -1.877151 0.448071
C -0.421337 -2.640769 1.218172
C -1.116679 -1.231685 -0.878683
C 1.014552 -2.712094 0.671116
C -0.792960 0.302508 -0.844381
C 0.699059 0.590147 -0.645420
C 1.613935 -0.448145 -0.299567
C -1.583398 1.042736 0.262504
C 1.199847 1.922017 -0.703370
C 2.919730 -0.151009 0.142281
C 2.504805 2.234265 -0.278686
C 3.350593 1.195868 0.182471
C 4.721442 1.535265 0.646183
C -3.906765 1.419934 0.898096
H -2.306724 -1.379736 0.985653
H -0.502186 -2.663438 2.309933
H -1.226292 -3.792405 -0.375081
H 1.731743 -2.414161 1.455414
H 1.251608 -3.747657 0.367212
H -1.135236 0.704604 -1.824915
H -1.335189 2.117057 0.303779
H -1.371302 0.617895 1.259072
H -1.893139 -1.237494 -2.715910
H 3.624867 -0.945333 0.406735
H 2.844357 3.274356 -0.318590
H -0.383460 2.706181 -1.640185
H 4.972317 2.625269 0.602378
H -5.380444 0.600162 -0.325301
H -5.961102 1.469878 1.100529


