%chk=000291476.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291476

0 1
S 1.396937 0.104070 -1.558065
F -3.329252 0.462805 1.966388
O 0.551305 0.213337 -2.729885
O 2.714498 -0.487090 -1.702339
O 2.141729 -3.077877 2.032569
O 2.419605 -0.865306 1.869756
N 0.616710 -0.931848 -0.408455
C -0.818071 -0.917125 -0.254604
C -1.377044 -0.212981 0.837791
C -1.652933 -1.593537 -1.179883
C 1.312872 -2.146099 0.036955
C -3.635153 -0.870056 0.054918
C -2.778338 -0.208915 0.948794
C -3.043313 -1.560884 -1.009206
C 1.475260 1.626816 -0.764945
C -0.557210 0.520815 1.842201
C -1.087172 -2.312846 -2.357485
C -5.115747 -0.839123 0.225417
C 2.320156 1.805718 0.335683
C 0.694859 2.691053 -1.234479
C 1.998700 -1.880394 1.367917
C 2.388072 3.053082 0.965179
C 0.762308 3.935734 -0.605104
C 1.610927 4.115653 0.494405
H 2.110232 -2.458940 -0.694161
H 0.619411 -3.016409 0.146138
H -3.679624 -2.079829 -1.725827
H -0.691663 1.608910 1.744018
H -0.832020 0.250520 2.872328
H 0.524078 0.327389 1.748942
H -0.288179 -3.012601 -2.087421
H -1.841514 -2.883078 -2.913557
H -0.651919 -1.581488 -3.073747
H -5.417877 -1.262279 1.195841
H -5.502365 0.191246 0.190932
H -5.642878 -1.406927 -0.552497
H 2.924438 0.969819 0.717973
H 0.033444 2.548379 -2.097923
H 3.046499 3.191700 1.822008
H 0.157091 4.764393 -0.969542
H 1.664676 5.088663 0.984907
H 2.613167 -2.987770 2.902668


%chk=000291476-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291476

0 1
S 1.251249 0.227737 -1.564845
F -3.673328 0.555443 1.874221
O 0.182423 0.500983 -2.768935
O 2.692404 -0.473028 -1.901600
O 2.518164 -3.403141 1.617251
O 2.557497 -1.097301 1.889528
N 0.497693 -0.910052 -0.130229
C -0.934420 -0.962311 -0.122988
C -1.596395 -0.157661 0.863425
C -1.691266 -1.770320 -1.038033
C 1.303393 -2.128818 -0.006653
C -3.795936 -1.010472 0.040492
C -3.000595 -0.223771 0.896587
C -3.100582 -1.777043 -0.924879
C 1.527393 1.875468 -0.689450
C -0.850294 0.711099 1.851372
C -1.034810 -2.585580 -2.138153
C -5.304328 -1.011045 0.150920
C 2.360612 1.906798 0.440652
C 0.897055 2.999926 -1.245371
C 2.162353 -2.098816 1.257660
C 2.575392 3.166931 1.045590
C 1.128260 4.248455 -0.621876
C 1.965243 4.329686 0.515827
H 2.020562 -2.212153 -0.857750
H 0.687415 -3.042957 0.003204
H -3.683997 -2.387210 -1.623856
H -0.854652 1.768929 1.526212
H -1.331218 0.678695 2.843622
H 0.198009 0.386398 1.929894
H -0.524615 -3.487745 -1.750204
H -1.791935 -2.928807 -2.862601
H -0.293422 -1.987433 -2.695780
H -5.631451 -1.302945 1.165343
H -5.717638 -0.002639 -0.034921
H -5.752635 -1.708743 -0.575388
H 2.793587 0.990225 0.854088
H 0.257348 2.895571 -2.127540
H 3.213514 3.234198 1.932688
H 0.656665 5.149898 -1.026611
H 2.139886 5.300212 0.992895
H 3.132102 -3.379964 2.400791


