%chk=000253746.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253746

0 1
Cl 4.646299 2.441226 -0.823616
S 0.449674 -1.969506 0.389036
O -1.178226 0.230001 -0.849742
O 0.096061 -2.699380 -0.794764
O 0.841857 -2.679677 1.590743
N -2.885690 0.290157 0.704750
N -0.982664 -1.140478 0.971531
C -3.644718 1.287860 -0.040888
C -4.479512 2.293537 0.739799
C -5.164216 1.192283 -0.049621
C -1.667435 -0.178388 0.196230
C 1.590916 -0.734529 0.048294
C 2.602597 -0.461862 0.981223
C 1.529306 -0.023011 -1.156204
C 3.555082 0.522106 0.717821
C 2.478143 0.966985 -1.435231
C 3.473536 1.222297 -0.491769
H -3.114524 1.611321 -0.956137
H -4.531429 3.322961 0.390149
H -4.502832 2.268569 1.826376
H -5.671651 0.388721 0.478317
H -5.704632 1.435450 -0.962749
H -3.298684 -0.082364 1.551858
H -1.372523 -1.435987 1.875641
H 2.651299 -1.028186 1.920743
H 0.728038 -0.228521 -1.883705
H 4.345839 0.740998 1.435255
H 2.433287 1.528018 -2.369438


%chk=000253746-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253746

0 1
Cl 4.795774 2.692168 -0.391493
S 0.401522 -1.989015 0.187510
O -1.436346 0.234868 -0.991824
O 0.125728 -2.658928 -1.255370
O 0.830154 -2.889184 1.473422
N -3.201125 -0.130827 0.510044
N -1.133781 -1.200362 0.831899
C -4.096046 0.804441 -0.141694
C -3.937361 2.305702 0.124093
C -5.122787 1.537294 0.728609
C -1.909122 -0.329682 0.036248
C 1.639308 -0.577487 0.014485
C 2.578613 -0.439753 1.049272
C 1.608613 0.220303 -1.140114
C 3.554276 0.574057 0.921494
C 2.588945 1.230307 -1.260302
C 3.538873 1.389080 -0.229312
H -4.398688 0.516423 -1.154302
H -4.118723 2.986171 -0.711333
H -3.130778 2.606780 0.797252
H -5.102950 1.353078 1.807591
H -6.121828 1.692720 0.313180
H -3.586760 -0.755239 1.219883
H -1.453886 -1.661252 1.691674
H 2.558474 -1.111419 1.913229
H 0.837680 0.077031 -1.901058
H 4.309335 0.721008 1.698217
H 2.606084 1.882321 -2.137397


