%chk=000093204.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093204

0 1
 O   -2.912100       1.137400     -0.6225000    
 O    3.284300      0.5624000     -0.3835000    
 O   -2.454800       1.713000       1.571700    
 O    4.392300      0.1520000       1.613500    
 N   -1.609700      0.6556000     -0.6750000    
 N    2.164700     -9.5500000E-02  0.2679000    
 C    1.156800     -0.2203000     -0.7920000    
 C   1.7400000E-02  -1.160200     -0.3951000    
 C   -1.320600     -0.6944000     -0.3335000    
 C   0.6810000       1.158900      -1.185100    
 C   0.2913000      -2.507600     -0.1057000    
 C  -0.6112000       1.498200      -1.102200    
 C   -2.337400      -1.584900      4.6900000E-02
 C  -0.7329000      -3.377100      0.2659000    
 C   -2.043200      -2.915600      0.3465000    
 C   -3.202700       1.653200      0.6045000    
 C    4.348600      0.5941000      0.4728000    
 C   -4.614600       2.157200      0.6066000    
 C    5.502700       1.273600     -0.2017000    
 H    1.618500     -0.6655000      -1.685500    
 H    1.395500       1.887800      -1.556800    
 H    1.307600      -2.888900     -0.1681000    
 H  -0.9521000       2.488200      -1.384300    
 H   -3.373500      -1.261400      0.1042000    
 H    2.560300      -1.020200      0.4433000    
 H  -0.5079000      -4.415400      0.4915000    
 H   -2.840400      -3.594400      0.6354000    
 H   -5.302500       1.333400      0.3998000    
 H   -4.851100       2.568700       1.592000    
 H   -4.726700       2.949600     -0.1377000    
 H    6.357400       1.299600      0.4805000    
 H    5.789300      0.7164000      -1.097100    
 H    5.230400       2.300700     -0.4574000    


%chk=000093204-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093204

0 1
O -2.980868 1.008060 -0.529064
O 3.347940 1.022503 0.119018
O -3.040828 2.222441 1.508927
O 4.256300 -1.122495 0.351471
N -1.551791 0.787735 -0.291096
N 2.032305 0.445520 0.598652
C 1.221625 0.090968 -0.661532
C 0.172824 -0.927243 -0.230527
C -1.190625 -0.553083 -0.026995
C 0.598684 1.335762 -1.239081
C 0.547957 -2.270563 0.012619
C -0.710301 1.642547 -1.022847
C -2.139648 -1.509429 0.415480
C -0.389075 -3.226742 0.454705
C -1.734490 -2.835557 0.658413
C -3.626063 1.785004 0.513506
C 4.404444 0.086158 0.048705
C -5.075533 1.957182 0.117722
C 5.684561 0.766047 -0.374403
H 1.914962 -0.381922 -1.390070
H 1.236286 2.052890 -1.761166
H 1.594084 -2.561347 -0.147835
H -1.178833 2.566559 -1.366755
H -3.183210 -1.215529 0.551474
H 2.311367 -0.461533 1.047243
H -0.077921 -4.259698 0.639118
H -2.473550 -3.567825 1.001538
H -5.370582 1.238584 -0.660975
H -5.711862 1.840070 1.009547
H -5.225682 2.981136 -0.269321
H 6.139630 0.203537 -1.207030
H 5.502181 1.807667 -0.676238
H 6.400411 0.751195 0.466596


