%chk=000209717.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209717

0 1
O -0.351798 1.793391 1.227488
O 1.952517 -0.477791 -0.565982
O 0.536367 -2.530216 1.230077
O 3.268432 -0.955812 1.211773
C -0.803942 -0.494842 0.582333
C -0.905516 -0.675318 -0.949056
C 0.282388 0.500047 1.030587
C -0.496293 1.845981 -1.265527
C -1.309871 0.603336 -1.684130
C -1.844492 -1.902274 -1.131715
C -0.776482 -1.946357 1.125856
C 1.447462 0.765828 0.026484
C -0.931053 2.482201 0.085468
C 1.014300 1.554126 -1.216775
C -1.486861 -2.815948 0.068001
C 0.800542 0.236771 2.444913
C -3.336529 -1.569865 -1.151974
C -0.378747 3.909548 0.224283
C -2.444432 2.477067 0.321846
C 2.816427 -1.281712 0.135627
C 3.039461 -2.536903 -0.629534
H -1.773587 -0.048611 0.943777
H 0.103053 -0.994182 -1.330774
H -0.670540 2.619286 -2.057279
H -2.389565 0.807867 -1.551646
H -1.177193 0.441805 -2.772663
H -1.588750 -2.416816 -2.085688
H -1.242305 -2.012575 2.129722
H 2.297102 1.252074 0.554310
H 1.314617 0.984108 -2.123931
H 1.580567 2.504516 -1.262879
H -2.372202 -3.314666 0.489607
H -0.800509 -3.625968 -0.249038
H -0.024033 0.083598 3.150127
H 1.483337 -0.627206 2.485028
H 1.364375 1.104767 2.818861
H -3.597487 -0.947045 -2.014591
H -3.942923 -2.480648 -1.216657
H -3.646749 -1.033891 -0.248390
H 0.699377 3.947316 0.036876
H -0.875177 4.609831 -0.451094
H -0.522746 4.269243 1.252426
H -2.983196 3.027762 -0.452834
H -2.836473 1.452229 0.362267
H -2.679517 2.935990 1.290911
H 1.082706 -2.044717 1.897523
H 2.982462 -2.388698 -1.716891
H 2.242497 -3.262148 -0.361704
H 4.008180 -2.992480 -0.381821


%chk=000209717-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209717

0 1
O -0.365630 1.791253 1.236678
O 2.001313 -0.599680 -0.497050
O 0.526621 -2.685311 1.168212
O 3.654033 -0.679754 1.156045
C -0.850996 -0.574444 0.546914
C -1.032682 -0.692485 -0.989669
C 0.243779 0.434436 1.029418
C -0.515860 1.845241 -1.284905
C -1.379339 0.623629 -1.715012
C -2.047296 -1.867241 -1.148475
C -0.812823 -2.069189 1.036288
C 1.420254 0.681174 0.024273
C -0.936439 2.529002 0.057440
C 0.996946 1.491546 -1.232975
C -1.546071 -2.878929 -0.072590
C 0.761458 0.136706 2.452595
C -3.531862 -1.484971 -0.938985
C -0.331115 3.949146 0.163194
C -2.464397 2.628303 0.270005
C 3.090702 -1.181667 0.154140
C 3.450103 -2.487907 -0.515301
H -1.785727 -0.169024 0.988122
H -0.067128 -1.062005 -1.386964
H -0.649697 2.618725 -2.068959
H -2.447380 0.872269 -1.584871
H -1.232097 0.471196 -2.803844
H -1.953836 -2.312760 -2.158726
H -1.326499 -2.151128 2.015892
H 2.220571 1.197869 0.585379
H 1.259136 0.894559 -2.125063
H 1.600296 2.414482 -1.284385
H -2.366455 -3.494893 0.336779
H -0.797331 -3.567244 -0.504389
H -0.054157 -0.227720 3.101776
H 1.601560 -0.576715 2.452582
H 1.147053 1.074879 2.885610
H -3.897304 -0.794743 -1.721108
H -4.165124 -2.390783 -0.977665
H -3.702024 -1.005871 0.044004
H 0.757357 3.944818 -0.014197
H -0.806304 4.633870 -0.563687
H -0.503598 4.343932 1.179211
H -2.947257 3.162741 -0.570330
H -2.936887 1.637767 0.369086
H -2.664988 3.189361 1.199504
H 0.955022 -2.341783 1.991985
H 3.518963 -2.361947 -1.608628
H 2.638879 -3.209515 -0.308971
H 4.401457 -2.867192 -0.114786


