%chk=000104896.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104896

0 1
 O   0.6156000       2.366600      0.5746000    
 O   0.1259000       1.261300      -1.344300    
 C  -1.3500000E-02  6.3699998E-02  0.7799000    
 C   -1.162600     -0.7937000      0.2098000    
 C   -2.524500     -9.9200003E-02  0.1167000    
 C    1.303800     -0.6957000       1.027600    
 C   0.2372000       1.265200     -0.1252000    
 C   -3.635100      -1.001000     -0.3985000    
 C    1.907800      -1.313800     -0.2022000    
 C    3.145400      -1.053400     -0.6385000    
 H  -0.3605000      0.4552000       1.746200    
 H  -0.8985000      -1.155800     -0.7917000    
 H   -1.272100      -1.685200      0.8410000    
 H   -2.806300      0.2734000       1.108800    
 H   -2.455900      0.7746000     -0.5408000    
 H    2.024900     -1.5000000E-02   1.498500    
 H    1.117100      -1.498300       1.751900    
 H   -4.582000     -0.4536000     -0.4394000    
 H   -3.770000      -1.867300      0.2568000    
 H   -3.406800      -1.364100      -1.405500    
 H    1.312900      -2.041300     -0.7474000    
 H   0.7800000       3.134300     -1.3400000E-02
 H    3.530200      -1.545900      -1.524800    
 H    3.791700     -0.3495000     -0.1260000    


%chk=000104896-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000104896

0 1
O 1.008331 2.254705 0.476945
O -0.116447 1.435116 -1.376620
C -0.074363 0.109578 0.733569
C -1.190194 -0.787763 0.148629
C -2.590723 -0.133737 0.184057
C 1.254626 -0.669227 1.039915
C 0.229583 1.287926 -0.184379
C -3.688517 -1.065165 -0.372773
C 1.918777 -1.269395 -0.182542
C 3.196911 -1.021136 -0.562601
H -0.415205 0.536471 1.698809
H -0.944078 -1.048781 -0.898057
H -1.215041 -1.734332 0.726392
H -2.838426 0.148929 1.228293
H -2.568786 0.802426 -0.406105
H 1.959872 0.007717 1.554495
H 0.988242 -1.477221 1.752253
H -4.681917 -0.581646 -0.339194
H -3.749390 -2.004394 0.209511
H -3.479847 -1.334112 -1.425218
H 1.307660 -1.957428 -0.785349
H 1.217598 2.991419 -0.159403
H 3.633208 -1.488409 -1.452617
H 3.842827 -0.340041 0.006091


