%chk=000289284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289284

0 1
O 3.042664 -3.012164 -0.329335
N 1.221011 0.541885 -0.969591
N -2.046032 -1.389495 -0.531500
C 0.381326 -0.703653 -1.077118
C 2.451159 0.525886 -0.295562
C -1.020867 -0.424025 -0.599079
C 0.470326 1.810453 -1.192749
C 0.947822 -1.898438 -0.303642
C 3.108676 -0.648869 -0.047416
C -1.512145 0.804218 -0.170379
C -0.665880 2.021902 -0.171275
C 3.059899 1.860880 0.069222
C 4.535875 -0.702406 0.421092
C 2.471759 -1.941724 -0.259135
C 4.587487 1.799535 0.198879
C 5.005638 0.607145 1.064242
C -2.890456 0.625545 0.196238
C -3.201373 -0.759808 -0.036521
C -3.894852 1.477856 0.692895
C -4.483718 -1.288796 0.218441
C -5.150756 0.953190 0.941373
C -5.440631 -0.417669 0.705902
H 0.358453 -0.949280 -2.178414
H 0.039727 1.756970 -2.221746
H 1.169360 2.676238 -1.192922
H 0.569632 -2.846127 -0.734473
H 0.598132 -1.892559 0.752738
H -1.255923 2.921977 -0.434442
H -0.258259 2.206013 0.844477
H 2.789414 2.648601 -0.667609
H 2.616223 2.180107 1.038494
H 4.663706 -1.543583 1.134882
H 5.179772 -0.955570 -0.448942
H 5.045527 1.711194 -0.806452
H 4.964451 2.744823 0.630986
H 4.576635 0.704440 2.079844
H 6.103345 0.592503 1.195269
H -1.954529 -2.358238 -0.764143
H -3.672474 2.526610 0.873927
H -4.701776 -2.335843 0.038026
H -5.943280 1.591981 1.326008
H -6.445971 -0.780006 0.919110


%chk=000289284-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289284

0 1
O 2.947996 -3.027601 0.469244
N 1.148846 0.685935 -0.178408
N -2.059318 -1.314983 -0.558720
C 0.392147 -0.568004 -0.484286
C 2.541085 0.575010 -0.111196
C -1.084694 -0.330746 -0.328169
C 0.449437 1.978321 -0.394695
C 0.897478 -1.704805 0.430946
C 3.182353 -0.665102 0.037615
C -1.698139 0.838595 0.107214
C -0.877669 2.065584 0.398605
C 3.347841 1.871069 -0.189828
C 4.699863 -0.801869 0.066203
C 2.413909 -1.880227 0.290922
C 4.860404 1.655799 -0.427910
C 5.408443 0.511663 0.445291
C -3.124361 0.584844 0.158040
C -3.323025 -0.779313 -0.267885
C -4.255987 1.365225 0.512113
C -4.603054 -1.367171 -0.345077
C -5.537001 0.782834 0.437378
C -5.708790 -0.568074 0.014193
H 0.633555 -0.858907 -1.537542
H 0.224858 2.110896 -1.475924
H 1.111451 2.798378 -0.082753
H 0.407231 -2.662559 0.182808
H 0.654586 -1.466280 1.485633
H -1.409179 2.987611 0.092130
H -0.659678 2.161921 1.481034
H 2.952293 2.515738 -0.997875
H 3.203235 2.433523 0.756990
H 4.954771 -1.617193 0.767351
H 5.064073 -1.143247 -0.925487
H 5.032344 1.405297 -1.493625
H 5.392395 2.605637 -0.229631
H 5.233120 0.741700 1.515587
H 6.501506 0.410605 0.307375
H -1.879013 -2.268030 -0.867069
H -4.137649 2.403664 0.841868
H -4.741664 -2.404621 -0.669398
H -6.419135 1.373252 0.708931
H -6.717766 -0.992670 -0.032394


