%chk=000188734.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188734

0 1
F -6.420545 2.327041 0.105177
F -6.180194 -2.295612 0.853952
O 3.737100 0.622981 1.010012
O -2.126495 -0.132955 -1.772983
O -4.210637 0.333200 1.768234
N -1.809226 0.255590 0.509645
N -3.997483 -0.021662 -0.490154
C 6.025669 0.698067 0.554764
C 7.132660 0.421324 -0.423570
C 4.664012 0.503638 -0.114348
C 7.675560 -0.871161 -0.583117
C 7.629657 1.480652 -1.197840
C 8.707945 -1.071747 -1.513559
C 7.180875 -2.029059 0.222912
C 2.390043 0.514253 0.751252
C 8.655798 1.269380 -2.121073
C 9.195677 -0.010171 -2.278233
C -0.374253 0.335615 0.539783
C 1.598261 0.657517 1.912641
C 1.814169 0.284901 -0.502446
C 0.219359 0.567759 1.803749
C 0.422710 0.195725 -0.604842
C -2.550889 0.029159 -0.642192
C -6.217854 0.022159 0.492858
C -4.743048 0.131492 0.694135
C -7.017076 1.147436 0.236921
C -6.894955 -1.201156 0.617335
C -8.406073 1.079662 0.103994
C -8.281331 -1.319438 0.492587
C -9.029829 -0.165352 0.237880
H 6.099489 1.728139 0.963448
H 6.097196 0.044387 1.450806
H 4.436293 1.291406 -0.851220
H 4.547974 -0.496711 -0.564073
H 7.212316 2.479626 -1.077433
H 9.134061 -2.065471 -1.640851
H 7.622007 -2.983438 -0.093068
H 6.089930 -2.142003 0.148499
H 7.423368 -1.902034 1.288486
H 9.033351 2.098977 -2.714955
H 9.996307 -0.180275 -2.995775
H 2.083841 0.835995 2.870451
H 2.419067 0.174757 -1.397657
H -0.400607 0.677031 2.694090
H -0.034325 0.016059 -1.585581
H -2.299514 0.377912 1.418457
H -4.490040 -0.191765 -1.380806
H -8.993673 1.977209 -0.094614
H -8.771868 -2.288413 0.596301
H -10.116379 -0.237429 0.141623


%chk=000188734-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188734

0 1
F -6.535286 2.058435 1.780467
F -6.114996 -1.929155 -0.959590
O 3.730791 0.897037 1.036744
O -2.124366 -0.535225 -1.908847
O -4.174060 0.604762 1.609295
N -1.847754 0.299904 0.293823
N -4.003013 -0.159236 -0.592114
C 6.099836 0.817213 0.563961
C 7.189868 0.418854 -0.423916
C 4.701003 0.533736 -0.010655
C 7.734228 -0.902227 -0.443209
C 7.649030 1.370401 -1.369469
C 8.719941 -1.219563 -1.412264
C 7.297996 -1.958231 0.560863
C 2.366525 0.716645 0.752619
C 8.629863 1.041248 -2.330673
C 9.168398 -0.264365 -2.352014
C -0.432196 0.421478 0.389841
C 1.474476 1.056475 1.800730
C 1.853390 0.232649 -0.475207
C 0.090815 0.909803 1.620192
C 0.460933 0.084922 -0.657946
C -2.566337 -0.147845 -0.788980
C -6.226207 0.052715 0.443818
C -4.728565 0.185048 0.542030
C -7.086636 0.961389 1.117767
C -6.893841 -0.991446 -0.244636
C -8.486016 0.838814 1.129278
C -8.283892 -1.167791 -0.262738
C -9.082516 -0.237957 0.438647
H 6.164690 1.894895 0.799176
H 6.196479 0.269720 1.518052
H 4.520625 1.140727 -0.921232
H 4.586257 -0.538298 -0.272875
H 7.234416 2.386278 -1.343530
H 9.142509 -2.231741 -1.427515
H 7.774947 -2.928786 0.342327
H 6.203192 -2.114801 0.555444
H 7.575658 -1.675360 1.594541
H 8.971417 1.793940 -3.049864
H 9.931517 -0.536739 -3.089770
H 1.885471 1.430593 2.742992
H 2.520651 -0.033743 -1.300019
H -0.592547 1.174385 2.436093
H 0.063299 -0.288842 -1.603477
H -2.420845 0.564263 1.118360
H -4.492826 -0.542600 -1.405948
H -9.081940 1.580731 1.666689
H -8.715547 -2.009553 -0.809666
H -10.170432 -0.350359 0.442005


