%chk=000277205.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277205

0 1
O 0.020691 -1.596000 -1.107496
O -2.325542 2.213254 0.582073
O -4.233855 -1.921045 0.474245
N -2.069842 -1.734422 -0.308603
N -3.251690 0.167353 0.522875
C 2.431848 0.355817 0.235582
C 1.509625 0.738382 -0.937207
C 3.803834 -0.103165 -0.273608
C 0.200875 1.248216 -0.420125
C 4.732229 -0.477993 0.890381
C -0.910114 0.454707 -0.247233
C 0.179518 2.691825 -0.085559
C 6.100945 -0.934679 0.391671
C -0.891947 -0.975989 -0.595101
C -2.147708 1.043124 0.296400
C -3.268130 -1.224315 0.250174
H 1.959847 -0.458347 0.823278
H 2.549985 1.214000 0.924765
H 2.003855 1.498251 -1.577967
H 1.380334 -0.154457 -1.601365
H 4.271929 0.690977 -0.885944
H 3.682908 -0.973350 -0.949835
H 4.852671 0.385829 1.573009
H 4.269698 -1.281981 1.496903
H -0.581022 3.238938 -0.679466
H 1.140730 3.202837 -0.220308
H -0.151278 2.872818 0.958416
H 6.607125 -0.149779 -0.181559
H 6.756743 -1.204346 1.227541
H 6.021650 -1.814783 -0.257390
H -2.051593 -2.740919 -0.538168
H -4.113219 0.579141 0.914824


%chk=000277205-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277205

0 1
O 0.129997 -1.704414 -0.738206
O -2.418216 2.253595 0.614197
O -4.385523 -1.930513 0.266310
N -2.114957 -1.727539 -0.266177
N -3.325391 0.150879 0.427247
C 2.453287 0.358878 0.247085
C 1.491211 0.748440 -0.924964
C 3.836221 -0.087463 -0.275525
C 0.173298 1.263207 -0.390401
C 4.795925 -0.506082 0.862132
C -0.941144 0.445798 -0.166705
C 0.167951 2.745087 -0.083934
C 6.178903 -0.953367 0.340548
C -0.892871 -1.028234 -0.417905
C -2.226259 1.037217 0.315713
C -3.354208 -1.221111 0.148315
H 1.989532 -0.465522 0.819588
H 2.573087 1.218962 0.937019
H 1.971567 1.554239 -1.512871
H 1.363239 -0.143884 -1.555345
H 4.297576 0.735124 -0.861190
H 3.703227 -0.938343 -0.974130
H 4.921165 0.340815 1.567410
H 4.333211 -1.330134 1.441709
H -0.556316 3.282179 -0.725952
H 1.172963 3.169827 -0.241407
H -0.177129 2.955312 0.942806
H 6.675890 -0.137455 -0.217634
H 6.846561 -1.250864 1.169857
H 6.083352 -1.817798 -0.343276
H -2.078498 -2.734561 -0.451752
H -4.206552 0.567622 0.742642


