%chk=000093283.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093283

0 1
 O    1.860800       2.202200      0.2415000    
 O   -6.482900     -0.2160000      0.6867000    
 O   -4.562600     -0.9968000       1.602500    
 N    1.236600     -6.1299998E-02 -9.7900003E-02
 C    1.962900      -1.327300     -0.2224000    
 C    3.385500     -0.9113000     -7.9499997E-02
 C    3.470100      0.4633000      0.1098000    
 C  -0.1465000      5.6499999E-02 -0.1673000    
 C    2.112300       1.018700      0.1004000    
 C   -2.928100      0.2932000     -0.3070000    
 C   -4.412300      0.4196000     -0.3818000    
 C  -0.7527000       1.309100     -3.7300002E-02
 C  -0.9393000      -1.077000     -0.3674000    
 C    4.530500      -1.685600     -0.1120000    
 C   -2.140800       1.427100     -0.1069000    
 C   -2.327400     -0.9589000     -0.4372000    
 C    4.675800       1.119600      0.2724000    
 C    5.764200      -1.047200      5.0099999E-02
 C    5.835900      0.3443000      0.2406000    
 C   -5.011700     -3.4299999E-02  -1.728400    
 C   -5.130100     -0.3377000      0.7410000    
 H    1.778100      -1.763100      -1.209100    
 H    1.667700      -2.002900      0.5866000    
 H   -4.683200       1.474900     -0.2391000    
 H  -0.2347000       2.242500      0.1194000    
 H  -0.5097000      -2.069000     -0.4737000    
 H    4.479800      -2.758900     -0.2585000    
 H   -2.594300       2.409500     -3.7000000E-03
 H   -2.923300      -1.853900     -0.5948000    
 H    4.728100       2.192100      0.4193000    
 H    6.679700      -1.632400      2.8700000E-02
 H    6.805700      0.8188000      0.3644000    
 H   -4.498400      0.4533000      -2.564500    
 H   -4.925500      -1.118200      -1.864300    
 H   -6.074600      0.2212000      -1.796800    
 H   -6.923400     -0.7112000       1.409900    


%chk=000093283-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093283

0 1
O 1.868019 2.342407 0.231209
O -5.663581 0.217071 1.645814
O -5.390484 -1.769779 0.478577
N 1.229055 0.043471 -0.069246
C 1.921434 -1.267587 -0.169820
C 3.386460 -0.904817 -0.031052
C 3.501420 0.492409 0.133613
C -0.188575 0.136522 -0.159219
C 2.148756 1.115735 0.112727
C -3.041193 0.268186 -0.357625
C -4.567237 0.357652 -0.508480
C -0.861688 1.387357 -0.065748
C -0.963533 -1.043415 -0.344983
C 4.530781 -1.721323 -0.047311
C -2.266148 1.436428 -0.162842
C -2.365792 -0.974445 -0.442300
C 4.752618 1.120487 0.286923
C 5.795883 -1.100262 0.105654
C 5.907158 0.305392 0.271227
C -5.035250 -0.056843 -1.927896
C -5.234266 -0.529487 0.539852
H 1.702488 -1.750623 -1.142362
H 1.583451 -1.950204 0.634379
H -4.876474 1.396572 -0.302444
H -0.279154 2.298283 0.082097
H -0.482277 -2.023665 -0.412947
H 4.457765 -2.807275 -0.174096
H -2.765751 2.409476 -0.083711
H -2.941251 -1.898219 -0.571760
H 4.810238 2.206430 0.412875
H 6.703419 -1.714104 0.096251
H 6.897913 0.757755 0.387447
H -4.525949 0.563567 -2.684997
H -4.797086 -1.116268 -2.122087
H -6.126629 0.074449 -2.040219
H -6.052342 -0.398433 2.326202


