%chk=000271923.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271923

0 1
S -6.024593 -1.714067 -0.387659
F -6.709577 -1.090596 -1.669898
O -1.220539 3.045391 1.005888
O -5.132337 -2.693346 -0.930946
O -7.131668 -2.048590 0.453516
N 3.533239 -0.174317 -0.051131
N 4.428151 -2.458461 -0.545880
N 4.368483 -1.582680 1.737691
N 3.288436 0.425798 2.292984
N 5.195116 -3.761205 1.270292
N -1.738535 1.067138 -0.064788
C 4.081663 -1.160217 -1.127757
C 2.997997 -1.389196 -2.185823
C 5.344744 -0.508426 -1.713169
C 2.634502 0.877462 -0.447961
C 3.758953 -0.470789 1.311908
C 1.335485 0.949803 0.088716
C 3.066259 1.835103 -1.385975
C 4.639416 -2.585191 0.754996
C 0.495512 1.993607 -0.307330
C 2.206203 2.862045 -1.773979
C 0.919088 2.953436 -1.233216
C -0.874488 2.125416 0.294661
C -3.098138 0.920163 0.351572
C -3.819892 -0.181195 -0.151119
C -5.149378 -0.361723 0.233877
C -3.723168 1.826121 1.234696
C -5.770635 0.527132 1.111781
C -5.049619 1.621285 1.607639
H 2.796303 -0.500605 -2.789215
H 2.056402 -1.729624 -1.738490
H 3.317409 -2.192248 -2.869931
H 6.104412 -0.329374 -0.942166
H 5.133461 0.445561 -2.208531
H 5.802377 -1.183022 -2.451408
H 1.000087 0.208415 0.817803
H 4.075368 1.766914 -1.805835
H 2.542657 3.605593 -2.498454
H 0.256232 3.770180 -1.522352
H 3.605116 0.232235 3.242158
H 3.279381 1.412431 2.066336
H 5.185504 -4.573972 0.668190
H 5.054350 -3.947511 2.253724
H -1.377455 0.333003 -0.681928
H -3.344037 -0.896217 -0.830995
H -3.166484 2.688790 1.627384
H -6.809510 0.373128 1.421519
H -5.530650 2.320821 2.294208


%chk=000271923-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271923

0 1
S -5.470076 -2.314889 0.830286
F -6.106770 -2.451078 -0.909015
O -1.519270 3.506200 -0.013387
O -4.230168 -3.333766 0.923707
O -6.760204 -2.437952 1.777838
N 3.359446 -0.201872 -0.197030
N 3.918427 -2.491209 -0.963697
N 3.839207 -1.921701 1.421873
N 3.191639 0.196290 2.148399
N 3.926176 -4.141187 0.706144
N -1.681914 1.164138 -0.030593
C 4.064304 -1.060283 -1.282314
C 3.401846 -0.818577 -2.651057
C 5.571911 -0.686172 -1.307429
C 2.626025 0.992674 -0.500343
C 3.476215 -0.674339 1.113681
C 1.241157 1.059649 -0.191509
C 3.251411 2.114567 -1.105637
C 3.903146 -2.813475 0.323736
C 0.490842 2.227719 -0.472269
C 2.502247 3.278170 -1.390194
C 1.132143 3.345047 -1.068140
C -0.973538 2.369656 -0.149487
C -3.040810 0.981405 0.324362
C -3.525521 -0.353902 0.380317
C -4.864295 -0.545524 0.738669
C -3.925820 2.057820 0.623506
C -5.771637 0.478795 1.048100
C -5.264105 1.796666 0.983347
H 3.551975 0.207188 -3.026066
H 2.321369 -1.035592 -2.600536
H 3.855276 -1.528166 -3.361691
H 6.022187 -0.832849 -0.309677
H 5.730130 0.361783 -1.622782
H 6.092563 -1.349017 -2.019991
H 0.795835 0.189679 0.306457
H 4.321379 2.076652 -1.331845
H 2.995402 4.138686 -1.854245
H 0.541297 4.245774 -1.259855
H 3.244338 -0.184536 3.090356
H 3.101884 1.198309 2.001885
H 3.984817 -4.862359 -0.006802
H 3.837829 -4.371039 1.691247
H -1.166700 0.311233 -0.259969
H -2.879712 -1.213638 0.166294
H -3.547121 3.079566 0.568351
H -6.805981 0.263333 1.329489
H -5.927177 2.636524 1.213117


