%chk=000208312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208312

0 1
S -0.252512 1.528026 0.311280
O -0.555142 1.769264 1.709940
O -0.543085 2.557120 -0.668158
O -2.680704 -2.119766 -0.735295
N -1.150353 0.117527 -0.118466
N -3.865367 -3.459170 1.433959
N -4.208349 -4.531715 1.395279
C -2.447346 -0.087032 0.562490
C 1.373279 1.004969 0.111408
C -3.576923 0.796829 0.027993
C 2.139020 1.499828 -0.952249
C 1.940144 0.097994 1.013640
C -2.846698 -1.560042 0.328842
C 4.030263 0.169761 -0.216854
C 3.459221 1.086707 -1.118766
C 3.261385 -0.320349 0.852785
C 5.447003 -0.262742 -0.389875
C -3.469068 -2.216669 1.481821
H -2.297780 0.113150 1.662419
H -1.195470 -0.156279 -1.112598
H -4.522315 0.604981 0.548450
H -3.348303 1.864516 0.161075
H -3.752042 0.642282 -1.045093
H 1.698985 2.219667 -1.654295
H 1.350191 -0.284684 1.852919
H 4.049616 1.475880 -1.946313
H 3.695606 -1.025932 1.558591
H 5.670017 -1.208915 0.122370
H 5.713789 -0.401685 -1.447568
H 6.137394 0.493021 0.017819
H -3.591454 -1.639644 2.401953


%chk=000208312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208312

0 1
S -0.432719 1.819350 0.070157
O -0.798039 2.213916 1.611547
O -0.493678 2.886865 -1.160049
O -4.062158 -1.722838 1.327025
N -1.593872 0.370089 -0.396164
N -2.031000 -3.549177 0.478904
N -2.209223 -4.699255 0.663532
C -2.698296 0.175093 0.573657
C 1.267084 1.018143 0.072482
C -3.987981 0.954293 0.234411
C 2.022614 1.073486 -1.108562
C 1.722561 0.421923 1.259572
C -2.987858 -1.347309 0.773166
C 3.813631 -0.144447 0.075533
C 3.305239 0.481064 -1.093360
C 3.007320 -0.162134 1.246175
C 5.203984 -0.751689 0.089486
C -1.922704 -2.239516 0.313175
H -2.326424 0.538232 1.558378
H -1.934428 0.649397 -1.337810
H -4.783543 0.689161 0.949195
H -3.798340 2.039938 0.291973
H -4.348586 0.704092 -0.780858
H 1.632008 1.580273 -1.996844
H 1.106541 0.435771 2.164343
H 3.918718 0.510573 -2.000737
H 3.390270 -0.633131 2.158726
H 5.228235 -1.695596 0.662113
H 5.568239 -0.959515 -0.930792
H 5.927733 -0.062719 0.565843
H -1.042324 -1.827435 -0.184713


