%chk=000281152.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281152

0 1
O 0.722655 0.666950 -1.718787
O 3.307868 1.164863 0.796494
O -0.440021 -1.214211 -2.243605
O 3.978249 0.155493 -1.123042
N 0.537044 -2.221141 0.438141
N -3.667227 0.342057 -0.793617
N 1.414422 -2.482681 1.448920
N 2.440953 -1.685258 1.361523
C -1.853824 -2.267921 1.142940
C -2.400934 -1.045613 0.504310
C -0.756347 -2.925382 0.285848
C -1.923850 0.303975 0.695588
C -2.731641 1.154462 -0.132725
C -3.453432 -0.993449 -0.400541
C -0.902094 0.881325 1.474762
C 1.038195 -1.170929 -0.344125
C -2.530178 2.549117 -0.196552
C -0.706411 2.249134 1.408176
C 2.266289 -0.837292 0.261769
C -1.513807 3.074507 0.580232
C 0.341863 -0.631101 -1.526771
C 3.275384 0.164921 -0.143063
C 0.073699 1.382199 -2.809883
C 4.276777 2.226031 0.566918
H -1.463443 -2.032563 2.158782
H -2.663037 -3.011477 1.312723
H -1.041808 -2.911240 -0.799287
H -0.613816 -3.990613 0.586711
H -4.053243 -1.796351 -0.791532
H -4.361544 0.652653 -1.443373
H -0.281271 0.253080 2.111471
H -3.155415 3.175805 -0.822217
H 0.084149 2.714463 1.995184
H -1.318216 4.146328 0.567019
H -0.097783 0.721077 -3.666207
H 0.799183 2.170554 -3.040425
H -0.866440 1.788078 -2.419332
H 4.046334 2.736871 -0.372806
H 5.286606 1.803608 0.545517
H 4.122614 2.872970 1.437360


%chk=000281152-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281152

0 1
O 0.572709 0.510256 -2.075434
O 3.534456 1.265082 0.892466
O -0.049840 -1.697780 -2.503186
O 3.457288 0.599560 -1.342013
N 0.480744 -2.039568 0.454583
N -3.554478 0.540404 -0.801530
N 1.187869 -2.050269 1.672746
N 2.155964 -1.114110 1.574345
C -1.959347 -2.329068 1.010757
C -2.437700 -1.010205 0.456409
C -0.698595 -2.911322 0.306010
C -2.008579 0.319838 0.866665
C -2.728028 1.272571 0.061308
C -3.380562 -0.829105 -0.556837
C -1.092235 0.797985 1.842256
C 0.995132 -1.080788 -0.395357
C -2.560722 2.667745 0.205005
C -0.918933 2.186883 1.988201
C 2.064414 -0.500925 0.322957
C -1.644187 3.112033 1.179267
C 0.454673 -0.825554 -1.749771
C 3.061923 0.485244 -0.156909
C 0.173107 0.878653 -3.454048
C 4.597547 2.231839 0.528659
H -1.738443 -2.236606 2.090316
H -2.750230 -3.096698 0.910305
H -0.873552 -3.049872 -0.772322
H -0.433221 -3.880688 0.761054
H -3.939657 -1.574773 -1.119952
H -4.207095 0.939240 -1.472370
H -0.527668 0.103177 2.474220
H -3.118644 3.382260 -0.410976
H -0.210239 2.567229 2.731653
H -1.485882 4.187252 1.319230
H 0.844579 0.389621 -4.179179
H 0.280904 1.970789 -3.488812
H -0.867889 0.568321 -3.644404
H 4.225472 2.941573 -0.229406
H 5.476033 1.699395 0.126550
H 4.839415 2.743683 1.470041


