%chk=000218646.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218646

0 1
F 8.776789 3.364451 -0.665107
O -4.392478 0.897225 -0.010997
O 5.707479 -1.839311 0.996470
O -9.829550 0.219334 -0.522473
N 1.647654 -1.496055 0.373765
N -1.050204 -0.439691 0.587944
C 0.536243 -2.011224 -0.492179
C 1.086499 -1.050447 1.692567
C -0.490759 -0.886664 -0.730423
C 0.056302 0.073449 1.460662
C 2.704716 -2.540995 0.578308
C -2.116774 0.592484 0.398864
C 3.606102 -2.642405 -0.665614
C -3.456046 -0.160030 0.359552
C 4.371619 -1.342194 -0.933037
C 5.478930 -1.096356 0.063782
C 6.330241 0.118303 -0.158830
C -5.730862 0.570854 -0.097437
C 5.879080 1.229371 -0.885834
C 7.616654 0.126294 0.409749
C -6.279545 -0.690605 0.130295
C -6.533441 1.682180 -0.456885
C 6.703253 2.342764 -1.063878
C 8.462812 1.222992 0.241686
C -7.667175 -0.864329 -0.000269
C -7.899122 1.510848 -0.585595
C 7.980937 2.308693 -0.496078
C -8.456111 0.228822 -0.354013
C -10.520323 -1.032380 -0.306426
H 0.969732 -2.325138 -1.465615
H 0.025243 -2.897401 -0.055698
H 0.611778 -1.879369 2.261948
H 1.921410 -0.657192 2.311739
H -0.013113 -0.058292 -1.298197
H -1.325605 -1.274856 -1.351487
H -0.380524 0.373895 2.437264
H 0.565306 0.964243 1.032461
H 3.339578 -2.249059 1.448666
H 2.287633 -3.541705 0.819383
H -2.002659 1.205603 -0.521760
H -2.131139 1.318225 1.240635
H 3.004448 -2.901837 -1.557701
H 4.323607 -3.475275 -0.512673
H -3.736237 -0.569818 1.343439
H -3.484613 -0.947819 -0.410336
H 4.787160 -1.347640 -1.959952
H 3.646870 -0.493390 -0.898358
H 4.874369 1.238613 -1.313237
H 7.946242 -0.740444 0.993275
H -5.663200 -1.540349 0.406552
H -6.058754 2.647600 -0.623747
H 6.357588 3.209148 -1.625653
H 9.461435 1.230785 0.676459
H -8.097950 -1.844610 0.176761
H -8.557035 2.334158 -0.859471
H -10.179664 -1.784810 -1.023183
H -10.392564 -1.365370 0.727418
H -11.563062 -0.749272 -0.501003


%chk=000218646-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218646

0 1
F 8.305136 3.709869 -0.969858
O -4.298257 1.079896 0.290806
O 5.868014 -1.943208 0.830442
O -9.788182 0.297569 -0.721349
N 1.679754 -1.678913 0.564371
N -0.941401 -0.451459 0.845062
C 0.537252 -2.096935 -0.285286
C 1.184460 -1.202857 1.880715
C -0.450311 -0.933485 -0.470476
C 0.202967 -0.034634 1.694917
C 2.730020 -2.722504 0.689606
C -1.986484 0.592089 0.726576
C 3.594853 -2.858606 -0.585308
C -3.363929 -0.039245 0.480556
C 4.272223 -1.530875 -0.973273
C 5.473547 -1.173233 -0.096527
C 6.193838 0.122982 -0.356287
C -5.648902 0.767145 0.046642
C 5.771949 1.045473 -1.352354
C 7.339198 0.430458 0.429559
C -6.174279 -0.542771 -0.022499
C -6.507837 1.882048 -0.138511
C 6.473313 2.250123 -1.564663
C 8.053746 1.626516 0.232743
C -7.554649 -0.740561 -0.278371
C -7.873507 1.687008 -0.391130
C 7.599920 2.510489 -0.764537
C -8.405522 0.372515 -0.463093
C -10.379840 -1.036974 -0.802760
H 0.914852 -2.410599 -1.275376
H -0.005830 -2.964933 0.167714
H 0.666757 -2.018990 2.445084
H 2.048433 -0.864592 2.482172
H 0.061005 -0.111832 -1.034727
H -1.307027 -1.278286 -1.077892
H -0.184273 0.279858 2.681565
H 0.756263 0.828203 1.245295
H 3.391439 -2.441390 1.528498
H 2.288747 -3.719466 0.941346
H -1.772524 1.325879 -0.087319
H -2.031587 1.162779 1.671637
H 2.975663 -3.211702 -1.432121
H 4.361933 -3.632001 -0.395520
H -3.663214 -0.654216 1.352216
H -3.359360 -0.682039 -0.423957
H 4.609092 -1.548519 -2.029866
H 3.514194 -0.723228 -0.892996
H 4.891622 0.832896 -1.966012
H 7.647692 -0.291839 1.192052
H -5.532551 -1.417133 0.121426
H -6.082571 2.888587 -0.080360
H 6.163525 2.973672 -2.323913
H 8.936492 1.878730 0.827134
H -7.941440 -1.762965 -0.327437
H -8.548971 2.535405 -0.536255
H -9.934462 -1.627738 -1.627958
H -10.263678 -1.590203 0.150486
H -11.448110 -0.868257 -1.004128


