%chk=000297948.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297948

0 1
O -3.067499 -2.544604 2.176411
N -1.068725 1.189126 1.236949
N 3.998120 0.887873 -2.171609
N -2.499497 -1.359916 0.301363
C 2.254260 1.549881 -0.603983
C 0.411509 1.041119 0.989180
C 0.736972 1.610487 -0.422489
C 2.690114 0.126148 -0.394312
C 0.838310 -0.423647 1.122874
C 2.103320 -0.798488 0.455928
C 2.865050 1.879980 -1.997706
C -1.469992 0.510604 2.514702
C -1.225283 -1.005919 2.409913
C 3.725232 -0.216328 -1.299747
C 0.095660 -1.326472 1.782633
C 2.713864 -2.072608 0.525712
C -1.474095 2.626784 1.299069
C 4.316305 -1.475080 -1.237526
C -2.362576 -1.702886 1.637920
C 3.806559 -2.379363 -0.286339
C -3.652786 -1.843615 -0.492299
C -4.788650 -0.811020 -0.569866
C -4.399914 0.443228 -1.362731
C -5.581228 1.398038 -1.520336
H 2.744162 2.209084 0.156459
H 1.009099 1.617135 1.749954
H 0.361855 2.644532 -0.525505
H 0.214496 1.014533 -1.194840
H 2.113920 1.808814 -2.805348
H 3.301621 2.896923 -2.021729
H -2.551606 0.705904 2.689618
H -0.926757 0.905286 3.401152
H -1.248328 -1.436245 3.449596
H 0.405972 -2.368315 1.884322
H 4.183876 0.639743 -3.140926
H 2.321531 -2.823065 1.207775
H -1.032120 3.196221 2.130100
H -2.572300 2.682063 1.383071
H -1.200329 3.127907 0.354820
H 5.133396 -1.757142 -1.891426
H 4.268855 -3.363925 -0.204703
H -1.991606 -0.551370 -0.069986
H -3.285493 -2.104449 -1.509223
H -4.037039 -2.786894 -0.030729
H -5.105563 -0.528001 0.453735
H -5.674806 -1.289960 -1.030874
H -4.016150 0.155433 -2.360818
H -3.564475 0.965361 -0.853391
H -5.971442 1.721012 -0.548405
H -5.292878 2.297663 -2.074910
H -6.409724 0.929528 -2.064100


%chk=000297948-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297948

0 1
O -2.861653 -2.872623 1.840063
N -1.049169 1.110666 1.098740
N 4.230746 0.863510 -2.025983
N -2.683809 -1.104669 0.309355
C 2.306111 1.448186 -0.749845
C 0.414330 0.964832 0.815115
C 0.772479 1.451272 -0.626289
C 2.834210 0.079089 -0.380383
C 0.901426 -0.483411 1.061076
C 2.229625 -0.837982 0.488782
C 2.985164 1.687232 -2.133613
C -1.410582 0.459908 2.396752
C -1.235678 -1.067410 2.302204
C 3.998735 -0.205198 -1.132849
C 0.129047 -1.387610 1.731630
C 2.925626 -2.071997 0.699048
C -1.499870 2.525300 1.093593
C 4.689638 -1.417385 -0.927165
C -2.348790 -1.771254 1.467444
C 4.133044 -2.328414 0.015536
C -3.699863 -1.604490 -0.627782
C -4.996425 -0.759134 -0.633957
C -4.796085 0.689231 -1.136428
C -6.105596 1.507514 -1.137562
H 2.715919 2.198425 -0.037354
H 0.984629 1.626917 1.523288
H 0.369296 2.464295 -0.800905
H 0.319288 0.765902 -1.367477
H 2.329056 1.322462 -2.956901
H 3.225696 2.748403 -2.315073
H -2.461289 0.712781 2.625816
H -0.776626 0.852062 3.227742
H -1.324684 -1.508025 3.312503
H 0.473944 -2.420641 1.855111
H 4.832473 0.744351 -2.841101
H 2.530655 -2.827035 1.385691
H -0.938844 3.155048 1.825569
H -2.570660 2.560215 1.359342
H -1.390169 2.974129 0.093610
H 5.602952 -1.670459 -1.475891
H 4.652334 -3.277115 0.195886
H -2.179510 -0.208335 0.151014
H -3.269762 -1.629251 -1.649849
H -3.926614 -2.642420 -0.325841
H -5.420898 -0.746957 0.389340
H -5.739395 -1.267514 -1.282644
H -4.372955 0.662278 -2.162170
H -4.044283 1.200008 -0.500389
H -6.528900 1.577706 -0.117893
H -5.942614 2.536288 -1.508754
H -6.868502 1.032415 -1.782752


