%chk=000218530.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218530

0 1
O -3.410969 1.699120 -0.247959
N -2.302359 -0.297363 -0.220249
C 0.110642 0.256639 0.195371
C 1.301729 1.010578 -0.429881
C 0.497090 -1.160872 0.661832
C -1.062088 0.251106 -0.814681
C 2.377487 1.360769 0.607623
C 0.892834 -2.114033 -0.473292
C 3.541216 2.122025 -0.023108
C 1.297786 -3.487146 0.058037
C -3.401471 0.516012 0.050407
H -0.225471 0.825664 1.100640
H 0.942889 1.943247 -0.909234
H 1.748187 0.407556 -1.243833
H 1.339592 -1.079432 1.379441
H -0.335820 -1.598105 1.243839
H -1.266215 1.295207 -1.161898
H -0.803431 -0.342882 -1.718155
H 2.752956 0.435160 1.088014
H 1.932414 1.966887 1.421251
H 0.055842 -2.223100 -1.190027
H 1.730679 -1.675282 -1.052449
H -2.264555 -1.262666 0.083959
H 4.304011 2.368401 0.724096
H 4.029789 1.536013 -0.809638
H 3.210219 3.064430 -0.474812
H 1.576720 -4.161111 -0.760036
H 0.483444 -3.965320 0.613213
H 2.158866 -3.421131 0.733232
H -4.251013 -0.003170 0.521796


%chk=000218530-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218530

0 1
O -3.319585 1.714253 0.294362
N -2.346983 -0.303940 -0.391802
C 0.066136 0.293215 0.150132
C 1.274820 1.060848 -0.451130
C 0.420068 -1.131651 0.661574
C -1.091060 0.287100 -0.889467
C 2.462344 1.254478 0.519897
C 0.996764 -2.107724 -0.392484
C 3.569191 2.152796 -0.073641
C 1.292244 -3.501773 0.203581
C -3.354765 0.457906 0.165826
H -0.297292 0.874927 1.023400
H 0.924443 2.062025 -0.778558
H 1.633760 0.547027 -1.367585
H 1.146647 -1.042714 1.493697
H -0.488559 -1.583644 1.111929
H -1.322257 1.329355 -1.172760
H -0.785348 -0.255137 -1.804509
H 2.896324 0.271134 0.788800
H 2.089838 1.700921 1.464527
H 0.290502 -2.217668 -1.240777
H 1.928964 -1.689781 -0.820721
H -2.466660 -1.317841 -0.428094
H 4.411853 2.275894 0.631279
H 3.972150 1.721519 -1.009821
H 3.176934 3.159538 -0.311217
H 1.703185 -4.190461 -0.557334
H 0.374079 -3.961736 0.616333
H 2.027223 -3.431004 1.027397
H -4.223959 -0.160661 0.490668


