%chk=000107083.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000107083

0 1
O -0.860419 0.477572 0.355145
O -0.360926 1.849676 -1.370208
O -4.150663 -1.957401 0.176029
O 2.376164 -2.394292 -1.025943
O 3.244543 -2.377771 1.030534
C 1.114323 -0.048516 -0.860935
C 1.488318 -0.743781 0.464421
C -3.298181 0.367217 0.135222
C 2.309063 0.721105 -1.455519
C 2.063380 0.253878 1.488085
C -2.094433 1.209615 0.621624
C -0.067870 0.892184 -0.697118
C 3.113666 1.459294 -0.430380
C 3.011688 1.243635 0.884046
C -3.124846 -1.082723 0.659355
C -3.366238 0.359846 -1.394175
C -4.572507 0.994070 0.723329
C 2.472673 -1.875995 0.250081
H 0.790826 -0.836028 -1.600556
H 0.558598 -1.210549 0.900282
H 1.945136 1.429513 -2.233992
H 2.970344 -0.000747 -1.985548
H 2.567300 -0.303061 2.309805
H 1.219613 0.803251 1.962795
H -2.057315 2.200137 0.131287
H -2.066472 1.325396 1.718333
H 3.810125 2.191587 -0.838918
H 3.616262 1.794196 1.604560
H -2.200339 -1.544122 0.260564
H -3.109517 -1.122603 1.761498
H -4.102050 -0.375459 -1.748463
H -3.641584 1.338577 -1.800661
H -2.403703 0.084999 -1.841086
H -4.684141 2.041575 0.418004
H -5.468543 0.470876 0.368203
H -4.584097 0.966218 1.817607
H -5.032154 -1.630586 0.445323
H 2.991974 -3.161782 -1.172330


%chk=000107083-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107083

0 1
O -0.897709 0.384844 0.342747
O -0.233664 2.065581 -1.133034
O -4.560062 -1.916447 0.428595
O 2.338080 -2.451873 -1.154598
O 3.497771 -2.313539 0.843713
C 1.187820 0.052989 -0.846589
C 1.624852 -0.737627 0.423855
C -3.388353 0.300618 0.109028
C 2.365726 0.851725 -1.457138
C 2.212136 0.198163 1.509162
C -2.174529 1.104107 0.630612
C -0.012161 0.968658 -0.576543
C 3.222068 1.525499 -0.400850
C 3.144065 1.244352 0.925523
C -3.383992 -1.107559 0.775623
C -3.335137 0.157477 -1.430399
C -4.661726 1.082821 0.530298
C 2.599381 -1.867800 0.098860
H 0.831754 -0.680112 -1.597626
H 0.727168 -1.239690 0.836973
H 1.959976 1.614450 -2.147392
H 2.987542 0.169832 -2.071323
H 2.756570 -0.412974 2.252889
H 1.381120 0.689971 2.053903
H -2.127712 2.102605 0.159790
H -2.203965 1.204227 1.731078
H 3.935205 2.282107 -0.754341
H 3.781665 1.787858 1.635328
H -2.526054 -1.693174 0.408851
H -3.291756 -0.997931 1.879421
H -4.159853 -0.491508 -1.773274
H -3.420943 1.140463 -1.928165
H -2.386483 -0.308379 -1.753078
H -4.632086 2.121589 0.153578
H -5.565586 0.611422 0.102818
H -4.774478 1.123852 1.631704
H -5.357211 -1.538612 0.877625
H 2.958559 -3.218985 -1.287326


