%chk=000198916.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198916

0 1
O -5.163775 1.403135 0.128580
N -0.299539 -2.650564 0.252784
N 1.025352 0.695187 -0.902091
C -0.354173 -1.477378 -0.690994
C 0.860293 -0.628834 -0.445903
C 2.010484 -1.049831 0.209041
C 2.122432 -2.395750 0.823483
C 1.032017 -3.334759 0.259606
C 2.947743 0.042384 0.188343
C 2.302439 1.128883 -0.503132
C -1.637404 -0.715718 -0.430489
C 4.254889 0.223480 0.674078
C 2.943133 2.367696 -0.704205
C -2.497191 -0.399190 -1.496403
C -1.966807 -0.318861 0.872595
C 4.879584 1.443144 0.473041
C 4.228368 2.503668 -0.209060
C -3.669146 0.313609 -1.270848
C -3.140510 0.395946 1.126715
C -3.979156 0.704925 0.048752
C -5.598025 1.852455 1.434812
H -0.323823 -1.813591 -1.766780
H 3.124394 -2.833573 0.651484
H 2.002783 -2.301908 1.925241
H 1.338602 -3.691647 -0.747404
H 0.938501 -4.229146 0.912991
H -1.035467 -3.317889 -0.001557
H 0.314022 1.255222 -1.329312
H 4.753532 -0.588623 1.197221
H 2.443153 3.176051 -1.225739
H -2.250052 -0.712909 -2.510707
H -1.293871 -0.579697 1.695456
H 5.890112 1.605099 0.841017
H 4.762587 3.443625 -0.340010
H -4.348876 0.570249 -2.079287
H -3.381953 0.694690 2.140730
H -5.768089 0.996473 2.094104
H -6.542521 2.358240 1.195203
H -4.872841 2.554709 1.855643


%chk=000198916-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198916

0 1
O -5.213348 1.494925 0.107591
N -0.244953 -2.670614 0.270355
N 1.050088 0.639016 -0.903561
C -0.346503 -1.514332 -0.658338
C 0.891950 -0.672714 -0.431770
C 2.045828 -1.077017 0.234190
C 2.167123 -2.449991 0.848671
C 1.067233 -3.365171 0.252710
C 2.970679 0.039416 0.193585
C 2.316173 1.107015 -0.527019
C -1.644865 -0.737608 -0.426010
C 4.285186 0.250515 0.686749
C 2.935423 2.354801 -0.751346
C -2.464147 -0.347698 -1.515888
C -2.037483 -0.368376 0.882412
C 4.908406 1.494898 0.463303
C 4.240717 2.536216 -0.246382
C -3.642932 0.396148 -1.309573
C -3.216074 0.373191 1.109638
C -4.021498 0.759193 0.006319
C -5.657078 1.883194 1.448544
H -0.344896 -1.842905 -1.732693
H 3.162423 -2.894865 0.650568
H 2.045371 -2.396723 1.948922
H 1.373096 -3.660643 -0.781779
H 0.973629 -4.288774 0.851843
H -1.041959 -3.308616 0.157573
H 0.315715 1.185503 -1.350012
H 4.808406 -0.541004 1.235563
H 2.428313 3.158101 -1.297853
H -2.184754 -0.639863 -2.536356
H -1.407994 -0.680495 1.722489
H 5.922780 1.670282 0.839344
H 4.750924 3.493269 -0.403647
H -4.285210 0.696856 -2.142802
H -3.494728 0.642798 2.132895
H -5.845368 0.995733 2.083764
H -6.596781 2.432688 1.291551
H -4.917692 2.542651 1.943448


