%chk=000027654.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027654

0 1
 O   -1.560500       3.422800      5.5000000E-02
 O   0.4038000      -3.426000     -6.6799998E-02
 O    3.290900       2.214400     -1.4700000E-02
 N   -3.147800       1.727800      4.2900000E-02
 N   -1.840400      -2.830200     -3.4100000E-02
 N    3.896700     -2.7200000E-02 -5.0900001E-02
 C   -4.238300       2.415700      0.6689000    
 C   -4.180900       2.256500     -0.7982000    
 C   -2.406600      -3.992500     -0.6526000    
 C   -2.428000      -3.824500      0.8145000    
 C    5.184700      8.2199998E-02 -0.6698000    
 C    5.053800     -6.4300001E-02  0.7939000    
 C   -1.856500       2.231200      3.8899999E-02
 C  -0.4786000      -2.572400     -4.3699998E-02
 C    2.992700       1.023300     -2.6699999E-02
 C  -0.7843000       1.195800      1.4900000E-02
 C  -0.1182000      -1.126100     -2.5699999E-02
 C    1.559900      0.6119000     -1.7300000E-02
 C   -1.121600     -0.1574000     -1.4000000E-03
 C   0.5564000       1.580600      6.8000001E-03
 C    1.222600     -0.7415000     -3.3799998E-02
 H   -3.998200       3.374200       1.105400    
 H   -4.879600       1.763800       1.243700    
 H   -4.780700       1.491500      -1.268600    
 H   -3.893200       3.099400      -1.409800    
 H   -1.699200      -4.679000      -1.094800    
 H   -3.301400      -3.780800      -1.219200    
 H   -3.337500      -3.492900       1.293100    
 H   -1.731400      -4.385700       1.420500    
 H    5.424400       1.050900      -1.083700    
 H    5.447300     -0.7812000      -1.263200    
 H    5.222700      -1.031800       1.243300    
 H    5.193300      0.8010000       1.425800    
 H   -2.164700     -0.4567000      4.6000001E-03
 H   0.8193000       2.635400      1.9200001E-02
 H    1.988800      -1.511300     -5.2999999E-02


%chk=000027654-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027654

0 1
O -1.536146 3.249299 1.403317
O 0.358380 -3.231179 -1.369308
O 3.209222 2.476492 -0.357421
N -3.183789 1.828514 0.549370
N -1.747615 -2.939522 -0.404807
N 3.926616 0.266996 -0.578688
C -4.288034 2.776891 0.307536
C -3.920642 1.716667 -0.742347
C -2.092455 -4.324722 -0.032943
C -2.350341 -3.163531 0.939938
C 5.332371 0.347080 -0.144768
C 4.433212 -0.816181 0.307136
C -1.842103 2.189947 0.781883
C -0.461774 -2.486878 -0.752867
C 2.937179 1.239294 -0.364765
C -0.815449 1.195097 0.316336
C -0.158652 -1.053258 -0.417905
C 1.529893 0.721172 -0.234708
C -1.156899 -0.144414 0.007785
C 0.528871 1.620702 0.204261
C 1.180434 -0.612540 -0.551455
H -4.008917 3.819127 0.113487
H -5.183154 2.636531 0.921285
H -4.554592 0.832191 -0.864876
H -3.408250 2.056632 -1.650446
H -1.256063 -5.002250 0.174838
H -2.934692 -4.769603 -0.571706
H -3.370962 -2.792935 1.082385
H -1.692912 -3.074370 1.813352
H 5.580668 1.127496 0.584175
H 6.083818 0.171560 -0.920754
H 4.552327 -1.802463 -0.153529
H 4.093690 -0.820534 1.350245
H -2.195584 -0.473144 0.098133
H 0.797295 2.653367 0.449119
H 1.924749 -1.320629 -0.927891


