%chk=000276739.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276739

0 1
S -1.719149 -0.054354 0.087317
O 2.793123 0.040135 -0.125897
O -2.223324 1.192342 0.608038
O -2.172783 -1.341024 0.554476
N -0.014738 -0.023195 0.221873
N -2.041570 -0.025044 -1.602509
C 0.659430 1.240261 -0.190108
C 0.708945 -1.240331 -0.242293
C 2.103100 1.216103 0.343331
C 2.150921 -1.181070 0.292967
H 0.107202 2.105092 0.248331
H 0.671153 1.365470 -1.296566
H 0.724798 -1.318328 -1.353031
H 0.192007 -2.144183 0.158871
H 2.715590 2.034557 -0.074290
H 2.131470 1.236783 1.447354
H 2.180963 -1.246912 1.395175
H 2.795226 -1.956204 -0.158087
H -2.476792 0.803875 -2.001160
H -2.443372 -0.853175 -2.036292


%chk=000276739-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276739

0 1
S -1.769980 -0.054027 0.069216
O 2.867726 0.042495 -0.167248
O -2.327936 1.356531 0.636874
O -2.272168 -1.505739 0.582650
N 0.069423 -0.022988 0.316210
N -2.030496 -0.023703 -1.771631
C 0.688231 1.238241 -0.172413
C 0.737251 -1.236508 -0.226174
C 2.149441 1.221918 0.334058
C 2.197134 -1.185092 0.281684
H 0.145878 2.096298 0.260179
H 0.675106 1.300377 -1.281709
H 0.725770 -1.250706 -1.337149
H 0.229516 -2.133328 0.168189
H 2.698113 2.095504 -0.053320
H 2.155444 1.231660 1.443553
H 2.204717 -1.243036 1.389691
H 2.779234 -2.018737 -0.143110
H -2.557780 0.832773 -2.009187
H -2.522424 -0.891137 -2.042864


