%chk=000298573.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298573

0 1
S 1.660133 -0.899819 1.352158
O 0.277280 0.095906 -1.097735
C -0.553256 0.116392 0.085111
C 0.353062 0.356506 1.301410
C -1.597915 1.217767 -0.097967
C -1.216214 -1.252621 0.141150
C -2.101274 1.443190 -1.388657
C -2.264063 -1.481105 1.045341
C -2.078420 1.980908 0.972780
C -0.781843 -2.286492 -0.698539
C -3.062885 2.431508 -1.607337
C -2.868357 -2.739107 1.108982
C -3.042751 2.970192 0.751530
C -1.391093 -3.543091 -0.632014
C 3.002460 -0.139128 0.492636
C -3.534344 3.198906 -0.536590
C -2.432992 -3.771706 0.271468
C 3.951908 0.583043 1.217858
C 3.136021 -0.341874 -0.882040
C 5.059007 1.115209 0.547425
C 4.245707 0.192981 -1.544844
C 5.204708 0.919904 -0.830559
H -0.214199 0.253787 2.248693
H 0.780272 1.374636 1.295483
H -1.735743 0.832847 -2.218361
H -2.615448 -0.680301 1.693374
H -1.713771 1.813714 1.984642
H 0.035683 -2.103905 -1.399976
H 0.719080 0.962302 -1.221985
H -3.448865 2.601181 -2.611241
H -3.680507 -2.914740 1.811558
H -3.411722 3.561881 1.587617
H -1.049152 -4.344716 -1.283912
H -4.284454 3.969198 -0.706211
H -2.904550 -4.750793 0.323912
H 3.840688 0.727596 2.292715
H 2.376682 -0.906834 -1.432122
H 5.808744 1.678587 1.099859
H 4.364008 0.039879 -2.616047
H 6.068874 1.333412 -1.348563


%chk=000298573-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298573

0 1
S 1.792452 -1.135192 1.327753
O 0.250872 -0.052810 -1.211875
C -0.564609 -0.015082 0.022347
C 0.366977 0.113478 1.267737
C -1.537437 1.187013 -0.060621
C -1.328985 -1.351497 0.059572
C -2.152325 1.458200 -1.311707
C -2.506229 -1.481875 0.838089
C -1.859608 2.011735 1.046773
C -0.829159 -2.482378 -0.630252
C -3.060458 2.527746 -1.452924
C -3.172485 -2.723944 0.927950
C -2.769640 3.085831 0.905853
C -1.501352 -3.722588 -0.546896
C 3.104639 -0.176800 0.442001
C -3.373354 3.348569 -0.342966
C -2.672249 -3.850344 0.234426
C 3.742732 0.914848 1.079267
C 3.514033 -0.583832 -0.850077
C 4.779408 1.610406 0.414508
C 4.563724 0.104029 -1.503488
C 5.193767 1.204311 -0.876008
H -0.202240 -0.066632 2.194473
H 0.823524 1.118027 1.316261
H -1.904524 0.820421 -2.166199
H -2.917252 -0.609241 1.358931
H -1.409778 1.830308 2.028845
H 0.077256 -2.372367 -1.229568
H 0.839466 0.745247 -1.228050
H -3.525784 2.721791 -2.426003
H -4.084076 -2.809712 1.530280
H -3.005261 3.714219 1.772367
H -1.107250 -4.590210 -1.088426
H -4.078347 4.180414 -0.451231
H -3.191136 -4.813525 0.299676
H 3.441616 1.203247 2.092595
H 3.007755 -1.424350 -1.334284
H 5.270829 2.455244 0.909901
H 4.881219 -0.215420 -2.502334
H 6.003766 1.737915 -1.385691


