%chk=000064916.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064916

0 1
 O  -0.8549000      -2.931700      0.4322000    
 C  -0.1991000     -0.5987000      0.6107000    
 C   -1.640100     -0.2308000       1.043800    
 C   -2.568800      0.1121000     -0.1265000    
 C   0.4843000      0.5717000     -0.1318000    
 C   -3.983600      0.4303000      0.3650000    
 C  -0.2264000      -1.864200     -0.2674000    
 C    1.993600      0.5062000     -0.1335000    
 C   -4.920400      0.7426000     -0.8021000    
 C    2.699800       1.111500      0.8934000    
 C    2.642700     -0.1581000      -1.161400    
 C   -6.318200       1.091300     -0.3164000    
 C    4.093300       1.050900      0.8921000    
 C    4.036300     -0.2188000      -1.162500    
 C    4.761600      0.3858000     -0.1357000    
 H   0.3534000     -0.8253000       1.532600    
 H   -1.592200      0.6289000       1.724800    
 H   -2.072400      -1.053200       1.627100    
 H   -2.180500      0.9742000     -0.6800000    
 H   -2.631300     -0.7263000     -0.8272000    
 H   0.1899000       1.522700      0.3331000    
 H   0.1250000      0.6360000      -1.167500    
 H   -4.377700     -0.4217000      0.9323000    
 H   -3.949000       1.286600       1.049500    
 H  -0.7472000      -1.711900      -1.216600    
 H   0.7886000      -2.195500     -0.5056000    
 H   -4.523300       1.582500      -1.384000    
 H   -4.977500     -0.1206000      -1.475400    
 H    2.188400       1.629400       1.699600    
 H    2.088800     -0.6269000      -1.969500    
 H   -6.757300      0.2599000      0.2444000    
 H   -6.299700       1.972300      0.3331000    
 H   -6.971400       1.310000      -1.166800    
 H  -0.3565000      -3.076700       1.254600    
 H    4.658200       1.520900       1.692000    
 H    4.556800     -0.7354000      -1.963500    
 H    5.846600      0.3387000     -0.1367000    


%chk=000064916-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064916

0 1
O -0.607807 -2.973626 0.820372
C -0.214938 -0.495903 0.691855
C -1.682455 -0.135627 1.049901
C -2.618638 0.160261 -0.145905
C 0.481857 0.618955 -0.153104
C -4.066287 0.459622 0.305905
C -0.100648 -1.866320 -0.012101
C 2.000428 0.503706 -0.189857
C -5.026790 0.755214 -0.868713
C 2.771768 0.808810 0.963407
C 2.682182 0.082549 -1.360257
C -6.470298 1.050692 -0.406867
C 4.179047 0.691741 0.949823
C 4.091319 -0.036501 -1.380285
C 4.845550 0.266375 -0.223813
H 0.345510 -0.572877 1.650965
H -1.674565 0.748950 1.721240
H -2.108221 -0.976586 1.632770
H -2.237826 1.025270 -0.726458
H -2.633942 -0.705043 -0.838814
H 0.193352 1.596257 0.282926
H 0.079559 0.601409 -1.184263
H -4.453127 -0.403996 0.886045
H -4.062750 1.325035 1.001911
H -0.730939 -1.899954 -0.917110
H 0.950803 -2.055406 -0.311793
H -4.639145 1.617541 -1.449236
H -5.029103 -0.110380 -1.562343
H 2.264548 1.150409 1.875119
H 2.104218 -0.149767 -2.263662
H -6.890792 0.192028 0.149998
H -6.499749 1.930641 0.263343
H -7.137127 1.256548 -1.264419
H -0.037937 -3.043131 1.627805
H 4.756632 0.936852 1.848666
H 4.598503 -0.362264 -2.295681
H 5.937605 0.177218 -0.237168


