%chk=000239319.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239319

0 1
O -4.549855 0.865360 -0.131630
N -1.880739 -0.075238 0.187409
N 0.336042 0.841840 0.161249
N 1.414606 -1.767487 -0.164608
C -2.638909 -0.330546 -1.084363
C -2.307963 1.232129 0.791733
C -4.137461 -0.371614 -0.742884
C -3.814647 1.154162 1.076703
C -0.459084 -0.224472 0.039583
C 0.103582 -1.581620 -0.122347
C 1.714870 0.645385 0.137006
C 2.256129 -0.661766 -0.040335
C -0.780408 -2.779315 -0.203629
C 2.594341 1.762126 0.275893
C 3.671982 -0.841063 -0.080527
C 3.952739 1.558356 0.232715
C 4.494182 0.252054 0.053797
H -2.317909 -1.302753 -1.522331
H -2.444266 0.457344 -1.845857
H -2.078976 2.098375 0.131482
H -1.741193 1.392335 1.735408
H -4.767894 -0.412250 -1.649059
H -4.381467 -1.209169 -0.065587
H -4.053703 0.386916 1.833944
H -4.230325 2.132604 1.376951
H -1.436545 -2.836795 0.680677
H -1.429359 -2.740642 -1.093512
H -0.201422 -3.716045 -0.252206
H 2.160468 2.753343 0.411386
H 4.065133 -1.849567 -0.217188
H 4.640992 2.397516 0.335572
H 5.577457 0.136299 0.025953


%chk=000239319-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239319

0 1
O -4.656423 0.795749 -0.020969
N -1.850348 0.068155 0.006774
N 0.352974 0.865437 0.230393
N 1.404808 -1.734088 -0.290039
C -2.755207 -0.397311 -1.077369
C -2.298861 1.373033 0.560272
C -4.196649 -0.496581 -0.548875
C -3.749604 1.242848 1.052352
C -0.465621 -0.179989 -0.035487
C 0.077087 -1.532128 -0.247012
C 1.720881 0.649772 0.221363
C 2.259120 -0.652825 -0.094716
C -0.787184 -2.774497 -0.319941
C 2.616885 1.728652 0.493565
C 3.670924 -0.844513 -0.152443
C 3.999303 1.518997 0.429495
C 4.530492 0.230508 0.102581
H -2.430813 -1.372371 -1.467315
H -2.727067 0.332624 -1.917020
H -2.224596 2.168216 -0.211802
H -1.629179 1.658453 1.387006
H -4.896968 -0.750666 -1.361484
H -4.250230 -1.271881 0.246858
H -3.795356 0.525626 1.900557
H -4.140104 2.221451 1.376453
H -1.683204 -2.680090 0.318487
H -1.119825 -2.994128 -1.352876
H -0.184664 -3.634013 0.014042
H 2.190831 2.708009 0.733170
H 4.046785 -1.844172 -0.392621
H 4.686487 2.348622 0.629954
H 5.615726 0.088904 0.058047


