%chk=000224116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224116

0 1
S -5.603819 -1.069954 -1.339300
O 2.119030 -2.687993 -0.417729
N -2.372994 0.490726 0.353283
C 1.817666 0.820330 0.094438
C 3.282221 0.649894 -0.003238
C 1.201392 -0.459940 -0.052940
C 3.563964 -0.737458 -0.210554
C 2.272796 -1.506365 -0.254265
C 1.044763 1.951049 0.296077
C -0.165782 -0.612557 -0.005652
C 4.310156 1.570871 0.073846
C 4.860789 -1.190594 -0.337927
C -0.955757 0.552907 0.196736
C -0.354135 1.810811 0.351784
C 5.636396 1.102358 -0.057181
C 5.908879 -0.246778 -0.258508
C -3.125309 -0.194665 -0.454699
C -4.559053 -0.230102 -0.216643
C -5.301891 0.309364 0.797692
C -6.715119 0.045684 0.671019
C -7.035333 -0.687144 -0.431454
H 1.499689 2.932662 0.414684
H -0.626236 -1.595783 -0.102950
H 4.114739 2.628427 0.231349
H 5.073487 -2.248669 -0.495432
H -0.981016 2.688890 0.521128
H 6.456488 1.819046 0.002201
H 6.938724 -0.587518 -0.356584
H -2.771650 -0.762317 -1.335299
H -4.884615 0.879770 1.621389
H -7.426561 0.410151 1.401228
H -8.007410 -1.017902 -0.756598


%chk=000224116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224116

0 1
S -5.558978 -1.447505 -1.175760
O 2.057000 -2.673487 -0.560565
N -2.401133 0.619433 0.324343
C 1.843363 0.864484 0.120227
C 3.310726 0.663361 0.006730
C 1.195880 -0.391460 -0.089942
C 3.559143 -0.716859 -0.269209
C 2.244897 -1.445488 -0.339040
C 1.068965 2.005321 0.402544
C -0.193545 -0.532221 -0.042297
C 4.386919 1.561139 0.122000
C 4.860338 -1.214081 -0.432944
C -0.989202 0.628886 0.224778
C -0.337959 1.874667 0.465424
C 5.707100 1.061435 -0.042080
C 5.946099 -0.307596 -0.315976
C -3.133278 -0.237613 -0.355502
C -4.571708 -0.294595 -0.177962
C -5.392908 0.438602 0.684047
C -6.784095 0.108790 0.575468
C -7.047932 -0.879615 -0.367916
H 1.534102 2.980363 0.582533
H -0.646984 -1.521076 -0.174242
H 4.223670 2.623712 0.332297
H 5.022632 -2.276295 -0.643782
H -0.972652 2.735893 0.696712
H 6.556757 1.748035 0.044792
H 6.974360 -0.664483 -0.436705
H -2.698773 -0.930146 -1.105540
H -4.977747 1.184194 1.364935
H -7.567701 0.580847 1.172581
H -8.002859 -1.319442 -0.650046


