%chk=000212606.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212606

0 1
O 0.613847 -0.305000 -0.521690
O 2.592862 1.557606 -0.614835
N -2.916367 -1.206927 -0.477382
C -3.427322 -1.100785 0.929837
C -3.989254 -0.875201 -1.472266
C -4.599152 -2.075727 1.131505
C -5.170895 -1.845094 -1.302732
C -5.724370 -1.799049 0.126747
C -1.710504 -0.342970 -0.673721
C -0.492546 -1.266864 -0.519898
C 1.885779 -0.788008 -0.399201
C 2.895675 0.212753 -0.372679
C 2.252702 -2.134560 -0.296451
C 4.239024 -0.128475 -0.243570
C 3.608056 -2.467919 -0.173610
C 4.594094 -1.481150 -0.147764
C 1.944933 2.274889 0.385806
C 1.736186 1.816348 1.690967
C 1.547280 3.556764 -0.037311
C 1.107960 2.676442 2.596855
C 0.926096 4.390046 0.889535
C 0.704230 3.955587 2.204426
H -3.744712 -0.068657 1.193554
H -2.595231 -1.370125 1.615555
H -3.556860 -0.993483 -2.489808
H -4.345383 0.173737 -1.385474
H -4.975141 -1.995864 2.167344
H -4.237463 -3.116220 1.007246
H -4.836082 -2.875420 -1.538534
H -5.961746 -1.597501 -2.033520
H -6.533655 -2.542782 0.246193
H -6.181513 -0.811847 0.327708
H -1.631237 0.504539 0.042825
H -1.692505 0.123116 -1.682364
H -0.373682 -1.956747 -1.370227
H -0.486954 -1.817435 0.434158
H 1.505568 -2.922261 -0.318183
H 4.994242 0.657336 -0.228558
H 3.890431 -3.518322 -0.098167
H 5.642449 -1.755547 -0.053349
H 2.049339 0.821060 1.991759
H 1.728616 3.867956 -1.062596
H 0.935398 2.342296 3.619537
H 0.609440 5.388445 0.588799
H 0.219267 4.616324 2.917532


%chk=000212606-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212606

0 1
O 0.642702 -0.222973 -0.444011
O 2.763066 1.561191 -0.593842
N -2.970699 -1.145803 -0.495768
C -3.411937 -1.360526 0.907385
C -4.090811 -0.669579 -1.348557
C -4.549043 -2.399956 0.977811
C -5.250796 -1.686205 -1.350398
C -5.738207 -1.967193 0.089526
C -1.759292 -0.297397 -0.591593
C -0.498800 -1.157753 -0.427932
C 1.926674 -0.753424 -0.312866
C 2.999143 0.187858 -0.339044
C 2.225073 -2.130428 -0.167838
C 4.332679 -0.247706 -0.246689
C 3.569078 -2.559900 -0.068099
C 4.625831 -1.625344 -0.111468
C 2.040648 2.349994 0.336070
C 1.775954 1.945870 1.663876
C 1.641131 3.621494 -0.132523
C 1.092636 2.833311 2.525751
C 0.961930 4.496634 0.740871
C 0.681612 4.108456 2.073565
H -3.764894 -0.397202 1.363565
H -2.547853 -1.704560 1.505614
H -3.708900 -0.529073 -2.376706
H -4.476703 0.323459 -0.995392
H -4.871250 -2.521728 2.030012
H -4.161708 -3.376636 0.628637
H -4.895258 -2.628564 -1.810443
H -6.078209 -1.297658 -1.974937
H -6.524803 -2.745175 0.088043
H -6.194106 -1.046547 0.509731
H -1.741797 0.522608 0.164158
H -1.726329 0.181891 -1.586345
H -0.414856 -1.880412 -1.262524
H -0.512069 -1.714895 0.530705
H 1.418545 -2.869222 -0.147833
H 5.125666 0.505393 -0.289067
H 3.783523 -3.628937 0.037047
H 5.666097 -1.958495 -0.041598
H 2.099430 0.962087 2.018524
H 1.866274 3.899939 -1.166413
H 0.886109 2.524363 3.556915
H 0.650770 5.483171 0.379205
H 0.154647 4.790877 2.748869


