%chk=000248340.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248340

0 1
S 2.626658 1.613046 1.410680
S -0.311599 2.205886 0.993991
N 1.108363 0.205977 -0.200032
N -3.792645 0.771895 -1.547319
N -2.102515 2.379997 -0.892837
C -2.181745 0.224919 0.230157
C 3.380674 0.290774 0.552999
C 2.415176 -0.353559 -0.270197
C -3.293747 -0.120894 -0.601510
C -1.628925 1.526091 0.003106
C 1.064319 1.218192 0.617973
C -1.719960 -0.718332 1.193455
C -3.916465 -1.401118 -0.461718
C 4.701791 -0.141577 0.595273
C 2.783741 -1.449510 -1.065411
C -2.337000 -1.940687 1.309316
C -3.440643 -2.284559 0.474514
C 5.056582 -1.233591 -0.199369
C 4.108890 -1.876910 -1.018205
C -3.200688 1.961360 -1.655430
H -0.871903 -0.459730 1.830264
H -4.760032 -1.640229 -1.112225
H 5.438402 0.354036 1.225435
H 2.043072 -1.938689 -1.697587
H -1.989482 -2.669839 2.041318
H -3.900665 -3.266698 0.595205
H 6.084408 -1.595807 -0.189041
H 4.422300 -2.725571 -1.627259
H -3.575763 2.688227 -2.393746


%chk=000248340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248340

0 1
S 2.577864 1.476931 1.696296
S -0.334119 2.388328 1.016960
N 1.119089 0.399318 -0.311215
N -3.733494 0.636106 -1.643839
N -2.183451 2.393266 -0.973773
C -2.159604 0.277347 0.246626
C 3.312215 0.182979 0.651006
C 2.369996 -0.254350 -0.338764
C -3.216303 -0.179579 -0.639667
C -1.676426 1.605511 -0.024942
C 1.053742 1.291699 0.644358
C -1.700773 -0.582638 1.290119
C -3.754444 -1.492306 -0.473047
C 4.605430 -0.366320 0.732209
C 2.738300 -1.264533 -1.257364
C -2.252226 -1.858082 1.436104
C -3.276717 -2.317825 0.547689
C 4.955623 -1.376165 -0.193684
C 4.031109 -1.819495 -1.177126
C -3.214115 1.867647 -1.744793
H -0.921772 -0.230373 1.973055
H -4.544624 -1.810398 -1.159317
H 5.324458 -0.029309 1.484899
H 2.015711 -1.589778 -2.011345
H -1.899576 -2.515714 2.237653
H -3.691742 -3.323001 0.678131
H 5.956106 -1.819396 -0.149295
H 4.328862 -2.601138 -1.883852
H -3.618518 2.534367 -2.511282


