%chk=000208323.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208323

0 1
O 3.531803 1.401714 -0.070784
O -0.884038 2.561024 -0.074005
N -0.378856 0.294147 -0.011041
N 2.894636 -1.492649 0.018883
N 1.343118 1.971699 -0.072175
C 0.595311 -0.735264 0.012443
C 1.927098 -0.405766 -0.006419
C -1.802464 -0.039516 0.008493
C 2.392161 0.984298 -0.050532
C -0.038994 1.691796 -0.054382
C 0.084137 -2.131873 0.057035
C 3.732884 -1.478746 -1.219986
C 3.749775 -1.406325 1.243199
C -2.460079 -0.156826 1.241300
C -2.476556 -0.229909 -1.206166
C -3.819732 -0.479671 1.248798
C -3.836050 -0.552086 -1.176100
C -4.505464 -0.679827 0.045808
H 0.919526 -2.861707 0.072498
H -0.534663 -2.376626 -0.819664
H -0.521976 -2.324528 0.955333
H 1.615398 2.965839 -0.103201
H 4.380814 -2.368538 -1.214523
H 4.369674 -0.583730 -1.326058
H 3.078565 -1.543945 -2.102392
H 4.397890 -2.295188 1.281156
H 3.107628 -1.419275 2.136785
H 4.387634 -0.506909 1.287733
H -1.925512 0.015767 2.174437
H -1.954656 -0.113511 -2.155041
H -4.347768 -0.568923 2.198346
H -4.376778 -0.697630 -2.111438
H -5.566164 -0.928216 0.060361


%chk=000208323-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208323

0 1
O 3.567091 1.456136 -0.063763
O -0.957165 2.599500 -0.072192
N -0.387705 0.308546 -0.016805
N 2.953558 -1.411285 0.014876
N 1.294866 1.970726 -0.066747
C 0.601027 -0.701840 0.005031
C 1.954007 -0.375971 -0.008378
C -1.807736 -0.030370 0.005775
C 2.369885 1.037525 -0.045243
C -0.078342 1.698583 -0.054492
C 0.129775 -2.133295 0.043621
C 3.762968 -1.510794 -1.226575
C 3.772764 -1.445017 1.253524
C -2.477034 -0.138577 1.243484
C -2.495893 -0.234638 -1.209208
C -3.850549 -0.467070 1.264546
C -3.869469 -0.563015 -1.182927
C -4.547031 -0.682922 0.052680
H 1.022691 -2.775905 0.058834
H -0.492425 -2.376508 -0.836549
H -0.489416 -2.329795 0.937471
H 1.549627 2.963610 -0.093607
H 4.363834 -2.438073 -1.185941
H 4.448609 -0.647317 -1.365690
H 3.091806 -1.575750 -2.100922
H 4.372052 -2.374199 1.258339
H 3.108380 -1.461602 2.135260
H 4.460384 -0.576352 1.340317
H -1.930526 0.047301 2.174105
H -1.964010 -0.122500 -2.159927
H -4.375561 -0.547521 2.222291
H -4.409262 -0.717755 -2.123183
H -5.612900 -0.934756 0.070694


