%chk=000233470.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233470

0 1
S -0.681928 1.526537 0.127775
O 5.154050 -0.099551 -0.320537
C 1.896242 0.861729 -0.417395
C 2.241808 -0.504610 1.370511
C 2.838611 -0.242529 -0.992440
C 3.072507 -1.187699 0.242044
C 2.423404 1.003507 1.038612
C 0.515055 0.183873 -0.197527
C 0.735006 -0.716370 1.040468
C 4.232325 0.266862 -1.378729
C 4.587091 -1.168450 0.479558
C -2.234043 0.704461 -0.022404
C -2.779298 0.475657 -1.287474
C -2.926592 0.349997 1.136846
C -4.036760 -0.122991 -1.393858
C -4.185838 -0.245704 1.027823
C -4.748143 -0.485742 -0.237186
C -6.087780 -1.136442 -0.352735
H 1.872726 1.781800 -1.014038
H 2.523208 -0.810359 2.383383
H 2.365488 -0.772643 -1.838530
H 2.715669 -2.215524 0.050568
H 1.826701 1.674203 1.668495
H 3.469164 1.340384 1.090907
H 0.178711 -0.393848 -1.079321
H 0.494648 -1.768994 0.831055
H 0.106192 -0.421637 1.896853
H 4.611243 -0.195660 -2.304614
H 4.318489 1.363424 -1.440397
H 4.885778 -0.917508 1.509659
H 5.079180 -2.100959 0.158785
H -2.235880 0.765589 -2.187434
H -2.495867 0.538221 2.121167
H -4.467250 -0.304473 -2.376348
H -4.731569 -0.522629 1.927312
H -6.738052 -0.909550 0.502998
H -6.628735 -0.822667 -1.255771
H -5.985361 -2.231105 -0.400379


%chk=000233470-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233470

0 1
S -0.677095 1.811944 -0.047502
O 5.141904 -0.052906 0.044585
C 2.013897 0.984713 -0.379036
C 2.088592 -0.626781 1.230527
C 2.950275 -0.097050 -1.008771
C 3.007859 -1.216633 0.117458
C 2.375850 0.899939 1.132739
C 0.573407 0.395508 -0.396631
C 0.615715 -0.700533 0.722307
C 4.426554 0.342791 -1.186917
C 4.511265 -1.317601 0.478914
C -2.254501 0.857000 -0.079074
C -2.757638 0.326507 -1.291031
C -2.997239 0.691085 1.113134
C -3.982716 -0.375624 -1.302426
C -4.230906 0.000787 1.089122
C -4.739724 -0.552256 -0.113806
C -6.046786 -1.326001 -0.127982
H 2.096706 1.972881 -0.860892
H 2.237659 -1.090830 2.219739
H 2.539688 -0.469572 -1.964754
H 2.626267 -2.193338 -0.231275
H 1.701761 1.505386 1.763132
H 3.425209 1.163026 1.340383
H 0.296250 -0.006622 -1.385898
H 0.351314 -1.700586 0.332467
H -0.092875 -0.461312 1.534357
H 4.881034 -0.164159 -2.065220
H 4.559167 1.433352 -1.289701
H 4.703674 -1.407002 1.561859
H 4.985587 -2.173820 -0.047251
H -2.201848 0.480583 -2.222720
H -2.613615 1.109133 2.049786
H -4.362913 -0.779410 -2.248961
H -4.801887 -0.112256 2.018888
H -6.735531 -0.973048 0.659607
H -6.562460 -1.233353 -1.100100
H -5.871700 -2.405341 0.048643


