%chk=000214685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214685

0 1
S -0.443522 1.624256 -0.652351
F 6.015696 0.038705 0.221396
F 4.875632 1.621341 -0.584516
F 4.824770 1.229060 1.494287
O -4.610713 -2.362026 0.498183
O -4.472401 -1.136105 -1.368302
N -1.219076 -0.585313 0.470864
C -3.696643 -0.209668 0.803555
C -4.652418 0.999718 0.916296
C -4.561219 1.915220 -0.313187
C -3.149468 2.513263 -0.482709
C -2.349323 0.244814 0.329967
C -2.127642 1.471550 -0.249744
C -4.267530 -1.215449 -0.182361
C -0.131772 -0.007489 0.007987
C 1.214548 -0.562550 -0.032393
C 2.335533 0.260638 0.154368
C 1.386122 -1.942231 -0.257762
C 3.620858 -0.297412 0.099587
C 2.670380 -2.484952 -0.308281
C 3.792233 -1.668099 -0.132915
C 4.803321 0.610960 0.300258
H -3.592690 -0.708707 1.808390
H -4.396132 1.568930 1.832627
H -5.693368 0.650028 1.056081
H -5.306655 2.727700 -0.238601
H -4.823227 1.332152 -1.224453
H -3.001914 3.354678 0.230535
H -3.052419 2.955481 -1.497549
H 2.208412 1.328897 0.350840
H 0.507446 -2.581565 -0.386453
H -4.981974 -3.068734 -0.093893
H 2.801647 -3.553722 -0.483888
H 4.788508 -2.112770 -0.177665


%chk=000214685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214685

0 1
S -0.392496 1.890163 -0.205582
F 5.978831 -0.188521 -0.861967
F 4.658058 1.635018 -1.170936
F 5.413420 1.116740 0.899231
O -4.874462 -2.353174 -0.141634
O -4.072460 -0.954622 -1.811764
N -1.215068 -0.574674 0.402825
C -3.727904 -0.357201 0.583211
C -4.758550 0.793101 0.835364
C -4.618121 1.930185 -0.203609
C -3.223886 2.610673 -0.121705
C -2.356668 0.225624 0.327363
C -2.151230 1.563030 0.012764
C -4.197298 -1.210990 -0.595453
C -0.096913 0.095779 0.159190
C 1.252651 -0.479339 0.172276
C 2.408133 0.298668 -0.092122
C 1.404995 -1.866638 0.459513
C 3.683870 -0.302919 -0.069660
C 2.683383 -2.455389 0.477668
C 3.834505 -1.680289 0.215867
C 4.902888 0.542599 -0.303401
H -3.690091 -1.017096 1.466774
H -4.579342 1.190628 1.853211
H -5.783675 0.380374 0.824232
H -5.403356 2.689913 -0.035821
H -4.763881 1.520285 -1.219832
H -3.186256 3.298263 0.748258
H -3.055026 3.232864 -1.020433
H 2.319167 1.365415 -0.325050
H 0.505754 -2.456769 0.659364
H -5.201194 -2.872810 -0.926375
H 2.787853 -3.523062 0.694898
H 4.829368 -2.135229 0.221535


