%chk=000205607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205607

0 1
S 1.832131 1.964126 -0.676647
S 4.642566 1.026731 -0.263399
O 0.321543 -1.228279 0.832737
N 2.393370 -0.333300 0.358080
C 3.114153 -1.551685 0.841956
C 0.939310 -0.311771 0.349398
C 0.453007 0.939570 -0.271434
C 3.052893 0.766454 -0.151093
C -0.794332 1.327248 -0.567453
C 3.444182 -2.490476 -0.310940
C -2.046328 0.596794 -0.333933
C -3.049248 0.669418 -1.322407
C -2.286198 -0.132767 0.840083
C -4.262803 0.008271 -1.138626
C -3.510664 -0.783926 1.022913
C -4.496884 -0.717797 0.036365
H 4.040627 -1.233308 1.374772
H 2.453994 -2.060007 1.585924
H -0.943958 2.301944 -1.065131
H 2.542215 -2.828549 -0.836843
H 4.099360 -2.014397 -1.053707
H 3.965098 -3.384661 0.053881
H -2.874018 1.233077 -2.238051
H -1.515346 -0.204016 1.611061
H -5.031146 0.057097 -1.909054
H -3.688108 -1.350143 1.936928
H -5.447415 -1.230746 0.178217


%chk=000205607-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205607

0 1
S 1.810892 1.735239 -1.242623
S 4.759349 1.057242 -0.599341
O 0.506418 -1.335465 0.906531
N 2.515683 -0.299421 0.275505
C 3.316653 -1.310192 1.013526
C 1.089107 -0.407981 0.272339
C 0.476700 0.670851 -0.536789
C 3.112955 0.730469 -0.446642
C -0.838233 0.981453 -0.822488
C 3.710798 -2.497237 0.113940
C -2.137705 0.409958 -0.462575
C -3.282733 1.083878 -0.999912
C -2.355317 -0.736448 0.363796
C -4.588287 0.637692 -0.727112
C -3.666421 -1.176589 0.632286
C -4.786470 -0.498906 0.093528
H 4.212660 -0.794842 1.398775
H 2.688973 -1.649362 1.854548
H -0.945892 1.866216 -1.470301
H 2.815050 -3.013028 -0.272210
H 4.328421 -2.158366 -0.735099
H 4.299941 -3.224145 0.701022
H -3.134909 1.965864 -1.635993
H -1.494153 -1.263789 0.780993
H -5.447649 1.169598 -1.149117
H -3.816604 -2.056633 1.267261
H -5.801226 -0.851155 0.309750


