%chk=000100801.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000100801

0 1
O -4.692403 -0.760513 -0.234005
O 5.001895 0.708516 -0.261590
C -0.820695 2.097613 0.670767
C -1.431963 0.795243 0.228828
C 0.379619 2.449342 -0.221265
C -0.560748 -0.227545 -0.237459
C 0.898098 -0.013285 -0.164399
C 1.373519 1.320839 -0.228331
C -2.819052 0.604992 0.246934
C 1.835717 -1.058936 -0.020079
C -1.108427 -1.387153 -0.797074
C 2.740900 1.603631 -0.272847
C -3.320858 -0.610829 -0.274899
C -2.491036 -1.594153 -0.816069
C 3.211959 -0.792695 -0.063120
C 3.640017 0.530489 -0.208484
C -3.768383 1.625091 0.782456
C 1.454674 -2.469491 0.213594
C 0.865456 -2.889300 1.331748
H -1.555776 2.925466 0.642455
H -0.499953 2.010374 1.730990
H 0.841858 3.393979 0.124066
H 0.037129 2.640583 -1.261850
H -0.460842 -2.145559 -1.237179
H 3.095091 2.624956 -0.345996
H -2.902462 -2.501895 -1.243791
H 3.946583 -1.589725 0.028383
H -3.730774 2.555747 0.200229
H -4.810901 1.267281 0.746150
H -3.549787 1.866601 1.831092
H 1.736624 -3.154476 -0.590583
H -4.974356 -1.625296 -0.617786
H 5.248990 1.660191 -0.357464
H 0.617132 -3.924248 1.518820
H 0.582654 -2.226636 2.140057


%chk=000100801-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100801

0 1
O -4.783315 -0.702786 -0.358221
O 5.075901 0.772432 -0.521832
C -0.804935 2.066729 0.802067
C -1.446128 0.775798 0.313310
C 0.354565 2.434689 -0.152785
C -0.562774 -0.252797 -0.148591
C 0.915298 -0.038791 -0.076333
C 1.378082 1.309792 -0.189951
C -2.858038 0.623885 0.257410
C 1.900364 -1.085406 0.030692
C -1.129456 -1.403592 -0.753542
C 2.750915 1.608597 -0.321159
C -3.377272 -0.568715 -0.311931
C -2.523087 -1.567638 -0.834439
C 3.271302 -0.768078 -0.161172
C 3.695292 0.559880 -0.350218
C -3.810055 1.690301 0.771915
C 1.658625 -2.498871 0.432730
C 0.697333 -2.987696 1.262903
H -1.540925 2.886583 0.844866
H -0.399628 1.936289 1.827129
H 0.838328 3.376161 0.166524
H -0.060532 2.609215 -1.167663
H -0.476226 -2.178018 -1.161745
H 3.072233 2.655241 -0.408685
H -2.943720 -2.465050 -1.306959
H 4.030881 -1.554725 -0.108942
H -3.768604 2.606135 0.150749
H -4.846133 1.320663 0.751784
H -3.566613 1.985328 1.808906
H 2.433856 -3.199650 0.087225
H -5.032127 -1.565473 -0.772816
H 5.269571 1.734595 -0.645156
H 0.690917 -4.046611 1.544209
H -0.094397 -2.359219 1.682020


