%chk=000215671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215671

0 1
O -0.424916 0.560790 2.689581
N 0.875108 -0.932529 1.576419
N 3.563870 -0.520908 0.794857
N -2.928451 0.092447 -1.703451
C -2.289979 -0.817492 0.472475
C -2.644287 -1.742308 1.599144
C 1.315160 -1.570228 0.307744
C 1.878999 -0.923346 2.669134
C -2.560593 -3.219095 1.184205
C -1.158583 -0.033539 0.485015
C -3.831628 -3.722260 0.489771
C 2.853127 -1.718872 0.267884
C 3.217237 -0.286220 2.231535
C -4.083788 -3.067337 -0.873147
C -3.167872 -0.725605 -0.683825
C -4.412328 -1.570891 -0.779351
C -0.221768 -0.062654 1.658783
C -0.876255 0.870043 -0.593849
C -1.796681 0.903173 -1.677617
C 3.628677 0.618258 -0.072120
C 0.264886 1.726857 -0.635867
C -1.568825 1.782845 -2.784370
C 3.670512 0.434764 -1.474071
C 3.794787 1.921929 0.445464
C 0.466836 2.559565 -1.709673
C -0.458312 2.589098 -2.793158
C 3.886232 1.522423 -2.317663
C 4.010099 2.998583 -0.413574
C 4.055817 2.810012 -1.797705
H -1.990980 -1.567872 2.481054
H -3.666620 -1.501551 1.964267
H 0.974790 -0.969227 -0.567250
H 0.830155 -2.568587 0.225591
H 2.036213 -1.973366 3.001783
H 1.463124 -0.366149 3.545271
H -1.682845 -3.375284 0.527601
H -2.373905 -3.834881 2.086682
H -3.758146 -4.820177 0.353863
H -4.707165 -3.563675 1.149834
H 3.180290 -2.592794 0.875808
H 3.186246 -1.928251 -0.774321
H 3.206013 0.803782 2.468320
H 4.048967 -0.725920 2.829492
H -4.925974 -3.586497 -1.373516
H -3.207960 -3.216669 -1.535467
H -5.068168 -1.364804 0.091286
H -5.003149 -1.266924 -1.673381
H 0.973168 1.716945 0.194989
H -2.295385 1.787644 -3.598040
H 3.550764 -0.558734 -1.902193
H 3.763084 2.093549 1.522017
H 1.344360 3.207404 -1.748183
H -0.267701 3.265049 -3.626081
H 3.922112 1.365516 -3.395853
H 4.143219 3.997361 0.002724
H 4.228315 3.651604 -2.461765


%chk=000215671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215671

0 1
O -1.114457 0.587656 2.865308
N 0.446587 0.387644 1.155223
N 3.233563 0.307783 0.305738
N -4.108087 -0.180733 -1.229107
C -2.639710 -1.049839 0.549458
C -2.246791 -2.228402 1.425117
C 0.823605 0.142790 -0.256459
C 1.555422 0.644707 2.106472
C -1.665859 -3.443590 0.641063
C -1.960793 0.178907 0.616530
C -2.729993 -4.352328 -0.017535
C 2.206556 -0.530272 -0.338791
C 2.782705 1.216868 1.375971
C -3.613716 -3.672972 -1.088618
C -3.719986 -1.181726 -0.410657
C -4.477643 -2.489784 -0.562933
C -0.856029 0.397046 1.632075
C -2.359982 1.273102 -0.232939
C -3.451907 1.040423 -1.151438
C 4.579658 0.250687 -0.093318
C -1.743426 2.566517 -0.204541
C -3.885193 2.096865 -2.013236
C 5.058563 -0.811381 -0.923141
C 5.515441 1.251499 0.317054
C -2.187135 3.583147 -1.054455
C -3.262870 3.347173 -1.968115
C 6.409531 -0.859564 -1.322343
C 6.865051 1.182309 -0.083419
C 7.329301 0.131286 -0.907722
H -1.511887 -1.892506 2.176458
H -3.130071 -2.573654 2.000284
H 0.842929 1.095697 -0.822601
H 0.069547 -0.508303 -0.729738
H 1.831249 -0.294317 2.626202
H 1.193105 1.347276 2.876720
H -0.953206 -3.080030 -0.127912
H -1.076401 -4.058577 1.349539
H -2.221871 -5.225604 -0.474097
H -3.387867 -4.757107 0.780083
H 2.155244 -1.546352 0.112660
H 2.455466 -0.657146 -1.409415
H 2.549927 2.232765 0.986100
H 3.590699 1.330540 2.122174
H -4.299027 -4.436225 -1.506702
H -2.987935 -3.319872 -1.932468
H -4.930427 -2.785107 0.406433
H -5.303018 -2.291528 -1.267314
H -0.933456 2.760437 0.508207
H -4.715879 1.885513 -2.693531
H 4.386079 -1.617147 -1.233468
H 5.187242 2.100877 0.924231
H -1.715212 4.571278 -1.019123
H -3.600138 4.154311 -2.627558
H 6.747357 -1.689117 -1.954722
H 7.557066 1.967223 0.243898
H 8.377981 0.085852 -1.218479


