%chk=000097712.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097712

0 1
 O    3.219500       1.020900      0.7418000    
 O   -2.925100       2.516100      6.3000000E-03
 O   -1.096600      -3.576400      0.1847000    
 N  -0.2354000     -3.5999999E-03 -0.1205000    
 C   0.8451000      0.7984000      0.4369000    
 C   -1.536900      0.5792000      0.2130000    
 C  -0.1591000      -1.383200      0.3650000    
 C    2.220900      0.1945000      0.1443000    
 C   -1.643600       1.997400     -0.3246000    
 C   -1.218200      -2.246200     -0.3020000    
 C    2.529300      0.1028000      -1.344800    
 H   0.8689000       1.806900      1.0800000E-02
 H   0.7303000      0.9273000       1.522000    
 H   -1.724100      0.5743000       1.295100    
 H   -2.363600      2.9999999E-02 -0.2467000    
 H  -0.2566000      -1.440200       1.457500    
 H   0.7892000      -1.866900      0.1144000    
 H    2.362000     -0.7837000      0.6103000    
 H   -1.520700       2.035800      -1.412200    
 H  -0.9323000       2.687300      0.1334000    
 H   -1.092000      -2.261200      -1.389800    
 H   -2.238800      -1.941300     -6.3400000E-02
 H    3.554000     -0.2534000      -1.498600    
 H    2.469800       1.089400      -1.818000    
 H    1.849200     -0.5772000      -1.865400    
 H    3.043600       1.051100       1.697800    
 H   -3.590400       1.963100     -0.4377000    
 H   -1.769800      -4.110700     -0.2702000    


%chk=000097712-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097712

0 1
O 3.427098 0.724491 0.613187
O -2.721422 2.690537 -0.623774
O -1.204703 -3.680361 0.219363
N -0.279843 -0.061860 0.348149
C 0.966056 0.578067 0.816579
C -1.484485 0.793970 0.436205
C -0.473412 -1.460960 0.792427
C 2.211301 0.149074 -0.002119
C -1.598544 1.750718 -0.771053
C -0.983289 -2.342901 -0.356144
C 2.185051 0.656955 -1.443053
H 0.867315 1.675698 0.727660
H 1.157896 0.361574 1.899984
H -1.509883 1.400539 1.371578
H -2.378505 0.139040 0.458848
H -1.184943 -1.540878 1.645094
H 0.489096 -1.874873 1.143539
H 2.280987 -0.961922 0.003041
H -1.673560 1.160402 -1.708280
H -0.708554 2.397178 -0.841058
H -0.226677 -2.364773 -1.167684
H -1.927929 -1.925776 -0.768147
H 3.055452 0.277233 -2.004598
H 2.223247 1.761308 -1.453826
H 1.256804 0.322894 -1.937926
H 3.482064 0.426692 1.557869
H -3.571777 2.182666 -0.625376
H -1.496241 -4.304232 -0.491084


