%chk=000225424.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225424

0 1
O 5.220181 -0.420699 0.334865
O 4.612719 0.810877 -2.835537
N -4.611023 0.939290 0.090584
N 0.105757 -1.799102 1.596911
N 3.084712 0.843418 -1.127147
C -3.432603 0.277258 0.431141
C -5.136141 2.066997 0.903847
C -5.311414 0.680741 -1.193074
C -1.728522 -1.408064 -0.074294
C -2.891225 -0.723034 -0.419776
C -1.083266 -1.106337 1.148210
C -2.762146 0.571514 1.650415
C -1.603993 -0.110636 1.991100
C -6.111841 1.568933 1.970452
C -4.734144 1.507397 -2.342010
C -1.165156 -2.441978 -0.993698
C 1.353840 -1.489925 1.035491
C 1.586035 -0.398925 0.253263
C 2.465751 -2.392619 1.422124
C 2.916931 -0.061394 -0.231479
C 3.734170 -2.094589 1.113030
C 4.087471 -0.840321 0.400092
C 4.277391 1.297805 -1.779768
C 4.930534 2.474771 -1.121883
H -4.292044 2.617551 1.381834
H -5.639478 2.799411 0.233224
H -5.249740 -0.406965 -1.433065
H -6.393462 0.906703 -1.058503
H -3.382187 -0.957955 -1.360855
H -3.148739 1.332920 2.321819
H -1.087034 0.123830 2.924250
H -6.982059 1.071876 1.526150
H -5.638587 0.837561 2.639152
H -6.478719 2.396011 2.587779
H -4.839592 2.584144 -2.166958
H -3.661279 1.314056 -2.479826
H -5.234938 1.275077 -3.288242
H -0.059434 -2.769558 1.860645
H -1.759010 -2.564257 -1.909661
H -0.146250 -2.168240 -1.315014
H -1.109032 -3.427919 -0.514973
H 0.774539 0.261226 -0.066556
H 2.211880 -3.301631 1.972765
H 4.580132 -2.731463 1.380508
H 5.528240 2.139988 -0.256884
H 5.614539 2.982035 -1.817968
H 4.206036 3.215824 -0.758480


%chk=000225424-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225424

0 1
O 5.588011 -0.491710 0.565912
O 5.511418 1.860337 -1.719868
N -4.764760 0.937654 -0.002210
N 0.192251 -1.856594 0.329535
N 3.706787 1.476162 -0.310975
C -3.543123 0.260845 0.082725
C -4.889904 2.357653 0.385685
C -5.988480 0.276523 -0.498188
C -2.165153 -1.770287 -0.342679
C -3.388330 -1.077130 -0.406273
C -1.021938 -1.126066 0.228443
C -2.386696 0.872582 0.666085
C -1.162535 0.193153 0.733332
C -5.188526 2.566113 1.889466
C -6.144329 0.330547 -2.036930
C -2.060671 -3.182240 -0.895285
C 1.513352 -1.399356 0.321789
C 1.925665 -0.103105 0.016315
C 2.512125 -2.428353 0.642637
C 3.325376 0.254009 0.020443
C 3.855422 -2.154480 0.689165
C 4.359920 -0.795320 0.434288
C 4.992520 1.980574 -0.569636
C 5.587912 2.839189 0.536367
H -3.971089 2.900922 0.097666
H -5.707151 2.799728 -0.214849
H -6.010781 -0.771783 -0.147063
H -6.855364 0.775054 -0.024866
H -4.233718 -1.589996 -0.874100
H -2.443052 1.876463 1.094446
H -0.316110 0.680584 1.223977
H -6.132764 2.067917 2.174540
H -4.383353 2.148044 2.518217
H -5.285657 3.643354 2.119333
H -6.179535 1.376609 -2.390858
H -5.298612 -0.167407 -2.542009
H -7.080232 -0.168867 -2.349371
H 0.085233 -2.872375 0.372556
H -3.004643 -3.488549 -1.375008
H -1.256786 -3.264261 -1.651351
H -1.850543 -3.930131 -0.102312
H 1.222876 0.670463 -0.297217
H 2.154225 -3.444885 0.860330
H 4.596061 -2.921071 0.938612
H 5.764124 2.221052 1.434357
H 6.543773 3.264173 0.191989
H 4.894583 3.655865 0.806837


