%chk=000056184.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056184

0 1
 O    1.242700       2.751100     -9.9999997E-05
 O    3.867600      0.3647000      0.2142000    
 O   0.6728000      -3.486600     -0.2094000    
 O   0.9988000      -1.878800      -1.774700    
 O   -3.302700      -1.687700      0.1285000    
 N    1.572400     -5.2900001E-02  0.2063000    
 C    1.710100      -1.468700      0.5239000    
 C   0.2764000      0.5255000      8.7399997E-02
 C   0.1591000       1.916500     -1.5500000E-02
 C    2.707200      0.7386000      4.5299999E-02
 C    2.416400       2.130800     -0.4777000    
 C  -0.8968000     -0.2431000      0.1158000    
 C    1.059700      -1.772600       1.841200    
 C   -2.151200      0.3690000      4.1600000E-02
 C   -1.095400       2.530400     -6.9700003E-02
 C    1.099600      -2.261000     -0.6158000    
 C   -2.250700       1.754400     -4.8700001E-02
 C   -3.357100     -0.4443000      4.9100000E-02
 C   -4.729100      0.2147000     -4.1800000E-02
 H    2.771000      -1.738900      0.5682000    
 H    3.257600       2.775000     -0.1986000    
 H    2.385900       2.089400      -1.573700    
 H  -0.9020000      -1.321100      0.1537000    
 H    1.291200      -1.003800       2.588400    
 H    1.468600      -2.712500       2.235600    
 H  -2.0900000E-02  -1.921600       1.843000    
 H   -1.176200       3.612500     -0.1316000    
 H   -3.204600       2.269400     -0.1024000    
 H   -4.823800      0.7637000     -0.9822000    
 H   -4.891600      0.8699000      0.8179000    
 H   -5.500600     -0.5618000     -2.5200000E-02
 H   0.2812000      -3.999800     -0.9480000    


%chk=000056184-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056184

0 1
O 1.271010 2.773974 0.059464
O 3.823313 0.190316 0.023506
O 1.058893 -3.696824 -0.154650
O 1.077045 -2.037460 -1.780231
O -3.376174 -1.671761 0.038099
N 1.497175 -0.047356 0.193101
C 1.673105 -1.472630 0.567308
C 0.202895 0.555435 0.070449
C 0.114795 1.980603 0.030044
C 2.662405 0.682242 -0.072621
C 2.453736 2.120368 -0.540407
C -0.992928 -0.184728 0.042879
C 1.108436 -1.828296 1.958470
C -2.257354 0.459680 0.010970
C -1.131976 2.633783 0.007932
C 1.221341 -2.378572 -0.589322
C -2.319238 1.878092 0.003570
C -3.480945 -0.408746 -0.006245
C -4.853453 0.252746 -0.076675
H 2.776086 -1.600536 0.605872
H 3.321877 2.721755 -0.237910
H 2.359523 2.134507 -1.645562
H -1.005910 -1.277982 0.044488
H 1.585875 -1.185876 2.717987
H 1.340205 -2.880322 2.187982
H 0.017177 -1.697740 2.024539
H -1.143565 3.727279 -0.009757
H -3.282885 2.395526 -0.016110
H -4.948979 0.876707 -0.984578
H -5.025394 0.908132 0.797484
H -5.626561 -0.530126 -0.094704
H 0.816069 -4.271792 -0.930371


