%chk=000257396.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257396

0 1
O 3.403309 -1.394789 0.232583
O 0.791518 -1.203654 2.037728
O 3.452096 0.201059 1.856024
N 1.860167 0.904302 -2.152735
C -3.628308 -0.291363 -0.338593
C -5.130203 -0.352777 -0.409559
C -0.828257 -0.186316 -0.197571
C -2.845562 -1.085808 -1.191680
C -2.997028 0.556918 0.585485
C -1.452787 -1.033201 -1.125714
C -1.604760 0.613379 0.655436
C -5.680872 -1.418063 0.537617
C 0.648050 -0.133759 -0.120510
C 1.336325 -0.607717 0.946576
C 2.840131 -0.518757 1.112483
C 4.868760 -1.385169 0.095840
C 1.321273 0.441384 -1.239760
C 5.285489 -0.191654 -0.731926
H -5.570698 0.635702 -0.162523
H -5.460823 -0.564453 -1.447895
H -3.326716 -1.746344 -1.912246
H -3.596408 1.179565 1.248715
H -0.848610 -1.645882 -1.795667
H -1.120571 1.290319 1.359745
H -5.293100 -2.414082 0.291691
H -6.774632 -1.466888 0.485014
H -5.408718 -1.209930 1.579342
H 5.314795 -1.393318 1.105459
H 5.022334 -2.353899 -0.415649
H 6.330646 -0.269725 -1.055388
H 4.667672 -0.089299 -1.637909
H 5.184382 0.749845 -0.171913
H -0.209196 -1.282128 1.959001


%chk=000257396-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257396

0 1
O 3.475460 -0.590287 -0.322607
O 0.790779 -0.752432 2.009594
O 3.452230 -1.407678 1.868996
N 1.572803 -1.195875 -2.837294
C -3.717511 -0.274011 -0.349337
C -5.230690 -0.137862 -0.289472
C -0.864834 -0.602877 -0.395376
C -3.102645 -1.241819 -1.187098
C -2.875629 0.543259 0.447757
C -1.703867 -1.404313 -1.215801
C -1.473229 0.388631 0.428443
C -5.858668 -1.055720 0.795216
C 0.622192 -0.779098 -0.422500
C 1.367337 -0.809171 0.749931
C 2.857575 -0.977795 0.855448
C 4.960757 -0.769711 -0.400222
C 1.204143 -1.000480 -1.714293
C 5.679049 0.452099 0.177359
H -5.506560 0.912242 -0.076111
H -5.669429 -0.391593 -1.273037
H -3.729854 -1.871066 -1.830034
H -3.320933 1.324100 1.076296
H -1.252699 -2.151144 -1.878224
H -0.848662 1.092022 0.992835
H -5.627081 -2.117789 0.596855
H -6.957519 -0.940944 0.815897
H -5.467640 -0.807472 1.798526
H 5.229035 -1.693297 0.142405
H 5.141061 -0.891149 -1.479703
H 6.769208 0.344120 0.026834
H 5.351082 1.375636 -0.329553
H 5.488269 0.546930 1.259258
H -0.203832 -0.781962 1.940513


