%chk=000217866.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217866

0 1
F 2.030636 -4.414922 -0.455742
O 5.665381 0.475056 1.061465
O -1.154565 -1.464078 -0.967903
N 0.961612 2.223921 -0.122461
N -2.719419 -0.002108 -0.196919
C 3.268710 2.635018 0.609725
C 4.091019 1.676325 -0.256262
C 4.643062 3.041848 0.119456
C 2.022639 3.274916 0.019776
C 4.658020 0.441262 0.382138
C 0.327003 1.904186 1.199087
C -0.070137 2.637877 -1.130804
C -1.747905 1.126395 -0.007076
C -0.672439 0.750836 1.030471
C -1.070698 1.492523 -1.341837
C 3.928828 -0.835531 0.133592
C 4.616712 -2.042617 0.355346
C 2.587469 -0.855321 -0.282399
C -4.096906 0.287484 0.148228
C -2.320712 -1.272247 -0.666235
C -3.409797 -2.323339 -0.760633
C 3.983075 -3.268429 0.152836
C 1.929034 -2.069748 -0.483251
C -4.500937 0.234019 1.492214
C -5.007647 0.631581 -0.864269
C 2.646867 -3.247375 -0.263425
C -2.828211 -3.674816 -1.154242
C -5.827958 0.525293 1.816893
C -6.331111 0.917873 -0.521526
C -6.742729 0.864985 0.814511
H 3.160075 2.383422 1.673584
H 3.766931 1.510649 -1.293228
H 5.469738 3.087533 0.832897
H 4.758274 3.798181 -0.651803
H 1.713289 4.136835 0.650973
H 2.248531 3.693448 -0.986783
H -0.173072 2.782483 1.661003
H 1.133606 1.586862 1.897166
H 0.453970 2.843591 -2.090362
H -0.604907 3.569075 -0.845585
H -2.333317 2.008052 0.366316
H -1.129662 0.496197 2.001572
H -0.134864 -0.164575 0.690020
H -0.536822 0.598344 -1.740915
H -1.819321 1.771680 -2.102303
H 5.657068 -2.008271 0.693632
H 2.038971 0.084549 -0.444660
H -4.173818 -2.004612 -1.501185
H -3.948416 -2.406860 0.207305
H 4.511335 -4.204978 0.317296
H 0.878774 -2.085870 -0.803155
H -3.785875 -0.030717 2.269593
H -4.681807 0.679513 -1.902078
H -3.612419 -4.430510 -1.266749
H -2.275306 -3.612197 -2.102489
H -2.110992 -4.037869 -0.405201
H -6.150617 0.486414 2.857315
H -7.045090 1.185833 -1.300272
H -7.775956 1.089632 1.074542


%chk=000217866-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217866

0 1
F 2.108212 -4.659827 -0.485477
O 5.500186 0.517132 1.246270
O -1.106276 -1.375313 -1.162310
N 0.930733 2.344998 -0.111479
N -2.712059 -0.002698 -0.177032
C 3.314388 2.724455 0.574645
C 4.000862 1.625024 -0.291462
C 4.666030 2.989964 -0.082367
C 2.031479 3.336650 0.025173
C 4.545164 0.418776 0.411288
C 0.427430 1.853161 1.196561
C -0.187623 2.844526 -0.950433
C -1.729555 1.112016 0.072228
C -0.571561 0.691856 1.008186
C -1.185187 1.708009 -1.249442
C 3.896402 -0.905464 0.130968
C 4.579451 -2.095857 0.501519
C 2.597869 -0.994779 -0.444243
C -4.097291 0.270124 0.152012
C -2.306996 -1.199586 -0.778079
C -3.361362 -2.307701 -0.929656
C 3.991029 -3.356407 0.286912
C 1.980467 -2.247975 -0.646851
C -4.487960 0.390073 1.509245
C -5.054052 0.468446 -0.873781
C 2.702881 -3.397183 -0.282911
C -2.712978 -3.698610 -1.071491
C -5.826893 0.698870 1.835678
C -6.394609 0.767331 -0.543083
C -6.785085 0.884025 0.811235
H 3.351223 2.547112 1.655620
H 3.505798 1.445076 -1.249628
H 5.548303 2.993170 0.564025
H 4.704720 3.665405 -0.942764
H 1.732304 4.200595 0.673602
H 2.230651 3.746769 -0.983852
H -0.059122 2.686705 1.772073
H 1.281774 1.494700 1.797035
H 0.229945 3.230045 -1.899297
H -0.723903 3.696870 -0.452216
H -2.315118 1.902320 0.583408
H -0.974206 0.390684 1.994798
H -0.049406 -0.173728 0.573167
H -0.675732 0.913696 -1.819519
H -2.023494 2.098957 -1.857976
H 5.569345 -2.007073 0.960345
H 2.043963 -0.083141 -0.698108
H -3.972134 -2.090313 -1.828944
H -4.063462 -2.283014 -0.076126
H 4.501199 -4.286724 0.552950
H 0.965071 -2.317207 -1.050460
H -3.744192 0.229710 2.297836
H -4.741411 0.399321 -1.921571
H -3.486220 -4.463458 -1.265172
H -1.987064 -3.707100 -1.901045
H -2.167289 -3.980748 -0.154081
H -6.123619 0.786246 2.886667
H -7.129747 0.918322 -1.341257
H -7.824078 1.119470 1.065867


