%chk=000256275.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256275

0 1
S 4.429623 1.011492 -0.161668
S -4.429389 -1.010678 -0.167281
F 7.922006 -1.713884 1.114831
F -7.922154 1.708433 1.121481
O 3.019626 0.084549 -0.170691
O -3.019391 -0.083703 -0.171510
O 4.430385 1.758863 1.067179
O 4.473217 1.715825 -1.415851
O -4.430423 -1.763968 1.057949
O -4.472702 -1.708954 -1.424854
C 0.703084 -0.299956 -0.163855
C -0.702850 0.300770 -0.162751
C 1.764326 0.800939 -0.165824
C -1.764091 -0.800106 -0.169604
C 5.565239 -0.317685 -0.132507
C -5.565014 0.318341 -0.131965
C 6.989846 0.199229 0.051814
C -6.989674 -0.199466 0.049413
C 8.027397 -0.925411 -0.004562
C -8.027210 0.925435 -0.001780
H 0.856152 -0.954688 0.718776
H 0.854611 -0.956032 -1.045638
H -0.854173 0.960560 -1.041792
H -0.856123 0.951772 0.722600
H 1.721382 1.428934 0.744467
H 1.716110 1.430477 -1.074499
H -1.715744 -1.425721 -1.080977
H -1.721278 -1.432021 0.737978
H 5.491389 -0.932418 -1.057001
H 5.316652 -1.044021 0.677094
H -5.490894 0.937577 -1.053428
H -5.316664 1.040719 0.681242
H 7.077196 0.743492 1.021298
H 7.240684 0.941757 -0.738909
H -7.077310 -0.748453 1.016204
H -7.240278 -0.938127 -0.744999
H 9.060085 -0.524075 -0.010151
H 7.885518 -1.592258 -0.876093
H -9.059896 0.524131 -0.009636
H -7.885074 1.596530 -0.870002


%chk=000256275-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256275

0 1
S 4.571284 1.151553 0.011303
S -4.571674 -1.152602 -0.011386
F 7.914879 -2.028687 0.605625
F -7.912040 2.023459 0.627817
O 3.080759 0.032913 0.189625
O -3.079845 -0.037684 0.178491
O 4.947629 1.840628 1.427671
O 4.371125 2.091795 -1.296723
O -4.945037 -1.859096 1.397152
O -4.375832 -2.076292 -1.331786
C 0.707814 -0.318805 0.149933
C -0.707040 0.313974 0.160873
C 1.792226 0.768141 0.173458
C -1.791663 -0.772834 0.142597
C 5.783067 -0.292301 -0.365536
C -5.783157 0.296943 -0.366525
C 7.221330 0.184390 -0.152221
C -7.221323 -0.181409 -0.156165
C 8.210516 -0.966469 -0.360924
C -8.210218 0.972302 -0.349986
H 0.839148 -0.975749 1.030149
H 0.843036 -0.943840 -0.752730
H -0.840902 0.972256 -0.718108
H -0.839673 0.937683 1.064698
H 1.707505 1.394871 1.082251
H 1.738796 1.409333 -0.728112
H -1.734941 -1.383164 -0.779830
H -1.710581 -1.430190 1.029929
H 5.530835 -0.561358 -1.403071
H 5.480690 -1.081195 0.339451
H -5.533035 0.579296 -1.401029
H -5.478611 1.076410 0.347947
H 7.335443 0.584267 0.871447
H 7.475611 0.995525 -0.861966
H -7.333797 -0.593067 0.863020
H -7.477319 -0.984145 -0.874800
H 9.246771 -0.636421 -0.170913
H 8.128128 -1.420226 -1.365685
H -9.246317 0.640804 -0.161674
H -8.129396 1.437189 -1.349768


