%chk=000211674.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211674

0 1
Cl -5.028998 2.893554 -0.976204
S 0.621745 -3.351839 0.051980
S -1.998376 -2.943165 -1.108787
N 1.626835 -0.899733 0.421048
N -0.782351 -1.054426 0.304362
C 2.761265 0.075224 0.635727
C 3.990354 -0.377541 -0.183744
C 2.319303 1.476854 0.156525
C 5.140701 0.624688 -0.026566
C 3.461558 2.486714 0.317757
C 4.713995 2.037396 -0.446319
C 0.361903 -0.520695 1.113971
C 1.961983 -2.303954 0.734853
C -0.761437 -2.297510 -0.242910
C -1.835475 -0.108138 -0.029340
C -2.691699 0.330713 0.993616
C -1.968102 0.362605 -1.347122
C -3.686262 1.265683 0.697445
C -2.965569 1.293217 -1.641124
C -3.805041 1.734042 -0.613444
H 3.040436 0.124160 1.719613
H 3.707798 -0.470283 -1.252707
H 4.325930 -1.384343 0.129140
H 1.427831 1.822401 0.716329
H 2.005648 1.421018 -0.906146
H 6.004169 0.296066 -0.636348
H 5.495315 0.634305 1.022045
H 3.702290 2.621115 1.389824
H 3.134109 3.479184 -0.047127
H 5.540910 2.750726 -0.271558
H 4.515790 2.060043 -1.535838
H 0.269291 0.594392 1.180295
H 0.269742 -0.935174 2.149288
H 2.900152 -2.604657 0.212931
H 2.082462 -2.532467 1.814163
H -2.597749 -0.066963 2.003615
H -1.308317 -0.008476 -2.135152
H -4.365304 1.615887 1.475457
H -3.092037 1.664980 -2.658951


%chk=000211674-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211674

0 1
Cl -4.734707 3.541438 0.678874
S 0.850948 -2.952015 -1.031156
S -1.722229 -1.908208 -2.150557
N 1.735072 -1.111465 0.979719
N -0.606446 -0.885842 0.146703
C 2.452538 0.098894 0.467704
C 3.901976 0.134061 1.014569
C 2.443576 0.266056 -1.077756
C 4.635454 1.428855 0.588285
C 3.176436 1.565022 -1.496294
C 4.622263 1.605772 -0.948060
C 0.341842 -0.989051 1.342516
C 2.057040 -2.409775 0.467236
C -0.560409 -1.781459 -0.911139
C -1.626802 0.137250 0.232018
C -2.451336 0.201520 1.381120
C -1.760884 1.116169 -0.784178
C -3.399051 1.240111 1.526734
C -2.708312 2.150990 -0.652562
C -3.512509 2.199730 0.505145
H 1.908401 0.964359 0.901303
H 4.463048 -0.742190 0.627718
H 3.875142 0.040851 2.116237
H 1.404924 0.272492 -1.454900
H 2.946437 -0.603067 -1.546675
H 5.675184 1.411319 0.967135
H 4.139022 2.302126 1.060106
H 2.616355 2.443431 -1.112580
H 3.180038 1.648434 -2.599804
H 5.110707 2.558827 -1.227656
H 5.214210 0.792107 -1.415886
H 0.172890 -0.080629 1.940546
H 0.050484 -1.878431 1.934856
H 3.069622 -2.454806 0.043846
H 1.908329 -3.200312 1.218757
H -2.377962 -0.570709 2.154226
H -1.136936 1.058827 -1.680094
H -4.041238 1.288793 2.410451
H -2.818318 2.906128 -1.435910


