%chk=000105399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105399

0 1
 O    2.624400      -1.494300     -0.2603000    
 O   -3.875300      -1.121100     -2.1900000E-02
 N    2.365700       1.302300     -8.5500002E-02
 N   -2.441000      0.7489000      3.8199998E-02
 C    1.235800      0.4559000     -9.8999999E-02
 C    1.386800     -0.9282000     -0.1854000    
 C  -4.0100001E-02   1.014900     -2.4499999E-02
 C   -1.164800      0.1899000     -3.6400001E-02
 C   0.2619000      -1.753100     -0.1972000    
 C   -1.013900      -1.194100     -0.1228000    
 C    2.612600       2.176200       1.043100    
 C    3.298400       1.296500      -1.193900    
 C   -3.676500      8.7800004E-02  3.9600000E-02
 C    3.254700      -1.837700      0.9718000    
 C   -4.828700       1.056100      0.1342000    
 H  -0.1611000       2.094400      3.7000000E-02
 H   0.3731000      -2.832000     -0.2655000    
 H   -1.835600      -1.896300     -0.1379000    
 H    2.423400       1.658700       1.990000    
 H    1.970700       3.061700      0.9934000    
 H    3.653800       2.516600       1.060200    
 H    4.136500      0.6230000     -0.9888000    
 H    3.705800       2.299600      -1.361300    
 H    2.817000      0.9837000      -2.127300    
 H   -2.467300       1.764800      9.8700002E-02
 H    2.666800      -2.591500       1.505000    
 H    3.388300     -0.9522000       1.600900    
 H    4.239100      -2.257300      0.7470000    
 H   -4.767800       1.611900       1.074100    
 H   -5.775500      0.5098000      0.1047000    
 H   -4.796600       1.754800     -0.7066000    


%chk=000105399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105399

0 1
O 2.661432 -1.715782 -0.440327
O -3.959601 -1.019068 -0.247533
N 2.455522 1.140225 0.194610
N -2.429859 0.718357 0.161989
C 1.299521 0.336122 0.004562
C 1.403681 -1.063030 -0.308951
C -0.009767 0.867521 0.155317
C -1.170820 0.069896 -0.022533
C 0.247320 -1.833542 -0.519049
C -1.049813 -1.294392 -0.384258
C 2.291265 2.460937 0.816550
C 3.519868 1.100150 -0.835548
C -3.716477 0.186822 0.051339
C 3.377583 -1.893192 0.842298
C -4.824799 1.205257 0.333956
H -0.130304 1.932694 0.385036
H 0.383807 -2.890366 -0.771326
H -1.942652 -1.901511 -0.533973
H 1.679608 2.381800 1.732041
H 1.821224 3.215141 0.141311
H 3.286944 2.844509 1.101614
H 4.476898 1.432511 -0.392810
H 3.283067 1.766988 -1.694961
H 3.638826 0.072162 -1.208640
H -2.376763 1.708361 0.413724
H 2.781989 -2.526997 1.526811
H 3.579710 -0.915884 1.319451
H 4.321446 -2.399970 0.587749
H -4.780135 1.565563 1.378818
H -5.796147 0.716456 0.172625
H -4.751974 2.081961 -0.336290


