%chk=000077452.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077452

0 1
 O   -2.565800      -1.262700      0.3421000    
 N    2.719500      0.4408000     -0.1941000    
 N  -0.8502000     -2.2800000E-02 -0.6177000    
 C   0.9762000      -1.116600      0.6274000    
 C    1.791000      0.1527000      0.8923000    
 C   0.1329000      -1.070900     -0.6453000    
 C    3.674200     -0.6566000     -0.3610000    
 C    3.428900       1.697200      5.3399999E-02
 C   -2.132300     -0.2120000     -0.1194000    
 C   -2.955400       1.023700     -0.2068000    
 C   -4.218800       1.027100      0.2292000    
 H    1.615200      -2.006300      0.6138000    
 H   0.3042000      -1.259500       1.484500    
 H    2.323100      3.9400000E-02   1.846400    
 H    1.098000      0.9937000       1.020800    
 H   0.7554000     -0.9154000      -1.532000    
 H  -0.3790000      -2.031700     -0.7713000    
 H    4.189900     -0.9072000      0.5732000    
 H    4.437500     -0.3866000      -1.100800    
 H    3.198300      -1.557500     -0.7596000    
 H    4.034400       1.657600      0.9662000    
 H    2.720200       2.527900      0.1445000    
 H    4.087500       1.940300     -0.7879000    
 H  -0.5770000      0.8873000     -0.9772000    
 H   -2.518900       1.922800     -0.6278000    
 H   -4.812900       1.932600      0.1625000    
 H   -4.691900      0.1501000      0.6566000    


%chk=000077452-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077452

0 1
O -2.648412 -1.141498 0.174768
N 2.329875 0.476938 -0.094936
N -0.577841 -0.267041 -0.458775
C 1.124991 -1.538411 0.890993
C 1.829034 -0.183436 1.143499
C 0.166547 -1.523415 -0.332105
C 3.393305 -0.301131 -0.770615
C 2.776367 1.863643 0.175911
C -1.931727 -0.153068 -0.189720
C -2.477858 1.234431 -0.370449
C -3.786605 1.510569 -0.142939
H 1.865563 -2.348641 0.745062
H 0.555777 -1.790282 1.805572
H 2.651174 -0.332483 1.889271
H 1.101689 0.510861 1.605048
H 0.746719 -1.674390 -1.261832
H -0.572939 -2.338068 -0.249057
H 4.306948 -0.424414 -0.137095
H 3.688242 0.210100 -1.704189
H 3.024043 -1.305637 -1.036393
H 3.649936 1.915311 0.872521
H 1.949641 2.442733 0.625533
H 3.066279 2.353332 -0.770976
H -0.004465 0.547137 -0.704987
H -1.783961 2.021966 -0.698434
H -4.199966 2.516381 -0.272660
H -4.458156 0.705911 0.178986


