%chk=000234704.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234704

0 1
Cl 7.196275 1.446142 0.449060
S 3.663587 -1.049653 0.785684
N -0.942360 -0.651941 -1.076143
N 0.706576 -2.017884 -0.230428
N 0.263065 1.543446 -0.875482
N 2.519054 1.265552 0.028964
C -2.262067 -0.220958 -1.575438
C 0.127869 0.181905 -0.749065
C 1.163797 -0.693403 -0.231161
C -3.245602 -0.067867 -0.439418
C -0.541635 -1.976255 -0.718233
C 2.370608 -0.067626 0.152495
C -3.138219 1.029781 0.426894
C -4.263168 -1.013044 -0.253716
C -4.050076 1.179809 1.474551
C -5.174433 -0.855460 0.795003
C 1.465855 2.012888 -0.474443
C 4.990614 0.113472 1.206334
C -5.069026 0.238922 1.659152
C 5.742776 0.502786 -0.044400
H -2.618696 -0.956262 -2.333786
H -2.140019 0.755218 -2.114126
H -1.199801 -2.825629 -0.850176
H -2.340309 1.761820 0.283817
H -4.351094 -1.868391 -0.920398
H 1.641169 3.099154 -0.549298
H -3.965901 2.031370 2.148936
H -5.966865 -1.588586 0.939301
H 5.640783 -0.409701 1.940816
H 4.588887 1.010566 1.727700
H -5.778999 0.358408 2.476264
H 6.103462 -0.366701 -0.626728
H 5.140593 1.156322 -0.709831


%chk=000234704-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234704

0 1
Cl 7.172467 1.774808 0.250941
S 3.769131 -1.165484 0.850262
N -0.911248 -0.676043 -0.995403
N 0.715295 -2.083161 -0.173199
N 0.302198 1.477711 -0.843263
N 2.570113 1.192022 0.036793
C -2.216898 -0.196919 -1.511118
C 0.186964 0.129790 -0.696002
C 1.191155 -0.760557 -0.191891
C -3.271244 -0.044562 -0.419827
C -0.538342 -1.984824 -0.654634
C 2.418313 -0.154156 0.178852
C -3.161558 1.001637 0.531947
C -4.365873 -0.939343 -0.343433
C -4.129001 1.141357 1.550146
C -5.337134 -0.798500 0.674759
C 1.526796 1.935190 -0.456259
C 5.069530 0.184449 1.164839
C -5.218531 0.240901 1.624932
C 5.806844 0.507030 -0.127615
H -2.556249 -0.904399 -2.287955
H -2.009371 0.774331 -1.994075
H -1.219017 -2.825030 -0.776853
H -2.320221 1.702526 0.468930
H -4.463986 -1.745580 -1.081723
H 1.702536 3.010463 -0.545935
H -4.037680 1.951722 2.281701
H -6.181479 -1.494752 0.725205
H 5.735204 -0.241468 1.932156
H 4.541018 1.067224 1.554046
H -5.969519 0.351056 2.415027
H 6.326645 -0.361315 -0.556693
H 5.149840 0.992078 -0.861958


