%chk=000296455.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296455

0 1
S 1.828757 -0.326293 1.311732
S 1.425123 0.140588 -1.748958
O 1.389853 0.774793 2.114948
O 3.171583 -0.419811 0.780476
O 0.292845 -0.106963 -2.608247
O 2.037738 1.425637 -1.625132
O -1.972298 2.601894 0.094630
O -0.112700 1.990436 -0.836994
N 0.867966 -0.408174 -0.140143
N -1.165776 1.764215 -0.269124
C -0.534134 -0.676349 -0.011891
C -1.512845 0.345172 -0.020182
C 1.466717 -1.802126 2.166144
C 2.656325 -1.043374 -2.073111
C -0.957123 -2.011788 0.146410
C -2.870802 0.033072 0.164802
C -2.308745 -2.311138 0.315195
C -3.266915 -1.290461 0.340092
H 2.066373 -1.900603 3.087477
H 0.422882 -1.878931 2.506930
H 1.678608 -2.714140 1.591674
H 2.282127 -2.069089 -2.168714
H 3.206884 -0.835570 -3.003489
H 3.444104 -1.065127 -1.286648
H -0.226932 -2.818301 0.098437
H -3.609014 0.845577 0.166951
H -2.622470 -3.351537 0.423596
H -4.320833 -1.530407 0.481737


%chk=000296455-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296455

0 1
S 1.648706 -0.639255 1.562959
S 1.610546 -1.432161 -1.639919
O 0.649603 0.050406 2.643452
O 2.965207 0.140177 1.012451
O 2.746719 -2.514639 -1.227443
O 0.489305 -1.779779 -2.761062
O -1.049450 2.665673 0.824279
O 0.646638 1.565961 -0.223983
N 0.537691 -1.341612 0.099066
N -0.541584 1.615383 0.289290
C -0.815266 -0.908454 0.003630
C -1.379254 0.398851 0.178707
C 2.221762 -2.348694 2.167296
C 2.484086 0.216186 -2.094971
C -1.726364 -1.973875 -0.259156
C -2.773645 0.605297 0.180835
C -3.117704 -1.760286 -0.317198
C -3.646395 -0.472158 -0.071912
H 2.932740 -2.151122 2.982070
H 1.318597 -2.875702 2.500592
H 2.682495 -2.811951 1.282529
H 2.998088 0.522119 -1.172417
H 3.154893 -0.058091 -2.922531
H 1.683815 0.908565 -2.380767
H -1.301469 -2.971988 -0.396313
H -3.150202 1.616249 0.359593
H -3.784814 -2.600538 -0.533767
H -4.727446 -0.303360 -0.086713


