%chk=000291116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291116

0 1
S 0.959265 -0.570365 -0.705566
O 1.036348 -2.010461 -1.099964
C -2.692111 0.177875 0.513265
C -3.980352 0.535661 -0.299259
C -2.142219 -1.217346 0.157821
C -1.572290 1.222235 0.325802
C 0.179315 -0.523093 0.973799
C -0.920843 -1.580989 1.012259
C -0.352866 0.890759 1.196887
C -4.510814 1.911628 0.157796
C -3.702741 0.578753 -1.812059
C -5.073381 -0.516163 -0.015240
C 2.621731 -0.094700 -0.237367
C 3.659208 -1.010393 -0.403418
C 2.871452 1.206410 0.195675
C 4.973979 -0.617139 -0.128788
C 4.186249 1.598131 0.469320
C 5.235989 0.686333 0.306136
H -2.978415 0.170024 1.594072
H -1.877736 -1.261992 -0.917501
H -2.926257 -1.985764 0.300597
H -1.945345 2.231257 0.586095
H -1.281977 1.272903 -0.741054
H 0.943393 -0.765009 1.746867
H -1.235966 -1.736811 2.063417
H -0.513436 -2.559968 0.669328
H 0.445348 1.645294 1.031117
H -0.633320 0.993781 2.267131
H -3.796652 2.713253 -0.055156
H -5.443378 2.165316 -0.356755
H -4.716986 1.926693 1.232165
H -3.322571 -0.381444 -2.178347
H -2.960770 1.341931 -2.066180
H -4.612082 0.805791 -2.377556
H -5.293190 -0.591361 1.053848
H -6.008711 -0.262944 -0.524555
H -4.776688 -1.511641 -0.362894
H 3.440864 -2.028463 -0.746862
H 2.052424 1.917200 0.330559
H 5.790566 -1.325876 -0.255111
H 4.393393 2.611194 0.807746
H 6.259074 0.993302 0.518031


%chk=000291116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291116

0 1
S 1.081975 -0.104155 -0.931681
O 1.004271 -1.703681 -1.437542
C -2.765363 0.227663 0.454742
C -4.154890 0.420882 -0.268007
C -2.044463 -1.099912 0.093534
C -1.774502 1.403251 0.230574
C 0.187239 -0.111222 0.898829
C -0.745698 -1.319379 0.907134
C -0.499642 1.245793 1.092483
C -4.852119 1.704188 0.268394
C -4.001929 0.539964 -1.809048
C -5.084336 -0.784374 0.052638
C 2.867066 0.065959 -0.288907
C 3.665175 -1.087454 -0.365749
C 3.357571 1.299384 0.181731
C 5.008437 -1.007229 0.069196
C 4.703402 1.366207 0.616191
C 5.525326 0.215173 0.561194
H -2.995520 0.194846 1.546110
H -1.786521 -1.111774 -0.983564
H -2.708355 -1.965279 0.268997
H -2.247228 2.371649 0.475165
H -1.489529 1.445107 -0.839915
H 1.051064 -0.244885 1.572509
H -0.990955 -1.545872 1.965743
H -0.200503 -2.191975 0.494383
H 0.208264 2.077141 0.898785
H -0.776560 1.322520 2.165860
H -4.306427 2.623961 -0.009057
H -5.872284 1.788941 -0.151220
H -4.941731 1.677614 1.371814
H -3.515244 -0.352247 -2.242593
H -3.407317 1.426850 -2.094985
H -4.996777 0.641047 -2.282834
H -5.152233 -0.956733 1.144428
H -6.106331 -0.588747 -0.323155
H -4.732275 -1.717980 -0.420313
H 3.218568 -2.007441 -0.765409
H 2.722227 2.192543 0.207807
H 5.650041 -1.893966 0.019648
H 5.107831 2.313950 0.988583
H 6.567775 0.273475 0.893610


