%chk=000246940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246940

0 1
Cl -4.949723 3.866665 0.074141
S -2.925576 -1.996624 -0.178404
O -3.705410 -2.806688 0.737166
O -2.731642 -2.427872 -1.533256
O -0.458205 -0.391080 -0.670023
N 5.839860 1.301457 0.059100
N -1.372225 -2.017804 0.637047
N 0.943603 -1.476304 0.846338
C 4.628756 0.545054 0.164648
C -3.461359 -0.367945 -0.108499
C 2.166533 -0.765721 0.583624
C 4.510022 -0.478794 1.133293
C 3.483837 0.891159 -0.588294
C 3.296495 -1.125204 1.343637
C 2.267254 0.247809 -0.382664
C -0.278986 -1.230915 0.201285
C -2.993749 0.573603 -1.033562
C -4.392544 0.004584 0.872267
C 7.087559 0.572246 0.426421
C 6.020459 2.064527 -1.208429
C -3.453358 1.894215 -0.983522
C -4.859770 1.317185 0.935459
C -4.377844 2.242223 0.001813
H 5.369535 -0.763928 1.738619
H 3.533473 1.678915 -1.339021
H 3.234537 -1.906671 2.098574
H 1.393637 0.534339 -0.979876
H -1.245835 -2.691586 1.402853
H 1.003583 -2.213057 1.549010
H -2.253978 0.283642 -1.796193
H -4.762175 -0.739248 1.590479
H 7.013204 0.217723 1.469403
H 7.309319 -0.289051 -0.222242
H 7.941715 1.268051 0.388218
H 6.943848 2.663370 -1.145687
H 5.187037 2.779172 -1.327614
H 6.074437 1.433358 -2.108815
H -3.089932 2.633882 -1.697788
H -5.583887 1.616813 1.692991


%chk=000246940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246940

0 1
Cl -5.744690 3.817387 -0.034814
S -2.906646 -1.968714 -0.048243
O -3.687054 -2.890875 1.043298
O -2.691884 -2.463648 -1.572331
O -0.424672 -0.221929 -0.743954
N 6.138066 0.992441 -0.163065
N -1.277369 -1.739687 0.812262
N 1.039133 -1.424378 0.673384
C 4.879509 0.409859 0.030996
C -3.685172 -0.253958 -0.039011
C 2.292772 -0.780111 0.424872
C 4.685235 -0.643932 0.979724
C 3.734025 0.839910 -0.710712
C 3.417074 -1.218505 1.169687
C 2.467092 0.259130 -0.524288
C -0.208948 -1.072073 0.170468
C -3.351246 0.648374 -1.060925
C -4.613627 0.010432 0.980257
C 7.290630 0.523212 0.612766
C 6.302458 2.071396 -1.143466
C -3.993466 1.906493 -1.055507
C -5.249874 1.271988 0.979908
C -4.925286 2.194404 -0.036229
H 5.522558 -1.017710 1.574825
H 3.827347 1.637088 -1.453246
H 3.304803 -2.020956 1.911542
H 1.610835 0.599443 -1.109693
H -1.174631 -2.426413 1.570006
H 1.080063 -2.210857 1.324679
H -2.605946 0.388113 -1.816253
H -4.844270 -0.748028 1.734868
H 7.139196 0.660244 1.703768
H 7.502400 -0.551088 0.431407
H 8.185754 1.095859 0.323140
H 7.351983 2.405608 -1.148894
H 5.667984 2.948986 -0.901951
H 6.046372 1.739795 -2.170969
H -3.765564 2.647427 -1.826011
H -5.982438 1.526774 1.750202


