%chk=000048185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048185

0 1
 O    2.661100      9.7300000E-02  -1.648900    
 O    3.755800     -0.2899000      0.4628000    
 O   -3.500700       1.942200     -4.1099999E-02
 O   -1.353500       2.530000     -0.4656000    
 N   -3.001900      -3.156200     -0.6946000    
 C   -1.808400      0.3104000      0.4380000    
 C   -2.513300     -0.7689000     -0.4102000    
 C  -0.2947000      0.1427000      0.4823000    
 C   0.4147000      0.2181000     -0.7008000    
 C   -2.305800      -2.182900      0.1407000    
 C    1.782400      5.9999999E-02 -0.6103000    
 C   0.3128000     -7.9899997E-02   1.713300    
 C    2.407600     -0.1612000      0.5955000    
 C   -2.165000       1.699300     -7.6499999E-02
 C    1.699500     -0.2365000       1.777200    
 C    3.909500     -0.1246000     -0.9616000    
 H   -2.200400      0.2636000       1.463400    
 H   -2.171300     -0.7197000      -1.452500    
 H   -3.591000     -0.5599000     -0.4409000    
 H  -5.7200000E-02  0.3885000      -1.661400    
 H   -1.244100      -2.446800      0.1636000    
 H   -2.686200      -2.251600       1.165400    
 H  -0.2686000     -0.1361000       2.629100    
 H    2.195800     -0.4115000       2.725000    
 H    4.568800      0.7312000      -1.146500    
 H    4.379900      -1.026100      -1.370800    
 H   -2.661100      -3.090300      -1.653100    
 H   -3.994200      -2.925700     -0.7344000    
 H   -3.717200       2.842100     -0.3659000    


%chk=000048185-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048185

0 1
O 2.771314 0.182202 -1.624288
O 3.790411 -0.306721 0.497431
O -2.787313 2.533631 0.728832
O -2.157199 2.016207 -1.443135
N -3.014530 -3.327198 -0.653860
C -1.912757 0.308166 0.342976
C -2.577784 -0.817677 -0.509973
C -0.386370 0.163236 0.429377
C 0.410687 0.288145 -0.749304
C -2.411292 -2.227990 0.120617
C 1.786415 0.115252 -0.606190
C 0.223101 -0.117979 1.676553
C 2.386792 -0.170701 0.639330
C -2.274795 1.666398 -0.246743
C 1.629304 -0.293580 1.804850
C 4.073781 -0.017859 -0.935072
H -2.324189 0.275979 1.367411
H -2.144736 -0.807253 -1.528291
H -3.659530 -0.599121 -0.620205
H -0.038370 0.534271 -1.715534
H -1.336656 -2.449338 0.254169
H -2.859616 -2.230533 1.133942
H -0.402703 -0.203368 2.571456
H 2.095353 -0.513723 2.768313
H 4.664016 0.913362 -1.003526
H 4.586713 -0.886222 -1.381028
H -2.550794 -3.517518 -1.547392
H -4.032150 -3.265698 -0.757450
H -2.993801 3.413228 0.307936


