%chk=000183623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183623

0 1
O -0.345328 -3.226226 0.089568
O 0.783972 2.193010 -0.394900
O 0.183771 2.853964 1.704274
C -1.149803 -0.972949 -0.059767
C -0.880909 0.437932 -0.127940
C -2.557888 -1.493050 0.019345
C -1.997859 1.442525 -0.146590
C -0.086117 -1.858373 -0.041642
C 0.439350 0.843804 -0.182518
C 1.287123 -1.439072 -0.056393
C 1.557982 -0.051747 -0.138760
C -3.030409 -1.557755 1.482680
C -2.099288 2.149518 -1.507852
C 2.377209 -2.357503 0.033404
C 2.912997 0.398794 -0.171558
C -4.489915 -1.990291 1.584191
C -3.219272 3.185356 -1.521051
C 3.672102 -1.900946 0.009506
C 3.943399 -0.506256 -0.101913
C -0.312241 -3.945322 -1.170820
C 0.637505 3.129161 0.625669
C 1.126533 4.433704 0.100127
H -3.243623 -0.860548 -0.580012
H -2.614179 -2.509172 -0.425938
H -2.970540 0.967801 0.099123
H -1.837003 2.185138 0.666739
H -2.383741 -2.265125 2.041909
H -2.889889 -0.573227 1.970687
H -1.129313 2.631822 -1.749356
H -2.266933 1.398905 -2.304810
H 2.147494 -3.418646 0.141368
H 3.097503 1.469790 -0.253919
H -5.158776 -1.290168 1.071932
H -4.648842 -2.981270 1.143701
H -4.811266 -2.044057 2.631006
H -4.197420 2.726851 -1.334976
H -3.069950 3.954395 -0.754741
H -3.275897 3.693351 -2.490462
H 4.509299 -2.593280 0.080918
H 4.980125 -0.174495 -0.124780
H -0.501464 -4.976657 -0.851634
H 0.668774 -3.848405 -1.643827
H -1.105255 -3.582241 -1.830253
H 1.507876 4.358624 -0.931492
H 1.937459 4.828612 0.732499
H 0.317245 5.181326 0.102958


%chk=000183623-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183623

0 1
O -0.389856 -3.206409 0.037428
O 0.876864 2.295861 -0.327104
O 0.560660 2.773683 1.951752
C -1.131010 -0.885070 -0.059920
C -0.818062 0.525726 -0.106120
C -2.567843 -1.374424 0.039445
C -1.919732 1.571110 -0.184788
C -0.081080 -1.818861 -0.054367
C 0.526574 0.907870 -0.159807
C 1.300789 -1.428273 -0.064179
C 1.616075 -0.019520 -0.143307
C -3.047754 -1.480595 1.516558
C -2.314919 1.896417 -1.653176
C 2.370823 -2.377323 0.015374
C 2.989365 0.387111 -0.181104
C -4.504058 -1.979671 1.620518
C -3.445851 2.944154 -1.733048
C 3.701517 -1.953928 -0.014023
C 4.012490 -0.562291 -0.124016
C -0.366232 -3.911504 -1.259691
C 0.878504 3.150260 0.808473
C 1.268586 4.552632 0.396333
H -3.252885 -0.708325 -0.518096
H -2.649197 -2.379125 -0.411656
H -2.814145 1.225064 0.363568
H -1.602186 2.504612 0.311494
H -2.370278 -2.172058 2.051552
H -2.949415 -0.494234 2.011432
H -1.418273 2.262128 -2.189373
H -2.629775 0.964751 -2.163624
H 2.123703 -3.436678 0.134774
H 3.223371 1.453061 -0.255881
H -5.199703 -1.296789 1.096289
H -4.612539 -2.983233 1.167761
H -4.828048 -2.047780 2.674987
H -4.358598 2.584445 -1.221381
H -3.143051 3.892244 -1.249539
H -3.711262 3.169041 -2.781977
H 4.511141 -2.688405 0.057184
H 5.058925 -0.239355 -0.152978
H -0.581115 -4.966250 -1.028875
H 0.624169 -3.823765 -1.746621
H -1.140965 -3.508208 -1.941766
H 1.912568 4.545108 -0.494307
H 1.755258 5.060778 1.242751
H 0.351048 5.123621 0.156751


