%chk=000270831.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270831

0 1
S -6.161910 -2.406600 1.345123
F -7.459450 -1.508255 1.483787
O -0.024360 2.973075 -1.231778
O -2.477275 1.191966 -3.122539
O -6.543775 -3.388824 0.375542
O -5.843504 -2.732832 2.703633
N 4.356710 -0.325280 -0.122503
N 5.398973 -2.111485 1.289514
N 6.762720 -0.571049 -0.037212
N 5.853499 1.328459 -1.083559
N 7.738365 -2.394461 1.132966
N -2.217126 1.445319 -0.833958
C 4.133573 -1.542205 0.820956
C 3.330768 -1.075118 2.042914
C 3.376485 -2.602241 0.007651
C 3.227765 0.516952 -0.440967
C 5.665740 0.104865 -0.403593
C 6.563446 -1.695298 0.820498
C 2.369572 0.139776 -1.484219
C 2.993565 1.702772 0.289902
C 1.259866 0.931425 -1.799252
C 1.900108 2.501020 -0.018750
C 1.043485 2.096755 -1.061475
C -0.862355 2.807476 -2.388156
C -3.171068 0.503272 -0.359122
C -1.927264 1.726000 -2.184198
C -5.028293 -1.301672 0.698088
C -3.290222 0.354641 1.043839
C -3.978052 -0.258532 -1.225892
C -4.216748 -0.545694 1.556721
C -4.898410 -1.154165 -0.690135
H 3.231686 -1.906777 2.757543
H 3.839163 -0.266849 2.580522
H 2.324452 -0.738809 1.780666
H 3.336177 -3.543061 0.578443
H 2.349320 -2.305107 -0.215980
H 3.887980 -2.835050 -0.933718
H 2.563543 -0.773932 -2.050714
H 3.679842 1.990888 1.089857
H 0.592818 0.625030 -2.601928
H 1.697577 3.425074 0.521458
H 6.807123 1.500798 -1.398514
H 5.155790 1.596177 -1.765447
H 7.694391 -3.021395 1.925824
H 8.609458 -1.890997 1.032553
H -0.268683 2.609454 -3.301022
H -1.336771 3.810092 -2.477221
H -1.668058 1.948237 -0.119111
H -2.667019 0.934044 1.722266
H -3.884823 -0.150044 -2.313611
H -4.306701 -0.668638 2.644336
H -5.522393 -1.753698 -1.366727


%chk=000270831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270831

0 1
S -6.513020 -2.274428 1.418233
F -7.852483 -1.006973 1.666525
O -0.085234 2.944559 -1.120601
O -2.575032 1.260303 -3.232618
O -7.073956 -3.294562 0.310594
O -6.087461 -2.745581 2.895176
N 4.459814 -0.282776 0.007617
N 5.594972 -1.877091 1.533743
N 6.839334 -0.610959 -0.163421
N 5.793259 0.983785 -1.501675
N 7.939355 -1.841838 1.483265
N -2.300494 1.406929 -0.888603
C 4.337006 -1.590757 0.832227
C 3.225723 -1.422293 1.885692
C 4.004615 -2.755924 -0.142725
C 3.306143 0.513788 -0.315328
C 5.708384 -0.001717 -0.537637
C 6.717027 -1.461919 0.957993
C 2.451900 0.164769 -1.391700
C 3.005559 1.673833 0.450214
C 1.309548 0.939827 -1.697759
C 1.879005 2.460476 0.150111
C 1.031812 2.088882 -0.920826
C -0.878214 2.774090 -2.344245
C -3.296568 0.530888 -0.398747
C -1.995315 1.719614 -2.208764
C -5.225095 -1.148859 0.689555
C -3.378601 0.356598 1.012642
C -4.195917 -0.160311 -1.260183
C -4.353253 -0.486297 1.571801
C -5.175668 -1.006281 -0.707009
H 3.197122 -2.343383 2.490276
H 3.460792 -0.581116 2.559495
H 2.234427 -1.263609 1.426489
H 3.992302 -3.702971 0.424033
H 3.015399 -2.620230 -0.617976
H 4.779962 -2.833842 -0.925843
H 2.681480 -0.721154 -1.992376
H 3.669481 1.948318 1.275976
H 0.660060 0.630387 -2.522631
H 1.644175 3.361966 0.724236
H 6.725473 1.218406 -1.833037
H 4.969335 1.425287 -1.899585
H 7.962517 -2.464352 2.285349
H 8.786933 -1.448585 1.086142
H -0.252099 2.523571 -3.218250
H -1.347457 3.757661 -2.520248
H -1.705542 1.881877 -0.197737
H -2.680552 0.883744 1.672975
H -4.119991 -0.024504 -2.340293
H -4.425682 -0.633646 2.653428
H -5.875580 -1.548103 -1.350668


