%chk=000202722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202722

0 1
O 1.099752 -2.189097 1.313930
N 2.349629 -0.080692 -1.307619
N 0.038268 -1.511793 -0.590501
C -1.311532 -1.904652 -0.105883
C -2.216486 -0.665502 0.073632
C 2.512703 -1.234472 -0.374125
C 1.161779 -1.659939 0.209149
C -1.934642 -2.878032 -1.114528
C 2.582148 1.232220 -0.615769
C 3.241351 -0.232221 -2.507877
C -1.794841 0.293173 1.153789
C 1.527994 1.481870 0.458171
C 2.748102 0.668807 -3.640530
C -1.039198 -0.111863 2.263259
C -2.210007 1.633553 1.058534
C -0.706086 0.807495 3.261505
C -1.875199 2.548046 2.059443
C -1.123191 2.138268 3.165145
H -1.187030 -2.426608 0.886823
H -2.304817 -0.129766 -0.894205
H -3.247649 -1.012790 0.307281
H 3.197102 -1.025398 0.480657
H 2.940053 -2.123822 -0.890589
H 0.092771 -0.961390 -1.447686
H -2.899302 -3.254449 -0.757155
H -1.283887 -3.748801 -1.270154
H -2.099077 -2.418855 -2.094797
H 3.600356 1.304931 -0.174416
H 2.511089 2.029898 -1.390669
H 4.307329 -0.013091 -2.281411
H 3.197575 -1.292751 -2.844349
H 0.508797 1.350108 0.066863
H 1.622280 0.798581 1.312188
H 1.597661 2.502288 0.849602
H 1.676415 0.518190 -3.826859
H 2.885458 1.731957 -3.410737
H 3.284098 0.455955 -4.571540
H -0.684352 -1.145275 2.346003
H -2.796691 1.963710 0.204655
H -0.116736 0.480755 4.117448
H -2.202217 3.582935 1.978329
H -0.865070 2.850221 3.944895


%chk=000202722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202722

0 1
O 1.220814 -2.497658 1.166804
N 2.413290 0.099558 -1.187673
N 0.146078 -1.155731 -0.430098
C -1.191763 -1.754257 -0.311085
C -2.252194 -0.694233 0.094140
C 2.488249 -0.694873 0.065735
C 1.229860 -1.553891 0.313090
C -1.598074 -2.463248 -1.623387
C 3.055444 1.441638 -1.077600
C 2.884481 -0.694645 -2.362208
C -1.967979 0.099594 1.366850
C 2.216821 2.437494 -0.254833
C 2.349956 -0.171822 -3.708237
C -1.248009 -0.448383 2.460756
C -2.478387 1.418416 1.490335
C -1.055323 0.301057 3.643691
C -2.288801 2.169479 2.671925
C -1.575780 1.610738 3.757730
H -1.101494 -2.516047 0.485846
H -2.394719 0.010538 -0.750925
H -3.218506 -1.229383 0.205941
H 2.574038 -0.014861 0.932910
H 3.369471 -1.371963 0.103358
H 0.345271 -0.366397 -1.065583
H -2.591184 -2.938089 -1.520256
H -0.864517 -3.246415 -1.881296
H -1.649994 -1.745024 -2.464326
H 4.083070 1.359820 -0.646010
H 3.175300 1.840895 -2.100572
H 4.000838 -0.743757 -2.388929
H 2.525892 -1.730988 -2.217815
H 1.225560 2.581966 -0.719264
H 2.054087 2.090407 0.781448
H 2.727594 3.416868 -0.202582
H 1.245176 -0.169074 -3.709950
H 2.694942 0.854609 -3.926418
H 2.697637 -0.821482 -4.532428
H -0.817462 -1.453833 2.393102
H -3.031661 1.860818 0.651421
H -0.493967 -0.140250 4.475212
H -2.693753 3.185623 2.744237
H -1.425600 2.188487 4.676847


