%chk=000216419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216419

0 1
Cl 0.740891 -4.272571 -0.060325
S -2.123640 0.617882 0.168959
S 4.955052 -1.184494 0.002895
S 6.596548 1.299445 0.367826
O 1.646750 0.695268 0.519396
N -3.713783 -1.438215 0.108431
N 3.907787 1.118710 0.466360
C -4.564612 -0.301425 0.163560
C -3.846458 0.918710 0.200043
C -2.345031 -1.149329 0.099724
C -5.966028 -0.299009 0.182210
C -4.257730 -2.809157 0.066277
C -4.498863 2.141334 0.254545
C -1.324482 -2.046728 0.047257
C -6.616120 0.937370 0.237183
C -5.899122 2.142086 0.272879
C 3.704314 2.578822 0.688892
C 3.189759 -1.141264 0.105000
C 2.756137 0.233913 0.367524
C 0.057852 -1.682655 0.036063
C 5.160116 0.559704 0.300612
C 2.509239 -2.297565 -0.041638
C 1.093977 -2.562211 -0.010841
C 3.770681 3.353486 -0.599395
C 3.125083 4.503748 -0.774218
H -6.534471 -1.223693 0.155057
H -4.863882 -3.015641 0.966958
H -3.442375 -3.557116 0.029526
H -4.886421 -2.951325 -0.831357
H -3.940672 3.077207 0.282474
H -1.571869 -3.114443 0.012551
H -7.707052 0.963938 0.252609
H -6.436444 3.088251 0.315408
H 2.714325 2.711503 1.193404
H 4.487109 2.955038 1.395007
H 0.294373 -0.600297 0.062343
H 3.123003 -3.209851 -0.211074
H 4.406049 2.921209 -1.376077
H 3.188949 5.080039 -1.686943
H 2.487462 4.962026 -0.032304


%chk=000216419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216419

0 1
Cl 0.734610 -4.322432 -0.316043
S -2.101747 0.727673 0.386468
S 5.115919 -1.215293 0.168611
S 6.763377 1.379272 0.579563
O 1.684707 0.756524 0.453561
N -3.725623 -1.356217 0.064802
N 4.009458 1.142919 0.513890
C -4.599889 -0.251734 0.198328
C -3.905441 0.975597 0.386391
C -2.361376 -1.060890 0.123444
C -6.012830 -0.258532 0.162441
C -4.176194 -2.743857 -0.125586
C -4.586021 2.192585 0.544046
C -1.328273 -1.989868 -0.001759
C -6.701051 0.965120 0.320710
C -6.001433 2.180994 0.510700
C 3.802156 2.604772 0.703275
C 3.277390 -1.102840 0.173130
C 2.866262 0.285216 0.378788
C 0.045753 -1.644287 0.067569
C 5.278803 0.583165 0.440145
C 2.532126 -2.270872 -0.002764
C 1.125202 -2.518382 -0.050083
C 3.854326 3.361227 -0.611294
C 2.797966 4.030027 -1.133716
H -6.576826 -1.183554 0.012656
H -5.271987 -2.789668 -0.066903
H -3.756785 -3.393863 0.662402
H -3.856756 -3.125470 -1.111984
H -4.038753 3.128900 0.688741
H -1.587617 -3.040780 -0.167628
H -7.795550 0.967457 0.293704
H -6.553146 3.118315 0.631192
H 2.815752 2.720680 1.181785
H 4.601762 2.952830 1.382332
H 0.346665 -0.595721 0.227148
H 3.135606 -3.179777 -0.131710
H 4.824162 3.353657 -1.126870
H 2.881275 4.582900 -2.076258
H 1.820425 4.036906 -0.636421


