%chk=000215926.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215926

0 1
O -1.429937 2.016004 0.315166
O 5.093258 -1.218392 -1.530495
N -1.656067 -0.275231 0.122524
N 4.762219 0.212627 0.250061
N -3.531092 0.487311 -1.130915
C 0.568075 0.696494 0.185033
C 3.343542 0.353620 0.190359
C -3.058183 -0.340446 -0.156239
C -3.885251 -1.265268 0.545699
C -0.909146 0.932455 0.188154
C 1.346156 1.301902 1.183355
C 1.185343 -0.059801 -0.820787
C 2.727332 1.130103 1.198489
C 2.566628 -0.238900 -0.822379
C -5.243934 -1.284393 0.213438
C -3.333624 -2.167606 1.595487
C -5.744350 -0.421224 -0.766515
C -4.857429 0.450633 -1.414063
C 5.565383 -0.564283 -0.625980
C 7.033059 -0.492836 -0.313797
H 0.861911 1.915808 1.947413
H 0.584946 -0.503027 -1.618922
H -1.179233 -1.171551 0.217874
H 3.318270 1.601392 1.979746
H 3.042852 -0.832695 -1.611531
H -5.918600 -1.970922 0.725669
H -2.703572 -2.956075 1.160100
H -2.722426 -1.611567 2.323402
H -4.123592 -2.671639 2.169601
H 5.226603 0.732666 0.998475
H -6.800413 -0.424762 -1.021533
H -5.195578 1.144523 -2.193066
H 7.435650 0.525253 -0.405061
H 7.596009 -1.120363 -1.027430
H 7.272590 -0.865710 0.690969


%chk=000215926-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215926

0 1
O -1.406195 2.114669 0.572638
O 5.138663 -1.713276 -1.078597
N -1.733100 -0.174818 0.107386
N 4.789160 0.255587 0.155158
N -3.696843 0.811022 -0.799308
C 0.546339 0.719418 0.231194
C 3.373177 0.368105 0.148105
C -3.136605 -0.216820 -0.105956
C -3.872636 -1.349004 0.373317
C -0.935991 0.975493 0.305443
C 1.407562 1.642717 0.879438
C 1.127725 -0.364139 -0.476764
C 2.798730 1.470063 0.843969
C 2.523650 -0.551125 -0.525012
C -5.257912 -1.367075 0.095340
C -3.200246 -2.462087 1.152780
C -5.861546 -0.297571 -0.605891
C -5.038215 0.769573 -1.026862
C 5.596673 -0.729886 -0.429757
C 7.092595 -0.503691 -0.209949
H 0.956110 2.494787 1.397697
H 0.495932 -1.056568 -1.046175
H -1.260595 -1.075726 0.199768
H 3.449116 2.191444 1.355795
H 2.965754 -1.381253 -1.077805
H -5.862963 -2.212689 0.442577
H -2.478390 -3.032186 0.532549
H -2.646966 -2.066761 2.025693
H -3.945054 -3.186001 1.523947
H 5.282953 0.998333 0.656779
H -6.934165 -0.290624 -0.820986
H -5.451537 1.622524 -1.577035
H 7.423768 0.451541 -0.658172
H 7.644811 -1.326244 -0.685946
H 7.343640 -0.483633 0.866944


