%chk=000183189.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183189

0 1
O 2.013714 1.640410 2.173355
C 1.936453 1.177881 -0.223744
C 2.818710 1.223784 1.050367
C 2.791510 1.064343 -1.499659
C 3.899635 2.310367 0.966721
C 3.841508 2.180546 -1.560355
C 4.732084 2.173156 -0.310341
C 0.873927 0.097787 -0.141364
C -0.478171 0.477154 -0.102908
C 1.220337 -1.285739 -0.092016
C -1.516800 -0.514976 -0.041433
C 0.184043 -2.262754 -0.016542
C -1.168055 -1.858159 0.001072
C -0.885922 1.877022 -0.116974
C -2.924392 -0.098868 -0.021227
C 2.577497 -1.769915 -0.108787
C -3.249834 1.276132 -0.045451
C -2.180757 2.258148 -0.089284
C 0.517123 -3.663098 0.044148
C 2.868835 -3.103369 -0.047837
C -3.978744 -1.043071 0.021666
C 1.819398 -4.072853 0.031568
C -4.604572 1.684052 -0.025819
C -5.302067 -0.631768 0.040018
C -5.618697 0.741046 0.016370
H 1.430966 2.188176 -0.269539
H 3.253024 0.229980 1.291722
H 2.132424 1.107235 -2.387799
H 3.295798 0.078073 -1.547865
H 4.543049 2.257233 1.865814
H 3.415877 3.307133 1.016330
H 3.344225 3.164704 -1.660908
H 4.462741 2.060820 -2.467957
H 5.326968 1.240122 -0.276309
H 5.467004 2.998899 -0.365952
H 1.244174 1.048033 2.287046
H -1.944306 -2.624728 0.050693
H -0.084944 2.627887 -0.144932
H 3.389368 -1.039449 -0.181122
H -2.462044 3.311155 -0.096919
H -0.298292 -4.383023 0.101409
H 3.899692 -3.453830 -0.059476
H -3.742200 -2.108360 0.039935
H 2.083599 -5.127765 0.079528
H -4.842226 2.746626 -0.044029
H -6.104825 -1.366519 0.072828
H -6.661839 1.052441 0.031557


%chk=000183189-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183189

0 1
O 2.030182 1.649534 2.210652
C 2.009239 1.135688 -0.230598
C 2.879831 1.308579 1.055434
C 2.879158 1.009939 -1.522440
C 3.874464 2.468802 0.900787
C 3.871229 2.191400 -1.632639
C 4.749515 2.306504 -0.363985
C 0.911160 0.066801 -0.098610
C -0.469189 0.464639 -0.044537
C 1.239453 -1.338358 -0.053727
C -1.538264 -0.534582 -0.042422
C 0.165745 -2.321643 -0.035520
C -1.184932 -1.894113 -0.049476
C -0.870867 1.863468 0.028199
C -2.952254 -0.113222 -0.030662
C 2.588570 -1.853775 -0.011403
C -3.271056 1.287712 0.016727
C -2.192952 2.250845 0.059840
C 0.472287 -3.727176 -0.002798
C 2.854901 -3.220951 0.029786
C -4.037790 -1.039615 -0.063831
C 1.787708 -4.176800 0.027201
C -4.632378 1.714842 0.031297
C -5.372989 -0.605676 -0.051306
C -5.678084 0.782719 -0.002744
H 1.515353 2.116655 -0.339139
H 3.438533 0.374481 1.275551
H 2.203010 0.990733 -2.398615
H 3.444153 0.061278 -1.548011
H 4.496902 2.530907 1.812488
H 3.295164 3.411542 0.839760
H 3.307556 3.137671 -1.768788
H 4.505127 2.062966 -2.531170
H 5.381939 1.398867 -0.270832
H 5.440686 3.166217 -0.451602
H 1.327928 0.953862 2.301822
H -1.957214 -2.669635 -0.050291
H -0.108184 2.641506 0.089208
H 3.433085 -1.164678 0.004102
H -2.449758 3.314834 0.127686
H -0.360227 -4.441009 0.003948
H 3.892730 -3.570298 0.067805
H -3.843313 -2.115343 -0.104030
H 2.011972 -5.248420 0.054744
H -4.847993 2.789248 0.069923
H -6.183992 -1.341663 -0.079913
H -6.721146 1.116821 0.007730


