%chk=000187404.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187404

0 1
O 4.735808 2.141835 -0.731000
C 1.068424 -0.726612 0.027855
C -0.381755 -0.748450 -0.016902
C 1.752868 0.503479 0.186664
C -1.106074 0.447559 0.095180
C 3.183356 0.525067 0.232299
C -2.556123 0.427793 0.050402
C 0.973007 1.710993 0.298097
C -0.386703 1.684092 0.254170
C 3.902057 -0.659052 0.113045
C -3.227306 -0.808716 -0.107193
C 1.834257 -1.923051 -0.086024
C -1.097876 -1.989558 -0.176110
C 3.206753 -1.892024 -0.046105
C -2.458019 -2.020899 -0.219553
C 3.915062 1.830826 0.409702
C -3.336494 1.616168 0.160050
C -4.651281 -0.840554 -0.152693
C 5.394349 -0.684703 0.153612
C -4.712010 1.565617 0.113924
C -5.379022 0.323334 -0.044321
H 1.506111 2.657843 0.420420
H -0.963276 2.608215 0.339593
H 1.311036 -2.874734 -0.207222
H -0.518524 -2.911410 -0.261554
H 3.781790 -2.812956 -0.134171
H -2.994730 -2.961703 -0.339980
H 3.233955 2.689982 0.578009
H 4.649110 1.789179 1.239210
H -2.825898 2.572744 0.281895
H -5.152446 -1.799770 -0.274422
H 5.818109 -1.589396 -0.298553
H 5.830055 0.178066 -0.384098
H 5.761629 -0.632765 1.188729
H -5.303682 2.475947 0.198119
H -6.466971 0.306405 -0.078266
H 4.220855 2.029510 -1.556709


%chk=000187404-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187404

0 1
O 4.492247 2.359274 -0.849928
C 1.083188 -0.760911 0.048102
C -0.379494 -0.772853 -0.004426
C 1.794688 0.488232 0.212208
C -1.111543 0.455917 0.086404
C 3.238423 0.505185 0.270364
C -2.572925 0.448982 0.033118
C 1.013439 1.700016 0.292408
C -0.369708 1.682032 0.227840
C 3.969409 -0.697903 0.136066
C -3.265647 -0.809243 -0.111759
C 1.857859 -1.955461 -0.065673
C -1.115823 -2.006003 -0.147181
C 3.254375 -1.920592 -0.030775
C -2.499097 -2.024417 -0.198844
C 3.997425 1.810309 0.440412
C -3.364638 1.638963 0.119274
C -4.694697 -0.837222 -0.165967
C 5.488448 -0.715360 0.153164
C -4.763233 1.590442 0.064182
C -5.439141 0.342946 -0.079870
H 1.518290 2.664300 0.403263
H -0.905388 2.633307 0.289495
H 1.365883 -2.923354 -0.193769
H -0.577571 -2.954827 -0.214983
H 3.821176 -2.853333 -0.133639
H -3.034645 -2.975062 -0.307138
H 3.397463 2.572793 0.970726
H 4.919314 1.655178 1.021182
H -2.881323 2.613854 0.231545
H -5.198665 -1.804759 -0.276837
H 5.873162 -1.698802 -0.165800
H 5.904975 0.055276 -0.519030
H 5.888273 -0.517769 1.167162
H -5.343055 2.517512 0.132775
H -6.533283 0.314577 -0.121864
H 3.732241 2.387075 -1.486108


