%chk=000087433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087433

0 1
 O   0.9741000      -2.730500       1.332200    
 O   -4.228400      0.3847000     -0.8014000    
 N    2.916500      -1.146900     -0.9061000    
 C   0.7048000       1.044900     -0.5988000    
 C    1.733100      0.6151000      0.4587000    
 C    1.912100     -0.8728000      0.1263000    
 C    1.360800      0.6662000      -2.018400    
 C   0.5206000       2.578700     -0.4854000    
 C    1.378000      0.9658000       1.918600    
 C  -0.5978000      0.1953000     -0.3073000    
 C    2.804600     -3.0999999E-02  -1.924900    
 C   0.4963000       3.137500      0.9456000    
 C   0.3496000       2.089800       2.039300    
 C   0.8204000      -1.688500      0.7183000    
 C  -0.5406000      -1.067600      0.4001000    
 C   -1.857400      0.6471000     -0.7177000    
 C    4.257400      -1.247300     -0.3495000    
 C   -1.695900      -1.782700      0.7114000    
 C   -3.010300     -8.0799997E-02 -0.4030000    
 C   -2.931100      -1.277500      0.3137000    
 C   -5.366800     -0.3994000     -0.4518000    
 H    2.671500       1.162400      0.2824000    
 H    2.551700      -1.088800       1.006600    
 H    1.453200       1.554500      -2.654000    
 H   0.6946000     -2.6900001E-02  -2.548300    
 H  -0.3662000       2.921300      -1.027400    
 H    1.358600       3.076800     -0.9935000    
 H    2.302600       1.282600       2.420400    
 H    1.030100      0.1056000       2.500100    
 H    3.061400     -0.4380000      -2.909500    
 H    3.534700      0.7597000      -1.706400    
 H  -0.3088000       3.876500       1.034000    
 H    1.429600       3.689500       1.118900    
 H   0.4448000       2.565200       3.022700    
 H  -0.6633000       1.672300       2.009400    
 H   -1.966300       1.565800      -1.285400    
 H    4.569600     -0.3459000      0.1903000    
 H    4.981500      -1.420000      -1.153900    
 H    4.341300      -2.108000      0.3245000    
 H   -1.649700      -2.731500       1.237300    
 H   -3.794300      -1.877700      0.5814000    
 H   -5.338400      -1.386200     -0.9263000    
 H   -6.247800      0.1175000     -0.8465000    
 H   -5.495500     -0.4624000      0.6341000    


%chk=000087433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087433

0 1
O 1.216285 -2.638906 1.412162
O -4.108164 0.294241 -0.816051
N 2.709577 -0.972983 -0.760616
C 0.753104 1.179480 -0.439803
C 1.822491 0.902168 0.664106
C 2.247734 -0.576788 0.597540
C 1.331193 0.747297 -1.857347
C 0.465611 2.715187 -0.441413
C 1.334882 1.275320 2.101062
C -0.475180 0.282360 -0.167932
C 2.728306 0.096788 -1.770442
C 0.435097 3.376292 0.973992
C 0.210925 2.344872 2.100334
C 1.046467 -1.502058 0.869478
C -0.287936 -1.023500 0.403655
C -1.775081 0.657262 -0.555435
C 3.798322 -1.953459 -0.791243
C -1.400212 -1.885836 0.567430
C -2.877326 -0.218104 -0.386632
C -2.696934 -1.505729 0.180956
C -5.291314 -0.560159 -0.672825
H 2.701981 1.532290 0.424533
H 3.028352 -0.788954 1.359871
H 1.378194 1.628188 -2.525747
H 0.647299 0.017868 -2.325407
H -0.472252 2.925459 -0.987263
H 1.266172 3.197244 -1.035342
H 2.205149 1.648583 2.675618
H 0.977604 0.372026 2.631877
H 2.977422 -0.356721 -2.748945
H 3.514566 0.869216 -1.570398
H -0.348116 4.156621 1.009993
H 1.397696 3.893477 1.160807
H 0.177229 2.852421 3.083330
H -0.771101 1.857134 1.961326
H -1.981163 1.634754 -0.999819
H 4.782234 -1.533109 -0.464783
H 3.917016 -2.351056 -1.815879
H 3.549702 -2.797822 -0.124530
H -1.213231 -2.869734 1.011621
H -3.535859 -2.193769 0.318900
H -5.188183 -1.490617 -1.263505
H -6.125678 0.039092 -1.065294
H -5.477979 -0.811938 0.388860


