%chk=000282794.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282794

0 1
S 3.482729 2.625569 1.477305
O 2.468964 -0.854927 1.461387
O 0.377514 1.523567 -0.091667
O 3.538380 -0.695911 -0.529304
O -0.554476 -1.999411 0.611274
O -0.734617 2.950241 1.267706
O 5.675967 -0.004897 -0.687323
O -2.021247 -1.106704 -0.859384
C 1.242796 1.130829 1.001294
C 2.686982 1.323468 0.510816
C 1.099964 -0.401048 1.235772
C 3.379164 -0.018409 0.771548
C 0.524279 -1.189749 0.058897
C 4.980748 2.938803 0.523728
C -0.602262 2.485331 0.162858
C 4.766362 -0.657619 -1.147279
C -1.337888 2.777257 -1.086364
C -1.815707 -1.858190 0.069861
C 4.730570 -1.484924 -2.381045
C -2.780988 -2.732486 0.772935
C -1.727461 4.104759 -1.333108
C -1.660481 1.758267 -1.992287
C -2.431451 4.408214 -2.498832
C -2.371085 2.072051 -3.154997
C -4.134495 -2.654344 0.404007
C -2.370290 -3.618909 1.780241
C -2.752208 3.392606 -3.409010
C -5.073035 -3.463955 1.046260
C -3.315701 -4.426022 2.417218
C -4.664009 -4.348215 2.051280
H 0.980707 1.717910 1.914592
H 2.684423 1.575927 -0.579423
H 0.585008 -0.655573 2.189050
H 4.335829 -0.048691 1.325802
H 1.259811 -1.925634 -0.324385
H 0.152058 -0.549435 -0.766950
H 5.505871 2.010145 0.242201
H 5.663953 3.527914 1.151091
H 4.773928 3.508625 -0.388256
H 3.722386 -1.873258 -2.600196
H 5.070223 -0.905981 -3.254698
H 5.405056 -2.352430 -2.286391
H -1.482222 4.887384 -0.612366
H -1.371230 0.720727 -1.780450
H -2.734997 5.434744 -2.698762
H -2.629260 1.281117 -3.858465
H -4.440735 -1.959615 -0.382822
H -1.313956 -3.671120 2.058593
H -3.304518 3.634338 -4.317164
H -6.123760 -3.406154 0.764790
H -3.001640 -5.115517 3.199936
H -5.399652 -4.978965 2.551386


%chk=000282794-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282794

0 1
S 3.472547 1.033088 2.521952
O 2.922090 -1.478295 0.236981
O 0.686585 0.744623 -0.452218
O 3.486517 0.018570 -1.507649
O -0.783599 -1.806428 0.538499
O -1.172444 1.487021 0.762551
O 5.258231 1.518919 -1.294131
O -1.067627 -4.101683 0.886683
C 1.358299 0.304108 0.794803
C 2.799451 0.854568 0.757050
C 1.552712 -1.234411 0.792086
C 3.576516 -0.235534 -0.012456
C 0.558103 -2.041097 -0.047185
C 4.896691 2.217250 2.136219
C -0.599050 1.306651 -0.338450
C 4.421649 0.922989 -2.016987
C -1.153822 1.655897 -1.675345
C -1.498030 -2.929381 1.002554
C 4.261143 1.080227 -3.512289
C -2.793740 -2.536305 1.623605
C -2.428960 2.277188 -1.727085
C -0.449210 1.378442 -2.876780
C -2.995168 2.620202 -2.971333
C -1.021810 1.722756 -4.118947
C -3.662515 -3.576301 2.048785
C -3.164434 -1.177581 1.807703
C -2.292887 2.343950 -4.169014
C -4.897539 -3.261128 2.649877
C -4.401534 -0.870891 2.413653
C -5.269162 -1.907152 2.833355
H 0.767692 0.656126 1.656234
H 2.852870 1.841010 0.273874
H 1.560297 -1.605472 1.833804
H 4.643671 -0.314502 0.244489
H 0.800512 -3.116475 -0.015502
H 0.533302 -1.676929 -1.085322
H 5.417468 1.891047 1.222861
H 5.577660 2.173143 2.999790
H 4.509481 3.239764 2.008864
H 3.334823 1.643104 -3.729154
H 5.120115 1.631380 -3.921532
H 4.172311 0.094308 -3.997384
H -2.954646 2.479636 -0.788125
H 0.530428 0.894443 -2.821333
H -3.979273 3.099018 -3.010726
H -0.483046 1.505194 -5.047501
H -3.350189 -4.615342 1.900440
H -2.490981 -0.377834 1.486293
H -2.734786 2.609003 -5.136015
H -5.567695 -4.063735 2.976110
H -4.686217 0.176425 2.561121
H -6.228497 -1.661872 3.303127


