%chk=000024189.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024189

0 1
 O   -1.617900      -1.535800     -0.7531000    
 O  -0.3824000      0.1173000      -2.033600    
 O   0.3966000     -0.1781000       2.587700    
 O    3.677200      -1.289700     -0.4219000    
 N    1.676900     -0.4905000      -1.225500    
 N    2.065700     -0.6387000       1.083000    
 C   7.8599997E-02  0.5711000      0.3035000    
 C   -1.433800      0.4784000      0.5525000    
 C   0.5081000       2.049000      0.3258000    
 C   -1.927300     -0.9644000      0.5149000    
 C   0.4003000      3.3500001E-02  -1.087400    
 C   0.8253000     -0.1280000       1.435100    
 C   -3.433900      -1.025900      0.7277000    
 C  -0.2827000       2.845000     -0.6584000    
 C    2.558100     -0.8224000     -0.2036000    
 C   -2.036000      -2.890700     -0.8268000    
 C   -1.072800       3.869900     -0.3197000    
 H   -1.993700       1.029100     -0.2141000    
 H   -1.694600      0.9300000       1.518800    
 H    1.572200       2.150500      7.5099997E-02
 H   0.3969000       2.460800       1.338000    
 H   -1.436600      -1.547300       1.303000    
 H   -3.975800     -0.6469000     -0.1460000    
 H   -3.780400      -2.048600      0.9085000    
 H   -3.729900     -0.4359000       1.601800    
 H    1.969300     -0.7308000      -2.168600    
 H    2.644900     -0.9881000       1.841400    
 H  -0.1632000       2.633400      -1.717100    
 H   -3.110800      -2.962100      -1.015100    
 H   -1.756800      -3.453700      6.9600001E-02
 H   -1.528500      -3.347600      -1.681800    
 H   -1.597200       4.434800      -1.082700    
 H   -1.213200       4.161100      0.7153000    


%chk=000024189-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000024189

0 1
O -1.230214 -1.765981 -0.260967
O -0.339687 0.697645 -2.322583
O 0.343838 -0.255968 2.381358
O 3.219453 -1.899245 -0.871364
N 1.465933 -0.507522 -1.545960
N 1.802517 -0.974831 0.741055
C -0.036741 0.622129 0.121308
C -1.575470 0.549178 0.330236
C 0.478596 2.107894 0.377819
C -2.097917 -0.885862 0.560171
C 0.304799 0.261568 -1.334371
C 0.678758 -0.245223 1.166431
C -3.582608 -1.018144 0.185812
C -0.267165 3.171459 -0.400303
C 2.232144 -1.176489 -0.581299
C -1.396026 -3.194355 0.009309
C -0.865951 4.243388 0.175966
H -2.046023 0.991073 -0.565587
H -1.852596 1.170495 1.199681
H 1.559026 2.148011 0.125588
H 0.384965 2.297202 1.463110
H -1.944802 -1.164908 1.625724
H -3.718397 -0.849242 -0.897277
H -3.988206 -2.012381 0.444352
H -4.178459 -0.263387 0.731711
H 1.726652 -0.685874 -2.521021
H 2.323850 -1.486805 1.459876
H -0.298225 3.049895 -1.491386
H -2.373670 -3.568435 -0.352927
H -1.301786 -3.410825 1.094537
H -0.589602 -3.705884 -0.540138
H -1.371277 5.006944 -0.425894
H -0.863109 4.393183 1.263335


