%chk=000084694.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084694

0 1
 O    3.073900       1.377900      0.7909000    
 C   -1.995300      9.9799998E-02 -0.1207000    
 C   -3.484500     -2.5699999E-02  0.2137000    
 C   -1.152400      -1.020700      0.4911000    
 C   -4.291200       1.099000     -0.4168000    
 C   0.2710000     -0.8949000      0.1499000    
 C    2.855400     -0.6532000     -0.4829000    
 C    3.289200      0.8061000     -0.4936000    
 C    1.433800     -0.7884000     -0.1315000    
 H   -1.623700       1.070400      0.2332000    
 H   -1.867300      9.7900003E-02  -1.211200    
 H   -3.865300     -0.9887000     -0.1454000    
 H   -3.623200     -5.2999998E-03   1.300700    
 H   -1.266800      -1.011000       1.581400    
 H   -1.524200      -1.991000      0.1412000    
 H   -3.953500       2.075100     -5.4200001E-02
 H   -4.197000       1.085700      -1.507400    
 H   -5.351100      0.9914000     -0.1660000    
 H    3.452300      -1.208200      0.2503000    
 H    3.042100      -1.098700      -1.465800    
 H    4.350700      0.8972000     -0.7441000    
 H    2.712400       1.385900      -1.221600    
 H    3.608900      0.8752000       1.428600    


%chk=000084694-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084694

0 1
O 3.261554 1.485968 0.811544
C -2.028908 0.110249 -0.157375
C -3.523550 -0.021334 0.210637
C -1.171607 -1.029880 0.461868
C -4.389307 1.101213 -0.400340
C 0.263783 -0.922518 0.142778
C 2.891777 -0.664620 -0.459082
C 3.387258 0.805664 -0.480017
C 1.461844 -0.813635 -0.136053
H -1.638994 1.086014 0.191408
H -1.910073 0.096385 -1.258457
H -3.899210 -1.007974 -0.130631
H -3.629746 -0.012417 1.314933
H -1.306940 -1.023364 1.562887
H -1.560142 -2.006856 0.107725
H -4.053294 2.095354 -0.050368
H -4.324096 1.095739 -1.504680
H -5.453640 0.987340 -0.124003
H 3.503637 -1.242017 0.266401
H 3.098699 -1.107187 -1.455513
H 4.441080 0.819609 -0.834625
H 2.770924 1.404733 -1.169172
H 3.703153 0.939333 1.509934


