%chk=000078942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078942

0 1
 O   -1.327000      -1.207600      0.5962000    
 O   -1.546400       1.689300       1.341200    
 O    1.332100      -1.984100      0.3439000    
 O   -2.939400       1.491100     -0.9968000    
 O    2.489500      0.4857000       1.237000    
 O   -3.349400      -1.318200     -0.4890000    
 O    4.328900      0.8011000     -0.8217000    
 C  -0.2581000     -0.2444000      0.7151000    
 C  -0.8773000       1.062400      0.2469000    
 C   0.9148000     -0.7075000     -0.1370000    
 C   -1.877900      0.5979000     -0.7919000    
 C    2.092800      0.2778000     -0.1234000    
 C   -2.307400     -0.7347000     -0.2379000    
 C    3.325000     -0.2088000     -0.8826000    
 H   1.0700000E-02 -0.2131000       1.777100    
 H  -0.1783000       1.801300     -0.1468000    
 H   0.5993000     -0.8675000      -1.174900    
 H   -1.378300      0.4120000      -1.749500    
 H    1.801200       1.253200     -0.5234000    
 H    3.086800     -0.4038000      -1.932600    
 H    3.742200      -1.112800     -0.4274000    
 H   -2.037100       2.448700      0.9828000    
 H   0.5633000      -2.578100      0.3025000    
 H   -3.513000       1.113900      -1.685400    
 H    3.224300       1.122900       1.232500    
 H    5.098100      0.4671000      -1.314000    


%chk=000078942-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078942

0 1
O -1.235557 -1.203933 0.520218
O -1.488155 1.796227 1.267341
O 1.373034 -1.954639 0.028618
O -3.193150 1.494696 -0.784825
O 2.376819 0.711111 1.129926
O -3.407097 -1.391761 -0.316995
O 4.538135 0.642761 -0.525446
C -0.173047 -0.112648 0.543538
C -0.907239 1.169129 0.091136
C 0.972106 -0.602949 -0.365909
C -2.033043 0.620135 -0.820764
C 2.200181 0.321024 -0.268564
C -2.341287 -0.762273 -0.208455
C 3.476206 -0.352621 -0.791342
H 0.166451 -0.030767 1.585012
H -0.232902 1.868797 -0.437493
H 0.630736 -0.616865 -1.427391
H -1.678992 0.481584 -1.862725
H 2.008641 1.228282 -0.885481
H 3.393080 -0.565102 -1.876090
H 3.650061 -1.291367 -0.235577
H -2.337926 2.227705 0.973009
H 0.554101 -2.469861 0.250841
H -4.013905 0.935753 -0.842465
H 3.295673 1.085170 1.197890
H 5.426476 0.216212 -0.597108


