%chk=000217820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217820

0 1
O 1.171868 -1.964560 -0.049506
O 2.246332 1.986402 0.212740
N 0.330549 0.202483 0.047858
N 2.716257 -0.279608 0.103172
N -3.839721 -0.529894 -0.091266
N 4.446243 1.415592 0.226652
C -1.063605 -0.099923 -0.002011
C -1.951456 0.993186 0.028888
C -3.333882 0.737603 -0.017731
C 1.345900 -0.761878 0.024754
C -1.573461 -1.406287 -0.077841
C 3.765210 -1.332874 0.024476
C -2.963771 -1.567945 -0.119946
C -4.318865 1.858806 0.011735
C 3.089788 1.091377 0.193166
H 0.586552 1.217665 0.103552
H -1.590567 2.015999 0.086922
H -0.911817 -2.275756 -0.104331
H 3.295350 -2.335044 -0.095943
H 4.357830 -1.366684 0.952031
H 4.417499 -1.176061 -0.849800
H -3.410652 -2.568565 -0.179462
H -4.179181 2.536403 -0.842281
H -5.358667 1.492081 -0.030725
H -4.221881 2.452594 0.931456
H 5.176544 0.745920 0.388073
H 4.684903 2.388365 0.379268


%chk=000217820-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217820

0 1
O 1.226395 -2.101647 -0.055860
O 2.099937 2.000585 0.229697
N 0.350738 0.084189 0.056470
N 2.713421 -0.287545 0.096653
N -3.873466 -0.492467 -0.109291
N 4.335952 1.437138 0.261807
C -1.039223 -0.174575 -0.001363
C -1.909747 0.946325 0.039471
C -3.310351 0.756532 -0.016349
C 1.366586 -0.848410 0.027654
C -1.615184 -1.470022 -0.097696
C 3.815628 -1.273196 0.056926
C -3.020593 -1.559828 -0.146954
C -4.263217 1.934787 0.023529
C 3.000652 1.090301 0.196872
H 0.679802 1.075083 0.127140
H -1.501230 1.960804 0.113609
H -0.986512 -2.359897 -0.132459
H 3.355874 -2.269021 -0.025535
H 4.414566 -1.239835 0.985957
H 4.462664 -1.109900 -0.824670
H -3.499452 -2.543351 -0.221199
H -4.088975 2.622654 -0.824705
H -5.298806 1.565270 -0.028113
H -4.140873 2.520868 0.953301
H 5.102868 0.772119 0.236394
H 4.535845 2.432434 0.332616


