%chk=000284035.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284035

0 1
S -4.463385 0.628494 1.066546
O 6.009933 0.539728 1.235678
O -5.200412 -1.736643 0.189192
N 7.069205 0.328598 -0.819687
N -0.742401 -0.999656 1.114224
N 4.893470 -0.550101 -0.535437
N 3.782941 -0.714611 0.260759
C 8.266858 1.171102 -0.442729
C 8.955226 0.525929 0.766440
C 7.817021 2.602638 -0.115240
C 9.205779 1.169621 -1.663527
C 0.445891 -0.850860 0.219396
C 1.642516 -1.566710 0.869871
C 5.998368 0.157728 0.086492
C -1.931971 -0.261671 0.582292
C 2.837614 -1.554464 -0.053531
C -3.046919 -0.366912 1.619687
C 2.816085 -2.499458 -1.219094
C -5.532814 -0.587650 0.277906
C -6.767390 0.045480 -0.229890
C -7.260397 -0.366547 -1.480190
C -7.445697 1.026482 0.507143
C -8.418872 0.216211 -1.996218
C -8.609005 1.601227 -0.014703
C -9.092400 1.201140 -1.264129
H 8.283202 0.511602 1.641160
H 9.854458 1.076392 1.056106
H 9.241586 -0.511958 0.568261
H 8.666381 3.237947 0.152375
H 7.294975 3.077639 -0.950243
H 7.127199 2.608406 0.745205
H 9.503714 0.153984 -1.947838
H 10.126858 1.719885 -1.435896
H 8.757051 1.650718 -2.538073
H 6.888541 0.253316 -1.818539
H 0.271049 -1.235961 -0.807932
H 0.680255 0.234512 0.121819
H 1.392482 -2.611073 1.140908
H 1.883586 -1.063223 1.837109
H -0.973129 -1.994121 1.221127
H -1.640648 0.804001 0.431816
H -2.276629 -0.642777 -0.404894
H -2.718682 0.027024 2.604384
H -3.360741 -1.419282 1.781998
H 5.111558 -1.244209 -1.260888
H 3.663029 -3.198538 -1.189763
H 1.906031 -3.114694 -1.237431
H 2.849556 -1.960084 -2.175858
H -6.735868 -1.143298 -2.039976
H -7.082849 1.340608 1.488478
H -8.800096 -0.098294 -2.966818
H -9.138204 2.363572 0.555966
H -9.997311 1.654911 -1.668415


%chk=000284035-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284035

0 1
S -4.689245 0.876081 1.395934
O 6.221625 0.337625 1.485152
O -4.944021 -1.543842 0.139936
N 7.101288 0.407878 -0.695510
N -0.854568 -0.704419 1.040241
N 4.944307 -0.414839 -0.362635
N 3.796640 -0.589397 0.396015
C 8.467272 0.912999 -0.351310
C 9.176366 -0.089091 0.596009
C 8.371986 2.312809 0.313581
C 9.240509 1.012266 -1.689030
C 0.348276 -0.444710 0.220690
C 1.525098 -1.333490 0.696130
C 6.108345 0.139207 0.247004
C -2.040514 0.104319 0.690449
C 2.762769 -1.183991 -0.165826
C -3.097244 -0.056626 1.796861
C 2.740744 -1.711413 -1.595435
C -5.503460 -0.436380 0.342539
C -6.841013 -0.073777 -0.215222
C -7.510978 -1.051314 -1.001661
C -7.456318 1.186858 0.005872
C -8.775657 -0.771325 -1.555905
C -8.722281 1.463212 -0.550638
C -9.384720 0.486741 -1.331929
H 8.610659 -0.193315 1.535885
H 10.193764 0.272644 0.831960
H 9.258941 -1.082617 0.119066
H 9.382961 2.686075 0.560183
H 7.889481 3.037218 -0.368306
H 7.779424 2.251435 1.240845
H 9.323374 0.022887 -2.176907
H 10.261538 1.387234 -1.503974
H 8.746602 1.715645 -2.387475
H 6.858347 0.397927 -1.688265
H 0.166077 -0.608324 -0.872570
H 0.630839 0.618088 0.343395
H 1.195164 -2.395116 0.685426
H 1.776931 -1.068770 1.736121
H -1.081189 -1.709293 1.067364
H -1.728151 1.163672 0.625924
H -2.492194 -0.167558 -0.292995
H -2.739714 0.344759 2.757660
H -3.384432 -1.115904 1.914374
H 4.994572 -0.738391 -1.337957
H 3.555768 -2.443527 -1.772892
H 1.788410 -2.221065 -1.810536
H 2.854760 -0.897193 -2.340887
H -7.021775 -2.017636 -1.161671
H -6.950526 1.948478 0.609322
H -9.287171 -1.528418 -2.159960
H -9.192723 2.436747 -0.376543
H -10.368346 0.705037 -1.762499


