%chk=000289824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289824

0 1
S -0.000668 2.716937 0.000277
O 6.366903 -2.363259 -0.322537
O -6.361939 -2.371264 0.322088
O -0.058827 3.444822 1.261223
O 0.056589 3.445082 -1.260565
O 5.003811 -1.634801 -1.970586
O -4.999461 -1.641886 1.970233
N 4.689792 -0.937412 0.284716
N -4.686663 -0.943109 -0.284816
C 5.398547 -1.237489 1.562963
C -5.395266 -1.243488 -1.563075
C 1.364502 1.651543 0.077820
C -1.364505 1.649847 -0.077436
C 3.576444 -0.058692 0.214570
C -3.574369 -0.063070 -0.214489
C 6.523771 -2.190162 1.121846
C -6.519261 -2.197718 -1.122188
C 1.896528 1.094663 -1.090808
C -1.895626 1.091815 1.091057
C 1.961024 1.372403 1.309804
C -1.960906 1.370459 -1.309429
C 2.990225 0.236540 -1.035273
C -2.988275 0.232365 1.035371
C 3.059999 0.518326 1.395243
C -3.058844 0.515063 -1.395017
C 5.296172 -1.625207 -0.806478
C -5.292026 -1.632119 0.806179
H 4.707314 -1.713864 2.291643
H 5.793238 -0.304774 2.021567
H -4.703575 -1.718706 -2.292075
H -5.791160 -0.311051 -2.021205
H 7.539537 -1.782913 1.257689
H 6.448677 -3.205229 1.545820
H -7.535542 -1.791638 -1.257682
H -6.443012 -3.212504 -1.546627
H 1.458439 1.341215 -2.065096
H -1.457662 1.338498 2.065367
H 1.568497 1.836714 2.224283
H -1.569105 1.835621 -2.223793
H 3.391380 -0.195770 -1.958181
H -3.388722 -0.200818 1.958177
H 3.499972 0.318575 2.366967
H -3.498745 0.315157 -2.366743


%chk=000289824-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289824

0 1
S -0.000654 2.639040 0.000563
O 6.653584 -2.355253 -0.257966
O -6.649081 -2.363366 0.256799
O -0.058450 3.413003 1.444359
O 0.056157 3.413459 -1.443029
O 5.202006 -1.704825 -1.963369
O -5.198577 -1.712300 1.962815
N 4.950917 -0.921804 0.290872
N -4.947817 -0.927840 -0.291016
C 5.600056 -1.217476 1.586729
C -5.596386 -1.223603 -1.587131
C 1.506998 1.501575 0.073824
C -1.506858 1.499681 -0.073015
C 3.787256 -0.110879 0.195594
C -3.785107 -0.115582 -0.195291
C 6.900763 -1.935232 1.146461
C -6.896437 -1.942919 -1.147464
C 2.077438 1.048021 -1.126147
C -2.076737 1.045058 1.126816
C 2.046258 1.202565 1.332345
C -2.045737 1.200374 -1.331626
C 3.221940 0.230503 -1.068420
C -3.220222 0.226136 1.068839
C 3.193184 0.386717 1.391181
C -3.191650 0.383124 -1.390711
C 5.542573 -1.643567 -0.769590
C -5.538883 -1.650813 0.768974
H 4.951540 -1.864112 2.208405
H 5.818142 -0.290985 2.145154
H -4.947069 -1.869280 -2.208966
H -5.815297 -0.297074 -2.145170
H 7.772930 -1.259695 1.147393
H 7.120489 -2.839615 1.732117
H -7.769314 -1.268300 -1.148241
H -7.115095 -2.847251 -1.733597
H 1.653189 1.349122 -2.089591
H -1.652863 1.346399 2.090351
H 1.593870 1.619858 2.238063
H -1.593859 1.618506 -2.237213
H 3.677332 -0.147197 -1.985407
H -3.675139 -0.152383 1.985715
H 3.614697 0.145362 2.370618
H -3.612886 0.141552 -2.370219


