%chk=000200425.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200425

0 1
O 3.930738 -0.583521 -0.592966
O -7.042426 -0.260880 0.179305
O 5.738966 0.524842 0.229980
C 1.545373 -0.264149 -0.310963
C 0.723323 0.949815 0.228963
C -0.697012 0.939238 -0.350579
C -1.399684 -0.361584 0.137073
C 2.962974 0.092745 0.280186
C 0.887380 -1.549725 0.211547
C 1.628445 2.167674 -0.029138
C -0.581759 -1.616780 -0.242093
C -2.841073 -0.444145 -0.436127
C 3.065595 1.638283 0.165234
C -1.502921 2.165849 0.104913
C 1.654568 -0.308619 -1.840624
C -3.622427 0.825222 -0.151386
C -2.921702 2.119924 -0.471396
C -3.562567 -1.697090 0.109862
C -5.070091 -1.648004 -0.143976
C 3.185030 -0.384845 1.633663
C -4.889792 0.825757 0.282951
C -5.668561 -0.425580 0.571750
C 5.279939 -0.322330 -0.495651
C 3.379043 -0.776863 2.756072
C 5.995438 -1.232974 -1.435406
H 0.632978 0.838542 1.341883
H -0.648487 0.936889 -1.464857
H -1.473149 -0.316769 1.251341
H 0.942825 -1.595233 1.316029
H 1.437221 -2.437936 -0.151578
H 1.406016 2.993186 0.665399
H 1.487005 2.568606 -1.046703
H -0.621353 -1.769843 -1.338313
H -1.048384 -2.514770 0.205895
H -2.777244 -0.535068 -1.551192
H 3.716830 1.914991 -0.681622
H 3.549393 2.071843 1.058476
H -0.998019 3.096026 -0.215890
H -1.547190 2.209877 1.210365
H 2.322802 -1.121714 -2.154204
H 0.680050 -0.474226 -2.311766
H 2.068029 0.619743 -2.248480
H -2.888610 2.242800 -1.574784
H -3.500348 2.988418 -0.096609
H -3.375098 -1.793943 1.197897
H -3.136713 -2.605802 -0.355762
H -5.283048 -1.596453 -1.227695
H -5.560603 -2.572455 0.212268
H -5.445526 1.743997 0.464120
H -5.766139 -0.595887 1.670528
H 3.550244 -1.109230 3.719618
H -7.110847 0.004228 -0.756893
H 5.305220 -1.841151 -2.040675
H 6.648320 -1.923964 -0.878802
H 6.637726 -0.659561 -2.121085


%chk=000200425-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200425

0 1
O 4.013757 -0.674768 -0.581374
O -7.119706 -0.293825 0.544626
O 5.779659 0.475294 0.445991
C 1.565464 -0.229658 -0.471517
C 0.733261 0.969398 0.085623
C -0.726957 0.969058 -0.407088
C -1.404808 -0.370946 0.022512
C 2.968249 0.122019 0.164001
C 0.908843 -1.551594 -0.014877
C 1.626625 2.208828 -0.186912
C -0.583972 -1.607928 -0.437771
C -2.891238 -0.447866 -0.467187
C 3.094170 1.675126 -0.067580
C -1.526365 2.175173 0.135020
C 1.702220 -0.206970 -2.018086
C -3.665353 0.805764 -0.048518
C -2.993875 2.133752 -0.357521
C -3.590482 -1.744837 0.022890
C -5.126959 -1.667880 -0.095462
C 3.057082 -0.226806 1.594217
C -4.886136 0.749236 0.554702
C -5.672345 -0.526486 0.783893
C 5.369341 -0.426293 -0.314596
C 3.124489 -0.511154 2.790804
C 6.228320 -1.420916 -1.068725
H 0.690909 0.832243 1.189486
H -0.738748 1.030323 -1.518242
H -1.427376 -0.374413 1.136967
H 0.974590 -1.629045 1.087913
H 1.451227 -2.421389 -0.433842
H 1.431648 3.022003 0.533145
H 1.433286 2.614072 -1.198503
H -0.666248 -1.707383 -1.539747
H -1.028167 -2.526831 -0.011980
H -2.856252 -0.465161 -1.582510
H 3.665621 1.850321 -0.996199
H 3.656597 2.145829 0.751707
H -1.052720 3.122453 -0.187207
H -1.505536 2.160535 1.244410
H 2.335698 -1.046563 -2.349161
H 0.718344 -0.308056 -2.505738
H 2.163306 0.724350 -2.388876
H -2.988557 2.285337 -1.459521
H -3.575715 2.967688 0.077351
H -3.318031 -1.917861 1.085404
H -3.217247 -2.615372 -0.546899
H -5.409490 -1.468375 -1.150297
H -5.598291 -2.624140 0.195782
H -5.383937 1.674194 0.880398
H -5.657238 -0.821768 1.850182
H 3.204918 -0.745703 3.836155
H -7.220889 0.041650 -0.383774
H 5.827797 -1.600524 -2.079446
H 6.225536 -2.386831 -0.531508
H 7.262375 -1.049902 -1.124413


