%chk=000078707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078707

0 1
 O   3.1999999E-03   2.735000      0.1032000    
 N   -2.652700      -2.631800     -0.2029000    
 N    3.766000     -0.7872000       2.022100    
 N   -5.056700      -1.131300      7.5599998E-02
 N    4.847800      -1.271600     -0.5670000    
 C   -1.334500      0.8182000      1.8200001E-02
 C    1.243900      0.7677000     -0.1436000    
 C  -5.0299998E-02   1.500500     -7.9999998E-04
 C   -1.388700     -0.5707000     -9.9900000E-02
 C    1.887600      0.3405000      0.9942000    
 C   -2.620600      -1.224600     -8.1799999E-02
 C    3.095800     -0.3434000      0.8603000    
 C   -2.512300       1.553100      0.1543000    
 C    1.739800      0.5502000      -1.408100    
 C   -3.798300     -0.4896000      5.4200001E-02
 C    3.626000     -0.5805000     -0.4079000    
 C   -3.744200      0.8992000      0.1722000    
 C    2.948000     -0.1337000      -1.542200    
 H  -0.4881000      -1.169100     -0.2072000    
 H    1.466500      0.5303000       1.977900    
 H   -2.497500       2.635700      0.2480000    
 H    1.215100      0.8966000      -2.293100    
 H   -4.654300       1.484100      0.2789000    
 H    3.349700     -0.3116000      -2.536600    
 H   -1.786400      -3.145100     -0.3002000    
 H   -3.526900      -3.136300     -0.1928000    
 H    3.363100     -0.6036000       2.931800    
 H    4.642500      -1.284200       1.961200    
 H   -5.132500      -2.134300     -8.9999996E-03
 H   -5.897900     -0.5778000      0.1743000    
 H    5.364800      -1.608200      0.2320000    
 H    5.213700      -1.431700      -1.496600    


%chk=000078707-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078707

0 1
O -0.045328 1.990297 1.747692
N -3.156868 -2.637558 -0.722818
N 4.758237 0.149105 1.687119
N -5.279022 -0.865713 -0.687354
N 4.973384 -1.167816 -0.737173
C -1.406652 0.515004 0.426196
C 1.194000 0.394996 0.445614
C -0.084651 1.017562 0.917122
C -1.623482 -0.834237 0.027419
C 2.345751 0.540090 1.267366
C -2.901251 -1.288865 -0.357856
C 3.600042 0.042346 0.874251
C -2.507901 1.412164 0.416056
C 1.340275 -0.221272 -0.826801
C -4.010025 -0.378487 -0.337531
C 3.723249 -0.638735 -0.386162
C -3.786053 0.974345 0.028753
C 2.591474 -0.725856 -1.235308
H -0.788805 -1.544623 0.043869
H 2.231931 1.086355 2.211373
H -2.339559 2.444510 0.737433
H 0.486436 -0.276771 -1.508684
H -4.632217 1.672813 0.038607
H 2.693366 -1.208681 -2.215455
H -2.387221 -3.298873 -0.622479
H -3.753008 -2.793291 -1.538841
H 4.630815 0.553261 2.614947
H 5.628938 0.416107 1.221768
H -5.467037 -1.854346 -0.515194
H -6.074941 -0.232426 -0.642048
H 5.606894 -1.433000 0.017365
H 5.070827 -1.663603 -1.620546


