%chk=000231224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231224

0 1
O 1.430401 -1.538399 1.710664
O 2.719987 1.884389 0.221688
O -3.114988 -1.991906 -0.698655
O -1.129513 2.927643 0.201682
O 4.069061 0.188704 -0.557246
N 1.276533 -1.577243 -2.040579
N -0.361388 -1.684118 0.268570
N -3.807862 2.671916 0.223393
N 4.842704 1.773675 0.958572
C 1.871429 -1.670254 -0.672332
C 1.013765 -1.037916 0.434694
C 1.079310 -2.841463 -1.265165
C -0.284348 -2.921428 -0.570081
C 0.739579 0.503935 0.487275
C -1.280185 -0.672164 0.029316
C -0.745656 0.582009 0.219795
C 1.542386 1.365196 -0.480686
C -2.738792 -0.894537 -0.340575
C -1.536891 1.780799 0.172540
C 2.711757 -1.073782 2.180653
C -3.578048 0.300796 -0.239449
C -3.053010 1.538624 0.027260
C -5.042335 0.084438 -0.442409
C 3.899886 1.187367 0.116279
H 2.954753 -1.659378 -0.508864
H 1.524323 -3.786941 -1.571092
H 1.959886 -1.634735 -2.799637
H -1.136728 -2.985390 -1.283825
H -0.331847 -3.802267 0.108008
H 0.944900 0.856663 1.534987
H 1.014010 2.316819 -0.714063
H 1.849834 0.849875 -1.405351
H 2.680367 0.003365 2.376506
H 3.506785 -1.325306 1.470285
H 2.828100 -1.636293 3.116059
H -5.612321 0.295007 0.472443
H -5.255425 -0.965061 -0.713584
H -5.439887 0.703388 -1.256593
H -4.790067 2.675951 0.013089
H -3.341368 3.571203 0.259514
H 4.652087 2.682628 1.359828
H 5.818214 1.558089 0.800189


%chk=000231224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231224

0 1
O 1.212001 -1.602738 1.955979
O 2.870112 1.577294 0.336702
O -3.086260 -2.082066 -0.710057
O -1.342507 2.964382 0.757904
O 3.821089 0.692727 -1.647726
N 1.452621 -1.332884 -1.823877
N -0.340004 -1.596284 0.169708
N -3.904019 2.631767 0.118217
N 5.123200 1.544899 0.104968
C 1.940554 -1.543404 -0.403670
C 0.951039 -1.001135 0.630468
C 1.265514 -2.681402 -1.148694
C -0.158823 -2.846030 -0.606613
C 0.663483 0.543526 0.741361
C -1.310010 -0.635409 0.073786
C -0.828712 0.621937 0.439278
C 1.477890 1.456945 -0.192942
C -2.731028 -0.897264 -0.359997
C -1.689470 1.757821 0.458897
C 2.521530 -1.264157 2.534164
C -3.628701 0.246346 -0.341146
C -3.143540 1.496261 0.057264
C -5.072480 0.048774 -0.750843
C 3.931734 1.227976 -0.514430
H 3.012659 -1.539374 -0.198410
H 1.823775 -3.558298 -1.488199
H 2.258970 -1.301963 -2.474359
H -0.937017 -2.916407 -1.380981
H -0.226504 -3.729440 0.053884
H 0.858990 0.858196 1.784260
H 1.059260 2.475414 -0.161331
H 1.507651 1.069157 -1.223613
H 2.749825 -0.184575 2.435983
H 3.338365 -1.851351 2.069415
H 2.446986 -1.532230 3.599575
H -5.773979 0.287420 0.073909
H -5.228958 -1.005104 -1.031652
H -5.347885 0.676900 -1.622003
H -4.890080 2.643449 -0.127468
H -3.413944 3.485424 0.408250
H 5.124006 2.033683 0.997088
H 5.992064 1.365112 -0.389943


