%chk=000041878.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041878

0 1
 O    3.734200      -1.391400     -0.2744000    
 O    4.791100      0.7207000     -0.4916000    
 O    5.805100      -1.671100      0.7103000    
 O    4.638300       2.431000       1.055800    
 C   -2.700000      0.4914000     -0.1935000    
 C   -1.398900     -0.1662000      0.2735000    
 C   -3.955400     -0.2171000      0.3278000    
 C  -0.1438000      0.5040000     -0.2947000    
 C   -5.256300      0.3949000     -0.1988000    
 C    1.158900     -0.1359000      0.1913000    
 C   -6.509800     -0.3495000      0.2747000    
 C   -7.811500      0.2785000     -0.2308000    
 C    2.378700      0.5966000     -0.3749000    
 C   -9.063400     -0.4584000      0.2524000    
 C    3.701000     -2.4999999E-03  0.1182000    
 C   -10.36130      0.1749000     -0.2243000    
 C    4.842100      -2.097800      8.8100001E-02
 C    5.148800       1.907800      7.4800000E-02
 C    4.711900      -3.511700     -0.3909000    
 C    6.290200       2.502100     -0.6930000    
 H   -2.714900       1.539100      0.1309000    
 H   -2.722700      0.4985000      -1.290300    
 H   -1.357700     -0.1416000       1.369400    
 H   -1.402400      -1.223200     -1.9900000E-02
 H   -3.957900     -0.1886000       1.424300    
 H   -3.915600      -1.274500      3.8100000E-02
 H  -0.1509000       1.565000     -1.5900001E-02
 H  -0.1803000      0.4642000      -1.390500    
 H   -5.236300      0.3982000      -1.295600    
 H   -5.314900       1.442600      0.1205000    
 H    1.192900     -0.1097000       1.287100    
 H    1.174500      -1.190100     -0.1090000    
 H   -6.522300     -0.3693000       1.371500    
 H   -6.458000      -1.392500     -6.0899999E-02
 H    2.328900       1.661100     -0.1181000    
 H    2.349500      0.5449000      -1.471200    
 H   -7.859100       1.323100      0.1006000    
 H   -7.803100      0.2940000      -1.327600    
 H   -9.067200     -0.4877000       1.348500    
 H   -9.028400      -1.498500     -9.3199998E-02
 H    3.766200      4.9100000E-02   1.213000    
 H   -10.40990      0.1886000      -1.317600    
 H   -10.44830       1.204700      0.1364000    
 H   -11.22040     -0.3911000      0.1487000    
 H    3.839400      -3.980800      7.0900001E-02
 H    4.626600      -3.527900      -1.480300    
 H    5.603900      -4.075600     -0.1034000    
 H    7.149800       1.827800     -0.6607000    
 H    6.577200       3.454100     -0.2373000    
 H    5.985200       2.688700      -1.725700    


%chk=000041878-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041878

0 1
O 3.791910 -1.238817 -0.465922
O 4.818473 0.869878 -0.598707
O 5.528020 -1.606245 1.060758
O 5.063956 2.123630 1.360989
C -2.788803 0.460848 -0.348205
C -1.452944 -0.096062 0.193164
C -4.030145 -0.216255 0.275115
C -0.211298 0.585488 -0.423969
C -5.367365 0.331648 -0.272292
C 1.120042 0.005137 0.103085
C -6.608011 -0.344394 0.353948
C -7.946274 0.199727 -0.194849
C 2.351901 0.706394 -0.512412
C -9.186085 -0.477113 0.433313
C 3.670597 0.145995 0.003523
C -10.518964 0.071673 -0.120303
C 4.796191 -2.028659 0.143808
C 5.489014 1.790421 0.235218
C 4.830925 -3.396665 -0.495452
C 6.749766 2.276969 -0.438828
H -2.834048 1.553905 -0.159116
H -2.818092 0.335065 -1.450978
H -1.426467 0.024026 1.296456
H -1.406369 -1.188042 -0.001684
H -4.004392 -0.084546 1.377244
H -3.981190 -1.310376 0.092408
H -0.248320 1.674865 -0.214017
H -0.245835 0.479159 -1.528458
H -5.394484 0.197737 -1.374192
H -5.416253 1.426062 -0.091709
H 1.149665 0.105428 1.207959
H 1.165890 -1.077934 -0.121500
H -6.582012 -0.208407 1.455644
H -6.557741 -1.439227 0.175587
H 2.332329 1.785342 -0.265933
H 2.335712 0.616626 -1.614932
H -7.998441 1.294506 -0.017003
H -7.974601 0.063000 -1.296414
H -9.156632 -0.340090 1.533764
H -9.132491 -1.570829 0.255471
H 3.773686 0.191719 1.103546
H -10.586411 -0.081471 -1.214141
H -10.609997 1.157670 0.071323
H -11.388851 -0.427660 0.345013
H 3.814767 -3.819934 -0.559919
H 5.217864 -3.312114 -1.526752
H 5.485620 -4.062444 0.084894
H 7.526225 1.494452 -0.359766
H 7.110919 3.189015 0.058207
H 6.572745 2.463801 -1.510282


