%chk=000192937.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192937

0 1
S 4.301309 0.171067 0.450964
O 3.112177 -0.379961 -0.623772
O 5.474726 -0.553263 -0.473049
O 4.421003 1.579125 0.352574
O 4.169765 -0.513763 1.689137
C -2.461110 -0.135837 0.419906
C -3.227865 -1.044489 -0.564654
C -2.982470 1.315031 0.342045
C -4.736764 -0.990710 -0.290548
C -4.491762 1.365178 0.614412
C -5.263729 0.450265 -0.346963
C -0.972307 -0.187438 0.152543
C -0.103648 -0.658283 1.150718
C -0.443531 0.229589 -1.081069
C 1.274825 -0.717737 0.934962
C 0.929717 0.187345 -1.321089
C 1.765016 -0.289288 -0.302460
H -2.660530 -0.513259 1.456044
H -2.861040 -2.083959 -0.478299
H -3.026231 -0.734445 -1.607091
H -2.767859 1.745548 -0.653993
H -2.441945 1.947033 1.070842
H -4.955292 -1.430807 0.701368
H -5.273642 -1.617437 -1.027013
H -4.855073 2.405485 0.518032
H -4.695821 1.066703 1.660645
H -5.179632 0.838451 -1.380119
H -6.341417 0.467470 -0.099913
H -0.503465 -0.986702 2.111067
H -1.112134 0.594666 -1.861703
H 1.943113 -1.096523 1.712790
H 1.354218 0.507747 -2.270090
H 5.149201 -1.087101 -1.230425


%chk=000192937-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192937

0 1
S 4.507044 0.655727 0.237637
O 3.107463 -0.682894 -0.705116
O 5.746824 -0.679472 -0.001243
O 5.079344 1.959094 -0.521762
O 4.102390 0.774898 1.800765
C -2.499312 -0.219303 0.374804
C -3.347578 -0.999131 -0.677932
C -2.980480 1.264169 0.449704
C -4.857655 -0.913090 -0.356434
C -4.491219 1.346217 0.769382
C -5.334654 0.554953 -0.257986
C -1.009675 -0.320922 0.097643
C -0.130337 -0.901473 1.058758
C -0.454631 0.170591 -1.125380
C 1.248298 -1.000297 0.820641
C 0.919137 0.090095 -1.379437
C 1.790352 -0.523395 -0.418489
H -2.698789 -0.679674 1.365225
H -3.019001 -2.055527 -0.711743
H -3.163195 -0.572666 -1.685195
H -2.782497 1.762748 -0.521237
H -2.392822 1.807397 1.214046
H -5.057090 -1.428509 0.605847
H -5.433747 -1.453263 -1.132271
H -4.808491 2.406508 0.791770
H -4.672494 0.936954 1.784822
H -5.244086 1.036673 -1.253748
H -6.405659 0.590947 0.018566
H -0.546332 -1.271342 2.002978
H -1.113983 0.622054 -1.874689
H 1.929713 -1.432650 1.560172
H 1.357835 0.467797 -2.308922
H 5.193132 -1.463512 -0.295375


