%chk=000086108.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086108

0 1
 O   -2.315400     -0.1410000     -0.2358000    
 O   -3.898800       1.072700      0.9289000    
 C   0.6172000     -0.8359000     -0.1275000    
 C    1.751100      -1.865200     -0.4348000    
 C    1.129400      0.4737000      0.5291000    
 C  -0.5162000      -1.465500      0.7275000    
 C    2.195300       1.218200     -0.2843000    
 C    1.288400      -3.069100      -1.259700    
 C    2.456000      -2.354300      0.8369000    
 C   -1.719800     -0.5579000      0.9838000    
 C    2.670500       2.512900      0.3830000    
 C    3.672400       3.297900     -0.4499000    
 C   -3.405300      0.6780000     -0.1188000    
 C   -3.924900       1.035400      -1.478300    
 H   0.1794000     -0.5539000      -1.095400    
 H    2.502900      -1.363800      -1.054900    
 H    1.509600      0.2685000       1.536400    
 H   0.2914000       1.168200      0.6540000    
 H  -0.8879000      -2.359500      0.2146000    
 H  -0.1242000      -1.785200       1.699200    
 H    1.794200       1.446800      -1.279100    
 H    3.074300      0.5820000     -0.4295000    
 H   0.7479000      -2.742800      -2.154200    
 H    2.149300      -3.661700      -1.589000    
 H   0.6352000      -3.733300     -0.6855000    
 H    3.297500      -3.005500      0.5738000    
 H    1.788200      -2.935100       1.480100    
 H    2.866100      -1.525000       1.419600    
 H   -1.437300      0.3123000       1.585600    
 H   -2.461100      -1.127500       1.558300    
 H    3.122300       2.275600       1.353500    
 H    1.804800       3.155100      0.5846000    
 H    4.569800       2.701900     -0.6434000    
 H    3.237900       3.587100      -1.412000    
 H    3.974000       4.208800      7.6300003E-02
 H   -4.233000      0.1299000      -2.006700    
 H   -3.153400       1.566600      -2.041400    
 H   -4.794000       1.691200      -1.373800    


%chk=000086108-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086108

0 1
O -2.363277 -0.340654 -0.238289
O -3.982963 1.115301 0.592452
C 0.643528 -0.662878 0.055237
C 1.615314 -1.773988 -0.467833
C 1.387113 0.515724 0.746588
C -0.460664 -1.233919 0.990419
C 2.346840 1.313796 -0.166441
C 0.906591 -2.754234 -1.435433
C 2.329378 -2.552774 0.665342
C -1.704103 -0.349926 1.106671
C 2.928487 2.569094 0.523897
C 3.907321 3.352063 -0.377561
C -3.513472 0.445369 -0.355740
C -4.075623 0.354075 -1.758964
H 0.130598 -0.252881 -0.841304
H 2.398793 -1.256686 -1.059256
H 1.948654 0.138383 1.626842
H 0.634879 1.224552 1.151740
H -0.786176 -2.231337 0.641316
H -0.052062 -1.370528 2.012379
H 1.807947 1.620083 -1.087859
H 3.186421 0.669113 -0.496579
H 0.399070 -2.211134 -2.254538
H 1.636396 -3.451864 -1.887671
H 0.145061 -3.366738 -0.916748
H 3.052098 -3.275030 0.242137
H 1.608001 -3.128367 1.275394
H 2.888008 -1.881207 1.342700
H -1.471488 0.694123 1.383925
H -2.430582 -0.744313 1.840539
H 3.445321 2.264866 1.457193
H 2.095898 3.233510 0.833525
H 4.767316 2.720606 -0.671273
H 3.407650 3.688509 -1.305719
H 4.305043 4.246914 0.135504
H -4.347081 -0.690211 -1.992091
H -3.316111 0.667557 -2.495867
H -4.964326 0.995631 -1.843435


