%chk=000195655.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195655

0 1
I -4.387115 2.396664 -1.013253
S -3.514990 -1.233838 0.614219
O 1.930499 0.481036 0.254966
O -1.645208 0.428504 0.312031
O 3.725267 -0.834811 0.112873
O 0.990785 -1.972179 -1.459378
O 3.406260 2.577445 -1.083167
O -0.849026 -3.137640 0.629299
O 6.077504 2.513524 0.179036
O 7.326091 -0.124504 -0.258224
O 0.600235 3.215331 0.012387
O 5.189508 -3.521841 -0.476940
C 0.691423 0.088679 -0.401432
C 0.509333 -1.428370 -0.215431
C -0.312965 0.985354 0.358617
C 3.121440 0.330047 -0.499854
C 3.949329 1.600174 -0.182269
C -0.961578 -1.874576 -0.042427
C 5.450342 1.402834 -0.475227
C 5.968352 0.074394 0.121948
C 5.074373 -1.105021 -0.320737
C -1.743804 -0.894663 0.841132
C -0.496233 2.364933 -0.306018
C 5.438420 -2.417166 0.392684
C -4.305756 0.150175 1.500689
C -5.648472 0.284823 0.869813
C -5.898684 1.156201 -0.196801
C -6.714855 -0.496334 1.357433
C -7.163991 1.256286 -0.774843
C -7.984317 -0.402258 0.786492
C -8.211608 0.473714 -0.280630
H 0.739858 0.325225 -1.490423
H 1.145408 -1.809494 0.621371
H 0.009434 1.096974 1.421473
H 2.946385 0.148353 -1.577323
H 3.788940 1.939494 0.869888
H -1.436835 -2.021191 -1.042387
H 5.664355 1.482367 -1.564989
H 6.034056 0.147591 1.236310
H 5.085564 -1.244248 -1.425308
H -1.425276 -0.924083 1.903538
H -0.616895 2.288954 -1.400625
H -1.374012 2.890168 0.125586
H 6.528526 -2.484816 0.589490
H 4.868455 -2.531186 1.334274
H 1.013020 -2.953692 -1.405032
H 3.854097 3.447464 -0.930677
H -1.728305 -3.571460 0.702415
H 7.051719 2.361878 0.239086
H 7.407821 -0.359976 -1.208268
H -4.360772 -0.070248 2.583318
H -3.683153 1.072171 1.391974
H 1.456798 2.821811 -0.315976
H 4.221762 -3.642385 -0.599357
H -6.544021 -1.184125 2.185741
H -7.343848 1.938809 -1.608531
H -8.800179 -1.013534 1.172213
H -9.201960 0.547365 -0.727669


%chk=000195655-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195655

0 1
I -5.724726 2.482292 -1.560697
S -3.621133 -0.895408 -0.267181
O 2.153594 0.606411 0.508809
O -1.444343 0.751285 -0.405980
O 3.971420 -0.834020 0.225642
O 1.388464 -2.339665 -0.058800
O 3.798217 2.837581 -0.181959
O -1.261104 -2.828860 0.761701
O 6.619304 2.340380 0.181622
O 7.582339 -0.280269 -0.735860
O 1.046907 3.416281 0.144028
O 4.283801 -3.401605 -0.564146
C 0.940045 0.088348 -0.157835
C 0.506230 -1.266500 0.427043
C -0.116377 1.196759 0.094465
C 3.386909 0.449556 -0.173778
C 4.351097 1.557436 0.274206
C -0.939190 -1.609548 0.008293
C 5.733152 1.307141 -0.354897
C 6.272029 -0.117804 -0.073985
C 5.215298 -1.153787 -0.509630
C -1.896650 -0.443936 0.312645
C 0.193639 2.531277 -0.627099
C 5.447638 -2.626827 -0.148688
C -4.603919 0.312878 0.859139
C -6.078678 0.202300 0.572796
C -6.763535 0.996130 -0.387748
C -6.846715 -0.751350 1.298674
C -8.151198 0.849735 -0.612667
C -8.230259 -0.910381 1.084334
C -8.885194 -0.106143 0.124814
H 1.122853 -0.029787 -1.246768
H 0.544954 -1.210081 1.535460
H -0.170979 1.395617 1.186945
H 3.247397 0.469262 -1.281783
H 4.436276 1.535355 1.378581
H -0.959375 -1.804073 -1.085725
H 5.639194 1.425853 -1.461838
H 6.498459 -0.232246 1.000047
H 5.024911 -1.073305 -1.607670
H -1.937951 -0.248199 1.406375
H 0.607139 2.326046 -1.638918
H -0.766295 3.061216 -0.749291
H 6.316956 -3.039379 -0.686304
H 5.625916 -2.705925 0.945353
H 0.962616 -3.192791 0.223263
H 4.463142 3.549724 -0.000246
H -2.208273 -3.068193 0.579128
H 7.549515 2.107819 -0.075175
H 7.443385 -0.374436 -1.714614
H -4.377716 0.030018 1.899989
H -4.201092 1.313437 0.638404
H 2.002409 3.115751 0.102259
H 3.463685 -2.911236 -0.261832
H -6.333626 -1.373876 2.041318
H -8.655952 1.475054 -1.354475
H -8.792789 -1.652029 1.660853
H -9.960319 -0.214177 -0.053499


