%chk=000198446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198446

0 1
S -1.781490 -0.530478 -2.815009
S 2.482882 -0.661305 -1.779832
S -4.132347 0.251851 -0.400255
P -2.300915 0.055836 -0.888078
O -1.365393 1.415443 -0.856050
O -1.365052 -1.032244 -0.051133
O 3.929630 -0.262008 1.089305
O 2.037359 0.976343 1.188848
C -0.052840 -1.133877 -2.612240
C 0.900834 0.008786 -2.372465
C -1.589543 2.425978 0.168623
C -1.731350 -1.385414 1.312653
C 2.096326 -1.116014 -0.072035
C -1.013226 1.996478 1.500929
C -2.765665 -2.491923 1.317654
C 2.614511 -0.004158 0.779143
C 4.634609 0.750924 1.856639
H 0.170577 -1.671905 -3.558193
H -0.026541 -1.898947 -1.805474
H 0.520227 0.770277 -1.648265
H 1.117257 0.579633 -3.300093
H -1.023084 3.273737 -0.273334
H -2.661984 2.692352 0.222289
H -0.751322 -1.732989 1.701428
H -2.046363 -0.487730 1.883213
H 1.001589 -1.261202 0.088408
H 2.592651 -2.084405 0.154931
H -0.900651 2.853655 2.176728
H -0.000163 1.565730 1.374119
H -1.629345 1.252802 2.022985
H -3.790917 -2.116633 1.174045
H -2.580853 -3.216020 0.511653
H -2.755899 -3.043684 2.265056
H 5.558123 0.235875 2.141457
H 4.042687 1.047762 2.728315
H 4.830681 1.610174 1.207535


%chk=000198446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198446

0 1
S -1.949742 -0.634827 -2.661283
S 2.522771 -1.141724 -1.727599
S -4.386775 0.741291 -0.198925
P -2.416060 0.276980 -0.623795
O -1.254573 1.560550 -0.643578
O -1.625013 -0.808181 0.513900
O 4.271092 -0.085165 1.049137
O 2.351367 1.230048 0.919232
C -0.229310 -1.373883 -2.262664
C 0.881167 -0.322154 -2.230413
C -1.397701 2.699244 0.324137
C -2.471042 -1.743994 1.314909
C 2.306699 -1.123956 0.168622
C -0.836915 2.358317 1.704622
C -2.885904 -2.984428 0.519088
C 2.926619 0.129120 0.745593
C 5.017001 1.099654 1.539265
H -0.074580 -2.119293 -3.061633
H -0.330645 -1.895102 -1.297955
H 0.666363 0.489216 -1.516864
H 1.064657 0.118021 -3.223986
H -0.815736 3.496071 -0.166981
H -2.464788 2.992838 0.360867
H -1.813566 -2.001241 2.162246
H -3.355214 -1.193392 1.689907
H 1.229093 -1.150529 0.391680
H 2.810683 -2.027010 0.540843
H -0.861869 3.264509 2.340009
H 0.206949 2.013829 1.620256
H -1.435877 1.574945 2.201231
H -3.569400 -2.723480 -0.307524
H -2.005458 -3.503547 0.101450
H -3.414198 -3.690101 1.187470
H 6.043874 0.740176 1.691956
H 4.577336 1.464184 2.482896
H 4.983696 1.905714 0.787385


