%chk=000053380.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053380

0 1
 O   -4.877200       2.113700      0.1369000    
 O    5.119200       1.261800     -1.8200001E-02
 O   -3.045600       1.595300       1.366700    
 C   -3.597600      0.1836000     -0.5488000    
 C   -2.420900     -0.6645000     -0.2017000    
 C  -3.5799999E-02 -0.9155000      9.4200000E-02
 C   -1.136100     -0.1219000     -0.2309000    
 C    1.296400     -0.3529000      6.5399997E-02
 C   -2.605500      -2.001000      0.1526000    
 C   -3.566300      0.7271000      -1.991800    
 C  -0.2211000      -2.252200      0.4486000    
 C   -1.505600      -2.794800      0.4778000    
 C   -3.785800       1.355100      0.4214000    
 C    2.390100      -1.165200     -0.2332000    
 C    1.487200       1.002200      0.3358000    
 C    3.674800     -0.6227000     -0.2612000    
 C    2.771900       1.544900      0.3077000    
 C    3.865800      0.7324000      9.2000002E-03
 C    6.192200      0.3745000     -0.3304000    
 H   -4.508200     -0.4231000     -0.4472000    
 H   -1.016900      0.9131000     -0.5408000    
 H   -3.599300      -2.439800      0.1820000    
 H   -2.772700       1.470300      -2.126700    
 H   -3.397400     -8.3800003E-02  -2.708700    
 H   -4.514000       1.210800      -2.252300    
 H   0.6011000      -2.900100      0.7397000    
 H   -1.650600      -3.833400      0.7606000    
 H    2.286000      -2.218200     -0.4806000    
 H   0.6708000       1.666900      0.6046000    
 H    4.478800      -1.308100     -0.5068000    
 H    2.915800       2.599600      0.5261000    
 H   -4.981800       2.855200      0.7706000    
 H    6.097700     -3.0200001E-02  -1.343800    
 H    6.295300     -0.4134000      0.4234000    
 H    7.115400      0.9628000     -0.3062000    


%chk=000053380-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000053380

0 1
O -4.679471 1.458346 1.207890
O 5.200736 1.285945 0.063821
O -3.014964 2.563726 0.028951
C -3.715364 0.285631 -0.677717
C -2.535666 -0.605252 -0.252616
C -0.104244 -0.925227 0.077685
C -1.211130 -0.108060 -0.276391
C 1.283139 -0.380670 0.063947
C -2.766121 -1.949290 0.127772
C -3.643027 0.662310 -2.180870
C -0.359671 -2.274277 0.452899
C -1.675496 -2.779152 0.473783
C -3.734685 1.550705 0.176021
C 2.397959 -1.204546 -0.239411
C 1.539229 0.991155 0.356279
C 3.716387 -0.699662 -0.252603
C 2.843282 1.511325 0.348647
C 3.941220 0.667424 0.044128
C 6.367329 0.454222 -0.240495
H -4.653026 -0.259319 -0.474991
H -1.038315 0.928727 -0.587268
H -3.789292 -2.342179 0.156953
H -2.745354 1.268919 -2.387205
H -3.596639 -0.254048 -2.793842
H -4.529714 1.246415 -2.486590
H 0.470678 -2.918206 0.763335
H -1.855259 -3.816946 0.776075
H 2.236550 -2.256207 -0.502177
H 0.707721 1.653906 0.620160
H 4.544874 -1.368919 -0.503346
H 3.038312 2.561995 0.583584
H -4.634679 2.281748 1.767293
H 6.310615 0.040920 -1.266448
H 6.473241 -0.373534 0.487682
H 7.230946 1.130573 -0.160936


