%chk=000292051.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292051

0 1
Cl 0.054535 1.840103 -4.032491
S -2.443529 1.838943 0.398174
F 4.029406 -1.463193 0.274591
F 3.684570 0.314411 1.358255
F 2.262383 -1.251030 1.410998
O -3.126970 2.658677 1.367562
O -2.965952 1.609991 -0.928249
O -0.275659 -4.037929 0.713337
O -0.187960 -2.703963 -0.990859
N -0.890649 2.600378 0.155114
N -0.342140 2.618159 -1.153925
N -0.465282 -2.966726 0.166646
C -2.012171 0.328895 1.127119
C 0.609552 1.562817 -1.383316
C -1.452192 -0.687274 0.352475
C 2.331356 0.030925 -0.602026
C 1.350101 0.991325 -0.331319
C -2.218142 0.141704 2.500499
C -1.085043 -1.890394 0.974082
C 0.909448 1.161883 -2.706097
C 2.610657 -0.363855 -1.915188
C -1.857586 -1.065265 3.109222
C 1.898788 0.215250 -2.970066
C -1.284796 -2.087927 2.351666
C 3.065989 -0.576580 0.564786
H -0.718881 3.527581 0.594169
H -1.083350 2.664574 -1.889926
H -1.294042 -0.568098 -0.731249
H 1.154658 1.312967 0.696243
H -2.667567 0.944397 3.103152
H 3.368862 -1.117871 -2.135051
H -2.020747 -1.206847 4.179815
H 2.110691 -0.080833 -4.000944
H -0.988039 -3.039298 2.812901


%chk=000292051-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292051

0 1
Cl -0.086351 2.149945 -4.080058
S -2.280528 1.830031 0.481907
F 3.966813 -1.644830 -0.128573
F 4.013496 0.322694 1.000673
F 2.313459 -1.128715 1.340995
O -3.608894 2.470615 1.220677
O -2.307705 1.470630 -1.147762
O -0.138884 -4.242480 1.159633
O 0.248842 -2.802611 -0.565684
N -0.264933 3.211633 0.166385
N -0.064979 2.884818 -1.123219
N -0.269938 -3.099735 0.578629
C -2.004325 0.145188 1.316473
C 0.789644 1.803420 -1.441839
C -1.260927 -0.817536 0.624486
C 2.372861 0.073106 -0.772538
C 1.560521 1.174015 -0.437249
C -2.564073 -0.071461 2.587213
C -1.066099 -2.053428 1.273602
C 0.879317 1.330131 -2.778345
C 2.439173 -0.408284 -2.099362
C -2.355869 -1.329845 3.202251
C 1.690395 0.233929 -3.109255
C -1.600267 -2.328139 2.552043
C 3.156433 -0.589519 0.327124
H -0.865590 4.066693 0.201134
H -0.678134 3.210161 -1.889075
H -0.869397 -0.643587 -0.381773
H 1.495395 1.556754 0.585097
H -3.162067 0.714070 3.061301
H 3.057386 -1.275818 -2.342136
H -2.783436 -1.528078 4.189800
H 1.729210 -0.123221 -4.141447
H -1.420247 -3.304651 3.008994


