%chk=000212582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212582

0 1
O 0.616557 -0.675709 -1.187322
O 2.757593 1.128926 -2.363286
O -2.094761 -0.410844 -1.279680
N 3.498729 0.815389 1.222729
C 2.401563 0.806866 -1.004615
C 3.674762 1.176486 -0.219372
C 2.051355 -0.685374 -0.900090
C 2.568249 1.763885 1.904974
C 4.823072 0.801035 1.914084
C -0.098948 -1.816937 -0.943023
C -1.508394 -1.635578 -0.943869
C 0.432426 -3.091362 -0.722858
C -2.367282 -2.713196 -0.742399
C -0.439867 -4.169430 -0.522446
C -1.823648 -3.988205 -0.534803
C -1.886496 0.675264 -0.433834
C -1.369243 0.590601 0.863498
C -2.304387 1.892832 -1.001641
C -1.272897 1.767996 1.611248
C -2.196275 3.047913 -0.231012
C -1.680975 2.991104 1.072122
H 1.521849 1.428213 -0.711523
H 3.903393 2.250138 -0.397710
H 4.534364 0.609400 -0.642264
H 2.226042 -1.085347 0.115772
H 2.558441 -1.295272 -1.664045
H 1.572119 1.694512 1.433960
H 2.884535 2.816869 1.888524
H 2.447628 1.455543 2.955581
H 5.469839 0.044757 1.440970
H 4.675268 0.488364 2.960651
H 5.356584 1.762750 1.914928
H 1.986540 0.985078 -2.952803
H 1.506045 -3.255719 -0.717238
H -3.445104 -2.551566 -0.753860
H -0.024830 -5.163881 -0.356879
H -2.488373 -4.835864 -0.380930
H -1.050748 -0.361528 1.278548
H -2.699082 1.910292 -2.014320
H -0.880366 1.725417 2.626913
H -2.514465 4.004120 -0.646185
H -1.604612 3.899860 1.662904


%chk=000212582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212582

0 1
O 0.517914 -0.465224 -0.652029
O 2.215777 1.411069 -1.854983
O -2.070807 -0.420658 -1.628443
N 4.286562 0.690392 1.180385
C 2.399302 0.983705 -0.461939
C 3.900991 1.157674 -0.173760
C 1.949610 -0.468744 -0.278586
C 3.808835 1.585572 2.257341
C 5.740844 0.444306 1.286317
C -0.178709 -1.675042 -0.646911
C -1.529342 -1.619612 -1.100682
C 0.361004 -2.916306 -0.233880
C -2.310100 -2.787292 -1.157981
C -0.433232 -4.085595 -0.287200
C -1.765130 -4.028229 -0.751361
C -2.280450 0.698789 -0.782496
C -2.256429 0.624796 0.628351
C -2.574876 1.911118 -1.445613
C -2.527334 1.791401 1.378548
C -2.843799 3.066700 -0.681863
C -2.820131 3.014935 0.732906
H 1.784101 1.622427 0.206659
H 4.162849 2.229793 -0.350260
H 4.455360 0.562471 -0.923044
H 2.086383 -0.793398 0.769207
H 2.508400 -1.140200 -0.960822
H 2.708731 1.669624 2.232731
H 4.234458 2.618453 2.185383
H 4.092571 1.164677 3.238308
H 6.051996 -0.290077 0.522550
H 5.973362 0.023947 2.281287
H 6.358462 1.367886 1.150452
H 1.267467 1.239937 -2.093520
H 1.394821 -2.977146 0.118467
H -3.336441 -2.705847 -1.529031
H -0.002159 -5.040785 0.031322
H -2.376425 -4.934887 -0.798425
H -2.034926 -0.322592 1.129886
H -2.590395 1.928198 -2.539628
H -2.511858 1.738951 2.473169
H -3.071372 4.008587 -1.193374
H -3.029684 3.914027 1.321958


