%chk=000214576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214576

0 1
Cl 6.051369 -2.504184 1.946633
S 3.390843 1.873703 -1.588744
N -4.544251 -1.492814 0.158400
N -1.673556 -1.353844 -0.272676
N 1.889478 0.113795 0.477833
C -3.851869 -0.173507 -0.066166
C -2.610495 -0.408435 -0.964220
C -4.815450 0.804814 -0.770932
C -3.602391 -2.450417 0.829853
C -5.778647 -1.324327 0.997218
C -6.095629 0.998875 0.049402
C -2.363787 -2.668380 -0.060493
C -6.757283 -0.359442 0.309304
C -0.410940 -1.522532 -1.066609
C 0.720314 -2.020640 -0.151717
C 1.051982 -1.023052 0.967856
C 3.283703 -0.093938 0.344855
C 1.234897 1.302270 0.037297
C 4.091846 0.707739 -0.493480
C 1.859185 2.224800 -0.823959
C 3.918912 -1.106198 1.103712
C -0.063731 1.607376 0.506737
C 5.475309 0.552508 -0.544556
C 1.247126 3.431563 -1.164974
C 5.299254 -1.255392 1.013045
C -0.680448 2.803182 0.147785
C 6.101599 -0.445054 0.210859
C -0.029200 3.725066 -0.679948
H -3.513213 0.278358 0.902589
H -2.932460 -0.774826 -1.962823
H -2.081878 0.557180 -1.118164
H -5.077142 0.411397 -1.773817
H -4.312013 1.773733 -0.936152
H -4.130860 -3.418878 0.961119
H -3.282212 -2.107472 1.837982
H -5.554935 -0.965419 2.025148
H -6.253976 -2.324545 1.096703
H -6.793833 1.666685 -0.488544
H -5.865709 1.502637 1.007133
H -1.658841 -3.357915 0.449746
H -2.670628 -3.152921 -1.013656
H -7.662058 -0.239127 0.931696
H -7.092812 -0.800218 -0.651300
H -0.526930 -2.214938 -1.927709
H -0.120986 -0.536417 -1.496676
H 0.439365 -2.989695 0.307046
H 1.620056 -2.225428 -0.766378
H 1.586441 -1.537754 1.799764
H 0.103185 -0.624728 1.411818
H 3.340346 -1.754967 1.762774
H -0.596080 0.892340 1.143221
H 6.081066 1.201984 -1.182066
H 1.759582 4.144424 -1.814249
H -1.680685 3.022736 0.521958
H 7.179534 -0.582502 0.171223
H -0.512367 4.662138 -0.944504


%chk=000214576-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214576

0 1
Cl 6.260145 -2.333320 1.021028
S 2.218794 1.713319 -1.944308
N -4.416914 -1.406385 0.037899
N -1.534443 -1.668547 -0.150341
N 1.608172 0.076821 0.578006
C -3.580304 -0.273615 -0.456332
C -2.293944 -0.824052 -1.103089
C -4.374846 0.581278 -1.467471
C -3.652251 -2.265946 0.973453
C -5.687452 -0.944782 0.652121
C -5.710238 1.076471 -0.870639
C -2.373930 -2.798792 0.309944
C -6.527822 -0.123410 -0.343051
C -0.198860 -2.082190 -0.643963
C 0.802650 -2.306680 0.513361
C 0.979330 -1.021526 1.354159
C 2.935503 -0.091537 0.092721
C 1.011058 1.378196 0.579764
C 3.404784 0.659656 -1.023159
C 1.240848 2.281811 -0.495075
C 3.837170 -1.000107 0.713899
C 0.191338 1.821383 1.653459
C 4.730219 0.535320 -1.480287
C 0.681032 3.574231 -0.501133
C 5.141882 -1.135584 0.210172
C -0.402669 3.101543 1.630635
C 5.621181 -0.382909 -0.875990
C -0.162206 3.986392 0.556269
H -3.273311 0.378246 0.406021
H -2.581616 -1.393033 -2.023786
H -1.654642 0.025430 -1.406930
H -4.579389 -0.034191 -2.366414
H -3.748134 1.437969 -1.783556
H -4.295573 -3.115084 1.274276
H -3.364071 -1.706046 1.901161
H -5.490259 -0.318852 1.564422
H -6.250964 -1.837806 0.984381
H -6.286559 1.639459 -1.629152
H -5.504224 1.776690 -0.034456
H -1.807487 -3.402757 1.042917
H -2.655873 -3.467753 -0.542384
H -7.455588 0.220957 0.153198
H -6.820091 -0.774634 -1.189580
H -0.253706 -3.005081 -1.271761
H 0.193345 -1.275099 -1.290780
H 0.440034 -3.106061 1.189556
H 1.766371 -2.654802 0.097409
H 1.535584 -1.228562 2.291644
H -0.039111 -0.698260 1.622013
H 3.527639 -1.586727 1.581136
H 0.025746 1.170941 2.516722
H 5.067004 1.139889 -2.328478
H 0.894449 4.248220 -1.337567
H -1.039344 3.411473 2.466453
H 6.642536 -0.505987 -1.243848
H -0.612898 4.983819 0.541530


