%chk=000097766.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097766

0 1
 O    3.011300      -1.045200      -1.967200    
 O   -5.499600      -1.333100     -0.2410000    
 O   -5.788600       1.424200     -0.4295000    
 O    1.773300      -2.046200      0.9954000    
 C   -2.048800     -0.2392000      0.2682000    
 C    2.985800     -0.1743000      0.2672000    
 C  -0.7371000     -0.8176000      0.5135000    
 C   -3.161900      -1.068400      0.1292000    
 C   -2.193800       1.144800      0.1722000    
 C    1.727000     -0.8993000      0.5646000    
 C    3.565200     -0.2830000     -0.9823000    
 C   0.4427000     -0.1959000      0.2911000    
 C   -4.420000     -0.5136000     -0.1056000    
 C    3.546200      0.5970000       1.267700    
 C   -4.565000      0.8704000     -0.2017000    
 C   -3.451900       1.699500     -6.2899999E-02
 C    4.750400      0.4052000      -1.241500    
 C    4.731400       1.285500       1.008600    
 C    5.333500       1.189400     -0.2460000    
 H  -0.7408000      -1.837300      0.8925000    
 H   -3.061500      -2.149300      0.2005000    
 H   -1.360000       1.830100      0.2934000    
 H   0.5173000      0.8084000     -0.1095000    
 H    3.083700      0.6757000       2.247300    
 H   -3.552000       2.779500     -0.1311000    
 H    5.224900      0.3347000      -2.216600    
 H    5.185500       1.896000       1.783500    
 H    6.256400       1.725200     -0.4478000    
 H    2.211400      -1.489800      -1.643700    
 H   -6.285000     -0.7809000     -0.3986000    
 H   -5.696600       2.391800     -0.4652000    


%chk=000097766-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097766

0 1
O 4.122915 -2.159179 -0.818838
O -5.643342 -1.319532 -0.293987
O -6.116330 1.220835 0.497371
O 1.647450 -1.993677 -0.684607
C -2.123209 -0.104791 -0.013108
C 2.992030 -0.072323 -0.171710
C -0.785710 -0.661020 -0.220477
C -3.247289 -0.952320 -0.243539
C -2.353633 1.239495 0.405809
C 1.681903 -0.738127 -0.318791
C 4.188155 -0.843546 -0.438924
C 0.421388 -0.024147 -0.065284
C -4.555010 -0.477283 -0.063977
C 3.147486 1.293024 0.218064
C -4.760409 0.866714 0.353623
C -3.663390 1.721714 0.587833
C 5.469205 -0.242818 -0.311539
C 4.415378 1.878318 0.340835
C 5.578715 1.101484 0.073386
H -0.731602 -1.711961 -0.539674
H -3.107102 -1.989143 -0.565710
H -1.510316 1.911225 0.590940
H 0.469734 1.022382 0.247833
H 2.263240 1.903107 0.427037
H -3.831422 2.756784 0.910416
H 6.348522 -0.858123 -0.522302
H 4.511610 2.926516 0.640797
H 6.570919 1.556793 0.168684
H 3.101844 -2.400970 -0.853829
H -6.485233 -0.822149 -0.119049
H -6.233097 2.157019 0.787419


