%chk=000083279.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083279

0 1
 O   0.4085000       1.283800     -8.3700001E-02
 O    4.181500     -0.2461000     -0.5979000    
 O  -0.5053000     -0.8457000      0.1461000    
 O    3.855100       2.538600      6.9100000E-02
 O  -0.1726000       3.942300      0.2751000    
 O   0.9058000      -3.268200     -0.8363000    
 O   -3.410800     -0.1370000      -2.627700    
 O   -1.355600     -0.7584000      -2.170600    
 N    2.117400      -1.920100      0.6241000    
 N   -2.489900     -0.3663000      -1.808300    
 C    1.879100     -0.6524000     -3.4699999E-02
 C    3.083000      0.2757000      0.1526000    
 C    2.780500       1.694300     -0.3351000    
 C    1.457100       2.195500      0.2487000    
 C   0.5946000     -6.5000001E-03  0.4960000    
 C    1.061300       3.560300     -0.3054000    
 C    1.606600      -3.119400      0.1613000    
 C   -1.747800     -0.4165000      0.5248000    
 C    2.027000      -4.284000       1.017300    
 C   -2.740500     -0.1747000     -0.4216000    
 C   -2.006500     -0.2244000       1.879800    
 C   -3.999900      0.2618000     -1.0400000E-02
 C   -3.266000      0.2122000       2.290900    
 C   -4.262600      0.4552000       1.345800    
 H    1.752300     -0.8630000      -1.105500    
 H    3.402700      0.2998000       1.201800    
 H    2.745900       1.698600      -1.432000    
 H    1.517800       2.278100       1.342400    
 H   0.6583000      8.7399997E-02   1.588300    
 H   0.9248000       3.528200      -1.391400    
 H    1.800600       4.328700     -6.4599998E-02
 H    2.639700      -1.914200       1.495800    
 H    3.923000     -0.2702000      -1.535100    
 H    3.758200       3.386000     -0.3965000    
 H  -0.8239000       3.251800      6.3199997E-02
 H    1.522300      -5.192800      0.6780000    
 H    3.108700      -4.425000      0.9405000    
 H    1.755700      -4.099500       2.060700    
 H   -1.251600     -0.4274000       2.633800    
 H   -4.802400      0.4618000     -0.7159000    
 H   -3.472300      0.3584000       3.347100    
 H   -5.243300      0.7940000       1.666600    


%chk=000083279-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083279

0 1
O 0.518437 1.851472 -0.140815
O 4.182462 -0.178404 -0.487072
O -0.742649 -0.130944 -0.391833
O 4.133382 2.377640 0.578816
O 0.367518 4.554798 0.617377
O 3.587742 -2.645374 -0.101804
O -3.617765 -2.897105 -1.126805
O -1.426398 -2.766040 -0.547760
N 1.406185 -1.776262 -0.216252
N -2.632030 -2.287917 -0.565006
C 1.654554 -0.333884 -0.460354
C 2.957049 0.268071 0.143244
C 2.967993 1.799233 -0.079653
C 1.720124 2.487733 0.487936
C 0.469468 0.434683 0.177356
C 1.626470 3.974540 0.140614
C 2.315156 -2.801140 -0.107905
C -1.946414 -0.001699 0.305043
C 1.720801 -4.195751 0.025041
C -2.922382 -1.026362 0.146817
C -2.267197 1.134111 1.085469
C -4.212737 -0.891873 0.711118
C -3.539801 1.243111 1.682557
C -4.520557 0.239995 1.487000
H 1.648193 -0.128259 -1.550653
H 2.968974 0.058722 1.238968
H 3.014073 1.966702 -1.178589
H 1.666204 2.349656 1.588776
H 0.458049 0.294806 1.284283
H 1.741663 4.107208 -0.955421
H 2.432362 4.517575 0.655914
H 0.411447 -2.041516 -0.299594
H 4.204673 -1.197362 -0.372916
H 4.898104 1.789408 0.332374
H -0.368656 4.096297 0.136653
H 2.154189 -4.840029 -0.758548
H 2.020861 -4.622495 0.997834
H 0.622448 -4.214027 -0.058155
H -1.528671 1.934834 1.184836
H -4.942472 -1.688866 0.543872
H -3.772455 2.126439 2.286179
H -5.511899 0.338977 1.938158


