%chk=000116408.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116408

0 1
Cl 4.489770 1.472671 0.362111
S -2.751880 0.682189 -1.396756
N 0.945959 -0.367738 -0.165722
C 0.008691 0.514498 -0.942726
C 2.370927 0.005113 -0.436181
C 0.674788 -1.819353 -0.434538
C -1.355277 0.453793 -0.357035
C 2.778612 1.004047 0.649020
C 1.351019 -2.683820 0.629037
C -1.762286 0.271888 0.927989
C -3.200899 0.315010 1.089271
C -3.875434 0.531003 -0.069782
H -0.007364 0.268445 -2.030397
H 0.377065 1.569380 -0.868945
H 2.538694 0.434210 -1.447617
H 3.028027 -0.893062 -0.378772
H -0.428325 -1.974711 -0.382911
H 0.993841 -2.135973 -1.450599
H 2.169038 1.924999 0.632096
H 2.709849 0.561683 1.660730
H 2.444140 -2.655502 0.554466
H 1.088837 -2.340574 1.639225
H 1.036721 -3.729382 0.539998
H -1.092347 0.103016 1.762475
H -3.660316 0.184586 2.060340
H -4.935549 0.610983 -0.229977


%chk=000116408-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116408

0 1
Cl 4.470666 1.655383 0.523418
S -2.845027 0.716457 -1.428348
N 0.970272 -0.403355 -0.326114
C 0.003046 0.445351 -1.059423
C 2.375452 0.043110 -0.462024
C 0.741587 -1.862752 -0.490108
C -1.368211 0.427259 -0.418919
C 2.703857 0.980919 0.707396
C 1.301664 -2.691171 0.680372
C -1.712586 0.261735 0.913588
C -3.131495 0.360357 1.170239
C -3.883589 0.604191 0.033684
H -0.079916 0.153129 -2.136476
H 0.392622 1.482774 -1.053890
H 2.569185 0.560597 -1.427098
H 3.051568 -0.828788 -0.427393
H -0.351602 -2.015044 -0.541924
H 1.168072 -2.231619 -1.455410
H 2.052591 1.867536 0.732978
H 2.678355 0.454641 1.671836
H 2.394286 -2.565412 0.792977
H 0.822409 -2.387715 1.627666
H 1.105922 -3.766820 0.516068
H -0.958515 0.066727 1.679211
H -3.574315 0.253081 2.163657
H -4.959997 0.726830 -0.071166


