%chk=000272494.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272494

0 1
O -1.230049 1.288675 -0.165641
O -0.757490 3.653390 -2.115449
O -7.004859 -0.009691 2.080236
N -3.400572 0.943591 -0.744944
N -2.989684 -0.606530 1.202740
N -5.628146 1.340989 -0.370630
N -4.972737 -0.948736 2.576385
N -0.427495 -0.691738 -1.873071
N -2.865014 -1.808610 3.276671
N 1.994803 1.655923 0.771467
N -0.021749 -1.851620 -2.422688
N 2.748570 1.525653 1.885790
C -2.046069 1.011218 -1.324371
C -3.770548 0.231590 0.401952
C -5.147864 0.477814 0.618968
C -0.028425 2.070636 -0.431356
C -4.598597 1.627106 -1.169802
C -1.678043 -0.326159 -1.941752
C -0.431447 3.527922 -0.724788
C -5.850118 -0.120601 1.767716
C -3.691263 -1.116329 2.354135
C 0.725972 1.946998 0.867899
C 1.350728 -2.239424 -2.264392
C 4.131105 1.185800 1.743719
C 1.759679 -3.415822 -2.924035
C 2.256378 -1.498856 -1.483234
C 4.862544 0.975310 2.931255
C 4.753648 1.071125 0.486806
C 3.083099 -3.840365 -2.791085
C 3.572419 -1.946234 -1.365557
C 3.990826 -3.112859 -2.015361
C 6.217229 0.651833 2.844026
C 6.109061 0.746475 0.428277
C 6.844540 0.535084 1.599463
H -1.981347 1.848243 -2.074419
H 0.512516 1.612999 -1.293773
H -4.602850 2.271087 -2.035444
H -1.968650 -0.543660 1.147045
H -2.511239 -0.865051 -2.405280
H 0.357363 4.246495 -0.446357
H -1.378855 3.798959 -0.214439
H 0.122373 2.081129 1.770836
H -2.208056 -2.470995 2.879637
H -3.384075 -2.219036 4.056788
H -0.655222 -2.485812 -2.918350
H 0.057508 3.712076 -2.656896
H 2.354600 1.589731 2.828930
H 1.066364 -3.991004 -3.531407
H 1.936644 -0.588362 -0.971610
H 4.389499 1.062280 3.905573
H 4.184576 1.240923 -0.427328
H 3.407792 -4.749005 -3.298631
H 4.278295 -1.378648 -0.755354
H 5.018912 -3.453299 -1.915929
H 6.789407 0.488945 3.757916
H 6.598536 0.660020 -0.542355
H 7.900879 0.283131 1.542596


%chk=000272494-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272494

0 1
O -1.263339 2.111491 -0.281341
O -0.982885 3.904375 -2.756315
O -5.644050 -1.544859 2.661298
N -3.284329 0.989316 -0.503327
N -2.071536 -0.887904 0.614868
N -5.302535 0.748840 0.553007
N -3.410097 -2.129184 2.205623
N -0.669084 -0.232182 -1.814761
N -1.186800 -2.744211 1.776313
N 1.923115 2.175118 0.585461
N -0.142070 -1.205829 -2.608341
N 2.671895 2.264150 1.724184
C -2.211259 1.598546 -1.293422
C -3.170913 -0.089582 0.371413
C -4.407693 -0.244981 1.014552
C -0.005570 2.748548 -0.766462
C -4.612534 1.470060 -0.333029
C -1.582264 0.600996 -2.260675
C -0.303187 4.094338 -1.459312
C -4.584708 -1.318879 2.015290
C -2.275204 -1.919171 1.552200
C 0.834054 2.903194 0.470771
C 0.882034 -2.052097 -2.112480
C 3.848212 1.495700 1.886074
C 1.200222 -3.232520 -2.832177
C 1.590283 -1.728279 -0.923855
C 4.555860 1.588813 3.113809
C 4.325071 0.643167 0.855793
C 2.213957 -4.090432 -2.356669
C 2.596624 -2.602168 -0.458405
C 2.913056 -3.786925 -1.164913
C 5.731582 0.834191 3.306464
C 5.502149 -0.104876 1.065649
C 6.214102 -0.018296 2.285881
H -2.650424 2.425778 -1.879214
H 0.521153 2.068614 -1.465272
H -4.982403 2.327057 -0.891788
H -1.197018 -0.732020 0.091577
H -1.977783 0.581714 -3.291640
H 0.636300 4.671003 -1.585558
H -1.008499 4.684869 -0.851146
H 0.461299 3.577825 1.264231
H -0.320600 -2.681294 1.245000
H -1.323396 -3.494806 2.448258
H -0.517181 -1.378613 -3.550767
H -0.318776 3.616614 -3.431436
H 2.373227 2.869214 2.502427
H 0.650478 -3.486528 -3.747275
H 1.381453 -0.787981 -0.403722
H 4.187838 2.244496 3.913460
H 3.776581 0.586469 -0.087788
H 2.450634 -5.002369 -2.915427
H 3.148039 -2.340108 0.451723
H 3.695918 -4.457990 -0.797536
H 6.270029 0.913051 4.257317
H 5.868651 -0.756894 0.264273
H 7.127719 -0.601865 2.438235


