%chk=000097970.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097970

0 1
 O    2.083500       1.517800      0.5615000    
 N   0.1411000      -1.022300      0.6460000    
 C  -5.6100000E-02  0.4349000      0.4162000    
 C   -1.367700      0.5503000     -0.3728000    
 C    1.167500      0.9256000     -0.3565000    
 C   -2.091900     -0.7409000     -2.7000001E-02
 C  -0.9495000      -1.738300     -2.8899999E-02
 C    1.464100      -1.382900      0.1260000    
 C    1.776800     -0.3401000     -0.9356000    
 C   -2.167800       1.795900     -2.8800000E-02
 H  -0.1430000      0.9259000       1.393200    
 H   -1.163200      0.5544000      -1.452500    
 H   0.9407000       1.662500      -1.133000    
 H   -2.863800     -0.9934000     -0.7603000    
 H   -2.558900     -0.6858000      0.9642000    
 H   -1.210200      -2.657900      0.5034000    
 H  -0.6963000      -1.998200      -1.064900    
 H    1.521800      -2.406800     -0.2592000    
 H    2.190600      -1.306500      0.9442000    
 H    2.854100     -0.2543000      -1.105900    
 H    1.283700     -0.6024000      -1.878800    
 H   -1.599500       2.699300     -0.2729000    
 H   -3.104800       1.820700     -0.5947000    
 H   -2.417400       1.831300       1.037000    
 H    1.657000       2.312500      0.9250000    


%chk=000097970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097970

0 1
O 2.193194 1.546101 0.530899
N 0.147392 -1.047977 0.618299
C -0.068575 0.427264 0.394636
C -1.412697 0.556655 -0.381495
C 1.186671 0.953087 -0.374469
C -2.137556 -0.767021 -0.022284
C -0.985634 -1.794248 -0.009180
C 1.515746 -1.383549 0.127034
C 1.829530 -0.318050 -0.961914
C -2.199908 1.837840 -0.057383
H -0.150481 0.959035 1.368567
H -1.188279 0.536197 -1.469894
H 0.903753 1.697790 -1.147132
H -2.933890 -1.029847 -0.740789
H -2.589410 -0.686464 0.984750
H -1.231740 -2.701869 0.571600
H -0.753090 -2.113109 -1.055370
H 1.545937 -2.420661 -0.251617
H 2.245864 -1.292984 0.951589
H 2.907193 -0.167478 -1.139868
H 1.343015 -0.579499 -1.920626
H -1.625189 2.746286 -0.320953
H -3.155053 1.874489 -0.613101
H -2.434550 1.888035 1.023062
H 1.738557 2.181277 1.140537


