%chk=000087768.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087768

0 1
 O    4.587600      0.5855000      6.2700003E-02
 O   -1.983000     -0.4308000       2.174600    
 O  -0.9499000      -2.439200     -0.3278000    
 C   0.6663000     -0.7566000     -0.1620000    
 C   -1.875300     -0.2940000     -0.2171000    
 C  -0.7081000      -1.226300     -0.2393000    
 C   0.9312000      0.6093000     -6.2899999E-02
 C    1.719100      -1.671300     -0.1861000    
 C   -2.445600      5.0600000E-02  0.9866000    
 C   -2.334900      0.1861000      -1.423100    
 C    3.301800      0.1457000     -1.2200000E-02
 C    2.249100       1.060400      1.1900000E-02
 C    3.036900      -1.220100     -0.1111000    
 C   -3.534500      0.9223000      0.9854000    
 C   -3.423900       1.057700      -1.424100    
 C   -4.023800       1.425900     -0.2199000    
 C    4.787000       1.994800      0.1642000    
 H   0.1420000       1.354600     -4.0399998E-02
 H    1.539700      -2.740600     -0.2623000    
 H   -1.871900     -9.7400002E-02  -2.363400    
 H    2.384000       2.134000      8.7399997E-02
 H    3.853100      -1.937200     -0.1299000    
 H   -4.011700       1.217800       1.916000    
 H   -3.804800       1.449800      -2.362500    
 H   -4.871600       2.104600     -0.2209000    
 H   -2.521500     -6.4900003E-02   2.897100    
 H    4.356900       2.396600       1.087900    
 H    4.421400       2.518000     -0.7259000    
 H    5.867400       2.165600      0.2141000    


%chk=000087768-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087768

0 1
O 4.678041 0.464266 0.372142
O -1.271131 0.285700 1.824196
O -0.888840 -2.243336 -1.268245
C 0.661273 -0.645007 -0.366924
C -1.923460 -0.246891 -0.448780
C -0.712499 -1.116129 -0.701216
C 0.968735 0.719205 -0.136048
C 1.722895 -1.596235 -0.350537
C -2.200527 0.419006 0.777889
C -2.903824 -0.184014 -1.474090
C 3.331655 0.172563 0.132979
C 2.292141 1.138414 0.104851
C 3.041001 -1.199910 -0.094978
C -3.400403 1.153228 0.949392
C -4.095218 0.552327 -1.318637
C -4.340209 1.227017 -0.099384
C 5.044083 1.863643 0.612606
H 0.167582 1.464667 -0.159621
H 1.479945 -2.645461 -0.546781
H -2.706327 -0.739480 -2.396801
H 2.502274 2.199773 0.265759
H 3.863901 -1.920288 -0.068196
H -3.601598 1.655082 1.905420
H -4.826553 0.595252 -2.131684
H -5.263385 1.799689 0.041387
H -1.607753 0.717824 2.648393
H 4.532103 2.263609 1.508918
H 4.808333 2.496064 -0.264876
H 6.130764 1.850321 0.779865