%chk=000199349.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199349

0 1
O 3.156379 0.234807 -2.008924
N -1.116309 -0.098541 -0.907724
C 1.296724 -0.667882 -0.689269
C 2.736783 -0.065846 -0.654341
C 0.274102 0.360899 -1.234022
C -2.107730 0.499315 -1.860532
C -1.458509 0.218324 0.520834
C 1.276343 -1.943065 -1.532869
C 3.751431 -1.088116 -0.153386
C 2.853273 1.215474 0.169220
C -3.493355 -0.109387 -1.585727
C -3.867193 0.035738 -0.136825
C -2.930984 0.180325 0.811064
C 3.711800 -1.522951 1.179553
C 3.777960 2.192024 -0.229864
C 4.723987 -1.601954 -1.022242
C 2.090197 1.422163 1.326336
C -5.313078 -0.005839 0.178070
C 4.636789 -2.466179 1.635028
C 3.924135 3.368451 0.508704
C 5.648177 -2.543630 -0.561676
C 2.239244 2.599596 2.065412
C 5.605824 -2.978578 0.766413
C 3.153086 3.575740 1.657118
C -5.944095 1.116484 0.737212
C -6.059535 -1.165440 -0.084250
C -7.310264 1.077366 1.028276
C -7.424443 -1.199156 0.212080
C -8.052160 -0.078946 0.766883
H 1.015105 -0.937759 0.359506
H 0.492469 1.377473 -0.839365
H 0.381247 0.422658 -2.339371
H -1.790157 0.244828 -2.894697
H -2.162313 1.606896 -1.793220
H -1.057037 1.205762 0.850399
H -0.950060 -0.563935 1.135806
H 0.244521 -2.292620 -1.676664
H 1.721611 -1.780480 -2.521841
H 1.838937 -2.752459 -1.053310
H -3.484661 -1.190865 -1.844971
H -4.249065 0.363245 -2.242101
H -3.186960 0.273514 1.865273
H 2.509671 0.822091 -2.444945
H 2.968596 -1.124184 1.867047
H 4.389191 2.017508 -1.119005
H 4.753646 -1.260023 -2.060105
H 1.378709 0.667589 1.659126
H 4.603100 -2.800664 2.670119
H 4.644061 4.121514 0.192376
H 6.402025 -2.938180 -1.240456
H 1.643898 2.754240 2.963472
H 6.325151 -3.712226 1.123808
H 3.267931 4.491472 2.233742
H -5.367182 2.016744 0.940416
H -5.571356 -2.039596 -0.511551
H -7.797448 1.949811 1.460254
H -8.000373 -2.100921 0.010942
H -9.115435 -0.107627 0.995265


%chk=000199349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199349

0 1
O 3.055805 0.172865 -2.074928
N -1.150925 0.005903 -0.884332
C 1.278546 -0.616543 -0.527443
C 2.741050 -0.043149 -0.636672
C 0.255518 0.336546 -1.210110
C -2.121324 0.525566 -1.876477
C -1.529086 0.386032 0.494295
C 1.158237 -2.029487 -1.137559
C 3.763409 -1.083919 -0.136214
C 2.953657 1.291468 0.121013
C -3.511233 -0.096973 -1.649806
C -3.957257 0.050157 -0.198055
C -3.013241 0.278330 0.761180
C 3.849266 -1.382312 1.246996
C 4.029018 2.127369 -0.282809
C 4.604491 -1.773834 -1.041116
C 2.170858 1.695305 1.232353
C -5.408979 -0.074849 0.119125
C 4.752562 -2.360179 1.716787
C 4.304973 3.334746 0.393263
C 5.514067 -2.748202 -0.570076
C 2.446106 2.903688 1.912149
C 5.590348 -3.049068 0.808690
C 3.512266 3.731092 1.495354
C -5.977431 0.505190 1.290471
C -6.281709 -0.778624 -0.758644
C -7.349743 0.368766 1.581172
C -7.656768 -0.917043 -0.469129
C -8.199975 -0.346536 0.703920
H 1.040719 -0.693268 0.551490
H 0.488866 1.402268 -0.954858
H 0.371747 0.222772 -2.305798
H -1.755556 0.265092 -2.886721
H -2.207202 1.642293 -1.828902
H -1.199414 1.437174 0.730323
H -0.992899 -0.268792 1.210722
H 0.091376 -2.310696 -1.178773
H 1.569703 -2.040929 -2.163404
H 1.702063 -2.782902 -0.543242
H -3.475043 -1.169180 -1.928246
H -4.242298 0.390177 -2.324364
H -3.303270 0.366430 1.816151
H 2.558516 0.975170 -2.375351
H 3.224815 -0.838015 1.965137
H 4.654635 1.810758 -1.124083
H 4.539352 -1.536035 -2.105754
H 1.337300 1.076179 1.581237
H 4.808962 -2.577816 2.789505
H 5.141788 3.962200 0.065732
H 6.161309 -3.273921 -1.281621
H 1.826211 3.197234 2.767059
H 6.294861 -3.805613 1.172516
H 3.724685 4.667717 2.022752
H -5.344178 1.091793 1.965585
H -5.881243 -1.238179 -1.668701
H -7.761276 0.831106 2.485810
H -8.303076 -1.471633 -1.159019
H -9.267556 -0.448684 0.927924


