%chk=000294382.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294382

0 1
S 2.624074 -2.916051 0.036541
S -4.746880 -0.186343 -0.294046
O -0.809417 2.900023 0.646823
O 2.784792 -2.980798 -1.640081
O -5.154766 -0.727607 1.248737
O 3.935280 -2.542229 0.499918
O 2.024299 -4.154554 0.436018
O -5.464875 1.053405 -0.434980
O -4.980452 -1.283510 -1.185182
O 4.698908 2.773606 -0.804633
O 2.621739 3.456426 -1.316357
N 1.646053 2.014717 1.024632
C -0.273546 0.587428 0.362506
C -0.754137 -0.722117 0.084058
C 1.147429 0.772992 0.573915
C 1.497515 -1.604234 0.162019
C 0.153346 -1.820535 -0.010464
C -1.270337 1.629692 0.398600
C -2.158380 -0.958700 -0.118782
C 2.003543 -0.323985 0.449862
C -3.050456 0.075782 -0.058945
C -2.615657 1.399357 0.196844
C 3.069965 2.338176 0.839877
C 3.363332 2.919338 -0.532790
H -0.244401 -2.819870 -0.219540
H -2.484990 -1.985074 -0.327764
H 3.084247 -0.199151 0.597050
H -3.342554 2.216000 0.226826
H 1.039508 2.837671 0.879793
H 3.728534 1.450162 1.032121
H 3.363194 3.089579 1.619324
H -1.526232 3.584943 0.593595
H 3.617115 -3.339244 -1.981272
H -6.072325 -0.592440 1.527316
H 4.960932 3.148046 -1.691135


%chk=000294382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294382

0 1
S 2.725118 -2.866059 -0.094981
S -4.909678 -0.272869 -0.170640
O -0.907454 3.004469 0.602402
O 2.881204 -2.796878 -1.943128
O -5.217449 -0.600135 1.631240
O 4.132890 -2.414603 0.563394
O 2.043750 -4.276461 0.306520
O -5.672723 1.093807 -0.582007
O -5.150427 -1.640984 -0.996680
O 5.092026 2.748558 -0.258877
O 3.204222 2.666576 -1.623696
N 1.580319 2.168615 0.729353
C -0.328518 0.652091 0.292096
C -0.791856 -0.704060 0.041360
C 1.105213 0.901733 0.433459
C 1.481807 -1.468146 0.043340
C 0.138834 -1.783226 -0.081035
C -1.335060 1.680318 0.379636
C -2.192813 -0.983459 -0.087961
C 2.001135 -0.185867 0.282847
C -3.081577 0.069375 0.020351
C -2.701463 1.409373 0.252113
C 2.986178 2.493342 0.857141
C 3.717256 2.631944 -0.490706
H -0.202782 -2.807317 -0.252428
H -2.538673 -2.002714 -0.284310
H 3.083494 -0.058249 0.359208
H -3.462465 2.196237 0.304687
H 0.887925 2.923726 0.741015
H 3.531595 1.755780 1.474376
H 3.089663 3.461232 1.380206
H -1.663330 3.640525 0.602420
H 3.491123 -3.541215 -2.221522
H -6.179485 -0.860116 1.733118
H 5.576401 2.855559 -1.121904


