%chk=000266513.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266513

0 1
S 4.068901 -2.720120 -0.265369
S -4.784425 -0.629700 1.084314
F -1.713250 2.634960 1.572851
F 0.032518 3.772807 1.263646
F -1.564792 3.845305 -0.145249
O 2.573349 -2.747455 -1.090070
O -3.109571 -0.947345 1.215490
O 4.896491 -3.699246 -0.903156
O 3.719001 -2.854378 1.125731
O -5.428538 -1.650633 1.862263
O -5.043834 -0.536330 -0.325264
O 0.569126 4.417800 -0.915836
O 1.966134 3.661921 -2.388011
N -0.301744 -1.843296 -0.300845
N 1.114647 3.510669 -1.524259
C 0.218051 -2.984469 -1.093107
C -1.138485 -2.195430 0.872394
C 0.042756 -0.534424 -0.592290
C 1.528186 -3.554002 -0.525684
C -2.641219 -2.134526 0.551954
C -0.554623 0.551478 0.125183
C 0.982122 -0.233718 -1.619712
C -0.213261 1.856380 -0.166720
C 0.724165 2.139499 -1.187221
C 1.301615 1.077394 -1.912120
C -0.845764 3.003193 0.607872
C 4.550838 -1.109856 -0.664849
C -4.805148 0.904457 1.871195
H 0.391995 -2.665284 -2.152602
H -0.557739 -3.782996 -1.134663
H -0.924810 -1.501282 1.726900
H -0.860462 -3.209888 1.236544
H 1.568168 -3.510911 0.582629
H 1.690824 -4.594683 -0.869464
H -2.848369 -2.041431 -0.533258
H -3.179510 -3.007823 0.970260
H -1.309823 0.322943 0.887857
H 1.460334 -1.048006 -2.173066
H 2.015519 1.313545 -2.712671
H 3.732880 -0.504593 -1.099382
H 4.898889 -0.525415 0.204523
H 5.370536 -1.061943 -1.402250
H -4.801128 1.762005 1.173524
H -5.681068 1.057341 2.524148
H -3.931381 1.074183 2.527736


%chk=000266513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266513

0 1
S 3.515418 -2.637024 0.091487
S -4.585825 -0.908362 1.262330
F -1.632649 2.344675 1.798264
F 0.269838 3.537394 1.863350
F -1.344674 4.009943 0.316750
O 2.418566 -2.793264 -1.453670
O -2.694472 -0.970721 1.254538
O 4.678550 -3.754607 0.075187
O 2.515255 -2.545437 1.367692
O -5.139959 -1.262817 2.737813
O -5.109582 -1.750578 -0.019186
O 1.157306 4.554126 -0.549995
O 1.531883 3.909732 -2.708609
N -0.205116 -1.771057 -0.353516
N 1.141820 3.672767 -1.494009
C -0.058317 -2.833435 -1.364564
C -0.632230 -2.210667 0.989438
C 0.092511 -0.440395 -0.639559
C 1.243341 -3.657705 -1.241252
C -2.156296 -2.339150 1.191995
C -0.336703 0.607800 0.239012
C 0.809331 -0.058360 -1.819657
C -0.044143 1.959545 -0.003846
C 0.698265 2.307599 -1.173679
C 1.091035 1.287748 -2.072211
C -0.646039 2.968832 0.962854
C 4.216906 -0.940793 -0.376761
C -4.649091 0.960242 0.942471
H -0.137485 -2.399758 -2.374128
H -0.907665 -3.539382 -1.261984
H -0.201975 -1.548510 1.757790
H -0.190741 -3.206792 1.180118
H 1.295284 -4.137699 -0.243425
H 1.274572 -4.449184 -2.012770
H -2.627512 -2.898442 0.359072
H -2.346434 -2.867747 2.146808
H -0.981788 0.357494 1.081914
H 1.189792 -0.814016 -2.509600
H 1.647485 1.585242 -2.965101
H 3.356090 -0.264125 -0.450812
H 4.912834 -0.670197 0.429452
H 4.723012 -1.086197 -1.340344
H -4.254686 1.103761 -0.071427
H -5.706536 1.243649 1.035014
H -4.011077 1.422569 1.706648


