%chk=000259053.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259053

0 1
O 0.631137 -1.496887 0.750239
O 0.346869 -2.170176 -1.414013
N -1.171704 -0.690770 -0.422571
C -1.685572 -0.188331 0.894009
C -2.796887 -1.121391 1.427178
C -3.897137 -1.379500 0.390294
C -2.181417 1.264323 0.741188
C -3.310102 -1.900196 -0.927795
C -2.216214 -0.959635 -1.455618
C -1.032833 2.232256 0.431564
C -1.530180 3.680324 0.337404
C -0.055545 -1.538102 -0.455927
C -0.380862 4.647108 0.018539
C 1.953821 -2.119810 0.766023
C -0.866962 6.091580 -0.077263
C 2.966339 -1.163457 0.144160
C 4.399600 -1.654158 0.372386
C 5.422054 -0.702608 -0.265291
C 6.854237 -1.181529 -0.040143
H -0.827238 -0.197686 1.623339
H -2.340294 -2.084515 1.731479
H -3.234762 -0.693450 2.347502
H -4.624795 -2.110275 0.791903
H -4.469108 -0.449384 0.207186
H -2.688053 1.567509 1.678092
H -2.952655 1.329324 -0.050218
H -2.891799 -2.915834 -0.780775
H -4.106630 -2.008869 -1.687137
H -1.731132 -1.388920 -2.363340
H -2.646431 0.024239 -1.747818
H -0.248041 2.150539 1.208067
H -0.543103 1.935243 -0.518153
H -2.016699 3.977408 1.286012
H -2.313310 3.761758 -0.440533
H 0.105082 4.352323 -0.932404
H 0.404395 4.567669 0.795607
H 1.901289 -3.088138 0.237412
H 2.098170 -2.269081 1.850684
H -1.320261 6.428394 0.861811
H -0.039655 6.773017 -0.305083
H -1.618165 6.213164 -0.865852
H 2.828690 -0.148185 0.565620
H 2.759017 -1.065047 -0.942814
H 4.602708 -1.748601 1.456589
H 4.523096 -2.670670 -0.050537
H 5.224103 -0.612610 -1.351927
H 5.298323 0.316907 0.149560
H 7.576467 -0.497444 -0.499988
H 7.021399 -2.173691 -0.475041
H 7.096951 -1.245836 1.026495


%chk=000259053-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259053

0 1
O 0.528141 -1.424158 0.862520
O 0.278778 -2.168145 -1.356298
N -1.490473 -1.115729 -0.219770
C -2.027852 -0.450728 1.002485
C -3.346561 -1.156558 1.423925
C -4.361321 -1.275067 0.260644
C -2.205277 1.079838 0.797373
C -3.708987 -1.981113 -0.950473
C -2.409033 -1.260655 -1.372375
C -0.891572 1.821196 0.466873
C -1.083427 3.347514 0.325347
C -0.206027 -1.606252 -0.332494
C 0.226405 4.097507 -0.009280
C 1.945287 -1.870939 0.807906
C 0.030344 5.622817 -0.145743
C 2.859291 -0.764740 0.263669
C 4.347687 -1.183191 0.298804
C 5.293107 -0.076675 -0.223140
C 6.778953 -0.494957 -0.193676
H -1.276725 -0.599610 1.794884
H -3.098648 -2.174034 1.786384
H -3.794064 -0.605764 2.273733
H -5.254495 -1.835201 0.596082
H -4.713606 -0.268780 -0.043154
H -2.632244 1.491032 1.735237
H -2.951236 1.284014 0.003231
H -3.469731 -3.029900 -0.686426
H -4.404528 -2.006348 -1.811241
H -1.870117 -1.818750 -2.154510
H -2.653233 -0.256762 -1.777524
H -0.143373 1.612219 1.258711
H -0.466690 1.414887 -0.473309
H -1.507133 3.756276 1.267044
H -1.833945 3.553996 -0.466859
H 0.647088 3.690916 -0.951575
H 0.976763 3.888338 0.780462
H 2.009821 -2.778545 0.181012
H 2.184341 -2.115229 1.857352
H -0.356107 6.058975 0.794950
H 0.979826 6.133989 -0.389899
H -0.695900 5.858372 -0.946733
H 2.714147 0.155291 0.863958
H 2.560577 -0.533474 -0.776392
H 4.637737 -1.448734 1.337380
H 4.489564 -2.099683 -0.310753
H 5.001686 0.189994 -1.259097
H 5.152167 0.839523 0.385869
H 7.434412 0.312018 -0.569712
H 6.950622 -1.389903 -0.821137
H 7.101762 -0.740791 0.835836


