%chk=000083225.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083225

0 1
 O    2.394600       1.799200       1.062800    
 O    4.465000     -0.6934000       1.132000    
 C   -1.128400     -0.6255000      0.2056000    
 C   0.1468000     -6.8000001E-03 -0.3709000    
 C   -2.374600      0.1202000     -0.2746000    
 C    1.396000     -0.7381000      0.1331000    
 C   -3.652100     -0.5183000      0.2755000    
 C    2.693400     -0.1113000     -0.4004000    
 C   -4.898300      0.2094000     -0.2336000    
 C   -6.204800     -0.3708000      0.3121000    
 C    2.834300       1.356300      2.2000000E-03
 C    3.881000     -0.9385000      7.6399997E-02
 C   -7.445000      0.3654000     -0.1706000    
 C    3.588600       2.245300     -0.9538000    
 C    4.303500      -2.093200     -0.7957000    
 H   -1.087500     -0.6010000       1.301400    
 H   -1.190900      -1.679100     -9.2699997E-02
 H   0.1788000       1.052500     -9.4599999E-02
 H   0.1153000     -5.2299999E-02  -1.466300    
 H   -2.405000      0.1139000      -1.371000    
 H   -2.321400       1.169000      4.1600000E-02
 H    1.404700     -0.7295000       1.231000    
 H    1.343200      -1.792400     -0.1660000    
 H   -3.698300      -1.572500     -2.3200000E-02
 H   -3.633600     -0.4925000       1.371700    
 H    2.674000     -0.1419000      -1.497100    
 H   -4.918900      0.1704000      -1.329800    
 H   -4.835800       1.269100      4.3900002E-02
 H   -6.282700      -1.425200      2.1299999E-02
 H   -6.183700     -0.3445000       1.408200    
 H   -8.346500     -9.1600001E-02  0.2491000    
 H   -7.519900      0.3288000      -1.262000    
 H   -7.419600       1.415600      0.1370000    
 H    3.074100       2.266400      -1.917600    
 H    3.630400       3.262900     -0.5555000    
 H    4.607900       1.871400      -1.076900    
 H    3.486200      -2.812800     -0.8806000    
 H    5.168500      -2.592700     -0.3504000    
 H    4.584100      -1.721400      -1.784200    


%chk=000083225-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083225

0 1
O 2.311739 2.094647 0.836331
O 4.689754 -0.717983 0.768461
C -1.154809 -0.486563 0.272623
C 0.118552 0.081869 -0.392356
C -2.458068 0.094967 -0.320389
C 1.413216 -0.507714 0.211946
C -3.735869 -0.477420 0.333817
C 2.706651 0.048894 -0.456771
C -5.039507 0.108701 -0.253699
C -6.318051 -0.470013 0.394687
C 3.032346 1.491743 0.001302
C 3.885531 -0.910885 -0.180759
C -7.615723 0.123533 -0.195197
C 4.271070 2.139493 -0.597870
C 4.008906 -2.115852 -1.105443
H -1.122285 -0.275264 1.361259
H -1.166542 -1.592376 0.168483
H 0.133573 1.181465 -0.273819
H 0.088047 -0.130478 -1.482464
H -2.485761 -0.103613 -1.412574
H -2.450170 1.198739 -0.205055
H 1.458281 -0.271219 1.290932
H 1.386831 -1.612052 0.115441
H -3.745226 -1.581539 0.215862
H -3.706684 -0.282257 1.426231
H 2.550938 0.072204 -1.557659
H -5.067426 -0.080084 -1.347569
H -5.034735 1.211929 -0.129487
H -6.323035 -1.572146 0.268488
H -6.287919 -0.283069 1.487661
H -8.514156 -0.307568 0.283843
H -7.683831 -0.074468 -1.281744
H -7.650002 1.220260 -0.052521
H 4.403594 1.875546 -1.662748
H 4.221155 3.233324 -0.480789
H 5.157052 1.766679 -0.049088
H 3.021976 -2.544510 -1.353498
H 4.652423 -2.884184 -0.649299
H 4.471565 -1.792239 -2.059168


