%chk=000062082.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062082

0 1
 O    3.695100       2.658000      5.6899998E-02
 O   -4.169700       2.170400     -0.2567000    
 C   0.6587000      -2.079100     -0.3597000    
 C  -0.5626000      -2.082600      0.5998000    
 C    1.477000     -0.8026000     -0.2479000    
 C    1.538000      -3.315100     -0.1325000    
 C   -1.515900     -0.9584000      0.3738000    
 C    1.611700      5.2000000E-03  -1.359300    
 C    2.061200     -0.4879000      0.9627000    
 C   -1.346300      0.2480000       1.053300    
 C   -2.577100      -1.113200     -0.5179000    
 C    2.362300       1.176400      -1.255900    
 C    2.811600      0.6834000       1.066200    
 C    2.962200       1.515500     -4.3200001E-02
 C   -2.238100       1.299400      0.8412000    
 C   -3.468800     -6.1799999E-02 -0.7302000    
 C   -3.299400       1.144500     -5.0600000E-02
 H   0.2692000      -2.154500      -1.384900    
 H  -0.2328000      -2.075600       1.647400    
 H   -1.100000      -3.034300      0.4858000    
 H    2.397200      -3.316100     -0.8125000    
 H    1.921300      -3.365200      0.8923000    
 H   0.9652000      -4.230600     -0.3161000    
 H    1.148600     -0.2478000      -2.308200    
 H    1.956400      -1.123600       1.836200    
 H  -0.5402000      0.3824000       1.768200    
 H   -2.718700      -2.047100      -1.055600    
 H    2.471600       1.816200      -2.127500    
 H    3.276600      0.9422000       2.013500    
 H   -2.097700       2.232400       1.380400    
 H   -4.293200     -0.1883000      -1.426700    
 H    3.693100       3.110100     -0.8043000    
 H   -3.901900       2.926200      0.2939000    


%chk=000062082-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062082

0 1
O 3.990307 2.627605 0.154190
O -4.423663 2.072778 -0.470738
C 0.642443 -2.067350 -0.336003
C -0.536819 -2.036428 0.700039
C 1.530424 -0.826495 -0.226879
C 1.454232 -3.379253 -0.180641
C -1.559139 -0.943469 0.430442
C 1.549675 0.146978 -1.254139
C 2.349124 -0.600974 0.913273
C -1.447525 0.339054 1.022984
C -2.645068 -1.172141 -0.456897
C 2.355658 1.304440 -1.162406
C 3.157760 0.546644 1.026244
C 3.160533 1.501835 -0.016682
C -2.381520 1.361453 0.745155
C -3.586455 -0.164682 -0.749109
C -3.451493 1.105791 -0.144700
H 0.185005 -2.067744 -1.345984
H -0.107302 -1.922220 1.714330
H -1.032099 -3.027223 0.672368
H 2.286531 -3.419475 -0.905796
H 1.887890 -3.468380 0.833066
H 0.807478 -4.261423 -0.345261
H 0.918721 0.004871 -2.139534
H 2.361046 -1.334052 1.729114
H -0.614876 0.545745 1.705169
H -2.761325 -2.159331 -0.921957
H 2.350812 2.044086 -1.974142
H 3.790226 0.718501 1.902518
H -2.274879 2.347073 1.217708
H -4.426423 -0.342237 -1.427435
H 3.927109 3.229847 -0.628108
H -4.241787 2.922677 0.001711


