%chk=000084431.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084431

0 1
 O   -2.209100       1.335400     -0.3616000    
 O   -2.214000      -1.335200      0.3619000    
 N    2.669000       1.072100     -0.2908000    
 C    1.361200      0.6569000     -0.1779000    
 C    1.388000     -0.6909000      0.1870000    
 C   0.1689000       1.364000     -0.3689000    
 C   0.1662000      -1.368300      0.3704000    
 C   -1.030700      0.6714000     -0.1813000    
 C   -1.034300     -0.6738000      0.1826000    
 C    2.756200      -1.068800      0.2891000    
 C    3.519200      3.6200002E-02 -1.0600000E-02
 C   -2.767400       1.981500      0.7795000    
 C   -2.773100      -1.980300     -0.7794000    
 H   0.1773000       2.411500     -0.6532000    
 H   0.1567000      -2.417000      0.6551000    
 H    2.958600       2.006700     -0.5439000    
 H    3.142000      -2.043900      0.5532000    
 H    4.590100      0.1772000     -4.9100000E-02
 H   -2.087700       2.753400       1.154300    
 H   -2.981900       1.254200       1.568900    
 H   -3.704900       2.457500      0.4793000    
 H   -3.711800      -2.454400     -0.4796000    
 H   -2.094900      -2.753500      -1.154000    
 H   -2.985700      -1.252500      -1.568800    


%chk=000084431-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084431

0 1
O -2.140464 1.380262 -0.487559
O -2.157019 -1.336107 0.508876
N 2.814275 1.064452 -0.415979
C 1.482881 0.663647 -0.250764
C 1.504772 -0.682935 0.260145
C 0.279238 1.363396 -0.487888
C 0.271188 -1.344749 0.500480
C -0.928643 0.693168 -0.223546
C -0.931118 -0.666209 0.247103
C 2.895381 -1.064480 0.397365
C 3.664731 0.019375 -0.022369
C -2.974656 1.630518 0.712053
C -2.946444 -1.635754 -0.707983
H 0.245691 2.393770 -0.855024
H 0.227549 -2.374105 0.869298
H 3.116206 1.971310 -0.763836
H 3.279440 -2.016841 0.757852
H 4.746510 0.129761 -0.071091
H -2.437288 2.294162 1.416348
H -3.233986 0.680653 1.212295
H -3.880284 2.133693 0.339524
H -3.861471 -2.133811 -0.351492
H -2.380701 -2.317680 -1.371476
H -3.197887 -0.706096 -1.250134


