%chk=000065372.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065372

0 1
 O   -2.290700     -0.1836000      0.8972000    
 O   -3.386200       2.539400     -5.9799999E-02
 O   -4.349200      -2.062300      0.6779000    
 O    4.113300      -1.973500     -0.3049000    
 O    3.660100       2.609400      0.3665000    
 N  -7.2400004E-02 -0.2934000      6.3500002E-02
 N    1.732400       1.348700      0.2442000    
 N    1.159600      -2.141800     -0.2393000    
 N    3.875900      0.3237000      3.1700000E-02
 C   -1.254100      0.5470000      0.2188000    
 C   -1.850400       1.037700      -1.092600    
 C   -3.292400       1.270400     -0.7034000    
 C   -3.562500      0.1629000      0.3095000    
 C   -4.142600      -1.090200     -0.3318000    
 C    1.232800      8.9299999E-02  7.9000004E-02
 C  -6.3500002E-02  -1.656000     -0.1324000    
 C    1.967300      -1.048000     -0.1066000    
 C    3.401500     -0.9894000     -0.1423000    
 C    3.121200       1.509700      0.2250000    
 H  -0.9758000       1.382800      0.8709000    
 H   -1.790800      0.2604000      -1.863700    
 H   -1.336900       1.931800      -1.459500    
 H   -3.979600       1.277000      -1.553400    
 H   -4.210100      0.4979000       1.127700    
 H   -3.454300      -1.516800      -1.068600    
 H   -5.101200     -0.8752000     -0.8141000    
 H  -0.9726000      -2.238700     -0.1936000    
 H   -2.896400       2.505600      0.7787000    
 H    1.111100       2.139900      0.3735000    
 H   -4.720000      -2.850400      0.2456000    
 H    4.885800      0.4383000      1.7400000E-02


%chk=000065372-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065372

0 1
O -2.589985 0.182236 1.233007
O -4.016641 2.530875 -0.045029
O -3.540249 -2.313671 0.092190
O 3.781051 -2.350904 -0.236048
O 3.588359 2.302940 -0.823182
N -0.312794 -0.190460 0.564919
N 1.624951 1.223070 -0.150016
N 0.735258 -2.225291 0.581846
N 3.601148 -0.030560 -0.502768
C -1.372667 0.838948 0.769615
C -1.743763 1.599614 -0.543439
C -3.287118 1.421847 -0.662573
C -3.543466 0.091560 0.080848
C -3.335651 -1.157209 -0.783487
C 1.001813 0.029736 0.182694
C -0.419348 -1.588935 0.812062
C 1.641876 -1.224567 0.189242
C 3.048349 -1.332522 -0.176218
C 2.995061 1.234853 -0.515802
H -1.044906 1.507721 1.586552
H -1.228735 1.153158 -1.411569
H -1.502717 2.674312 -0.499869
H -3.631959 1.416498 -1.708003
H -4.543511 0.056922 0.541965
H -2.321875 -1.171160 -1.236328
H -4.088424 -1.133722 -1.600896
H -1.361206 -2.029294 1.131966
H -3.887208 2.490751 0.938562
H 1.160672 2.132194 -0.156706
H -3.439245 -3.150489 -0.427240
H 4.592231 -0.035850 -0.765195


