%chk=000216898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216898

0 1
O -1.406902 -0.809948 1.857518
O 0.409652 1.351745 -1.257564
N -4.169950 0.306090 -0.083753
N -1.392496 0.659235 0.090058
N 1.784697 1.177135 -1.364422
C -6.577909 -0.217299 0.020540
C -5.834774 -1.472679 -0.472129
C -5.536909 0.922541 0.009707
C -4.383450 -1.025882 -0.747677
C -3.531366 0.162290 1.258803
C -2.031334 -0.079634 1.118406
C -0.023632 0.574806 -0.156679
C 1.051134 -0.069469 0.408050
C 2.190061 0.340536 -0.390688
C 3.583889 -0.072825 -0.198596
C 4.038464 -0.427014 1.083176
C 4.467410 -0.115942 -1.290666
C 5.364787 -0.824476 1.265605
C 5.792161 -0.515728 -1.098896
C 6.242002 -0.870899 0.176707
H -7.436165 0.023704 -0.628155
H -6.988950 -0.372617 1.031981
H -5.867830 -2.274997 0.284037
H -6.300851 -1.886891 -1.381433
H -5.653238 1.554436 -0.898438
H -5.638979 1.592537 0.881402
H -3.643715 -1.779738 -0.422237
H -4.219723 -0.861940 -1.835226
H -3.674640 1.099424 1.847324
H -3.957808 -0.659914 1.880647
H -1.958868 1.216448 -0.567471
H 1.051074 -0.741538 1.246625
H 3.358871 -0.386743 1.934272
H 4.117194 0.166296 -2.285259
H 5.715983 -1.098203 2.259308
H 6.475107 -0.548897 -1.946483
H 7.274903 -1.182349 0.322904


%chk=000216898-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216898

0 1
O -1.367157 -0.699539 2.256385
O 0.230801 0.605172 -1.521939
N -4.068650 0.166352 -0.106692
N -1.450046 0.157104 0.062279
N 1.697417 0.542189 -1.657077
C -6.503146 0.165834 0.089099
C -6.052807 -1.256800 -0.385021
C -5.259266 1.070133 -0.179514
C -4.546806 -1.086475 -0.783738
C -3.545317 -0.073126 1.266489
C -2.012782 -0.257674 1.264912
C -0.100245 0.159364 -0.235635
C 1.044471 -0.186734 0.462701
C 2.130108 0.065941 -0.452878
C 3.576141 -0.130668 -0.218557
C 4.044616 -0.615077 1.031528
C 4.519308 0.163270 -1.241947
C 5.425667 -0.801889 1.254336
C 5.897234 -0.024200 -1.016009
C 6.357574 -0.507555 0.232782
H -7.394317 0.526461 -0.452625
H -6.749613 0.157198 1.165821
H -6.169816 -1.997905 0.424699
H -6.646977 -1.613135 -1.243983
H -5.307348 1.488964 -1.202125
H -5.155904 1.910512 0.526722
H -3.916485 -1.944295 -0.494878
H -4.451890 -0.948180 -1.876312
H -3.760801 0.804883 1.904299
H -3.984056 -0.956400 1.774848
H -2.175867 0.464113 -0.620343
H 1.076684 -0.563658 1.478976
H 3.333273 -0.846244 1.831563
H 4.156548 0.536562 -2.205017
H 5.773602 -1.176266 2.223408
H 6.614163 0.205948 -1.811899
H 7.429590 -0.652580 0.406639


