%chk=000062071.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062071

0 1
 O   -2.640300      -3.281400       1.063800    
 C   -2.794300       2.090400      2.8600000E-02
 C   -3.531500       1.171200     -0.9717000    
 C   -2.951400     -0.2376000      -1.167400    
 C   -1.316100       2.299500     -0.3579000    
 C   -2.846900      -1.050700      0.1304000    
 C   -2.270600      -2.471000     -5.4699998E-02
 C  -0.5383000       3.166200      0.6421000    
 C   -3.548300       3.421600      0.1320000    
 C   0.9252000       3.379700      0.2310000    
 C  -0.7440000      -2.477800     -0.1415000    
 C   -2.862600      -3.113300      -1.313600    
 C    1.732000       2.105100      0.1767000    
 C    1.799600       1.372800      -1.008600    
 C    2.409400       1.659100       1.311500    
 C    3.222200     -0.2510000      7.5800002E-02
 C   -2.092200      -2.773300       2.269000    
 C    4.017900      -1.511300      2.1800000E-02
 C    2.544700      0.1947000      -1.059100    
 C    3.154600      0.4812000       1.261100    
 C    3.147800      -2.744500     -0.2866000    
 C    5.182800      -1.429700     -0.9829000    
 H   -2.832900       1.626900       1.021800    
 H   -4.575100       1.064500     -0.6469000    
 H   -3.566300       1.663600      -1.952500    
 H   -3.617300     -0.7419000      -1.876600    
 H   -1.971000     -0.1718000      -1.651400    
 H   -1.256300       2.748000      -1.357300    
 H  -0.8409000       1.316600     -0.4138000    
 H   -3.845800      -1.116400      0.5823000    
 H   -2.225700     -0.4941000      0.8398000    
 H  -0.5833000       2.705500       1.636600    
 H  -0.9998000       4.155900      0.7224000    
 H   -3.454000       4.003600     -0.7909000    
 H   -3.178700       4.030100      0.9626000    
 H   -4.614800       3.251600      0.3160000    
 H    1.397800       4.073600      0.9381000    
 H   0.9680000       3.881400     -0.7445000    
 H  -0.2721000      -1.842200      0.6156000    
 H  -0.3410000      -3.490100     -2.2800000E-02
 H  -0.4049000      -2.092900      -1.110300    
 H   -3.958100      -3.083300      -1.292300    
 H   -2.593700      -4.176100      -1.355400    
 H   -2.506800      -2.651600      -2.239700    
 H    1.280600       1.710600      -1.901700    
 H    2.362200       2.219800       2.241300    
 H   -1.005100      -2.874200       2.317700    
 H   -2.410400      -1.755200       2.503000    
 H   -2.483200      -3.401500       3.077200    
 H    4.469800      -1.688300       1.007400    
 H    2.583500     -0.3595000      -1.992800    
 H    3.675400      0.1476000       2.154700    
 H    2.698300      -2.691500      -1.283900    
 H    2.336400      -2.837900      0.4434000    
 H    3.747900      -3.659600     -0.2391000    
 H    4.827800      -1.331500      -2.014400    
 H    5.801100      -2.332200     -0.9277000    
 H    5.824500     -0.5686000     -0.7653000    


%chk=000062071-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062071

0 1
O -1.964384 -3.060369 1.136922
C -2.898867 2.188510 0.036008
C -3.659001 1.247012 -0.941747
C -2.996367 -0.125663 -1.228886
C -1.452171 2.478481 -0.444992
C -2.700865 -0.945115 0.050025
C -2.203073 -2.397822 -0.189534
C -0.597472 3.285772 0.557718
C -3.712481 3.488775 0.242476
C 0.898858 3.399577 0.141574
C -0.921889 -2.443784 -1.054280
C -3.303838 -3.291777 -0.791766
C 1.648572 2.073082 0.174966
C 2.004492 1.387694 -1.015152
C 2.005964 1.474381 1.410622
C 3.059363 -0.438577 0.262097
C -0.874537 -2.534476 1.955757
C 3.844751 -1.752792 0.316295
C 2.695480 0.156526 -0.973820
C 2.696756 0.242697 1.452099
C 3.087292 -2.916573 -0.375620
C 5.264260 -1.584612 -0.290918
H -2.828026 1.676790 1.020190
H -4.674542 1.070685 -0.529197
H -3.803069 1.781950 -1.904739
H -3.675667 -0.698391 -1.890853
H -2.059713 0.022911 -1.800253
H -1.494952 3.021638 -1.414105
H -0.934756 1.520694 -0.646314
H -3.615044 -0.997832 0.675494
H -1.937099 -0.405097 0.643529
H -0.658009 2.807475 1.557366
H -1.006760 4.308641 0.670729
H -3.769104 4.069216 -0.699559
H -3.264551 4.139657 1.014627
H -4.747870 3.260147 0.558492
H 1.396440 4.119356 0.821644
H 0.952970 3.834309 -0.875916
H -0.149474 -1.736770 -0.699926
H -0.499335 -3.465038 -1.042065
H -1.154759 -2.184892 -2.102566
H -4.185295 -3.303451 -0.127204
H -2.933906 -4.327385 -0.887787
H -3.612489 -2.934781 -1.789784
H 1.743401 1.830115 -1.984886
H 1.750473 1.983624 2.348982
H 0.108615 -2.597066 1.445207
H -1.040432 -1.484216 2.272417
H -0.852090 -3.175902 2.852384
H 3.968630 -2.022040 1.385125
H 2.959867 -0.340118 -1.915658
H 2.970447 -0.192825 2.421909
H 2.931662 -2.708279 -1.450764
H 2.094922 -3.078047 0.083080
H 3.662979 -3.857455 -0.294950
H 5.206293 -1.325223 -1.364532
H 5.841220 -2.523823 -0.199626
H 5.823981 -0.780726 0.220066


