%chk=000208014.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208014

0 1
S 2.143818 0.104467 1.480191
O -4.071775 -0.619740 -0.056758
N 2.116706 0.259050 -1.164715
C 1.378748 0.859381 -0.021053
C 3.528916 -0.063852 -0.788373
C 3.517215 -0.707095 0.594523
C -0.070672 0.479455 -0.039225
C -1.028458 1.399064 0.412263
C -0.478667 -0.794610 -0.482409
C -2.385904 1.068260 0.423913
C -1.824122 -1.146672 -0.484914
C -2.761141 -0.204301 -0.027212
H 1.509477 1.968019 0.057141
H 4.198949 0.823661 -0.802246
H 3.912074 -0.774998 -1.555991
H 2.087213 0.875796 -1.983256
H 3.327703 -1.795061 0.545958
H 4.457298 -0.549408 1.148578
H -0.721145 2.384399 0.763677
H 0.275317 -1.507255 -0.830064
H -3.123555 1.780067 0.776376
H -2.161991 -2.122973 -0.824078
H -4.689006 0.071246 0.284873


%chk=000208014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208014

0 1
S 2.289964 -0.117268 1.612729
O -4.219856 -0.509381 -0.139008
N 2.140625 0.156132 -1.056569
C 1.392649 0.711164 0.068948
C 3.584949 0.098068 -0.796184
C 3.724691 -0.708347 0.515109
C -0.083809 0.408474 0.013774
C -1.031188 1.394783 0.376556
C -0.550390 -0.871040 -0.390517
C -2.416534 1.121628 0.338941
C -1.925641 -1.156744 -0.439839
C -2.859759 -0.157895 -0.071611
H 1.561833 1.797529 0.238212
H 4.051323 1.102461 -0.654562
H 4.097239 -0.409064 -1.633979
H 1.829731 0.456819 -1.984961
H 3.608849 -1.788039 0.336566
H 4.672908 -0.498383 1.034662
H -0.687210 2.387147 0.693295
H 0.187421 -1.632771 -0.661501
H -3.140119 1.896976 0.622938
H -2.298034 -2.138288 -0.747991
H -4.792645 0.242940 0.152189


