%chk=000191630.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191630

0 1
S 2.636977 0.317223 -0.198786
O 1.332222 0.745644 0.871454
O -3.992370 1.083833 -0.440669
O 3.420702 -0.809582 0.691374
O 2.060723 -0.211334 -1.386560
O 3.452870 1.476656 -0.170659
O -0.639884 -2.723598 -0.082731
O 1.214305 -1.699057 0.347835
N 0.000564 -1.717249 0.121590
C 0.039656 0.753201 0.468819
C -0.666937 -0.414859 0.131793
C -0.628226 2.006606 0.511536
C -2.040305 -0.346578 -0.191345
C -2.666685 0.892421 -0.149578
C -1.970405 2.080689 0.207910
H -0.052023 2.892333 0.795705
H -2.573695 -1.260987 -0.462081
H -2.518885 3.026413 0.229050
H -4.447185 0.238609 -0.693291
H 3.069381 -1.737884 0.702435


%chk=000191630-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191630

0 1
S 2.850600 0.662068 -0.216585
O 1.280295 0.575740 1.217832
O -3.953313 1.067814 -0.689256
O 3.554955 -0.945021 0.173310
O 2.105957 0.672892 -1.652197
O 3.979520 1.742964 0.138464
O -1.054368 -2.859058 0.545376
O 1.071044 -2.102505 0.360563
N -0.204343 -1.899285 0.417430
C 0.044149 0.636332 0.669558
C -0.735173 -0.523230 0.308865
C -0.593458 1.913404 0.521855
C -2.070706 -0.412097 -0.118174
C -2.651801 0.870861 -0.250308
C -1.908850 2.040216 0.071972
H -0.003840 2.795104 0.791179
H -2.631023 -1.327485 -0.337641
H -2.387158 3.016762 -0.040326
H -4.413680 0.218569 -0.907800
H 2.751995 -1.551545 0.299683


