%chk=000273350.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273350

0 1
O 5.077593 -0.461349 0.041425
O 2.252359 3.014868 -0.109836
O -2.343084 1.134392 1.909891
O -0.327108 0.027682 1.955976
N 2.062803 0.848230 0.594581
N -0.028413 -1.395967 -0.734111
N 4.832036 1.748912 -0.438966
N -0.457627 -1.842849 -2.916709
N -0.470125 2.350166 1.728791
N 6.184995 2.078632 -0.167170
C 2.822656 0.289694 -0.547992
C 2.509023 -1.206733 -0.730617
C 1.209338 -1.426636 -1.401922
C 4.336933 0.460026 -0.264566
C 1.794350 2.204818 0.681262
C 0.919177 -1.704770 -2.743880
C 0.961838 2.636676 1.901589
C -1.017719 -1.652372 -1.700351
C -3.066332 -0.131984 2.061413
C -3.611988 -0.578600 0.736479
C -0.967438 1.066141 1.868129
C -3.963765 -1.926267 0.565384
C -3.815594 0.336735 -0.304138
C -4.523769 -2.349472 -0.642760
C -4.367011 -0.094779 -1.514096
C -4.724924 -1.435900 -1.683718
H 2.556629 0.853579 -1.489103
H 3.327673 -1.677197 -1.330866
H 2.567979 -1.745042 0.242278
H 1.627566 0.177043 1.242095
H -0.168664 -1.199588 0.248130
H 1.599272 -1.813725 -3.569322
H 1.098525 3.739769 2.034755
H 1.357017 2.153751 2.829022
H 4.231184 2.583018 -0.569654
H -2.074348 -1.688241 -1.475132
H -1.096342 3.132219 1.543870
H -3.875378 0.170857 2.759079
H -2.405945 -0.882222 2.538144
H 6.781180 1.681117 -0.908510
H 6.493200 1.622517 0.704843
H -3.807722 -2.644250 1.368843
H -3.541863 1.383118 -0.165018
H -4.801431 -3.394990 -0.775851
H -4.517185 0.616193 -2.326701
H -5.155149 -1.770719 -2.627490


%chk=000273350-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273350

0 1
O 5.216637 -0.491125 0.086938
O 2.396572 3.084423 -0.072979
O -2.373562 1.213940 1.913380
O -0.344430 0.002943 1.877017
N 2.125176 0.847362 0.528272
N 0.038664 -1.362827 -0.798754
N 4.907581 1.767509 -0.402237
N -0.412227 -2.030557 -2.915147
N -0.416161 2.343734 1.757006
N 6.235135 2.138421 -0.031492
C 2.942552 0.294331 -0.576713
C 2.615319 -1.203791 -0.798677
C 1.284103 -1.472263 -1.443359
C 4.462158 0.467603 -0.268907
C 1.894580 2.188992 0.686197
C 0.974302 -1.890004 -2.744334
C 1.031555 2.563397 1.912011
C -0.946262 -1.703055 -1.720580
C -3.158294 -0.045433 2.059576
C -3.737330 -0.522453 0.740141
C -0.985631 1.101100 1.841732
C -4.004506 -1.903061 0.562183
C -4.074642 0.388803 -0.290859
C -4.611491 -2.366170 -0.627469
C -4.666971 -0.076730 -1.486123
C -4.941769 -1.453857 -1.656297
H 2.703167 0.874235 -1.488567
H 3.402997 -1.617338 -1.449792
H 2.728529 -1.737800 0.165245
H 1.641867 0.202085 1.166716
H -0.124596 -1.059362 0.169353
H 1.665466 -2.101352 -3.558288
H 1.194276 3.636335 2.094045
H 1.389665 1.996974 2.792599
H 4.220938 2.533311 -0.507146
H -2.006675 -1.701576 -1.484671
H -1.042140 3.145718 1.675474
H -3.954546 0.242709 2.768165
H -2.515032 -0.815423 2.520959
H 6.861493 2.085362 -0.848282
H 6.566584 1.503387 0.710750
H -3.734108 -2.619099 1.348220
H -3.861369 1.454656 -0.158925
H -4.808071 -3.435621 -0.758139
H -4.909554 0.632052 -2.285180
H -5.395545 -1.813983 -2.585563


