%chk=000198945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198945

0 1
Cl 7.247848 1.377772 -1.491737
S 3.172916 -2.584714 1.085892
O -6.820555 0.733352 -0.120038
N -4.485661 -0.903975 -0.329849
N -0.328030 -0.569850 0.610751
C -3.582797 -1.900073 -0.998650
C -2.124354 -1.417716 -0.952918
C -4.639260 0.335943 -1.160814
C -5.835409 -1.509601 -0.073685
C -1.611352 -1.310884 0.494557
C -5.536717 1.327007 -0.404450
C -6.703749 -0.473907 0.659302
C 0.880723 -1.351575 0.225622
C -0.330963 0.837129 0.433821
C 1.672344 -1.654400 1.499689
C -1.530542 1.570938 0.611052
C 0.867704 1.541918 0.174723
C -1.513708 2.960655 0.547194
C 0.858554 2.934900 0.111207
C -0.324349 3.654745 0.295989
C 4.262137 -1.405449 0.366039
C 4.296601 -0.069026 0.770913
C 5.144410 -1.894659 -0.604820
C 5.223483 0.803330 0.191651
C 6.079726 -1.031188 -1.181399
C 6.100916 0.306300 -0.775151
H -3.668858 -2.865916 -0.452823
H -3.870997 -2.106944 -2.052470
H -1.491650 -2.109665 -1.539051
H -2.033504 -0.431183 -1.453914
H -5.066462 0.133049 -2.166187
H -3.630829 0.781843 -1.314226
H -6.347894 -1.837146 -1.003602
H -5.703042 -2.406927 0.566930
H -2.376887 -0.794259 1.128041
H -1.476593 -2.319789 0.939007
H -5.076242 1.657062 0.543425
H -5.810874 2.199137 -1.023193
H -7.754321 -0.799836 0.751493
H -6.289570 -0.222243 1.651648
H 1.511092 -0.793178 -0.506665
H 0.589934 -2.296522 -0.285805
H 1.902323 -0.729200 2.063457
H 1.088256 -2.291135 2.196085
H -2.466807 1.049444 0.815100
H 1.802160 1.008923 0.018349
H -2.440147 3.515418 0.694920
H 1.789128 3.466311 -0.088224
H -0.322039 4.738739 0.246349
H 3.615586 0.304423 1.538286
H 5.109983 -2.940421 -0.916440
H 5.264008 1.850050 0.493355
H 6.778129 -1.392709 -1.936235


%chk=000198945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198945

0 1
Cl 7.349109 1.691974 -1.185424
S 3.230793 -2.672622 1.247878
O -6.845971 0.881930 0.132521
N -4.563778 -0.844000 -0.397345
N -0.304086 -0.693637 0.126234
C -3.773515 -1.918542 -1.055906
C -2.289540 -1.522811 -1.217507
C -4.943304 0.247985 -1.334547
C -5.773679 -1.351994 0.302037
C -1.572080 -1.445736 0.156926
C -5.650995 1.378057 -0.568979
C -6.462807 -0.200904 1.053608
C 0.942242 -1.464021 0.006851
C -0.298308 0.714343 0.190439
C 1.599382 -1.708282 1.385425
C -1.521475 1.451992 0.299297
C 0.923089 1.459954 0.149371
C -1.509741 2.859789 0.368299
C 0.912865 2.868019 0.212242
C -0.298583 3.588068 0.324672
C 4.347885 -1.384710 0.547093
C 4.480312 -0.106642 1.142958
C 5.144206 -1.721532 -0.574501
C 5.386268 0.838949 0.612186
C 6.069997 -0.791403 -1.100248
C 6.170458 0.479245 -0.501784
H -3.839778 -2.824232 -0.420086
H -4.206448 -2.193798 -2.049194
H -1.780010 -2.255452 -1.873751
H -2.209585 -0.541637 -1.720463
H -5.623533 -0.133104 -2.137527
H -4.036280 0.652698 -1.819433
H -6.504144 -1.807938 -0.412548
H -5.470297 -2.132259 1.025734
H -2.267706 -0.993550 0.887474
H -1.355839 -2.469936 0.516744
H -4.947137 1.829554 0.164293
H -6.015976 2.157127 -1.258259
H -7.402574 -0.536112 1.522596
H -5.775627 0.196131 1.832161
H 1.659197 -0.954356 -0.662848
H 0.717562 -2.438862 -0.461901
H 1.788233 -0.760386 1.914134
H 0.962663 -2.340878 2.027795
H -2.482689 0.929272 0.332386
H 1.887645 0.950633 0.064244
H -2.464734 3.392864 0.455707
H 1.867921 3.405707 0.173068
H -0.298517 4.681574 0.375873
H 3.896824 0.155972 2.031534
H 5.038713 -2.705673 -1.041820
H 5.488871 1.827342 1.069379
H 6.688300 -1.049868 -1.964586


