%chk=000183632.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183632

0 1
O 1.437515 -1.407682 0.161636
O -1.524041 3.253790 -0.344327
O 1.903410 -1.602604 -2.067115
C -0.741138 -0.297096 0.178809
C -1.486117 0.906419 0.017620
C -1.435149 -1.505708 0.528089
C -2.919526 0.876353 0.110792
C 1.375315 0.946040 -0.269310
C 0.686778 -0.223411 -0.009550
C -2.820542 -1.512360 0.616998
C -3.572748 -0.315376 0.386675
C 2.864016 0.995399 -0.468237
C -0.740719 2.121819 -0.241340
C 0.629602 2.152088 -0.365455
C 3.620545 0.631419 0.817921
C -0.660728 -2.755113 0.813749
C -3.693554 2.138837 -0.097592
C -3.579205 -2.761659 0.952655
C 5.138500 0.641144 0.598407
C -5.068452 -0.394748 0.460419
C 5.893342 0.273481 1.874005
C 2.007161 -2.024727 -0.944803
C -0.867077 4.518672 -0.610245
C 2.735089 -3.232311 -0.458601
H 3.145393 0.306746 -1.296099
H 3.178543 1.999928 -0.816428
H 1.170069 3.075159 -0.546641
H 3.289896 -0.366012 1.174469
H 3.346792 1.338999 1.624136
H -1.269279 -3.528827 1.306712
H -0.266815 -3.191842 -0.113199
H 0.193252 -2.549496 1.479183
H -3.424773 2.893546 0.660014
H -3.470074 2.581388 -1.082384
H -4.782710 1.995916 -0.044675
H -2.920862 -3.598688 1.235055
H -4.265365 -2.600509 1.795399
H -4.175988 -3.097840 0.093176
H 5.407800 -0.063581 -0.212378
H 5.462992 1.640621 0.247902
H -5.400990 -0.698741 1.462262
H -5.555894 0.568559 0.239906
H -5.461960 -1.122642 -0.262191
H 5.619025 -0.725015 2.232442
H 5.681344 0.979826 2.685084
H 6.976442 0.278673 1.709299
H -0.187976 4.774779 0.207919
H -1.720270 5.207590 -0.644174
H -0.351355 4.485051 -1.574369
H 3.813812 -3.139424 -0.661175
H 2.382043 -4.135186 -0.980013
H 2.612433 -3.393047 0.623966


%chk=000183632-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183632

0 1
O 1.496843 -1.484232 0.074718
O -1.456885 3.296538 -0.451723
O 1.271173 -1.802392 -2.241510
C -0.721036 -0.324338 0.257483
C -1.476320 0.918499 0.095696
C -1.428005 -1.542242 0.603712
C -2.918439 0.898874 0.227172
C 1.413733 0.901535 -0.211960
C 0.706425 -0.273480 0.045632
C -2.837563 -1.559806 0.543722
C -3.581737 -0.341582 0.344942
C 2.922515 0.915823 -0.395998
C -0.720692 2.120554 -0.214911
C 0.672938 2.109830 -0.323464
C 3.704283 0.741982 0.935414
C -0.692117 -2.784117 1.105698
C -3.754142 2.173169 0.280763
C -3.608474 -2.863681 0.715661
C 5.235116 0.744346 0.726750
C -5.106514 -0.391659 0.332993
C 6.019438 0.584407 2.047037
C 1.723135 -2.171976 -1.141991
C -0.728137 4.498603 -0.855204
C 2.589972 -3.384101 -0.875443
H 3.232000 0.116180 -1.096607
H 3.222642 1.872768 -0.865057
H 1.222728 3.027050 -0.549442
H 3.393834 -0.206776 1.413837
H 3.422741 1.556305 1.633070
H -1.291609 -3.297610 1.875986
H -0.492600 -3.519271 0.300047
H 0.273725 -2.522880 1.557548
H -3.256776 2.947989 0.882419
H -3.907356 2.614219 -0.721521
H -4.742051 1.975631 0.724641
H -2.947323 -3.733592 0.831137
H -4.286927 -2.834099 1.589856
H -4.238065 -3.059936 -0.172810
H 5.508806 -0.074686 0.029682
H 5.536954 1.688434 0.227878
H -5.535333 -0.117941 1.318324
H -5.529272 0.305355 -0.410465
H -5.482113 -1.396647 0.088947
H 5.756507 -0.364413 2.551795
H 5.788320 1.409409 2.747007
H 7.111379 0.584298 1.873319
H -0.030608 4.836892 -0.063984
H -1.505328 5.261553 -1.012717
H -0.169105 4.333146 -1.796701
H 3.577278 -3.064889 -0.497084
H 2.718731 -3.960582 -1.802727
H 2.131112 -4.017868 -0.097167


