%chk=000115049.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115049

0 1
 O    2.297600      -2.179200     -4.5800000E-02
 O   -4.853300      -1.146600     -0.3854000    
 C    3.279300      1.2300000E-02 -0.4846000    
 C    2.610500       1.404000     -0.4012000    
 C    1.164900       1.101200     -0.1644000    
 C   0.9131000     -0.2568000     -1.6899999E-02
 C    2.170400     -0.9733000     -0.1617000    
 C  -0.3488000     -0.7674000      0.2262000    
 C   -1.400700      0.1436000      0.3210000    
 C   0.1213000       2.007600     -6.8200000E-02
 C   -1.167900       1.521600      0.1746000    
 C    4.445300     -0.1356000      0.4783000    
 C   -2.791000     -0.3478000      0.5790000    
 C  -0.5875000      -2.230700      0.3788000    
 C   -2.293600       2.499900      0.2779000    
 C   -3.559600     -0.6527000     -0.7077000    
 H    3.611500     -0.1750000      -1.512700    
 H    2.742900       1.949300      -1.341600    
 H    3.013000       2.006900      0.4198000    
 H   0.3121000       3.070800     -0.1778000    
 H    4.895800      -1.130300      0.3923000    
 H    5.220500      0.6080000      0.2678000    
 H    4.123000     -1.2000000E-02   1.518200    
 H   -3.362400      0.3778000       1.171300    
 H   -2.799000      -1.218900       1.245700    
 H  -0.3287000      -2.550100       1.393300    
 H   -1.611200      -2.546900      0.1693000    
 H   1.1200000E-02  -2.802700     -0.3371000    
 H   -2.690100       2.526500       1.298000    
 H   -1.960800       3.516800      4.0100001E-02
 H   -3.095900       2.266000     -0.4271000    
 H   -3.051400      -1.414900      -1.306600    
 H   -3.676700      0.2341000      -1.338000    
 H   -5.312400     -0.4552000      0.1212000    


%chk=000115049-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000115049

0 1
O 2.448180 -2.228104 0.054362
O -4.944125 -1.220447 -0.543638
C 3.314647 0.034225 -0.493353
C 2.645428 1.427799 -0.323696
C 1.168398 1.126197 -0.110021
C 0.929897 -0.265032 0.048167
C 2.222615 -0.992768 -0.095345
C -0.378281 -0.774280 0.296798
C -1.457416 0.157441 0.365636
C 0.101254 2.034838 -0.033156
C -1.214811 1.562172 0.202366
C 4.628052 -0.177597 0.286621
C -2.878600 -0.348274 0.582150
C -0.606012 -2.264355 0.491886
C -2.347145 2.572261 0.300260
C -3.605268 -0.652262 -0.755125
H 3.515628 -0.146842 -1.570303
H 2.812670 2.089951 -1.192816
H 3.063265 1.951081 0.559040
H 0.276355 3.110948 -0.149708
H 4.959970 -1.225963 0.190109
H 5.427450 0.483641 -0.093744
H 4.486177 0.035988 1.362132
H -3.474444 0.395547 1.145983
H -2.881361 -1.275992 1.180131
H -0.908853 -2.481279 1.535215
H -1.413241 -2.645343 -0.159497
H 0.315400 -2.829311 0.287970
H -2.782693 2.595642 1.317977
H -1.987614 3.589133 0.070324
H -3.172404 2.342736 -0.398867
H -3.065103 -1.428435 -1.321233
H -3.655592 0.260436 -1.386491
H -5.501021 -0.563449 -0.054134


