%chk=000220582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220582

0 1
O 4.631130 1.708949 0.859419
O 4.790946 -0.438269 1.057211
N -3.552093 -0.363519 -0.609217
N 4.181124 0.577688 0.761692
C -4.555491 -0.766971 0.423804
C -2.200857 -0.068501 -0.049768
C -1.200724 -0.006304 -1.222740
C 0.201177 0.147205 -0.711550
C -5.829260 -1.202772 -0.313104
C -4.872175 0.341656 1.442135
C 0.770357 1.426293 -0.577481
C 0.949655 -0.989403 -0.355179
C 2.069666 1.572757 -0.097973
C 2.249393 -0.855416 0.125409
C 2.805240 0.428703 0.252656
H -4.132414 -1.650984 0.971128
H -2.159413 0.876520 0.533483
H -1.911020 -0.887959 0.645340
H -1.468529 0.819807 -1.912097
H -1.302953 -0.928964 -1.837463
H -3.893220 0.438742 -1.147381
H -6.546082 -1.659401 0.376812
H -6.332590 -0.364743 -0.805919
H -5.596066 -1.943718 -1.089944
H -3.992834 0.617380 2.031899
H -5.644049 0.016081 2.148689
H -5.246238 1.249564 0.958564
H 0.193589 2.309897 -0.850459
H 0.509365 -1.982226 -0.456698
H 2.524090 2.563898 0.009156
H 2.842376 -1.733492 0.404374


%chk=000220582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220582

0 1
O 4.607928 1.879599 0.977919
O 4.934375 -0.377777 1.012170
N -3.571882 -0.395824 -0.568864
N 4.208900 0.666236 0.779537
C -4.621982 -0.727151 0.431542
C -2.213835 -0.143964 -0.057816
C -1.190480 -0.144298 -1.230817
C 0.229864 0.068462 -0.743551
C -5.909553 -1.124024 -0.318973
C -4.900849 0.402276 1.462446
C 0.726255 1.378384 -0.500596
C 1.077309 -1.039342 -0.471146
C 2.026373 1.586403 -0.002900
C 2.381360 -0.856709 0.027355
C 2.838403 0.460048 0.256165
H -4.254057 -1.615711 0.985184
H -2.103440 0.813063 0.509303
H -1.957163 -0.959026 0.647113
H -1.474189 0.656426 -1.942464
H -1.291513 -1.106565 -1.762979
H -3.887386 0.343886 -1.213702
H -6.698908 -1.435167 0.388448
H -6.301800 -0.268494 -0.903899
H -5.707503 -1.954579 -1.016745
H -3.981995 0.691119 2.004701
H -5.646242 0.076072 2.211516
H -5.299614 1.302231 0.954983
H 0.087239 2.243148 -0.713709
H 0.708534 -2.054395 -0.657584
H 2.422878 2.587719 0.184721
H 3.045073 -1.699548 0.237439


