%chk=000061129.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061129

0 1
 O    3.124500     -0.4947000     -0.1221000    
 O    4.020400       1.277100      -1.266400    
 C  -0.4271000      0.4738000      0.7401000    
 C   -1.020000     -0.3756000     -0.4408000    
 C    1.139600      0.5038000      0.6347000    
 C   -2.583000     -0.3374000     -0.5937000    
 C    1.823000     -0.8523000      0.3993000    
 C  -0.3995000      -1.788400     -0.4804000    
 C  -0.9957000       1.916300      0.6527000    
 C    1.116600      -1.716400     -0.6564000    
 C   -3.061400       1.138000     -0.5825000    
 C   -2.521900       1.970500      0.5751000    
 C    1.725800       1.346700     -0.4982000    
 C  -0.7795000     -8.5699998E-02   2.145300    
 C   -3.344500      -1.155400      0.4652000    
 C   -2.991100     -0.9244000      -1.971400    
 C    2.086400      -1.646100       1.680000    
 C    3.087500      0.7503000     -0.6807000    
 H  -0.6618000      0.1137000      -1.359500    
 H    1.542900      0.9440000       1.559800    
 H  -0.7967000      -2.360700      -1.324500    
 H  -0.6453000      -2.362500      0.4174000    
 H  -0.6104000       2.422100     -0.2407000    
 H  -0.6554000       2.508400       1.511600    
 H    1.536200      -2.730700     -0.6557000    
 H    1.333500      -1.328300      -1.661100    
 H   -4.158100       1.180800     -0.5722000    
 H   -2.749200       1.624200      -1.517300    
 H   -2.978300       1.649900       1.516200    
 H   -2.831200       3.013800      0.4359000    
 H    1.814600       2.396400     -0.2046000    
 H    1.182000       1.260400      -1.441400    
 H   -1.765900      0.2202000       2.495800    
 H  -0.7570000      -1.174900       2.190000    
 H  -8.2300000E-02  0.2886000       2.904600    
 H   -4.413400      -1.201500      0.2220000    
 H   -2.984700      -2.188000      0.5143000    
 H   -3.283500     -0.7280000       1.464900    
 H   -2.429200     -0.4566000      -2.787500    
 H   -2.824600      -2.005000      -2.022300    
 H   -4.056600     -0.7566000      -2.169600    
 H    1.181800      -2.078800       2.109400    
 H    2.785400      -2.468200       1.483600    
 H    2.566200      -1.017500       2.438600    


%chk=000061129-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000061129

0 1
O 3.181107 -0.497673 -0.149009
O 4.064950 1.267860 -1.371053
C -0.446734 0.470873 0.769633
C -1.033631 -0.378749 -0.423044
C 1.121630 0.512534 0.632400
C -2.598816 -0.335347 -0.608932
C 1.821074 -0.878524 0.427898
C -0.423952 -1.803535 -0.436645
C -1.001749 1.927530 0.678962
C 1.108093 -1.743527 -0.640127
C -3.061099 1.157068 -0.595633
C -2.544004 1.975218 0.606851
C 1.710745 1.357708 -0.525584
C -0.789205 -0.091815 2.183735
C -3.388059 -1.159344 0.445507
C -2.961552 -0.908707 -2.010510
C 2.147352 -1.659898 1.704230
C 3.105046 0.769578 -0.759144
H -0.651018 0.121497 -1.343968
H 1.522621 0.940822 1.574161
H -0.858413 -2.394878 -1.262910
H -0.666647 -2.350500 0.494607
H -0.604912 2.416583 -0.233001
H -0.634764 2.517009 1.544105
H 1.547483 -2.758447 -0.634019
H 1.317231 -1.317028 -1.640741
H -4.168652 1.188886 -0.632194
H -2.701304 1.641285 -1.528803
H -2.994853 1.603562 1.547403
H -2.873770 3.027711 0.506795
H 1.800100 2.431705 -0.300483
H 1.131174 1.265329 -1.464019
H -1.797926 0.208410 2.509797
H -0.745702 -1.192131 2.236004
H -0.077228 0.304588 2.931724
H -4.460879 -1.177439 0.174174
H -3.039233 -2.207824 0.479999
H -3.310919 -0.744285 1.462925
H -2.359186 -0.433206 -2.808209
H -2.808443 -2.001386 -2.069736
H -4.028045 -0.714654 -2.233440
H 1.243678 -2.127724 2.128467
H 2.871059 -2.459745 1.469366
H 2.596452 -1.004091 2.469960


