%chk=000066540.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066540

0 1
 O    1.644900      -1.932600      3.4100000E-02
 O   0.4986000       1.858300      0.2387000    
 O    3.556200      -2.163300       1.296200    
 O    1.141600      0.2131000       1.714800    
 C   -2.612700      -2.503000     -0.3050000    
 C   -3.609100      -1.361900     -7.9800002E-02
 C   -1.222400      -2.218700      0.2677000    
 C   -4.977600      -1.614100     -0.7162000    
 C  -0.2644000      -3.377500     -5.1000002E-03
 C   -5.907000     -0.4148000     -0.5230000    
 C    1.110600      -3.123100      0.5963000    
 C   -7.256100     -0.6433000      -1.185800    
 C   -1.568400       3.084000      0.2391000    
 C    2.880700      -1.565100      0.4734000    
 C    3.322900     -0.3105000     -0.1862000    
 C   -2.907900       3.305000      0.9361000    
 C  -0.7465000       2.005000      0.9300000    
 C    2.593500      0.8717000     -5.7999998E-02
 C    4.492300     -0.3295000     -0.9465000    
 C    1.367900      0.9235000      0.7283000    
 C   -3.706900       4.413000      0.2690000    
 C    3.033900       2.034700     -0.6899000    
 C    4.932600      0.8336000      -1.578200    
 C    4.203400       2.015500      -1.450000    
 H   -3.012100      -3.420200      0.1452000    
 H   -2.524800      -2.691500      -1.382400    
 H   -3.732600      -1.198800      0.9980000    
 H   -3.186600     -0.4370000     -0.4923000    
 H   -1.300400      -2.046600       1.347900    
 H  -0.8353000      -1.296200     -0.1804000    
 H   -5.429000      -2.510200     -0.2738000    
 H   -4.851000      -1.810700      -1.787800    
 H  -0.1657000      -3.506600      -1.089900    
 H  -0.6719000      -4.308700      0.4045000    
 H   -6.056700     -0.2290000      0.5469000    
 H   -5.447600      0.4856000     -0.9474000    
 H    1.771500      -3.966800      0.3664000    
 H    1.032800      -3.016300       1.684700    
 H   -7.757200      -1.520000     -0.7631000    
 H   -7.904800      0.2251000      -1.033900    
 H   -7.142700     -0.7983000      -2.263500    
 H  -0.9927000       4.017800      0.2169000    
 H   -1.727000       2.805000     -0.8101000    
 H   -2.742500       3.566300       1.987900    
 H   -3.492800       2.377800      0.9200000    
 H  -0.5481000       2.288400       1.970100    
 H   -1.284500       1.050500      0.9124000    
 H    5.068800      -1.244500      -1.055400    
 H   -3.916600       4.169300     -0.7775000    
 H   -4.662900       4.553200      0.7832000    
 H   -3.162600       5.362300      0.2989000    
 H    2.497900       2.975900     -0.5991000    
 H    5.843400      0.8189000      -2.169600    
 H    4.548400       2.921700      -1.939400    


%chk=000066540-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066540

0 1
O 1.720769 -1.933814 0.002567
O 0.512578 1.790087 0.197791
O 3.784111 -2.470965 0.953340
O 1.277402 0.265946 1.787749
C -2.638270 -2.342029 -0.328658
C -3.579845 -1.144235 -0.068146
C -1.230330 -2.141233 0.273290
C -4.989432 -1.320624 -0.675704
C -0.275615 -3.322348 -0.009117
C -5.924622 -0.118335 -0.410292
C 1.110832 -3.153838 0.613010
C -7.328233 -0.297061 -1.028150
C -1.712637 2.773950 0.152193
C 3.041197 -1.665954 0.342521
C 3.481910 -0.338820 -0.203491
C -3.053165 3.007031 0.889800
C -0.734972 1.964444 1.003188
C 2.684048 0.840103 -0.135027
C 4.739813 -0.294341 -0.849787
C 1.451727 0.893677 0.716002
C -4.057524 3.815665 0.041489
C 3.138531 2.024444 -0.767327
C 5.192105 0.894138 -1.462100
C 4.381900 2.052155 -1.433852
H -3.094355 -3.264168 0.089423
H -2.550771 -2.506602 -1.423153
H -3.671481 -0.982990 1.027084
H -3.117777 -0.222519 -0.482641
H -1.312483 -1.992022 1.370194
H -0.780856 -1.216055 -0.136070
H -5.454086 -2.241618 -0.265369
H -4.900133 -1.479564 -1.770850
H -0.166829 -3.464327 -1.102331
H -0.710670 -4.260354 0.393669
H -6.018164 0.034680 0.684724
H -5.456048 0.803749 -0.813365
H 1.774130 -4.014800 0.413656
H 1.063011 -2.985351 1.705160
H -7.828297 -1.195610 -0.619848
H -7.977116 0.573957 -0.821714
H -7.265082 -0.419435 -2.125998
H -1.255608 3.747340 -0.111477
H -1.896586 2.236194 -0.798003
H -2.863225 3.537076 1.845164
H -3.501168 2.028521 1.156955
H -0.469721 2.480701 1.945065
H -1.129753 0.963791 1.257603
H 5.349421 -1.203304 -0.872272
H -4.288424 3.291275 -0.904950
H -5.008571 3.968934 0.583014
H -3.650034 4.811027 -0.216834
H 2.514663 2.920944 -0.713488
H 6.166001 0.913701 -1.962492
H 4.722535 2.975185 -1.914748


