%chk=000205847.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205847

0 1
S 1.483868 -0.117699 -1.895178
P 1.047696 -0.373262 -0.072441
O 1.696007 -1.634666 0.732709
O 1.264746 0.770768 1.057069
O -0.576847 -0.865733 0.166556
O -2.456770 1.933464 -0.795550
N -1.237417 1.334753 -0.493937
C 1.665819 -2.933347 0.040712
C 1.652808 2.117238 0.617830
C 2.389441 -3.838055 1.017832
C 3.147973 2.180200 0.390382
C -1.500672 0.041523 -0.194530
C -2.922502 -0.232885 -0.290329
C -3.459881 0.967742 -0.663862
H 0.610322 -3.232476 -0.106056
H 2.196277 -2.853205 -0.928226
H 1.057329 2.441886 -0.258365
H 1.334188 2.694164 1.512320
H 2.410893 -4.875257 0.664926
H 3.425579 -3.507004 1.176058
H 1.904750 -3.820912 2.005332
H 3.515166 3.211343 0.473567
H 3.693223 1.580612 1.133691
H 3.444929 1.817280 -0.604535
H -3.389164 -1.179214 -0.100576
H -4.441862 1.335741 -0.877201


%chk=000205847-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205847

0 1
S 1.672269 -0.140985 -2.083485
P 1.135190 -0.409316 -0.116755
O 1.722688 -1.758939 0.751977
O 1.482622 0.771793 1.063296
O -0.617187 -0.800001 0.130186
O -2.612589 2.007032 -0.758966
N -1.308088 1.417012 -0.444680
C 1.599430 -3.116166 0.128148
C 1.733021 2.197543 0.645992
C 2.431198 -4.049065 1.001106
C 3.228374 2.436726 0.450478
C -1.589997 0.108646 -0.217089
C -2.988304 -0.206675 -0.351176
C -3.575615 0.995953 -0.683584
H 0.530208 -3.395722 0.119863
H 1.977175 -3.069561 -0.911525
H 1.136922 2.423096 -0.255701
H 1.323267 2.766380 1.496288
H 2.366562 -5.080741 0.608565
H 3.489673 -3.739868 1.006335
H 2.058768 -4.045617 2.039151
H 3.405354 3.512675 0.262308
H 3.793147 2.145251 1.352432
H 3.612508 1.867703 -0.413325
H -3.453528 -1.178160 -0.217291
H -4.597169 1.304003 -0.894349


