%chk=000240198.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240198

0 1
O -1.821639 2.893418 -1.003051
O 3.107994 2.443807 -0.346847
C -2.070341 -1.580281 0.024698
C -0.996470 -0.460937 0.282772
C 0.092378 -1.558817 0.487557
C -0.940359 -2.653470 0.120950
C 1.312847 -1.445657 -0.440301
C -1.176249 0.493026 1.458115
C -3.145551 -1.741547 1.092749
C -2.706461 -1.476137 -1.358318
C 2.090057 -0.152684 -0.120376
C 2.208148 -2.681737 -0.290554
C -1.972527 1.742978 1.072623
C 3.128759 0.196091 -1.190212
C -1.264484 2.594117 0.031581
C 3.635780 1.611763 -1.052105
C 0.126769 3.046817 0.344041
H -0.820821 0.124007 -0.644103
H 0.424247 -1.640565 1.539350
H -1.090196 -3.411238 0.894463
H -0.740380 -3.180865 -0.816592
H 0.952796 -1.396065 -1.498058
H -0.181310 0.785985 1.852013
H -1.682543 -0.016107 2.302656
H -2.716043 -1.809661 2.098430
H -3.841897 -0.895254 1.087250
H -3.732985 -2.651382 0.925677
H -3.329327 -0.576570 -1.439730
H -1.955121 -1.418184 -2.153449
H -3.343346 -2.340424 -1.573428
H 1.382870 0.708040 -0.018642
H 2.583020 -0.236935 0.866833
H 2.626464 -2.760797 0.718778
H 1.645706 -3.603328 -0.480432
H 3.045786 -2.658513 -0.994175
H -2.968366 1.447005 0.677611
H -2.177642 2.360043 1.968691
H 2.690574 0.074657 -2.205024
H 3.974470 -0.519560 -1.153185
H 4.528714 1.853252 -1.652306
H 0.262665 3.352496 1.386043
H 0.872140 2.243345 0.150005
H 0.434174 3.887868 -0.295399


%chk=000240198-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240198

0 1
O -1.833088 2.507728 -1.325843
O 3.277559 2.400859 -0.162067
C -2.144153 -1.584034 0.031719
C -0.983134 -0.504115 0.187162
C 0.064138 -1.671484 0.288245
C -1.024326 -2.655281 -0.267140
C 1.384821 -1.535733 -0.502355
C -1.033360 0.542489 1.314584
C -2.889067 -1.903969 1.344730
C -3.143397 -1.324569 -1.110127
C 2.142623 -0.256454 -0.068000
C 2.241401 -2.816254 -0.359748
C -1.945843 1.769450 0.992417
C 3.418921 0.045621 -0.872775
C -1.375976 2.611244 -0.152363
C 3.903450 1.479931 -0.743307
C -0.207908 3.539044 0.164125
H -0.856751 0.011229 -0.786757
H 0.297927 -1.895424 1.350278
H -1.135607 -3.629242 0.240653
H -0.897332 -2.832221 -1.352209
H 1.114040 -1.415854 -1.575752
H -0.008788 0.900423 1.537382
H -1.400471 0.074993 2.247979
H -2.191345 -2.139575 2.170318
H -3.528396 -1.060234 1.668489
H -3.543854 -2.784703 1.201853
H -3.809484 -0.472272 -0.877188
H -2.618659 -1.082690 -2.052483
H -3.778514 -2.214117 -1.289796
H 1.468526 0.612936 -0.172455
H 2.396594 -0.322488 1.009582
H 2.575429 -2.948022 0.688053
H 1.658032 -3.711919 -0.641935
H 3.141476 -2.790437 -1.001784
H -2.949997 1.415480 0.698355
H -2.039693 2.392916 1.902256
H 3.252294 -0.130507 -1.960317
H 4.262196 -0.623606 -0.603890
H 4.890643 1.692127 -1.230705
H -0.359559 4.067302 1.122471
H 0.736706 2.965657 0.256393
H -0.075773 4.267777 -0.651449


