%chk=000220460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220460

0 1
O 2.703944 -2.710516 0.261396
N 3.493249 1.263015 0.319884
C -1.600967 0.802423 -1.037024
C -2.979404 0.234739 -0.598943
C -3.346209 0.130620 0.908047
C -0.454045 -0.137339 -0.658913
C -1.599894 0.890263 -2.586907
C -1.400579 2.225856 -0.493108
C -4.586887 -0.793349 1.008490
C -3.731176 1.506464 1.487946
C -2.217298 -0.477612 1.752672
C 0.724243 0.331196 -0.054992
C -0.556484 -1.504426 -0.963792
C 1.783237 -0.527818 0.254583
C 0.479726 -2.393056 -0.669154
C 1.637144 -1.893496 -0.063000
C 3.034842 -0.031642 0.930798
C 3.971052 1.050147 -1.079081
C 4.583076 1.857863 1.151910
H -3.763964 0.844594 -1.089950
H -3.080968 -0.776642 -1.042949
H -1.792551 -0.079989 -3.052934
H -0.629266 1.239966 -2.955377
H -2.359184 1.588868 -2.949553
H -0.460176 2.667920 -0.840347
H -2.209896 2.887665 -0.820107
H -1.396347 2.239583 0.605864
H -4.365762 -1.803529 0.652616
H -5.425360 -0.407398 0.422409
H -4.928169 -0.884102 2.044293
H -4.489071 2.005639 0.878556
H -4.132317 1.411582 2.501642
H -2.860097 2.171594 1.545882
H -2.529001 -0.625050 2.790925
H -1.900065 -1.450194 1.361734
H -1.330523 0.165788 1.766856
H 0.849189 1.393154 0.179328
H -1.462514 -1.887985 -1.435031
H 0.385389 -3.446536 -0.908326
H 2.803040 0.156234 2.005359
H 3.819469 -0.824277 0.911651
H 2.535222 -3.646812 0.002287
H 3.145201 0.629692 -1.677567
H 4.836532 0.378968 -1.175460
H 4.231997 2.024242 -1.520114
H 5.481346 1.232572 1.258052
H 4.189231 2.075981 2.157227
H 4.884342 2.820441 0.708523


%chk=000220460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220460

0 1
O 2.788230 -2.957198 0.100593
N 3.425271 1.214577 0.487459
C -1.569735 0.701170 -1.113285
C -2.954800 0.216926 -0.542020
C -3.323712 0.268778 0.984990
C -0.417353 -0.275221 -0.762640
C -1.718562 0.699928 -2.672249
C -1.245579 2.158165 -0.695502
C -4.567186 -0.653463 1.160513
C -3.737634 1.698071 1.436687
C -2.193089 -0.257587 1.906853
C 0.801385 0.158445 -0.184170
C -0.532943 -1.657300 -1.069772
C 1.874118 -0.718502 0.098923
C 0.514598 -2.559341 -0.795714
C 1.712621 -2.091198 -0.208389
C 3.157496 -0.219584 0.755502
C 3.852672 1.456310 -0.906253
C 4.362685 1.803772 1.462885
H -3.739488 0.792840 -1.078344
H -3.085226 -0.834870 -0.869163
H -2.019078 -0.294407 -3.050175
H -0.760109 0.969124 -3.152762
H -2.485577 1.431761 -2.989979
H -0.377075 2.543401 -1.261768
H -2.107777 2.813573 -0.915150
H -1.012132 2.251299 0.378864
H -4.314774 -1.706634 0.932884
H -5.390017 -0.346525 0.486052
H -4.945802 -0.610292 2.199493
H -4.551793 2.094131 0.799386
H -4.107666 1.673411 2.479801
H -2.898294 2.411337 1.398569
H -2.547545 -0.290509 2.955459
H -1.878044 -1.276462 1.617710
H -1.297541 0.386424 1.871447
H 0.970255 1.210202 0.066235
H -1.447554 -2.046394 -1.531638
H 0.399367 -3.624562 -1.038937
H 3.066864 -0.343340 1.853722
H 4.005839 -0.874683 0.442352
H 2.580340 -3.879902 -0.188901
H 3.098097 1.052440 -1.602675
H 4.836629 0.979846 -1.148861
H 3.942259 2.542923 -1.085357
H 5.386401 1.349950 1.430267
H 3.966083 1.678173 2.486388
H 4.468168 2.886302 1.266971


