%chk=000130066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130066

0 1
 O   -2.581000      -1.074800      0.1932000    
 O   -4.121300      -2.131700      -1.143100    
 N   0.8890000      -1.645200     -0.5423000    
 N   -1.105000       4.403700      0.1915000    
 N   -4.217100      -2.280100       1.170200    
 C    1.633700      0.3787000      1.9099999E-02
 C   0.5041000     -0.3360000     -0.3725000    
 C  -0.7528000      0.2597000     -0.5366000    
 C    1.505900       1.762500      0.2604000    
 C    2.724400     -0.5458000      8.2900003E-02
 C  -0.8731000       1.639000     -0.2947000    
 C   0.2533000       2.386600      0.1021000    
 C    2.228300      -1.799800     -0.2733000    
 C   -1.926800     -0.5665000     -0.9607000    
 C    2.693700       2.575600      0.6839000    
 C    4.091500     -0.4299000      0.4115000    
 C    3.029500      -2.946400     -0.3183000    
 C   -2.100800       2.294400     -0.4411000    
 C   7.1999997E-02   3.752500      0.3275000    
 C    4.905400      -1.567500      0.3715000    
 C    4.380100      -2.806300      1.1400000E-02
 C   -2.161400       3.656400     -0.1898000    
 C   -3.684900      -1.857700     -2.9800000E-02
 C   -5.386700      -3.121400       1.277000    
 H   0.2754000      -2.398000     -0.8209000    
 H   -2.624100     -1.7500000E-02  -1.601800    
 H   -1.583100      -1.412000      -1.570100    
 H    3.269800       2.891300     -0.1910000    
 H    2.447000       3.453800       1.283600    
 H    3.335700       2.003800       1.356100    
 H    4.552600      0.5146000      0.6747000    
 H    2.620900      -3.911500     -0.5989000    
 H   -3.020700       1.796100     -0.7231000    
 H   0.8698000       4.428700      0.6097000    
 H    5.960300      -1.481300      0.6188000    
 H    5.029600      -3.677400     -1.5000000E-02
 H   -3.097100       4.197100     -0.2884000    
 H   -3.761000      -1.983300       2.027400    
 H   -5.787600      -3.373000      0.2923000    
 H   -6.140400      -2.585300       1.858700    
 H   -5.103000      -4.034100       1.806700    


%chk=000130066-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130066

0 1
O -3.206247 -0.637301 -0.271986
O -2.135801 -2.739306 -0.427900
N 0.359633 -1.514017 -0.603134
N -0.874060 4.814891 0.256702
N -4.006015 -2.382051 0.939103
C 1.403283 0.460572 0.010659
C 0.159102 -0.144688 -0.433879
C -1.020114 0.587154 -0.656872
C 1.473460 1.841386 0.265586
C 2.382949 -0.628798 0.095431
C -0.976959 1.989448 -0.346761
C 0.263747 2.617690 0.105949
C 1.688160 -1.833707 -0.278149
C -2.224053 -0.066936 -1.277509
C 2.793656 2.450953 0.698815
C 3.750251 -0.716056 0.457713
C 2.316199 -3.094696 -0.287021
C -2.130625 2.839184 -0.456957
C 0.215725 4.031488 0.377013
C 4.388903 -1.975941 0.447009
C 3.678814 -3.150962 0.081123
C -2.042098 4.196844 -0.158825
C -3.041563 -1.988223 0.049819
C -4.088236 -3.749853 1.460488
H -0.428005 -2.179176 -0.703776
H -2.846693 0.649333 -1.831783
H -1.931228 -0.892808 -1.948723
H 3.579013 2.240833 -0.051209
H 2.752239 3.540381 0.836188
H 3.132131 2.007531 1.654589
H 4.317637 0.172333 0.747416
H 1.769347 -3.999445 -0.571853
H -3.098211 2.422436 -0.751068
H 1.116652 4.552954 0.715656
H 5.445703 -2.049491 0.725134
H 4.196767 -4.116633 0.082355
H -2.917294 4.851100 -0.235137
H -4.674713 -1.672728 1.241430
H -3.278703 -4.338874 1.002354
H -5.056379 -4.216389 1.202334
H -3.962278 -3.766432 2.558475


