%chk=000229117.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229117

0 1
O -4.549665 0.830900 0.918215
O -4.574745 -0.912516 -0.654358
C -0.030241 -0.333617 0.384247
C 1.228852 0.243728 -0.276230
C -1.306161 0.247777 -0.240133
C 2.504768 -0.337441 0.347953
C -2.557875 -0.331823 0.422588
C 3.764732 0.239087 -0.311859
C -3.840679 0.230611 -0.180509
C 5.040690 -0.341742 0.312584
C 6.300545 0.234573 -0.347127
C -6.695456 0.042033 0.074013
C -5.897737 1.235705 0.603257
C -5.924375 -0.619329 -1.070244
C 7.577706 -0.345810 0.276550
C 8.835046 0.224237 -0.376415
H -0.033624 -1.436936 0.289108
H -0.014693 -0.125276 1.471775
H 1.232477 1.346726 -0.180689
H 1.213563 0.034964 -1.363397
H -1.321474 0.035310 -1.327396
H -1.302529 1.351233 -0.140784
H 2.520527 -0.129071 1.435203
H 2.501531 -1.440505 0.252987
H -2.557791 -0.128013 1.516215
H -2.576727 -1.440462 0.332558
H 3.749510 0.030280 -1.398951
H 3.768233 1.342081 -0.217019
H -3.734358 0.966779 -0.998288
H 5.056074 -0.132966 1.399692
H 5.037297 -1.444761 0.217887
H 6.305492 1.337453 -0.253026
H 6.286620 0.026604 -1.434226
H -6.834555 -0.694699 0.892874
H -7.705301 0.347795 -0.248828
H -5.860400 2.070719 -0.117166
H -6.268016 1.595364 1.580141
H -6.314232 -1.621910 -1.322409
H -5.889857 0.011074 -1.975256
H 7.593919 -0.136483 1.364066
H 7.574903 -1.449303 0.181319
H 8.869517 0.000830 -1.448745
H 8.888001 1.313401 -0.267291
H 9.740788 -0.195202 0.075413


%chk=000229117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229117

0 1
O -5.034519 0.161467 1.240350
O -4.091636 -0.397131 -0.923003
C -0.071719 -0.037015 0.771862
C 1.172671 0.309836 -0.075818
C -1.397038 0.394211 0.105947
C 2.500423 -0.153361 0.564460
C -2.633180 0.042739 0.962233
C 3.742973 0.189082 -0.288102
C -3.947680 0.416162 0.289996
C 5.070646 -0.290487 0.340548
C 6.311665 0.045247 -0.516992
C -6.552716 -0.345765 -0.653414
C -6.343097 0.482349 0.629863
C -5.366877 -0.094165 -1.605099
C 7.639505 -0.438092 0.109495
C 8.872857 -0.105009 -0.757784
H -0.095618 -1.131565 0.955428
H 0.017141 0.443483 1.769074
H 1.208996 1.406982 -0.242935
H 1.070064 -0.153255 -1.079640
H -1.495136 -0.093969 -0.882375
H -1.372603 1.488709 -0.081477
H 2.605555 0.309059 1.568522
H 2.462373 -1.250448 0.731050
H -2.592705 0.565060 1.936878
H -2.661051 -1.043195 1.170645
H 3.630837 -0.264482 -1.295463
H 3.787789 1.287214 -0.446349
H -3.989525 1.494885 -0.009712
H 5.186058 0.165486 1.346476
H 5.023595 -1.388129 0.501657
H 6.361811 1.142875 -0.677411
H 6.196168 -0.409667 -1.523409
H -6.593852 -1.418785 -0.394422
H -7.506550 -0.065465 -1.142021
H -6.381557 1.570548 0.394398
H -7.092528 0.254810 1.404134
H -5.390610 -0.751539 -2.488594
H -5.362246 0.967575 -1.942469
H 7.756473 0.020429 1.112924
H 7.586552 -1.533925 0.273877
H 8.796994 -0.581619 -1.753616
H 8.962661 0.986536 -0.915863
H 9.808937 -0.456278 -0.285554


