%chk=000198935.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198935

0 1
S 2.182983 -0.961065 0.086553
S -2.458334 -0.866201 0.036103
O 0.911278 -1.613751 0.420743
O 3.268748 -1.834148 -0.328256
O -3.825086 -0.742532 0.520661
O -2.186541 -0.428249 -1.334472
N 0.361603 1.503968 0.137563
C 0.581264 0.853202 -1.194775
C -1.083702 1.456715 0.564402
C 1.965495 0.201956 -1.216859
C -1.435284 0.076579 1.123762
C 0.843112 2.919791 0.121755
C 2.718569 -0.063023 1.482157
C -1.950424 -2.517167 0.212220
H 0.489453 1.563829 -2.045489
H -0.209849 0.078542 -1.390274
H -1.771981 1.746821 -0.264475
H -1.231779 2.213149 1.368445
H 2.755041 0.977943 -1.206036
H 2.108008 -0.294832 -2.203342
H -1.917706 0.190756 2.113617
H -0.485675 -0.477749 1.355607
H 0.795911 3.329906 1.143332
H 0.274565 3.589161 -0.542844
H 1.897269 2.947140 -0.193811
H 2.072679 0.805815 1.703475
H 2.709217 -0.669203 2.400133
H 3.744025 0.315711 1.397888
H -0.841312 -2.632901 0.241931
H -2.328330 -3.009458 1.115697
H -2.264316 -3.154305 -0.627210


%chk=000198935-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198935

0 1
S 2.357499 -1.036645 0.069254
S -2.589205 -0.884152 0.018564
O 0.932070 -1.797161 0.395016
O 3.644190 -1.903405 -0.439729
O -4.118379 -0.770192 0.590085
O -2.263783 -0.420719 -1.528129
N 0.343992 1.597690 0.115644
C 0.589788 0.866485 -1.156890
C -1.078928 1.523849 0.569232
C 2.016138 0.346548 -1.270771
C -1.426156 0.168653 1.201134
C 0.816947 3.003159 0.049213
C 2.842919 -0.103186 1.661668
C -1.988960 -2.687134 0.214038
H 0.396612 1.513182 -2.048405
H -0.128655 0.032644 -1.251243
H -1.787055 1.760169 -0.259641
H -1.214408 2.302727 1.341445
H 2.811204 1.086505 -1.080776
H 2.209008 -0.195588 -2.211496
H -2.046228 0.243650 2.107541
H -0.534482 -0.465756 1.339892
H 0.727619 3.479036 1.041628
H 0.248068 3.619542 -0.687289
H 1.882194 3.033073 -0.241726
H 2.044976 0.639691 1.808717
H 2.874918 -0.874010 2.444283
H 3.830926 0.343985 1.482161
H -0.894890 -2.665696 0.085354
H -2.298901 -3.009311 1.218107
H -2.510137 -3.241233 -0.578681


