%chk=000086093.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086093

0 1
 O   -1.726400      0.9025000     -0.5782000    
 O    2.411400      0.3749000      4.8999999E-02
 O   0.6737000       2.217000      -1.157600    
 O    4.142100      0.3699000       1.566600    
 C   0.4049000       1.722600      0.1565000    
 C  -0.4995000      0.5042000      2.4599999E-02
 C    1.727700       1.365200      0.8244000    
 C   -2.840100      0.1795000     -0.2431000    
 C   -2.714800      -1.165100      8.8699996E-02
 C   -4.086200      0.7970000     -0.2384000    
 C    3.613300     -3.3000000E-02  0.5402000    
 C   -3.849500      -1.901500      0.4293000    
 C   -5.220800      6.0400002E-02  0.1022000    
 C    4.201900      -1.056600     -0.3678000    
 C   -5.102400      -1.288800      0.4361000    
 C    3.469800      -1.481600      -1.603700    
 C    5.394900      -1.566700     -2.8800000E-02
 H  -0.1039000       2.521000      0.7065000    
 H  -0.6572000      9.2500001E-02   1.029800    
 H  -3.9200000E-02 -0.2543000     -0.6197000    
 H    1.553300      0.9859000       1.837900    
 H    2.361100       2.258900      0.8739000    
 H    1.163900       1.529200      -1.640000    
 H   -1.763300      -1.687400      6.7900002E-02
 H   -4.183000       1.847400     -0.4978000    
 H   -3.758800      -2.953700      0.6828000    
 H   -6.196600      0.5374000      0.1071000    
 H   -5.986000      -1.862500      0.6997000    
 H    2.497000      -1.912700      -1.345300    
 H    3.309400     -0.6266000      -2.268800    
 H    4.025200      -2.238100      -2.168500    
 H    5.876100      -2.316200     -0.6496000    
 H    5.929500      -1.262600      0.8649000    


%chk=000086093-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086093

0 1
O -1.813526 1.151806 0.101492
O 2.434724 0.439821 0.005067
O 0.612306 2.321590 -1.206106
O 4.271065 0.457093 1.435017
C 0.487057 1.857392 0.179762
C -0.454160 0.648556 0.313620
C 1.866181 1.579917 0.785390
C -2.864869 0.218994 0.104370
C -2.705418 -1.169511 0.340898
C -4.150659 0.759878 -0.146987
C 3.686564 -0.033868 0.440111
C -3.845187 -2.008378 0.322614
C -5.274213 -0.088869 -0.160258
C 4.174047 -1.158226 -0.424324
C -5.130009 -1.479481 0.074069
C 3.330823 -1.604436 -1.601045
C 5.370207 -1.718707 -0.092568
H 0.031586 2.710506 0.712965
H -0.371598 0.204456 1.328653
H -0.202387 -0.128136 -0.436512
H 1.821767 1.302615 1.854057
H 2.529961 2.453182 0.666841
H 1.124498 1.637025 -1.710648
H -1.720789 -1.603279 0.540267
H -4.240447 1.835055 -0.329829
H -3.720510 -3.081744 0.506035
H -6.265546 0.334959 -0.355887
H -6.005992 -2.136303 0.062174
H 2.325198 -1.924404 -1.273651
H 3.183645 -0.778963 -2.321148
H 3.812134 -2.444974 -2.128454
H 5.793951 -2.543577 -0.675197
H 5.937093 -1.351889 0.770009


