%chk=000294143.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294143

0 1
O 0.410127 1.431118 -0.614078
N -3.546284 0.673824 0.691684
N 1.195067 -0.468655 0.431252
C -4.403970 0.195502 -0.443695
C -4.706988 1.509552 0.257675
C -5.253168 -1.031469 -0.174867
C -2.188605 1.182394 0.366854
C -1.208322 0.001722 0.467677
C -4.656153 -2.282451 -0.813257
C 0.178585 0.428563 0.032185
C 2.594349 -0.342774 0.149362
C 3.444430 -1.354986 0.645043
C 3.123454 0.730620 -0.587272
C 4.814921 -1.279412 0.396093
C 4.497847 0.784527 -0.823532
C 5.347626 -0.213853 -0.336767
H -4.010029 0.236854 -1.470285
H -4.566112 2.455734 -0.264278
H -5.518579 1.578413 0.987276
H -6.276056 -0.852328 -0.564069
H -5.365778 -1.186801 0.919781
H -1.931254 1.959770 1.122860
H -2.092336 1.671023 -0.629194
H -1.560195 -0.836786 -0.172454
H -1.224694 -0.395349 1.504676
H -3.649040 -2.482844 -0.429034
H -5.269705 -3.165136 -0.597734
H -4.584530 -2.192098 -1.902981
H 0.933047 -1.289613 0.980774
H 3.046095 -2.188490 1.216350
H 2.466753 1.517948 -0.972067
H 5.473890 -2.058965 0.777493
H 4.909200 1.617133 -1.394773
H 6.416607 -0.161986 -0.526496


%chk=000294143-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294143

0 1
O 0.308655 1.082258 -1.230238
N -3.496676 0.457239 0.818049
N 1.211089 -0.453003 0.304390
C -4.488873 0.311873 -0.319766
C -4.613228 1.466520 0.661188
C -5.412209 -0.895268 -0.280026
C -2.143016 0.952512 0.442873
C -1.235115 -0.254751 0.122756
C -4.740557 -2.169839 -0.836765
C 0.154202 0.196019 -0.336082
C 2.614496 -0.298532 0.103336
C 3.477997 -1.106202 0.892909
C 3.166456 0.613385 -0.836277
C 4.875965 -1.006248 0.747288
C 4.569345 0.700123 -0.969471
C 5.431988 -0.100839 -0.186760
H -4.109186 0.577995 -1.320605
H -4.352662 2.471397 0.299432
H -5.382057 1.439159 1.440877
H -6.329092 -0.666525 -0.860356
H -5.724865 -1.064949 0.767610
H -1.737604 1.511854 1.307081
H -2.148073 1.639431 -0.434224
H -1.696634 -0.831508 -0.702582
H -1.193711 -0.921367 1.004486
H -3.843042 -2.422453 -0.242873
H -5.428208 -3.034275 -0.799823
H -4.428883 -2.032048 -1.889684
H 0.944982 -1.138506 1.015242
H 3.054071 -1.811518 1.620106
H 2.497193 1.230605 -1.437863
H 5.529482 -1.634558 1.362485
H 4.989640 1.404923 -1.695769
H 6.518332 -0.022205 -0.300742


