%chk=000274797.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274797

0 1
S 4.645257 1.933042 -0.672314
S -2.181191 2.635933 -0.246234
O 5.093167 -1.215771 -0.249420
O -5.109055 -1.184391 -0.571733
O 3.785984 -0.683804 -2.033202
O -4.156234 -1.450605 1.468323
O 0.629292 -0.367655 1.619945
O -0.723496 0.531276 -1.505093
N 1.742711 0.069859 -0.342216
N -1.836271 -0.228420 0.357545
C 3.695484 1.265183 0.768109
C -3.621692 1.541401 0.123446
C 3.086980 -0.073003 0.250103
C -3.166517 0.085243 -0.197892
C 2.665683 2.265735 1.239416
C 4.753662 0.980923 1.820948
C -4.788132 1.928125 -0.765326
C -3.903265 1.765974 1.597168
C 3.997976 -0.646705 -0.846142
C -4.153559 -0.931679 0.380415
C 0.614229 -0.093699 0.432367
C -0.705924 0.125201 -0.354063
C 6.109756 -1.756982 -1.140298
C -6.147404 -2.141362 -0.220157
H 3.025061 -0.799762 1.116749
H -3.127571 -0.047232 -1.324048
H 1.978024 2.597338 0.451126
H 3.136466 3.170558 1.650153
H 2.037872 1.841082 2.041634
H 5.328595 1.880224 2.083770
H 4.302820 0.612944 2.753561
H 5.480886 0.219009 1.491490
H -4.546694 1.890860 -1.835679
H -5.136542 2.950175 -0.557039
H -5.649794 1.258537 -0.617352
H -3.045378 1.517947 2.239072
H -4.747460 1.157730 1.952585
H -4.161699 2.814083 1.810589
H 1.681447 0.289394 -1.346372
H -1.783513 -0.476557 1.354560
H 3.625677 2.327666 -1.468005
H -1.960067 2.315234 -1.547448
H 6.723437 -2.360159 -0.463814
H 6.670390 -0.921450 -1.572350
H 5.643763 -2.362523 -1.925151
H -6.748679 -2.183165 -1.135067
H -6.719566 -1.764878 0.633007
H -5.690616 -3.108776 0.013535


%chk=000274797-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274797

0 1
S 4.660209 2.160767 -0.667985
S -2.623261 3.114717 -0.539944
O 5.027781 -1.392700 -0.203358
O -4.801595 -1.321959 -0.804251
O 3.560936 -0.919862 -1.945648
O -4.041512 -1.289486 1.397596
O 0.528677 -0.171166 1.717230
O -0.592328 0.473515 -1.648266
N 1.752265 0.169222 -0.260531
N -1.806820 0.156973 0.341421
C 3.796480 1.267239 0.814237
C -3.796827 1.721584 0.095064
C 3.077349 -0.055103 0.317761
C -3.132773 0.329172 -0.245759
C 2.788176 2.231815 1.469168
C 4.936608 0.930850 1.800507
C -5.164423 1.851498 -0.606580
C -3.911443 1.971023 1.613672
C 3.892418 -0.814446 -0.743154
C -4.017679 -0.832697 0.231445
C 0.601542 0.058964 0.467444
C -0.660713 0.253804 -0.398386
C 5.921466 -2.074267 -1.177677
C -5.713511 -2.443094 -0.451924
H 2.949616 -0.692080 1.215133
H -3.022862 0.260075 -1.342527
H 2.017598 2.574247 0.757915
H 3.326139 3.118056 1.845895
H 2.275362 1.734586 2.313524
H 5.449695 1.857237 2.111649
H 4.511317 0.453434 2.703351
H 5.674039 0.241595 1.361280
H -5.088798 1.645085 -1.689069
H -5.552045 2.875412 -0.475872
H -5.899453 1.144209 -0.177114
H -2.924471 1.949154 2.107167
H -4.551748 1.204931 2.085642
H -4.361090 2.962180 1.798448
H 1.658939 0.251499 -1.283299
H -1.702465 -0.062735 1.340282
H 3.497375 2.445207 -1.368240
H -2.514600 2.642814 -1.838657
H 6.754024 -2.456267 -0.571445
H 6.270759 -1.348718 -1.930559
H 5.379769 -2.893550 -1.678025
H -6.229918 -2.686442 -1.390092
H -6.425424 -2.123371 0.327248
H -5.128481 -3.300824 -0.081517


