%chk=000184029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184029

0 1
O -4.112405 -0.469183 -1.159446
O -4.777391 0.354676 -0.158446
O -0.744985 1.014034 -0.752135
O 1.295566 0.843588 -0.032680
O 0.489491 -0.793562 -1.481058
C -2.789526 -0.310106 -0.489999
C -3.520548 0.479853 0.653873
C -1.928955 0.516459 -1.453010
C -2.196153 -1.656242 -0.163680
C -3.163702 1.939004 0.815214
C -3.705691 -0.246910 1.966336
C 0.369789 0.217377 -0.836864
C 2.615399 0.351556 0.082027
C 3.129560 -0.769904 -0.563917
C 3.369713 1.154358 0.952491
C 4.469034 -1.099395 -0.321288
C 4.699753 0.799666 1.173387
C 5.249750 -0.323770 0.539526
H -2.419821 1.461964 -1.758879
H -1.641857 -0.062097 -2.351054
H -2.985496 -2.397956 0.030749
H -1.582315 -2.057431 -0.986160
H -1.550078 -1.614766 0.722360
H -3.583182 2.373907 1.730669
H -2.071914 2.082665 0.853948
H -3.548992 2.540782 -0.020406
H -2.772382 -0.298823 2.538759
H -4.454522 0.257405 2.593309
H -4.075042 -1.271150 1.815237
H 2.518849 -1.376657 -1.237821
H 2.916486 2.021607 1.428770
H 4.900440 -1.971900 -0.813259
H 5.314183 1.401669 1.843263
H 6.289643 -0.590416 0.719681


%chk=000184029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184029

0 1
O -4.089712 -0.625190 -1.214390
O -4.739086 0.668543 -0.593628
O -0.666965 0.793080 -0.506484
O 1.465574 0.694874 0.034761
O 0.652256 -0.815842 -1.601604
C -2.860984 -0.374647 -0.332232
C -3.737998 0.555981 0.578826
C -1.875388 0.352402 -1.263347
C -2.292829 -1.670185 0.229264
C -3.230616 1.942460 0.965937
C -4.433685 -0.160250 1.740509
C 0.509046 0.116471 -0.782822
C 2.849830 0.311750 0.038990
C 3.436354 -0.659104 -0.802914
C 3.606089 1.028130 0.991584
C 4.823853 -0.902811 -0.667651
C 4.986993 0.768003 1.108665
C 5.601843 -0.199546 0.278615
H -2.327058 1.267874 -1.673985
H -1.570482 -0.324225 -2.080300
H -3.056768 -2.240425 0.779305
H -1.902540 -2.302937 -0.587369
H -1.453660 -1.454284 0.915843
H -4.089280 2.574068 1.259006
H -2.546907 1.873507 1.830807
H -2.695356 2.444463 0.146276
H -3.711374 -0.433558 2.531910
H -5.192657 0.508144 2.183274
H -4.944090 -1.071580 1.387591
H 2.836675 -1.204413 -1.532460
H 3.105021 1.772417 1.617144
H 5.292937 -1.652656 -1.313964
H 5.579328 1.320957 1.845288
H 6.674334 -0.401166 0.369052


