%chk=000255325.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255325

0 1
S 0.362292 1.002401 -2.944258
O 1.800813 0.185322 1.901842
O -0.715677 -1.211052 -0.334435
O -1.108603 1.884513 1.780662
O 2.301759 -1.986540 2.455413
O 0.552635 1.640217 -1.392665
O -1.582203 3.982512 0.960025
O -0.146510 -3.425390 -0.619472
O 1.116440 -0.226561 -2.973904
O -1.049292 0.963014 -3.217636
C 0.358003 -0.325511 0.043090
C -0.207184 1.077755 -0.298625
C 0.620639 -0.571221 1.545066
C -0.073886 2.145354 0.812298
C 0.974422 -2.030080 1.882751
C -0.350243 3.579610 0.323231
C 2.912632 -0.707138 2.190496
C -2.176019 2.865227 1.663793
C -0.426672 -2.228253 -1.326727
C -1.665575 -2.289898 -2.220838
C -2.855821 -2.951806 -1.520237
C 3.570208 -0.227737 3.469180
C 3.821573 -0.797364 0.976070
C -2.529772 3.321507 3.064323
C -3.319012 2.290841 0.846455
C -2.432079 -4.281843 -0.884806
C -1.262888 -4.044014 0.069610
C 1.164423 2.264677 -3.813788
H 1.284376 -0.528071 -0.546261
H -1.279148 0.974817 -0.610853
H -0.195477 -0.155099 2.179629
H 0.884353 2.045023 1.375858
H 0.340330 -2.468099 2.668593
H 1.014208 -2.702241 1.001620
H -0.509646 3.662357 -0.763963
H 0.405145 4.308013 0.659217
H 0.530297 -2.024187 -1.861275
H -1.935462 -1.259964 -2.544783
H -1.405011 -2.845316 -3.143489
H -3.250085 -2.268604 -0.740652
H -3.678639 -3.112282 -2.240462
H 2.809000 0.086173 4.198414
H 4.150425 -1.036214 3.932791
H 4.233518 0.625135 3.294046
H 3.355140 -1.383051 0.172915
H 4.045266 0.197580 0.575468
H 4.767603 -1.293136 1.221851
H -3.163988 2.593680 3.582120
H -3.050942 4.287185 3.039097
H -1.620573 3.456049 3.668526
H -4.234829 2.881451 0.961776
H -3.535723 1.257747 1.147341
H -3.080214 2.278624 -0.225397
H -3.278572 -4.744497 -0.346115
H -2.134378 -5.000029 -1.673681
H -1.542448 -3.386999 0.911963
H -0.806935 -4.979396 0.437390
H 1.622480 3.022144 -3.151447
H 1.991755 1.902716 -4.447629
H 0.495970 2.831250 -4.483623


%chk=000255325-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255325

0 1
S -0.660343 1.387452 -3.202789
O 1.775753 0.074654 1.847229
O -0.805293 -1.399139 -0.427718
O -0.934914 2.074717 1.668805
O 1.680576 -1.920005 3.104073
O 0.460925 1.299716 -1.700477
O -0.824669 4.318310 0.984571
O 0.340919 -3.421867 -1.147213
O -0.627554 0.008972 -4.047719
O -2.086650 2.006480 -2.733677
C 0.243733 -0.450542 0.016709
C -0.211877 0.971463 -0.407423
C 0.487450 -0.618921 1.534959
C 0.070525 2.145181 0.565496
C 0.758453 -2.075322 1.961589
C -0.164723 3.536480 -0.076523
C 2.594223 -0.822807 2.735642
C -1.707623 3.361450 1.684352
C -0.431941 -2.259543 -1.578349
C -1.730153 -2.635121 -2.310000
C -2.561532 -3.677980 -1.531306
C 2.969157 -0.074089 4.011543
C 3.796962 -1.335905 1.925399
C -1.853797 3.826665 3.130110
C -3.041713 3.167447 0.943443
C -1.678243 -4.902804 -1.198019
C -0.447746 -4.436240 -0.404566
C 0.391261 2.694879 -4.081475
H 1.206266 -0.684736 -0.481306
H -1.310504 0.942241 -0.563005
H -0.312583 -0.152975 2.134155
H 1.063323 2.048416 1.030165
H -0.133682 -2.592220 2.342522
H 1.218930 -2.656922 1.139620
H -0.815565 3.466502 -0.970094
H 0.769727 4.061737 -0.324953
H 0.261094 -1.706695 -2.234528
H -2.304536 -1.713404 -2.498832
H -1.441282 -3.047503 -3.295640
H -2.939346 -3.226439 -0.593958
H -3.440675 -3.981273 -2.129181
H 2.058381 0.307929 4.499091
H 3.490394 -0.755113 4.706887
H 3.635397 0.773710 3.778216
H 3.457738 -1.938944 1.065854
H 4.384155 -0.483462 1.542411
H 4.447452 -1.960654 2.561905
H -2.460732 3.107093 3.705370
H -2.349048 4.812515 3.158698
H -0.858679 3.909734 3.594659
H -3.639435 4.094278 0.989196
H -3.609976 2.352089 1.424342
H -2.886200 2.900755 -0.116600
H -2.238459 -5.647200 -0.599602
H -1.349854 -5.398901 -2.132064
H -0.771317 -4.011625 0.566758
H 0.268180 -5.254616 -0.220790
H 1.395875 2.261330 -4.169698
H -0.083953 2.871591 -5.056468
H 0.369946 3.580482 -3.433898


