%chk=000225073.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225073

0 1
O -2.533354 -1.466414 -1.951387
O -5.214979 1.725181 0.043896
N -0.437053 -0.820742 0.235836
N -3.158400 1.373876 1.013735
N -3.872909 0.126478 -0.960157
N -0.864761 0.768383 1.833890
C 1.367991 -0.409321 1.984436
C -1.720699 -0.308446 -0.024090
C 0.045018 -0.149331 1.354281
C -1.959432 0.669376 0.980473
C 2.393925 -0.941215 1.018597
C 2.958755 -0.082047 0.011887
C -2.661667 -0.647659 -1.064550
C -4.162775 1.115333 0.026188
C 3.932840 -0.617970 -0.872081
C 2.794371 -2.255481 1.112272
C -3.403558 2.387257 2.068094
C 2.578953 1.290475 -0.137265
C 4.328386 -1.987961 -0.745885
C -4.946839 -0.105938 -1.965836
C 3.771849 -2.783431 0.222192
C 4.506472 0.220754 -1.880960
C 3.143829 2.072952 -1.112919
C 4.121427 1.532071 -1.997758
H 1.224103 -1.105864 2.845964
H 1.741579 0.531609 2.463465
H 0.025391 -1.513829 -0.331409
H 2.377630 -2.917482 1.870806
H -4.405079 2.840081 1.935230
H -2.640128 3.183865 2.016761
H -3.351285 1.919163 3.067293
H 1.829906 1.711369 0.535034
H 5.077698 -2.381348 -1.432146
H -4.629665 -0.888035 -2.681655
H -5.159984 0.823004 -2.522400
H -5.876015 -0.432572 -1.467724
H 4.065687 -3.827272 0.328908
H 5.252303 -0.204983 -2.551165
H 2.854041 3.117123 -1.227494
H 4.551726 2.177490 -2.762654


%chk=000225073-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225073

0 1
O -2.646199 -1.697545 -1.839682
O -5.211955 1.835260 -0.038513
N -0.532089 -0.927083 0.308628
N -3.115712 1.424168 0.933469
N -3.919291 0.086951 -0.916926
N -0.863691 0.786703 1.764600
C 1.327391 -0.491746 1.995746
C -1.790301 -0.396830 0.010238
C -0.005368 -0.193883 1.359797
C -1.964454 0.651543 0.925692
C 2.388794 -0.975077 1.011836
C 2.962218 -0.072712 0.037547
C -2.757975 -0.762449 -0.988800
C -4.144518 1.159241 -0.004220
C 3.965441 -0.576066 -0.881671
C 2.810295 -2.310470 1.045505
C -3.278918 2.518422 1.909588
C 2.580865 1.308627 -0.057224
C 4.363897 -1.952410 -0.809823
C -5.013378 -0.159617 -1.884215
C 3.797487 -2.805260 0.136212
C 4.542626 0.313499 -1.847187
C 3.161862 2.150973 -1.008476
C 4.151135 1.651702 -1.912572
H 1.185769 -1.259119 2.781639
H 1.641872 0.428231 2.520515
H -0.073154 -1.687943 -0.193854
H 2.382325 -2.991241 1.791570
H -4.260670 2.979884 1.729931
H -2.477440 3.264907 1.779550
H -3.226700 2.119844 2.936604
H 1.821119 1.709973 0.621599
H 5.121710 -2.322454 -1.510346
H -4.704316 -1.003431 -2.518426
H -5.188160 0.740801 -2.495343
H -5.946136 -0.399314 -1.348122
H 4.104463 -3.854938 0.191379
H 5.300268 -0.077588 -2.536611
H 2.858721 3.202022 -1.065757
H 4.597464 2.322924 -2.654175


