%chk=000224867.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224867

0 1
O 1.568908 -2.921335 1.535329
O -1.354563 0.482268 -1.650074
N 3.513240 0.125782 -0.329664
N -3.551239 -0.067383 -0.099339
C 3.319961 0.903990 0.939384
C 4.967378 0.049929 -0.697785
C -3.379572 0.785106 1.124736
C -4.999924 -0.211759 -0.464469
C 3.856359 2.333756 0.761603
C 5.525778 1.468576 -0.900951
C -3.952802 2.186200 0.861062
C -5.598131 1.175777 -0.750390
C 5.336236 2.322525 0.358891
C -5.429254 2.111545 0.453029
C 2.950560 -1.259953 -0.191005
C -2.904214 -1.411384 0.080467
C 1.446000 -1.224579 -0.115321
C -1.401709 -1.292670 0.038520
C 0.760431 -2.102316 0.763535
C -0.729276 -0.405794 -0.823510
C 0.681982 -0.376844 -0.904739
C -0.629015 -2.144699 0.847705
H 3.802774 0.421852 1.815998
H 2.227816 0.939263 1.148572
H 5.046969 -0.517595 -1.650240
H 5.575731 -0.490965 0.058401
H -2.289280 0.857106 1.338861
H -3.857487 0.338436 2.022167
H -5.588368 -0.723070 0.327155
H -5.064940 -0.840943 -1.378686
H 3.712022 2.904153 1.696202
H 3.262591 2.851703 -0.018630
H 5.004765 1.946914 -1.754995
H 6.594038 1.412141 -1.175505
H -3.366912 2.681164 0.059977
H -3.830960 2.812677 1.763535
H -5.101483 1.617544 -1.637743
H -6.666776 1.071572 -1.012884
H 5.690214 3.353697 0.177295
H 5.953586 1.924860 1.186008
H -6.041786 1.754769 1.302509
H -5.806827 3.121059 0.205124
H 3.363967 -1.815273 0.684555
H 3.235031 -1.845493 -1.097755
H -3.220574 -2.070753 -0.763914
H -3.231019 -1.921282 1.013644
H 1.162439 0.329777 -1.588580
H -1.116226 -2.834879 1.529911
H 1.034407 -3.501706 2.124509
H -2.360245 0.545133 -1.441604


%chk=000224867-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224867

0 1
O 1.521093 -3.191304 1.529992
O -1.393647 0.674758 -1.359695
N 3.564259 0.098577 -0.191539
N -3.560162 -0.055786 -0.128145
C 3.453317 1.016268 0.971163
C 4.960784 0.010169 -0.684525
C -3.514576 0.667678 1.180925
C -4.947290 -0.117198 -0.673930
C 3.933173 2.435752 0.607095
C 5.484860 1.397831 -1.106456
C -4.050646 2.104104 1.029701
C -5.529829 1.297272 -0.865252
C 5.380450 2.402231 0.064317
C -5.486458 2.100494 0.455691
C 2.981621 -1.234288 0.093197
C -2.919061 -1.412569 -0.048918
C 1.456411 -1.233367 0.105502
C -1.404787 -1.316485 0.074012
C 0.746515 -2.234643 0.820626
C -0.699717 -0.298959 -0.638638
C 0.714198 -0.274485 -0.615032
C -0.664474 -2.269999 0.808804
H 4.058704 0.632957 1.836706
H 2.397134 1.039533 1.294511
H 4.981856 -0.682048 -1.547701
H 5.644572 -0.414266 0.099858
H -2.466059 0.675031 1.527242
H -4.119722 0.113720 1.938585
H -5.604466 -0.705444 0.012068
H -4.910653 -0.650753 -1.641808
H 3.865882 3.086897 1.500314
H 3.256930 2.853427 -0.163805
H 4.878801 1.760420 -1.959289
H 6.533089 1.306866 -1.451836
H -3.377437 2.668711 0.355576
H -4.024267 2.605597 2.015564
H -4.939951 1.826098 -1.639197
H -6.567692 1.214176 -1.239880
H 5.698632 3.411290 -0.260297
H 6.070011 2.090532 0.876786
H -6.176993 1.638676 1.191823
H -5.839072 3.135272 0.288136
H 3.351429 -1.661746 1.055903
H 3.325990 -1.929025 -0.699771
H -3.180737 -1.933340 -0.992980
H -3.346769 -2.010986 0.787604
H 1.253748 0.503880 -1.162540
H -1.200109 -3.054707 1.363356
H 0.928907 -3.820696 2.010491
H -2.397189 0.582477 -1.053417


