%chk=000270817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270817

0 1
S -6.657370 1.302324 -1.682144
F -7.002661 2.361020 -0.558139
O -1.656172 -2.408491 1.292711
O -5.803025 2.030652 -2.571315
O -7.937652 0.797122 -2.070102
N 4.202065 0.107867 0.228341
N 5.945208 1.374319 -1.057029
N 6.517579 -0.617343 0.239539
N 4.920713 -1.920288 1.360543
N 8.051658 0.332578 -1.309158
N -2.205604 -0.573069 0.008385
C 4.588027 1.428550 -0.506422
C 3.614901 1.644273 -1.669504
C 4.515336 2.552479 0.539249
C 2.820330 -0.274993 0.322412
C 5.240332 -0.784912 0.593891
C 2.386415 -1.524668 -0.163552
C 1.898383 0.611937 0.913349
C 6.790878 0.421087 -0.706683
C 0.127817 -0.994505 0.532442
C 1.045300 -1.882537 -0.048699
C 0.557406 0.249537 1.014321
C -1.295601 -1.426213 0.677741
C -3.626485 -0.720635 -0.018624
C -4.368625 0.232860 -0.744447
C -5.759783 0.127149 -0.791494
C -4.294060 -1.769603 0.649321
C -6.424346 -0.910785 -0.137880
C -5.682563 -1.856360 0.582649
H 3.974093 2.474112 -2.299973
H 3.564449 0.767139 -2.327532
H 2.602221 1.891174 -1.342357
H 4.818809 3.505517 0.082017
H 3.505525 2.677967 0.947301
H 5.198845 2.374147 1.377812
H 3.098099 -2.211465 -0.628121
H 2.240952 1.579755 1.293232
H 0.706527 -2.856799 -0.411000
H -0.153065 0.931451 1.485438
H 5.715942 -2.447316 1.716100
H 4.145352 -1.860485 2.007094
H 8.746419 -0.232230 -0.839342
H 8.403698 1.168369 -1.756769
H -1.827420 0.208540 -0.534875
H -3.862700 1.046001 -1.275856
H -3.720825 -2.516222 1.217285
H -7.514498 -0.997573 -0.189590
H -6.197027 -2.670835 1.096537


%chk=000270817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270817

0 1
S -6.943101 1.618850 -0.790847
F -7.129151 2.245743 0.948791
O -1.540340 -2.832827 0.285838
O -6.071356 2.731440 -1.557398
O -8.417563 1.199278 -1.267883
N 4.207366 0.199507 0.165223
N 6.115223 1.013194 -1.197086
N 6.470127 -0.321455 0.826739
N 4.691119 -1.146022 2.079223
N 8.199289 0.057797 -0.693523
N -2.297846 -0.650679 -0.135892
C 4.760398 1.348880 -0.725538
C 3.874879 1.518025 -1.975010
C 4.821572 2.650517 0.119762
C 2.839618 -0.210072 0.160135
C 5.151424 -0.414380 1.003787
C 2.505716 -1.581751 -0.044143
C 1.783622 0.722545 0.357544
C 6.873177 0.291365 -0.383658
C 0.109494 -1.064717 0.122342
C 1.165901 -1.999058 -0.051120
C 0.440993 0.301220 0.333513
C -1.290333 -1.601545 0.106295
C -3.699277 -0.843399 -0.132398
C -4.512536 0.288731 -0.412423
C -5.900516 0.112729 -0.404946
C -4.321368 -2.096779 0.141091
C -6.559037 -1.097569 -0.141249
C -5.727026 -2.208105 0.130947
H 4.391267 2.226918 -2.642138
H 3.779150 0.558072 -2.509976
H 2.871024 1.911363 -1.747402
H 5.290463 3.445872 -0.484723
H 3.816633 2.991181 0.429576
H 5.440287 2.494178 1.021228
H 3.310601 -2.304952 -0.209066
H 2.019795 1.770084 0.563576
H 0.904818 -3.051284 -0.202849
H -0.334293 1.049070 0.543598
H 5.392946 -1.616734 2.645439
H 3.715956 -1.136996 2.365519
H 8.747685 -0.543665 -0.086408
H 8.592971 0.468951 -1.534850
H -1.982669 0.291751 -0.374768
H -4.078984 1.270188 -0.637373
H -3.689288 -2.962113 0.346585
H -7.649660 -1.173041 -0.157266
H -6.185370 -3.179709 0.340282


