%chk=000125950.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125950

0 1
 O    2.198300      0.3888000      0.9453000    
 O  -6.9799997E-02   1.724100       1.512600    
 O   -1.803100       2.590500     -0.5694000    
 O    2.085000       1.005100      -1.982400    
 O    4.031600     -0.5759000       1.865900    
 C    1.063200      0.1903000      7.0900001E-02
 C   0.2053000       1.447600      0.1413000    
 C   -1.098900       1.350700     -0.6721000    
 C    1.525100     -0.1386000      -1.347400    
 C   -2.024900      0.2229000     -0.2707000    
 C    2.554600      -1.216700      -1.289600    
 C    3.302100      -1.425300     -0.2015000    
 C    3.207600     -0.5217000      0.9595000    
 C   -1.890300      -1.011600     -0.8820000    
 C   -2.985700      0.4504000      0.6991000    
 C   -2.743500      -2.051100     -0.5120000    
 C   -3.838900     -0.5893000       1.069100    
 C   -3.717700      -1.840100      0.4635000    
 H   0.5191000     -0.6563000      0.5089000    
 H   0.7728000       2.319200     -0.2079000    
 H  -0.8554000       1.247400      -1.736300    
 H   0.6990000     -0.4738000      -1.972100    
 H    2.688200      -1.850600      -2.161000    
 H   0.7825000       1.791700       1.976100    
 H    4.048800      -2.210400     -0.1764000    
 H   -1.172300      -1.196500      -1.669100    
 H   -3.091000       1.411100       1.194000    
 H   -2.605100       2.526300      -1.116400    
 H    2.359300      0.7440000      -2.878300    
 H   -2.655300      -3.022600     -0.9896000    
 H   -4.595900     -0.4261000       1.830500    
 H   -4.382900      -2.649100      0.7507000    


%chk=000125950-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125950

0 1
O 2.202301 0.514341 1.009038
O -0.188314 1.681973 1.483645
O -1.695081 2.613826 -0.759648
O 1.952137 0.895310 -2.074644
O 4.215606 -0.061457 1.940138
C 1.078835 0.151114 0.077928
C 0.194375 1.418763 0.097278
C -1.077376 1.273853 -0.767693
C 1.579487 -0.308076 -1.295654
C -2.056428 0.190214 -0.331384
C 2.747262 -1.265803 -1.157518
C 3.558477 -1.238740 -0.065795
C 3.374409 -0.258267 1.037486
C -2.336680 -0.896296 -1.199171
C -2.729604 0.268537 0.917747
C -3.260157 -1.900363 -0.827277
C -3.653036 -0.733259 1.287427
C -3.919397 -1.820831 0.420473
H 0.531119 -0.683471 0.557224
H 0.779012 2.263230 -0.316279
H -0.730775 1.045800 -1.798948
H 0.736921 -0.826543 -1.800349
H 2.944959 -1.961907 -1.983060
H 0.649982 1.774087 2.006462
H 4.426951 -1.896284 0.038164
H -1.845093 -0.947759 -2.180503
H -2.502433 1.105559 1.582888
H -2.620761 2.529701 -1.102578
H 2.429120 0.623546 -2.900051
H -3.470346 -2.732469 -1.508629
H -4.165282 -0.669228 2.254139
H -4.638392 -2.594701 0.712344


