%chk=000225723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225723

0 1
S -4.023777 -1.413988 -1.954837
O 5.206245 -0.330462 -1.399910
C -1.925153 0.621493 -0.348514
C -2.695895 -0.564262 0.315289
C -0.586562 0.875129 0.359103
C 0.278007 -0.412534 0.197049
C 1.683621 -0.228743 0.856539
C -1.857843 -1.838395 0.113799
C -0.463958 -1.651783 0.741191
C -4.081162 -0.477890 -0.385554
C -2.965436 1.752060 -0.405811
C 0.130733 2.104121 -0.227060
C -4.311293 1.024076 -0.648482
C 2.303428 1.004387 0.195755
C 1.530653 2.281982 0.381085
C -2.955114 -0.356672 1.822315
C 2.571941 -1.486877 0.651649
C 1.576189 0.011584 2.374925
C 3.265313 -1.545629 -0.706735
C 3.404924 0.965561 -0.569047
C 4.090949 -0.291221 -0.926465
H -1.695932 0.332795 -1.408680
H -0.763443 1.056959 1.446731
H 0.451242 -0.573334 -0.896903
H -1.739335 -2.080251 -0.960760
H -2.361325 -2.713946 0.562153
H -0.560038 -1.581473 1.842058
H 0.146407 -2.557647 0.548848
H -4.885308 -0.913086 0.242252
H -2.744465 2.468705 -1.211874
H -2.989575 2.330113 0.532146
H -0.472018 3.013589 -0.046441
H 0.214175 2.009878 -1.327787
H -5.091388 1.417709 0.026327
H -4.672504 1.220328 -1.672376
H 1.460254 2.543555 1.455959
H 2.042566 3.141430 -0.095935
H -2.016034 -0.256974 2.379791
H -3.540432 0.547610 2.016515
H -3.497712 -1.205785 2.249975
H 1.962784 -2.402260 0.796493
H 3.347564 -1.520249 1.444839
H 2.535765 0.330503 2.797781
H 0.836043 0.784408 2.614583
H 1.270648 -0.898904 2.902259
H 2.529644 -1.641033 -1.530355
H 3.910197 -2.444110 -0.779437
H 3.850510 1.861631 -1.001623
H -5.287501 -1.202997 -2.378625


%chk=000225723-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225723

0 1
S -3.851966 -1.381087 -2.200754
O 4.964387 -0.360865 -1.931537
C -1.930896 0.619910 -0.297310
C -2.722881 -0.579469 0.315984
C -0.579113 0.874919 0.401619
C 0.292331 -0.425607 0.290762
C 1.738716 -0.222105 0.916249
C -1.861004 -1.858641 0.190417
C -0.466698 -1.663362 0.847976
C -4.053668 -0.506758 -0.496476
C -2.975032 1.760848 -0.361776
C 0.145334 2.106541 -0.194770
C -4.330677 1.026420 -0.651276
C 2.330160 1.009196 0.212311
C 1.569078 2.302404 0.407695
C -3.115906 -0.354205 1.807835
C 2.676362 -1.452088 0.710187
C 1.662886 0.022705 2.455655
C 3.227805 -1.603378 -0.721703
C 3.376395 0.935245 -0.673829
C 3.961695 -0.333492 -1.153653
H -1.704457 0.327866 -1.346735
H -0.771113 1.087680 1.474651
H 0.443890 -0.601626 -0.798719
H -1.716896 -2.103846 -0.880551
H -2.372424 -2.726370 0.651442
H -0.578440 -1.574707 1.945924
H 0.126633 -2.579282 0.668859
H -4.878522 -1.036686 0.009254
H -2.737817 2.501026 -1.145363
H -3.019614 2.307474 0.600247
H -0.456988 3.018635 -0.020829
H 0.238522 1.981369 -1.293118
H -5.114655 1.340578 0.063453
H -4.706225 1.263214 -1.661200
H 1.475332 2.562589 1.479862
H 2.083384 3.140969 -0.095549
H -2.234019 -0.228476 2.458515
H -3.752479 0.538246 1.941137
H -3.680789 -1.229515 2.179135
H 2.159247 -2.377297 1.021935
H 3.537351 -1.333433 1.398599
H 2.639187 0.375778 2.835541
H 0.900242 0.765690 2.742624
H 1.425622 -0.921903 2.978009
H 2.404828 -1.782630 -1.443949
H 3.918864 -2.460575 -0.803993
H 3.779784 1.847606 -1.132821
H -5.049159 -0.910403 -2.715765


