%chk=000245620.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245620

0 1
O -1.053119 -0.331549 2.030589
O 0.416792 2.471620 -1.471065
N -1.816324 -0.624048 -0.098990
N -1.002100 0.749874 -1.914196
N -2.498491 -0.981601 -2.409060
N -3.558461 -2.289408 0.707102
C 0.230328 0.835053 0.308490
C 0.471604 2.004992 1.299549
C 1.483896 -0.028289 0.218898
C -0.884527 -0.044851 0.877367
C -0.100580 1.456929 -1.083720
C -0.755391 2.884699 1.496418
C 2.261602 -0.070503 -0.946011
C 1.879611 -0.779247 1.339555
C -1.755692 -0.250964 -1.502031
C 3.414003 -0.862605 -0.991415
C 3.029502 -1.568347 1.288077
C 3.799939 -1.613854 0.121040
C -2.762451 -1.530497 0.344817
H 1.315991 2.614909 0.906482
H 0.808650 1.598864 2.275540
H -1.089428 3.345316 0.557047
H -1.599711 2.336430 1.930452
H -0.529865 3.711560 2.184197
H 1.995896 0.515705 -1.828800
H 1.289399 -0.751690 2.259320
H 4.012418 -0.888246 -1.902198
H 3.326786 -2.149155 2.161010
H 4.696921 -2.230122 0.081844
H -3.247372 -1.595034 -2.125784
H -2.511322 -0.665642 -3.376323


%chk=000245620-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245620

0 1
O -1.256596 -0.062760 2.113602
O 0.215064 2.605487 -1.471982
N -1.780859 -0.652260 -0.080698
N -0.945921 0.654445 -1.954961
N -2.305888 -1.202897 -2.334560
N -3.481233 -2.405834 0.684815
C 0.143506 0.931576 0.326234
C 0.502215 2.087620 1.311018
C 1.375226 -0.025541 0.182194
C -0.996581 0.087324 0.904155
C -0.215293 1.489213 -1.090313
C -0.642404 3.085276 1.583804
C 2.243270 0.057707 -0.936263
C 1.688159 -0.928198 1.232076
C -1.637302 -0.363910 -1.490860
C 3.395017 -0.757892 -1.005804
C 2.838306 -1.742987 1.156511
C 3.696455 -1.662860 0.036267
C -2.685475 -1.575388 0.353235
H 1.364386 2.617824 0.869957
H 0.838218 1.629705 2.258585
H -0.964013 3.589252 0.656352
H -1.512939 2.590291 2.049903
H -0.294516 3.866279 2.283354
H 2.036312 0.761629 -1.748861
H 1.040414 -0.995743 2.113684
H 4.057328 -0.680371 -1.875064
H 3.063851 -2.436600 1.973930
H 4.589288 -2.294936 -0.022347
H -2.850529 -2.001427 -2.009768
H -2.248962 -0.993726 -3.329994


