%chk=000298092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298092

0 1
S -3.055776 2.393120 1.096363
S -5.344845 2.874797 -0.596071
O -4.073314 -0.992371 0.878437
O -2.809575 -0.446324 -0.916149
O 0.435150 -1.417344 1.804331
N -0.668207 0.279711 0.766631
C -1.949384 -0.088781 1.389756
C -2.523678 1.064384 2.210342
C -2.930970 -0.497409 0.281106
C 0.484782 -0.484431 1.014849
C -4.848445 2.150972 0.975293
C 1.699973 -0.045884 0.287117
C 4.121742 -0.328444 -0.189931
C 2.864219 -0.681614 0.486155
C 4.467897 1.010692 -0.434028
C 4.996918 -1.355289 -0.587154
C -5.101435 -1.511435 -0.007057
C 5.672991 1.317149 -1.071950
C 6.195093 -1.042455 -1.231925
C 6.535632 0.293084 -1.474219
C -4.868933 1.626559 -1.803807
H -1.782915 -0.990045 2.063942
H -1.751279 1.481700 2.891382
H -3.350571 0.712541 2.856253
H -0.697207 1.019002 0.066343
H -5.130502 1.085140 1.064889
H -5.371316 2.701828 1.782277
H 1.599834 0.786523 -0.408410
H 2.921507 -1.531660 1.183994
H 3.801911 1.812288 -0.117203
H 4.736969 -2.396594 -0.398911
H -5.361835 -0.754194 -0.763958
H -4.733641 -2.425131 -0.484516
H -5.930981 -1.714926 0.677724
H 5.939251 2.357142 -1.256161
H 6.867208 -1.840477 -1.544927
H 7.472496 0.533998 -1.974190
H -5.197055 1.969671 -2.793347
H -5.327932 0.646680 -1.602892
H -3.777777 1.475025 -1.839879


%chk=000298092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298092

0 1
S -3.086971 2.558006 1.547465
S -4.628187 3.220273 -1.098596
O -4.019830 -1.686239 1.359571
O -3.017078 -0.741474 -0.519340
O 0.137252 -1.768723 1.467604
N -0.936507 0.275321 1.193178
C -2.176682 -0.207161 1.776589
C -2.930244 0.929179 2.518201
C -3.075727 -0.885546 0.720769
C 0.163522 -0.566838 1.043108
C -4.633807 2.225774 0.476115
C 1.340100 0.056369 0.380481
C 3.727690 -0.224560 -0.461383
C 2.478520 -0.670244 0.171649
C 3.921112 1.093197 -0.971007
C 4.802000 -1.153749 -0.572914
C -4.956769 -2.421742 0.472322
C 5.141975 1.462486 -1.567204
C 6.025509 -0.784549 -1.169742
C 6.200898 0.526239 -1.669917
C -3.213838 2.373371 -2.015667
H -1.925086 -0.996022 2.510310
H -2.361510 1.216308 3.417867
H -3.935409 0.596653 2.822762
H -0.962766 1.207539 0.767060
H -4.677976 1.152251 0.245040
H -5.524905 2.545126 1.036371
H 1.256713 1.106163 0.070023
H 2.446237 -1.712322 0.523642
H 3.113768 1.830633 -0.900432
H 4.667107 -2.171171 -0.185931
H -5.553958 -1.713414 -0.126933
H -4.390962 -3.084064 -0.203146
H -5.593686 -2.999843 1.155484
H 5.274207 2.479266 -1.953594
H 6.838818 -1.514539 -1.245200
H 7.149475 0.817378 -2.134364
H -3.252113 2.757470 -3.046812
H -3.350115 1.281663 -2.006397
H -2.254778 2.638731 -1.546532


