%chk=000001721.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001721

0 1
 O   -1.124300      0.9850000      0.5442000    
 O    1.027500       2.413400       1.233700    
 O    3.618000       1.226700       1.203800    
 O    4.216200       1.605400      -1.458100    
 O    1.401200      -3.449400     -0.2527000    
 O   -3.339200       1.993300       1.277500    
 O   -4.610900      0.7271000     -0.1400000    
 N   0.1264000      -1.715600      0.6330000    
 N  -0.6734000     -0.7587000      -2.857300    
 C   0.1196000      0.6544000     -9.8099999E-02
 C   0.1754000     -0.8296000     -0.5164000    
 C    1.249700       1.060700      0.8437000    
 C  -0.9912000      -1.146200      -1.478500    
 C    2.637900      0.9059000      0.2098000    
 C   -2.250500     -0.4528000      -1.034100    
 C   -2.245600      0.4965000     -8.5299999E-02
 C    2.890000       1.823900     -0.9841000    
 C   0.7469000      -2.949900      0.6588000    
 C   -3.533700       1.059700      0.3221000    
 C   0.5597000      -3.650000       1.978000    
 H   0.1622000       1.291800     -0.9906000    
 H    1.116200      -1.038100      -1.039100    
 H    1.199500      0.4866000       1.775700    
 H   -1.184900      -2.226000      -1.482200    
 H    2.838800     -0.1314000     -7.5300001E-02
 H   -3.175000     -0.7817000      -1.502100    
 H  -0.4330000      -1.428600       1.431400    
 H   0.1283000      -1.298700      -3.181800    
 H  -0.3766000      0.2160000      -2.887100    
 H    2.822300       2.878600     -0.7004000    
 H    2.200800       1.620300      -1.807500    
 H   0.8948000       2.947800      0.4327000    
 H    3.498400      0.6072000       1.943800    
 H   0.9728000      -4.660900       1.921400    
 H    1.077600      -3.094900       2.765100    
 H  -0.5051000      -3.718000       2.219000    
 H    4.349700       2.201100      -2.215100    
 H   -4.182400       2.395300       1.577300    


%chk=000001721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001721

0 1
O -0.997569 0.854182 0.597293
O 1.064680 2.453828 1.288856
O 3.645214 1.678366 1.448185
O 2.436423 1.151920 -2.037652
O 1.281675 -3.553055 -0.261968
O -3.225412 2.080833 1.237112
O -4.514341 0.901939 -0.299428
N 0.159007 -1.761225 0.690675
N -0.404721 -0.825598 -2.954386
C 0.304880 0.573332 -0.100153
C 0.338391 -0.910319 -0.495667
C 1.355777 1.059262 0.901929
C -0.785350 -1.160894 -1.574094
C 2.812393 1.090962 0.388998
C -2.055668 -0.423778 -1.195609
C -2.118882 0.478276 -0.169940
C 3.029327 1.901802 -0.902487
C 0.637422 -3.062817 0.717537
C -3.395205 1.138535 0.214754
C 0.353601 -3.850956 1.990905
H 0.332376 1.187636 -1.019272
H 1.306316 -1.161454 -0.961131
H 1.329555 0.416508 1.806230
H -0.997396 -2.247776 -1.556147
H 3.185663 0.063753 0.241717
H -2.963001 -0.617618 -1.774620
H -0.418245 -1.404202 1.455874
H 0.259319 -1.486033 -3.370135
H -0.122414 0.150454 -3.089944
H 4.121341 2.019677 -1.034493
H 2.554752 2.898465 -0.811096
H 0.098746 2.512371 1.510173
H 3.127167 2.445736 1.815384
H -0.184486 -4.778575 1.730647
H 1.311730 -4.148959 2.450892
H -0.238246 -3.289628 2.734402
H 2.893671 1.413264 -2.873873
H -4.114389 2.477990 1.445729


