%chk=000224628.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224628

0 1
O -3.782336 -1.910321 -1.980133
N -0.359806 -0.428448 1.189764
N 4.747024 -0.256826 -0.543068
N -1.653719 2.028356 1.312596
C 0.338261 -1.733029 1.343274
C 1.832617 -1.474409 1.630145
C 2.563465 -0.923077 0.401716
C 4.039211 -0.633019 0.720273
C -0.304101 -2.543243 2.477571
C -1.509440 -0.256721 0.445399
C 6.164524 0.144650 -0.280706
C -2.173170 1.046585 0.483640
C -2.041473 -1.265258 -0.365445
C 6.815036 0.591612 -1.600867
C -3.328181 1.264781 -0.323074
C -3.186026 -0.994164 -1.144498
C -3.836038 0.235809 -1.144150
C -3.940447 2.564699 -0.254866
C 8.288422 0.934240 -1.403203
C -3.413841 3.525631 0.564772
C -2.251546 3.213413 1.347940
C -3.197048 -3.229313 -2.093048
H 0.239384 -2.306402 0.380863
H 1.948772 -0.784586 2.488748
H 2.304799 -2.424226 1.952265
H 2.060794 -0.004409 0.038392
H 2.502689 -1.645316 -0.438616
H 4.114709 0.142315 1.513130
H 4.529855 -1.548460 1.120190
H -0.062290 0.328896 1.809684
H -0.205940 -2.044392 3.448583
H -1.378796 -2.686556 2.302695
H 0.149434 -3.535484 2.568511
H 4.249139 0.515182 -1.000796
H 6.701311 -0.743356 0.120839
H 6.259047 0.946432 0.482805
H -1.572864 -2.240305 -0.400781
H 6.276954 1.464502 -2.018367
H 6.708570 -0.215384 -2.355207
H -4.712665 0.393761 -1.761811
H -4.821647 2.755528 -0.866081
H 8.424427 1.749493 -0.683709
H 8.858738 0.072535 -1.037044
H 8.748350 1.250831 -2.346770
H -3.851428 4.518251 0.640035
H -1.822728 3.971572 2.010950
H -3.227177 -3.741617 -1.127493
H -2.179926 -3.160604 -2.489257
H -3.868901 -3.710850 -2.815587


%chk=000224628-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224628

0 1
O -4.188508 -2.010737 -1.758064
N -0.362112 -0.568871 1.041186
N 4.775898 -0.052122 -0.439503
N -1.338939 1.943055 1.034075
C 0.327164 -1.854192 1.222419
C 1.822850 -1.595769 1.528330
C 2.597062 -0.950835 0.357982
C 4.068366 -0.656766 0.708863
C -0.337862 -2.712165 2.330979
C -1.537797 -0.368422 0.350640
C 6.202869 0.255052 -0.201793
C -2.058957 0.990873 0.339252
C -2.245650 -1.377700 -0.339901
C 6.855642 0.874504 -1.453391
C -3.277368 1.284431 -0.381198
C -3.443367 -1.052992 -1.047429
C -3.964596 0.249802 -1.076485
C -3.724509 2.649662 -0.344860
C 8.347589 1.207967 -1.239832
C -2.991200 3.606961 0.360548
C -1.796489 3.211562 1.041494
C -3.701974 -3.390429 -1.782799
H 0.268466 -2.410239 0.261925
H 1.895413 -0.953958 2.432691
H 2.292833 -2.562666 1.795878
H 2.092888 -0.009608 0.057184
H 2.572325 -1.616878 -0.526200
H 4.106461 -0.016347 1.629479
H 4.584768 -1.604264 0.965941
H -0.009682 0.277278 1.506332
H -0.209022 -2.231881 3.318298
H -1.421367 -2.825030 2.148911
H 0.115553 -3.720100 2.373174
H 4.271539 0.775405 -0.791120
H 6.720052 -0.693480 0.048807
H 6.359746 0.941446 0.671424
H -1.873064 -2.404419 -0.330842
H 6.306309 1.798493 -1.731083
H 6.734237 0.169709 -2.297598
H -4.887262 0.449323 -1.628516
H -4.643254 2.925308 -0.875478
H 8.481832 1.933022 -0.414819
H 8.924871 0.298999 -0.985507
H 8.794050 1.646234 -2.150723
H -3.314955 4.651999 0.400635
H -1.204989 3.944480 1.602109
H -3.665864 -3.827325 -0.765548
H -2.701470 -3.459607 -2.252732
H -4.434528 -3.939462 -2.392932


