%chk=000058057.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058057

0 1
 O    1.471000     -7.5499997E-02 -0.2916000    
 O   0.1784000      0.8308000      -1.959500    
 N  -0.7615000     -0.2229000     -0.1191000    
 N    3.884100      2.6799999E-02 -0.2188000    
 C   -3.042500      -1.161600      0.1392000    
 C   -3.948200      0.7097000      0.9603000    
 C   -2.151100     -5.5000000E-02 -0.4759000    
 C   -3.351300     -0.5813000       1.525700    
 C   -2.763100       1.245500      0.1251000    
 C   -4.416100      -1.021900     -0.4769000    
 C   -4.956600      0.1046000      1.1500000E-02
 C   0.2842000      0.2339000     -0.8932000    
 C    2.668300      0.3418000     -0.9824000    
 C    3.852800      0.6577000       1.101800    
 C    4.033500      -1.422600     -8.0100000E-02
 C    3.698100       2.164800      0.9868000    
 C    5.320200      -1.774800      0.6471000    
 H   -2.638900      -2.175200      0.1431000    
 H   -4.363500       1.396000       1.698700    
 H   -2.225800     -4.0300000E-02  -1.570600    
 H   -4.070300      -1.181000       2.098700    
 H   -2.460800     -0.4131000       2.141100    
 H   -2.044800       1.770700      0.7654000    
 H   -3.092600       1.933600     -0.6615000    
 H   -4.851800      -1.673800      -1.216900    
 H   -5.910100      0.5283000     -0.2600000    
 H  -0.5352000     -0.6708000      0.7639000    
 H    2.705600     -0.1793000      -1.948100    
 H    2.611600       1.410200      -1.219900    
 H    3.059400      0.2519000       1.742000    
 H    4.803200      0.5015000       1.622800    
 H    3.185200      -1.880600      0.4440000    
 H    4.080600      -1.875700      -1.078100    
 H    3.891900       2.628800       1.960500    
 H    2.685300       2.460400      0.6961000    
 H    4.411700       2.592600      0.2742000    
 H    5.525100      -2.844800      0.5283000    
 H    5.258400      -1.587400       1.723500    
 H    6.179500      -1.232000      0.2388000    


%chk=000058057-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000058057

0 1
O 1.289063 -1.172120 0.120480
O 0.455629 0.699933 -1.065291
N -0.821198 -0.423204 0.545992
N 3.680710 -0.395851 0.127626
C -2.946478 -0.065086 -0.830735
C -4.342483 -0.191558 0.964942
C -2.022488 0.407940 0.375459
C -3.797535 -1.166896 -0.127410
C -2.986069 0.292181 1.609973
C -3.998564 1.037193 -0.996251
C -4.836245 0.964260 0.079006
C 0.316909 -0.219489 -0.206277
C 2.673718 -1.029299 -0.629939
C 3.637052 1.085505 0.267814
C 4.190134 -1.123116 1.318928
C 3.625145 1.837011 -1.075362
C 5.725455 -1.054209 1.451429
H -2.371107 -0.338000 -1.726192
H -5.066413 -0.594007 1.689560
H -1.684050 1.440928 0.195277
H -4.592448 -1.571235 -0.775511
H -3.193029 -1.997528 0.284177
H -2.613309 -0.458197 2.333620
H -3.095837 1.248470 2.145980
H -3.989263 1.793062 -1.785723
H -5.651167 1.645799 0.338117
H -0.827686 -1.216586 1.187588
H 2.904934 -2.089588 -0.808506
H 2.441699 -0.484755 -1.556452
H 2.755191 1.395407 0.873504
H 4.537540 1.377468 0.838373
H 3.712740 -0.733884 2.245767
H 3.874979 -2.178806 1.229357
H 3.738792 2.921494 -0.892689
H 2.669104 1.689986 -1.605696
H 4.460357 1.503385 -1.717168
H 6.059421 -1.610916 2.346939
H 6.080706 -0.012871 1.553495
H 6.209991 -1.492824 0.561799


