%chk=000191467.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191467

0 1
P 3.249977 2.989817 0.198887
P 5.279854 2.488837 2.496905
P 6.824705 -0.052879 1.611375
F -6.075519 1.623586 -1.706074
O 1.262910 -0.768745 2.123963
O 2.562583 -3.662139 1.547391
O 4.038675 -1.849407 0.635949
O 2.881427 1.454189 -0.246133
O 4.676112 2.744369 1.006023
O 3.945302 3.526473 -1.166619
O 2.212761 3.764815 0.863159
O 6.505381 1.516932 2.095584
O 4.134777 1.429644 3.028894
O -4.510681 -0.757289 -3.973178
O 5.619030 3.619004 3.337823
O 6.041848 -0.103425 0.190489
O 8.349026 0.264304 1.144805
O 6.591793 -1.102039 2.592515
N -0.577245 -1.869288 1.141191
N -2.851761 -1.503896 1.024531
N -0.053934 -1.615810 -1.308271
N -2.056527 -1.180146 -2.647584
N -4.255359 -0.983049 -1.665748
C 1.781253 -2.728935 0.827481
C 2.666181 -1.555178 0.323835
C 0.741537 -2.057138 1.771668
C 2.300237 -0.337947 1.197847
C 1.738597 0.847160 0.403825
C -0.876914 -1.634277 -0.210361
C -1.831162 -1.750335 1.844763
C -2.300452 -1.425416 -0.268115
C -2.878362 -1.191155 -1.553855
C -0.712749 -1.388080 -2.478972
C -4.996791 -0.744351 -2.876913
C -6.447413 -0.529734 -2.574649
C -6.937997 0.661094 -2.025266
C -7.370538 -1.532184 -2.913370
C -8.299381 0.882134 -1.795211
C -8.734095 -1.335275 -2.688532
C -9.195978 -0.133956 -2.133497
H 1.325827 -3.337874 0.012643
H 2.570831 -1.370773 -0.768621
H 0.616781 -2.587693 2.748734
H 3.147071 -0.034090 1.867660
H 1.173023 1.540117 1.063717
H 1.082162 0.536214 -0.436016
H 3.163073 -3.201194 2.198045
H 4.294965 -2.737106 0.272718
H -1.883151 -1.864073 2.920832
H -0.104833 -1.363353 -3.401899
H -4.770529 -0.979722 -0.768833
H 4.823094 3.101483 -1.412077
H 3.875601 1.437933 3.983320
H -7.015080 -2.464656 -3.358534
H -8.651463 1.821588 -1.368269
H -9.444963 -2.118675 -2.951968
H -10.265027 0.011167 -1.965757
H 5.142579 -0.607307 0.148280
H 8.524833 1.189630 0.800167


%chk=000191467-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191467

0 1
P 5.221947 3.127773 -0.076824
P 5.648899 2.312388 2.990858
P 5.727491 -0.839360 2.451500
F -6.614660 -1.168182 0.204085
O 1.230274 0.378387 0.976938
O 2.608065 -2.806894 1.211523
O 4.084720 -1.471840 -0.458597
O 4.274238 1.788450 -0.581953
O 6.072356 2.548304 1.363845
O 6.556628 3.002016 -1.106236
O 4.494924 4.519020 0.039079
O 6.115486 0.674104 3.230075
O 3.939867 2.242307 2.776727
O -5.249687 -1.183417 -3.886612
O 6.226123 3.265670 4.099647
O 6.034409 -0.618566 0.832145
O 7.011432 -1.717555 3.122504
O 4.276870 -1.408826 2.794710
N -0.579274 -1.141725 0.725342
N -2.872980 -1.205769 0.857669
N -0.336787 -1.019370 -1.755429
N -2.524635 -1.035094 -2.889763
N -4.596092 -1.151262 -1.622313
C 1.806762 -1.923161 0.374223
C 2.723768 -0.899703 -0.383934
C 0.803827 -1.026688 1.165394
C 2.626554 0.385747 0.473360
C 2.818385 1.712096 -0.258526
C -1.048735 -1.087988 -0.596327
C -1.723024 -1.198360 1.546764
C -2.465251 -1.136352 -0.488865
C -3.203981 -1.108255 -1.707274
C -1.157203 -0.997379 -2.852874
C -5.546962 -1.177870 -2.664479
C -6.999914 -1.203158 -2.223766
C -7.510340 -1.196928 -0.904719
C -7.968712 -1.235033 -3.265280
C -8.877015 -1.218549 -0.592168
C -9.349144 -1.257944 -2.992507
C -9.808024 -1.249302 -1.652976
H 1.282532 -2.587279 -0.325838
H 2.348180 -0.730222 -1.403734
H 0.835550 -1.287282 2.240676
H 3.314302 0.340089 1.336557
H 2.508891 2.557532 0.379809
H 2.274362 1.741656 -1.216529
H 3.144599 -2.300878 1.916357
H 3.995988 -2.412423 -0.107012
H -1.645241 -1.236799 2.631678
H -0.661018 -0.941524 -3.825946
H -4.957047 -1.172172 -0.657986
H 7.238153 2.338330 -0.820584
H 3.382172 2.478969 3.560205
H -7.584758 -1.240235 -4.290714
H -9.190439 -1.211186 0.455446
H -10.066861 -1.282126 -3.818173
H -10.880011 -1.266403 -1.431881
H 5.213379 -0.886708 0.171617
H 7.622564 -1.181169 3.691781


