%chk=000236563.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236563

0 1
S 2.551370 0.552746 0.628603
O 2.729023 0.764091 -1.106969
O 2.793315 1.838897 1.266249
O 0.404746 -2.977093 -0.289348
O 2.123925 -1.782474 0.285751
O -4.095014 1.412149 -0.131975
O -3.983111 -0.726724 -0.459058
N 0.935383 -1.929229 0.014441
N -3.489458 0.359623 -0.219280
N 4.112958 0.559629 -1.330034
C 0.731956 0.515251 0.358953
C 0.105000 -0.704430 0.086105
C -2.016996 0.406125 -0.014265
C -1.278523 -0.781870 -0.110553
C -0.014225 1.681487 0.458768
C -1.401592 1.635881 0.270251
H -1.772674 -1.741149 -0.333156
H 0.483722 2.635420 0.686358
H -2.010625 2.547472 0.340120
H 4.138315 -0.156163 -2.057677
H 4.428906 1.436261 -1.748984


%chk=000236563-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236563

0 1
S 2.539095 1.020091 0.853417
O 2.875773 0.802963 -1.404097
O 2.505525 2.614684 1.280459
O 0.535479 -2.783673 -0.719103
O 2.319058 -1.594032 0.054384
O -4.241064 1.266136 0.019504
O -3.914719 -0.898495 -0.632415
N 1.056548 -1.715948 -0.228195
N -3.489936 0.242650 -0.208244
N 3.978011 0.130108 -1.753199
C 0.718749 0.676484 0.505458
C 0.187471 -0.551461 0.035412
C -2.031031 0.392960 0.036653
C -1.193146 -0.707986 -0.204483
C -0.152396 1.762602 0.731018
C -1.532194 1.632421 0.499721
H -1.593747 -1.657528 -0.569053
H 0.293351 2.702931 1.080963
H -2.225399 2.461118 0.666168
H 3.974056 -0.890818 -1.632222
H 4.866917 0.640693 -1.817847


